A0A077Z662_TRITR Loading...

T-complex protein 1 subunit gamma

AlphaFold DB , UniProt , Accession A0A077Z662, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 528 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.2	Very low	75.3	Confident	209 Å²	209	78.7 Å²	78.7	100%	1.03	42%	0.422	S	S	*	.				0	135.8	0	-89.8	169.4	174.2	0	0	106.8
2	Q	58.1	Low	76.2	Confident	136 Å²	136	72.3 Å²	72.3	64%	0.636	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	109.3	179.9	-169.1	-176.8	-0.2	0	0	105.4	T4 E511 L513	Q2-T4 HydrophobicContact CG-CG2 3.87Å; Q2-E511 VanDerWaalsContact CD-OE1 3.28Å; Q2-E511 WeakPolarHBondContact CG-OE1 3.48Å; Q2-E511 PolarHBondContact NE2-OE1 3.49Å; Q2-L513 HydrophobicContact CG-CD2 4.28Å
3	E	67.4	Low	76.7	Confident	106 Å²	106	67.2 Å²	67.2	50%	0.495	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.5	169.6	-66.9	-179.6	-179.5	0	0	106.5	V8	E3-V8 HydrophobicContact CB-CG2 3.46Å; E3-V8 VanDerWaalsContact CB-CG2 3.46Å; E3-V8 WeakPolarHBondContact O-CG2 3.42Å
4	T	77.6	Confident	77.3	Confident	82 Å²	82	72.4 Å²	72.4	50%	0.503	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.5	-172.3	54	0	0	0	0	112.2	Q2 D510 E511	Q2-T4 HydrophobicContact CG-CG2 3.87Å; T4-D510 CarbonylContact C-O 3.55Å; T4-E511 HydrophobicContact CG2-CG 4.06Å
5	G	79.1	Confident	78	Confident	31 Å²	31	68.6 Å²	68.6	32%	0.32	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	-140.1	170.2	0	0	0	0	0	113	A7 V8 Q9 D510	G5-A7 VanDerWaalsContact C-N 3.27Å; G5-A7 PolarHBondContact O-N 3.11Å; G5-V8 PolarHBondContact O-N 3.13Å; G5-Q9 PolarHBondContact O-N 2.65Å; G5-D510 PolarHBondContact N-O 3.39Å
6	R	77.8	Confident	78.5	Confident	141 Å²	141	64.4 Å²	64.4	53%	0.532	34%	0.342	S	S	.	.	H	α-helix	trans	-62.3	-31.4	-170.7	-64.8	-177.7	-177.5	-178.1	-0.9	113.7	V8 Q9 L10 L102	R6-V8 VanDerWaalsContact C-N 3.3Å; R6-V8 PolarHBondContact O-N 3.39Å; R6-Q9 PolarHBondContact O-N 2.96Å; R6-L10 WeakPolarHBondContact O-CG 3.48Å; R6-L10 PolarHBondContact O-N 2.82Å; R6-L102 PolarHBondContact NH1-O 3.47Å
7	A	83.8	Confident	78.9	Confident	65 Å²	65	67.2 Å²	67.2	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-40.5	179.2	0	0	0	0	0	111.7	G5 L10 G11	G5-A7 VanDerWaalsContact C-N 3.27Å; G5-A7 PolarHBondContact O-N 3.11Å; A7-L10 PolarHBondContact O-N 2.94Å; A7-G11 PolarHBondContact O-N 3.28Å
8	V	86	Confident	79.4	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.006	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-42.6	175.5	174.1	0	0	0	0	111.1	E3 G5 R6 L10 G11 N12 I509 I512	E3-V8 HydrophobicContact CB-CG2 3.46Å; E3-V8 VanDerWaalsContact CB-CG2 3.46Å; E3-V8 WeakPolarHBondContact O-CG2 3.42Å; G5-V8 PolarHBondContact O-N 3.13Å; R6-V8 VanDerWaalsContact C-N 3.3Å; R6-V8 PolarHBondContact O-N 3.39Å; V8-L10 VanDerWaalsContact C-N 3.35Å; V8-L10 PolarHBondContact O-N 2.95Å; V8-G11 PolarHBondContact O-N 3.22Å; V8-N12 WeakPolarHBondContact O-CB 3.48Å; V8-N12 PolarHBondContact O-N 3.08Å; V8-N12 PolarHBondContact O-ND2 2.77Å; V8-I509 HydrophobicContact CG1-CG2 4.15Å; V8-I512 HydrophobicContact CG1-CD1 3.89Å; V8-I512 HydrophobicContact CG1-CG1 3.75Å
9	Q	81.7	Confident	79.9	Confident	16 Å²	16	63.4 Å²	63.4	8%	0.075	34%	0.336	C	S	.	.	H	α-helix	trans	-61.8	-44	178.5	-67.2	178.8	-37.4	0	0	111.5	G5 R6 N12 I13 P108 L507 I509	G5-Q9 PolarHBondContact O-N 2.65Å; R6-Q9 PolarHBondContact O-N 2.96Å; Q9-N12 WeakPolarHBondContact O-CB 3.48Å; Q9-N12 PolarHBondContact O-N 3.36Å; Q9-I13 WeakPolarHBondContact O-CD1 3.46Å; Q9-I13 WeakPolarHBondContact O-CG1 3.3Å; Q9-I13 PolarHBondContact O-N 2.93Å; Q9-I13 VanDerWaalsContact O-N 3.12Å; Q9-P108 VanDerWaalsContact NE2-CG 3.33Å; Q9-L507 PolarHBondContact NE2-O 3.22Å; Q9-I509 WeakPolarHBondContact CG-O 3.3Å
10	L	82.1	Confident	80.3	Confident	61 Å²	61	60.3 Å²	60.3	32%	0.319	32%	0.32	S	S	.	.	H	α-helix	trans	-64.5	-43.6	174.2	-67	173.3	0	0	0	111.7	R6 A7 V8 N12 I13 E14 E99	R6-L10 WeakPolarHBondContact O-CG 3.48Å; R6-L10 PolarHBondContact O-N 2.82Å; A7-L10 PolarHBondContact O-N 2.94Å; V8-L10 VanDerWaalsContact C-N 3.35Å; V8-L10 PolarHBondContact O-N 2.95Å; L10-N12 VanDerWaalsContact C-N 3.32Å; L10-N12 PolarHBondContact O-N 3.39Å; L10-I13 HydrophobicContact CD2-CD1 4.35Å; L10-I13 WeakPolarHBondContact O-CB 3.4Å; L10-I13 PolarHBondContact O-N 2.92Å; L10-I13 VanDerWaalsContact O-N 3.12Å; L10-E14 WeakPolarHBondContact O-CG 3.45Å; L10-E14 PolarHBondContact O-N 2.95Å; L10-E99 HydrophobicContact CD2-CG 3.96Å
11	G	86.5	Confident	80.6	Confident	18 Å²	18	61.1 Å²	61.1	19%	0.186	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-39.2	175.3	0	0	0	0	0	113.2	A7 V8 I13 E14 A15	A7-G11 PolarHBondContact O-N 3.28Å; V8-G11 PolarHBondContact O-N 3.22Å; G11-I13 VanDerWaalsContact C-N 3.34Å; G11-I13 PolarHBondContact O-N 3.26Å; G11-E14 PolarHBondContact O-N 3.5Å; G11-A15 VanDerWaalsContact O-CB 3.29Å; G11-A15 WeakPolarHBondContact O-CB 3.29Å; G11-A15 PolarHBondContact O-N 3.43Å
12	N	86.2	Confident	82.6	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.011	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-42.6	173.6	-70.3	-27.1	0	0	0	111.7	V8 Q9 L10 A16 H60 A62 L506 I509	V8-N12 WeakPolarHBondContact O-CB 3.48Å; V8-N12 PolarHBondContact O-N 3.08Å; V8-N12 PolarHBondContact O-ND2 2.77Å; Q9-N12 WeakPolarHBondContact O-CB 3.48Å; Q9-N12 PolarHBondContact O-N 3.36Å; L10-N12 VanDerWaalsContact C-N 3.32Å; L10-N12 PolarHBondContact O-N 3.39Å; N12-A16 WeakPolarHBondContact O-CB 3.26Å; N12-A16 PolarHBondContact O-N 3.36Å; N12-H60 PolarHBondContact OD1-CE1 3.43Å; N12-H60 VanDerWaalsContact OD1-CE1 3.27Å; N12-A62 HydrophobicContact CB-CB 4.03Å; N12-L506 PolarHBondContact ND2-O 3.22Å; N12-I509 PolarHBondContact ND2-O 3.38Å
13	I	82.4	Confident	84.1	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-64.2	-49.6	178.1	-67	159.4	0	0	0	110.4	Q9 L10 G11 A15 A16 R17 A92 L95	Q9-I13 WeakPolarHBondContact O-CD1 3.46Å; Q9-I13 WeakPolarHBondContact O-CG1 3.3Å; Q9-I13 PolarHBondContact O-N 2.93Å; Q9-I13 VanDerWaalsContact O-N 3.12Å; L10-I13 HydrophobicContact CD2-CD1 4.35Å; L10-I13 WeakPolarHBondContact O-CB 3.4Å; L10-I13 PolarHBondContact O-N 2.92Å; L10-I13 VanDerWaalsContact O-N 3.12Å; G11-I13 VanDerWaalsContact C-N 3.34Å; G11-I13 PolarHBondContact O-N 3.26Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 3.31Å; I13-A16 PolarHBondContact O-N 3.32Å; I13-R17 WeakPolarHBondContact O-CB 3.4Å; I13-R17 PolarHBondContact O-N 3.47Å; I13-A92 HydrophobicContact CG2-CB 4.06Å; I13-L95 HydrophobicContact CD1-CB 3.64Å; I13-L95 HydrophobicContact CD1-CD1 4.28Å; I13-L95 HydrophobicContact CD1-CD2 3.84Å; I13-L95 HydrophobicContact CD1-CG 4.1Å; I13-L95 HydrophobicContact CG1-CB 3.64Å; I13-L95 HydrophobicContact CG1-CD1 3.58Å; I13-L95 HydrophobicContact CG1-CD2 4.09Å; I13-L95 HydrophobicContact CG1-CG 3.92Å; I13-L95 HydrophobicContact CG2-CB 4.13Å
14	E	85.3	Confident	85.1	Confident	140 Å²	140	45.6 Å²	45.6	65%	0.654	25%	0.247	S	C	*	.	H	α-helix	trans	-60.8	-42.6	179.3	-72	-178.4	176.2	0	0	112	L10 G11 R17 A18	L10-E14 WeakPolarHBondContact O-CG 3.45Å; L10-E14 PolarHBondContact O-N 2.95Å; G11-E14 PolarHBondContact O-N 3.5Å; E14-R17 PolarHBondContact O-N 3.05Å; E14-A18 PolarHBondContact O-N 3.06Å
15	A	87.6	Confident	85.6	Confident	15 Å²	15	43.3 Å²	43.3	12%	0.124	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-43.2	177.9	0	0	0	0	0	112.4	G11 I13 R17 A18 I19 H60 A62 A63	G11-A15 VanDerWaalsContact O-CB 3.29Å; G11-A15 WeakPolarHBondContact O-CB 3.29Å; G11-A15 PolarHBondContact O-N 3.43Å; I13-A15 VanDerWaalsContact C-N 3.34Å; I13-A15 PolarHBondContact O-N 3.31Å; A15-R17 VanDerWaalsContact C-N 3.3Å; A15-R17 PolarHBondContact O-N 3.14Å; A15-A18 PolarHBondContact O-N 3.36Å; A15-I19 PolarHBondContact O-N 3.3Å; A15-H60 HydrophobicContact CB-CB 3.93Å; A15-H60 VanDerWaalsContact CB-CG 3.45Å; A15-H60 VanDerWaalsContact CB-ND1 3.34Å; A15-H60 WeakPolarHBondContact CB-ND1 3.33Å; A15-A62 HydrophobicContact CB-CB 4.28Å; A15-A63 HydrophobicContact CB-CB 4.43Å
16	A	86.3	Confident	86.1	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-63.7	-38.4	175	0	0	0	0	0	111.5	N12 I13 I19 A20 M66 L506	N12-A16 WeakPolarHBondContact O-CB 3.26Å; N12-A16 PolarHBondContact O-N 3.36Å; I13-A16 PolarHBondContact O-N 3.32Å; A16-I19 PolarHBondContact O-N 3.41Å; A16-A20 PolarHBondContact O-N 2.72Å; A16-A20 VanDerWaalsContact O-N 3.15Å; A16-M66 HydrophobicContact CB-CG 4.1Å; A16-M66 HydrophobicContact CB-SD 4.29Å; A16-L506 HydrophobicContact CB-CD1 3.85Å
17	R	84.6	Confident	86.6	Confident	112 Å²	112	36.4 Å²	36.4	42%	0.423	20%	0.2	S	C	.	.	H	α-helix	trans	-63.6	-45.3	176.5	-179.2	-178.7	170.6	174.5	-1.5	113.3	I13 E14 A15 I19 A20 E21 N89 A92	I13-R17 WeakPolarHBondContact O-CB 3.4Å; I13-R17 PolarHBondContact O-N 3.47Å; E14-R17 PolarHBondContact O-N 3.05Å; A15-R17 VanDerWaalsContact C-N 3.3Å; A15-R17 PolarHBondContact O-N 3.14Å; R17-I19 VanDerWaalsContact C-N 3.26Å; R17-I19 PolarHBondContact O-N 2.82Å; R17-A20 PolarHBondContact O-N 3.2Å; R17-E21 HydrophobicContact CG-CG 4.35Å; R17-E21 IonicContact CZ-OE1 2.81Å; R17-E21 IonicContact NE-OE1 3.19Å; R17-E21 PolarHBondContact NE-OE1 3.03Å; R17-E21 IonicContact NH2-OE1 3.41Å; R17-E21 PolarHBondContact NH2-OE1 3.32Å; R17-E21 WeakPolarHBondContact O-CG 3.48Å; R17-E21 PolarHBondContact O-N 3.16Å; R17-N89 WeakPolarHBondContact CA-OD1 3.03Å; R17-N89 WeakPolarHBondContact CB-OD1 3.15Å; R17-A92 HydrophobicContact CB-CB 4.27Å
18	A	88	Confident	86.7	Confident	56 Å²	56	34 Å²	34	46%	0.463	18%	0.182	S	C	.	.	H	α-helix	trans	-56.8	-43	176.9	0	0	0	0	0	111.5	E14 A15 V22	E14-A18 PolarHBondContact O-N 3.06Å; A15-A18 PolarHBondContact O-N 3.36Å; A18-V22 WeakPolarHBondContact O-CG2 3.19Å; A18-V22 PolarHBondContact O-N 3.14Å
19	I	89.1	Confident	86.6	Confident	7 Å²	7	36.6 Å²	36.6	4%	0.036	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-45.2	177.3	-70.2	-58.8	0	0	0	112.1	A15 A16 R17 V22 V23 L53 V58 A63 M66 I85	A15-I19 PolarHBondContact O-N 3.3Å; A16-I19 PolarHBondContact O-N 3.41Å; R17-I19 VanDerWaalsContact C-N 3.26Å; R17-I19 PolarHBondContact O-N 2.82Å; I19-V22 WeakPolarHBondContact O-CB 3.23Å; I19-V22 PolarHBondContact O-N 3.49Å; I19-V23 PolarHBondContact O-N 3.45Å; I19-L53 HydrophobicContact CG2-CD2 3.64Å; I19-V58 HydrophobicContact CD1-CG1 3.58Å; I19-A63 HydrophobicContact CD1-CB 4.04Å; I19-A63 HydrophobicContact CG1-CB 3.61Å; I19-M66 HydrophobicContact CG2-CB 4.14Å; I19-I85 HydrophobicContact CG2-CG2 3.84Å
20	A	87.3	Confident	86.8	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.008	22%	0.218	C	C	.	.	H	α-helix	trans	-70.7	-36	-178.8	0	0	0	0	0	113.5	A16 R17 V22 V23 R24 I85 N89	A16-A20 PolarHBondContact O-N 2.72Å; A16-A20 VanDerWaalsContact O-N 3.15Å; R17-A20 PolarHBondContact O-N 3.2Å; A20-V22 PolarHBondContact O-N 2.86Å; A20-V23 PolarHBondContact O-N 2.71Å; A20-R24 VanDerWaalsContact O-CB 3.28Å; A20-R24 WeakPolarHBondContact O-CB 3.48Å; A20-R24 PolarHBondContact O-N 3.11Å; A20-I85 HydrophobicContact CB-CG2 4.16Å; A20-N89 HydrophobicContact CB-CB 3.06Å
21	E	87.7	Confident	86.9	Confident	78 Å²	78	39.9 Å²	39.9	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-60	-32.9	174.1	-74.7	-176.6	-179.9	0	0	111.9	R17	R17-E21 HydrophobicContact CG-CG 4.35Å; R17-E21 IonicContact CZ-OE1 2.81Å; R17-E21 IonicContact NE-OE1 3.19Å; R17-E21 PolarHBondContact NE-OE1 3.03Å; R17-E21 IonicContact NH2-OE1 3.41Å; R17-E21 PolarHBondContact NH2-OE1 3.32Å; R17-E21 WeakPolarHBondContact O-CG 3.48Å; R17-E21 PolarHBondContact O-N 3.16Å
22	V	89.1	Confident	86.9	Confident	55 Å²	55	44.8 Å²	44.8	33%	0.333	23%	0.23	S	C	.	.	H	α-helix	trans	-64	-44.5	175.4	173.2	0	0	0	0	111.7	A18 I19 A20 K34 V52 I56	A18-V22 WeakPolarHBondContact O-CG2 3.19Å; A18-V22 PolarHBondContact O-N 3.14Å; I19-V22 WeakPolarHBondContact O-CB 3.23Å; I19-V22 PolarHBondContact O-N 3.49Å; A20-V22 PolarHBondContact O-N 2.86Å; V22-K34 WeakPolarHBondContact O-CE 3.44Å; V22-K34 PolarHBondContact O-NZ 2.84Å; V22-V52 HydrophobicContact CG1-CG1 4.1Å; V22-I56 HydrophobicContact CG1-CD1 3.81Å
23	V	89.8	Confident	86.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-93.4	-10.5	-176.6	-61	0	0	0	0	114.2	I19 A20 T25 C26 V52 L53 T82 I85	I19-V23 PolarHBondContact O-N 3.45Å; A20-V23 PolarHBondContact O-N 2.71Å; V23-T25 VanDerWaalsContact C-N 3.28Å; V23-T25 PolarHBondContact O-N 3.3Å; V23-C26 WeakPolarHBondContact O-CA 3.33Å; V23-C26 WeakPolarHBondContact O-CB 3.49Å; V23-C26 PolarHBondContact O-N 3.15Å; V23-V52 HydrophobicContact CG1-CG1 4.25Å; V23-L53 HydrophobicContact CG1-CD1 4.17Å; V23-L53 HydrophobicContact CG1-CD2 3.86Å; V23-L53 HydrophobicContact CG1-CG 3.82Å; V23-T82 HydrophobicContact CB-CG2 4.28Å; V23-T82 HydrophobicContact CG2-CG2 4.41Å; V23-T82 WeakPolarHBondContact O-CG2 3.43Å; V23-I85 HydrophobicContact CG2-CB 4.02Å; V23-I85 HydrophobicContact CG2-CG2 3.55Å
24	R	88.6	Confident	87.2	Confident	70 Å²	70	51.8 Å²	51.8	26%	0.264	27%	0.265	S	S	.	.	H	α-helix	trans	-55.2	-41.4	-177.7	-174.8	178.1	63.5	-167.2	-5.9	113.1	A20 C26 L27 I86 T440 N444	A20-R24 VanDerWaalsContact O-CB 3.28Å; A20-R24 WeakPolarHBondContact O-CB 3.48Å; A20-R24 PolarHBondContact O-N 3.11Å; R24-C26 PolarHBondContact O-N 3.05Å; R24-L27 PolarHBondContact O-N 2.69Å; R24-I86 HydrophobicContact CB-CG1 4.47Å; R24-T440 HydrophobicContact CG-CG2 3.5Å; R24-T440 WeakPolarHBondContact O-CG2 3.46Å; R24-N444 PolarHBondContact O-ND2 3.21Å
25	T	89.7	Confident	87.3	Confident	34 Å²	34	51.4 Å²	51.4	21%	0.209	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-3.3	179.4	65.7	0	0	0	0	113.4	V23 M32 K34	V23-T25 VanDerWaalsContact C-N 3.28Å; V23-T25 PolarHBondContact O-N 3.3Å; T25-M32 PolarHBondContact O-N 3.46Å; T25-K34 WeakPolarHBondContact OG1-CE 3.26Å; T25-K34 PolarHBondContact OG1-NZ 3.08Å
26	C	88.2	Confident	87.4	Confident	7 Å²	7	52 Å²	52	5%	0.047	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.5	177.3	-59.4	0	0	0	0	112.8	V23 R24 A31 K34 S47 T82	V23-C26 WeakPolarHBondContact O-CA 3.33Å; V23-C26 WeakPolarHBondContact O-CB 3.49Å; V23-C26 PolarHBondContact O-N 3.15Å; R24-C26 PolarHBondContact O-N 3.05Å; C26-A31 WeakPolarHBondContact O-CB 3.48Å; C26-K34 WeakPolarHBondContact SG-CE 2.95Å; C26-K34 VanDerWaalsContact SG-CG 3.52Å; C26-S47 WeakPolarHBondContact CB-O 3.18Å; C26-T82 HydrophobicContact CB-CG2 4.42Å
27	L	88.6	Confident	87.5	Confident	19 Å²	19	57 Å²	57	10%	0.099	30%	0.296	C	S	.	.	S	Bend	trans	-87.1	131.6	-179.7	-175.3	72	0	0	0	112.3	R24 T82 I86 I437 T440 L441 N444	R24-L27 PolarHBondContact O-N 2.69Å; L27-T82 HydrophobicContact CB-CG2 4.16Å; L27-T82 HydrophobicContact CD1-CG2 4.39Å; L27-I86 HydrophobicContact CB-CD1 3.69Å; L27-I86 HydrophobicContact CD1-CD1 4.43Å; L27-I86 HydrophobicContact CD2-CD1 3.74Å; L27-I86 HydrophobicContact CG-CD1 4.15Å; L27-I437 HydrophobicContact CD2-CD1 3.68Å; L27-I437 HydrophobicContact CD2-CG2 4.31Å; L27-T440 HydrophobicContact CB-CG2 4.04Å; L27-T440 HydrophobicContact CD2-CG2 3.95Å; L27-L441 HydrophobicContact CG-CD2 4.32Å; L27-N444 PolarHBondContact O-ND2 2.86Å
28	G	86.4	Confident	87.5	Confident	15 Å²	15	55.2 Å²	55.2	16%	0.155	29%	0.294	C	S	.	.	S	Bend	trans	96.6	177.3	170.6	0	0	0	0	0	114.9	R30 A31 S152 L441	G28-R30 VanDerWaalsContact C-N 3.26Å; G28-R30 PolarHBondContact O-N 2.62Å; G28-A31 VanDerWaalsContact O-CB 3.23Å; G28-A31 WeakPolarHBondContact O-CB 3.35Å; G28-A31 PolarHBondContact O-N 3.27Å; G28-A31 VanDerWaalsContact O-N 3.09Å; G28-S152 WeakPolarHBondContact O-CB 3.42Å; G28-L441 VanDerWaalsContact CA-CD2 3.49Å
29	P	83	Confident	87.4	Confident	56 Å²	56	58.5 Å²	58.5	36%	0.364	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.5	-172.2	29.2	-36.6	0	0	0	114.5	I473	P29-I473 HydrophobicContact CB-CG1 4.09Å; P29-I473 HydrophobicContact CG-CG1 3.99Å
30	R	85.5	Confident	87.4	Confident	125 Å²	125	64.2 Å²	64.2	47%	0.472	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	35.7	170.9	-73.1	-171.5	165.4	178.5	3.2	111.5	G28 M32 S445 I473	G28-R30 VanDerWaalsContact C-N 3.26Å; G28-R30 PolarHBondContact O-N 2.62Å; R30-M32 PolarHBondContact O-N 3.23Å; R30-S445 PolarHBondContact NH1-O 3.43Å; R30-S445 VanDerWaalsContact NH1-O 3.15Å; R30-I473 PolarHBondContact NE-O 3.01Å; R30-I473 PolarHBondContact NH1-O 3.01Å; R30-I473 PolarHBondContact NH2-O 3.41Å; R30-I473 VanDerWaalsContact NH2-O 3.15Å
31	A	85.8	Confident	87.2	Confident	21 Å²	21	66.7 Å²	66.7	17%	0.174	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-57.8	135.3	175.7	0	0	0	0	0	111.1	C26 G28	C26-A31 WeakPolarHBondContact O-CB 3.48Å; G28-A31 VanDerWaalsContact O-CB 3.23Å; G28-A31 WeakPolarHBondContact O-CB 3.35Å; G28-A31 PolarHBondContact O-N 3.27Å; G28-A31 VanDerWaalsContact O-N 3.09Å
32	M	86	Confident	87	Confident	120 Å²	120	64.9 Å²	64.9	59%	0.591	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-83.4	136.4	173.8	-63.3	-65.8	-72.4	0	0	109.7	T25 R30	T25-M32 PolarHBondContact O-N 3.46Å; R30-M32 PolarHBondContact O-N 3.23Å
33	L	86.5	Confident	86.8	Confident	107 Å²	107	66.8 Å²	66.8	56%	0.56	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-71.9	140.8	174.9	-63	171.4	0	0	0	110.7	I45	L33-I45 HydrophobicContact CB-CG2 3.94Å; L33-I45 HydrophobicContact CD1-CG2 3.93Å; L33-I45 HydrophobicContact CG-CG2 4.35Å
34	K	88	Confident	86.4	Confident	49 Å²	49	69 Å²	69	21%	0.213	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.3	170.6	-59.4	-70.3	169.2	162.7	0	108.4	V22 T25 C26 I45 T46 V52	V22-K34 WeakPolarHBondContact O-CE 3.44Å; V22-K34 PolarHBondContact O-NZ 2.84Å; T25-K34 WeakPolarHBondContact OG1-CE 3.26Å; T25-K34 PolarHBondContact OG1-NZ 3.08Å; C26-K34 WeakPolarHBondContact SG-CE 2.95Å; C26-K34 VanDerWaalsContact SG-CG 3.52Å; K34-I45 WeakPolarHBondContact O-CA 3.45Å; K34-T46 PolarHBondContact N-O 3.48Å; K34-T46 PolarHBondContact O-N 3.45Å; K34-V52 HydrophobicContact CB-CG2 3.71Å; K34-V52 HydrophobicContact CG-CG1 4.44Å; K34-V52 HydrophobicContact CG-CG2 3.84Å
35	M	88.6	Confident	86.2	Confident	132 Å²	132	70.3 Å²	70.3	65%	0.65	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.6	170.3	-178.1	179.8	-71.5	0	0	108.1	I45	M35-I45 HydrophobicContact CB-CG1 4.48Å; M35-I45 HydrophobicContact CE-CD1 3.82Å; M35-I45 HydrophobicContact CE-CG1 4.14Å; M35-I45 HydrophobicContact CG-CG1 4.28Å
36	L	88	Confident	85.8	Confident	26 Å²	26	69.3 Å²	69.3	14%	0.136	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	137.1	179.2	-58.6	156.7	0	0	0	107.7	T43 V44 T46 V52 E55 I56	L36-T43 WeakPolarHBondContact O-CA 3.49Å; L36-V44 HydrophobicContact CB-CB 4.37Å; L36-V44 PolarHBondContact N-O 3.02Å; L36-V44 PolarHBondContact O-N 3.04Å; L36-T46 HydrophobicContact CD1-CG2 4.4Å; L36-V52 HydrophobicContact CD1-CB 4.37Å; L36-V52 HydrophobicContact CD1-CG2 4.17Å; L36-V52 HydrophobicContact CD2-CG1 4.31Å; L36-E55 HydrophobicContact CB-CB 4.48Å; L36-E55 HydrophobicContact CD1-CB 3.95Å; L36-E55 HydrophobicContact CD1-CG 3.89Å; L36-I56 HydrophobicContact CD2-CG1 4.32Å
37	V	88.3	Confident	85.5	Confident	107 Å²	107	69.6 Å²	69.6	65%	0.648	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	113	177.1	-174.7	0	0	0	0	106.8	G42 T43	V37-G42 WeakPolarHBondContact CA-O 3.34Å; V37-T43 HydrophobicContact CG2-CG2 4.38Å
38	D	85.5	Confident	85.2	Confident	74 Å²	74	69.7 Å²	69.7	40%	0.396	41%	0.405	S	S	.	.			trans	-70.2	157.8	173.6	-179.2	19.8	0	0	0	110	V40 G41 G42	D38-V40 PolarHBondContact O-N 3.03Å; D38-V40 VanDerWaalsContact O-N 3.13Å; D38-G41 WeakPolarHBondContact O-CA 3.33Å; D38-G41 PolarHBondContact O-N 3.2Å; D38-G42 PolarHBondContact N-O 3.25Å
39	T	85.7	Confident	85.2	Confident	126 Å²	126	69 Å²	69	77%	0.773	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-28.8	173.3	58.8	0	0	0	0	113.7	G41	T39-G41 VanDerWaalsContact C-N 3.31Å
40	V	88.3	Confident	85.3	Confident	127 Å²	127	66.3 Å²	66.3	77%	0.77	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.8	177.9	-168.2	0	0	0	0	112.6	D38	D38-V40 PolarHBondContact O-N 3.03Å; D38-V40 VanDerWaalsContact O-N 3.13Å
41	G	83.4	Confident	85.2	Confident	53 Å²	53	60.5 Å²	60.5	55%	0.546	36%	0.359	S	S	.	.	S	Bend	trans	86.2	6.8	-178.7	0	0	0	0	0	114.7	D38 T39	D38-G41 WeakPolarHBondContact O-CA 3.33Å; D38-G41 PolarHBondContact O-N 3.2Å; T39-G41 VanDerWaalsContact C-N 3.31Å
42	G	83.8	Confident	85.3	Confident	39 Å²	39	59.6 Å²	59.6	40%	0.402	35%	0.351	S	S	.	.			trans	-66.3	138.6	168.9	0	0	0	0	0	110.9	V37 D38	V37-G42 WeakPolarHBondContact CA-O 3.34Å; D38-G42 PolarHBondContact N-O 3.25Å
43	T	85	Confident	85.5	Confident	95 Å²	95	54 Å²	54	58%	0.583	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.1	176.5	55.9	0	0	0	0	110.6	L36 V37	L36-T43 WeakPolarHBondContact O-CA 3.49Å; V37-T43 HydrophobicContact CG2-CG2 4.38Å
44	V	81.2	Confident	85.6	Confident	46 Å²	46	53.8 Å²	53.8	28%	0.279	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	123.6	174.3	-179.4	0	0	0	0	107.9	L36 T46	L36-V44 HydrophobicContact CB-CB 4.37Å; L36-V44 PolarHBondContact N-O 3.02Å; L36-V44 PolarHBondContact O-N 3.04Å; V44-T46 HydrophobicContact CG1-CG2 4.45Å
45	I	84	Confident	85.5	Confident	98 Å²	98	56 Å²	56	50%	0.503	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.1	176.5	-56.7	173.9	0	0	0	107.4	L33 K34 M35	L33-I45 HydrophobicContact CB-CG2 3.94Å; L33-I45 HydrophobicContact CD1-CG2 3.93Å; L33-I45 HydrophobicContact CG-CG2 4.35Å; K34-I45 WeakPolarHBondContact O-CA 3.45Å; M35-I45 HydrophobicContact CB-CG1 4.48Å; M35-I45 HydrophobicContact CE-CD1 3.82Å; M35-I45 HydrophobicContact CE-CG1 4.14Å; M35-I45 HydrophobicContact CG-CG1 4.28Å
46	T	81.6	Confident	85.5	Confident	13 Å²	13	52 Å²	52	8%	0.08	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150.7	-177.8	-167.4	0	0	0	0	112.9	K34 L36 V44 D48 A51 V52	K34-T46 PolarHBondContact N-O 3.48Å; K34-T46 PolarHBondContact O-N 3.45Å; L36-T46 HydrophobicContact CD1-CG2 4.4Å; V44-T46 HydrophobicContact CG1-CG2 4.45Å; T46-D48 PolarHBondContact OG1-N 3.32Å; T46-A51 HydrophobicContact CG2-CB 3.81Å; T46-V52 HydrophobicContact CG2-CG2 3.8Å
47	S	83.2	Confident	85.5	Confident	13 Å²	13	59 Å²	59	9%	0.091	34%	0.339	C	S	.	.			trans	-94.7	-10	167.8	50.1	0	0	0	0	112.5	C26 G49 N153	C26-S47 WeakPolarHBondContact CB-O 3.18Å; S47-G49 PolarHBondContact O-N 2.91Å; S47-N153 PolarHBondContact OG-OD1 3.36Å
48	D	82.4	Confident	85.5	Confident	21 Å²	21	55.2 Å²	55.2	11%	0.112	32%	0.316	C	S	.	.			trans	-74.4	114.8	-178.7	170	20.5	0	0	0	110.3	T46 N50 A51 V52 R54	T46-D48 PolarHBondContact OG1-N 3.32Å; D48-N50 PolarHBondContact O-N 3Å; D48-N50 PolarHBondContact OD1-N 2.98Å; D48-A51 HydrophobicContact CB-CB 3.99Å; D48-A51 PolarHBondContact O-N 3.33Å; D48-A51 WeakPolarHBondContact OD2-CB 3.44Å; D48-A51 PolarHBondContact OD2-N 3.23Å; D48-A51 VanDerWaalsContact OD2-N 3.14Å; D48-V52 WeakPolarHBondContact O-CG2 3.24Å; D48-V52 PolarHBondContact O-N 3.48Å; D48-R54 IonicContact OD2-NH2 3.65Å
49	G	84.6	Confident	85.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-58.5	-34.5	179.2	0	0	0	0	0	112.9	S47 V52 L53 T82	S47-G49 PolarHBondContact O-N 2.91Å; G49-V52 PolarHBondContact O-N 3.46Å; G49-L53 WeakPolarHBondContact O-CB 3.39Å; G49-L53 VanDerWaalsContact O-CG 3.22Å; G49-L53 WeakPolarHBondContact O-CG 3.35Å; G49-L53 PolarHBondContact O-N 3.37Å; G49-T82 WeakPolarHBondContact CA-OG1 3.11Å
50	N	85.6	Confident	85.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-73.1	-38.3	178.8	-174.1	46.4	0	0	0	112.1	D48 V52 L53 R54 S70 D74 T81	D48-N50 PolarHBondContact O-N 3Å; D48-N50 PolarHBondContact OD1-N 2.98Å; N50-V52 VanDerWaalsContact C-N 3.32Å; N50-L53 PolarHBondContact O-N 2.97Å; N50-R54 PolarHBondContact ND2-NH2 3.22Å; N50-R54 WeakPolarHBondContact O-CG 3.45Å; N50-R54 PolarHBondContact O-N 3.31Å; N50-R54 VanDerWaalsContact O-N 3.13Å; N50-R54 PolarHBondContact O-NE 3.04Å; N50-S70 PolarHBondContact OD1-OG 3.43Å; N50-D74 WeakPolarHBondContact ND2-CB 3.36Å; N50-D74 PolarHBondContact ND2-OD1 3.39Å; N50-D74 PolarHBondContact ND2-OD2 2.91Å; N50-D74 VanDerWaalsContact ND2-OD2 3.17Å; N50-T81 HydrophobicContact CB-CG2 3.97Å
51	A	83.8	Confident	85.9	Confident	4 Å²	4	50.8 Å²	50.8	3%	0.033	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-42.3	169.8	0	0	0	0	0	111.4	T46 D48 R54	T46-A51 HydrophobicContact CG2-CB 3.81Å; D48-A51 HydrophobicContact CB-CB 3.99Å; D48-A51 PolarHBondContact O-N 3.33Å; D48-A51 WeakPolarHBondContact OD2-CB 3.44Å; D48-A51 PolarHBondContact OD2-N 3.23Å; D48-A51 VanDerWaalsContact OD2-N 3.14Å; A51-R54 PolarHBondContact O-N 3.36Å
52	V	88.4	Confident	86.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-50	175.6	172.9	0	0	0	0	111.9	V22 V23 K34 L36 T46 D48 G49 N50 R54 E55 I56	V22-V52 HydrophobicContact CG1-CG1 4.1Å; V23-V52 HydrophobicContact CG1-CG1 4.25Å; K34-V52 HydrophobicContact CB-CG2 3.71Å; K34-V52 HydrophobicContact CG-CG1 4.44Å; K34-V52 HydrophobicContact CG-CG2 3.84Å; L36-V52 HydrophobicContact CD1-CB 4.37Å; L36-V52 HydrophobicContact CD1-CG2 4.17Å; L36-V52 HydrophobicContact CD2-CG1 4.31Å; T46-V52 HydrophobicContact CG2-CG2 3.8Å; D48-V52 WeakPolarHBondContact O-CG2 3.24Å; D48-V52 PolarHBondContact O-N 3.48Å; G49-V52 PolarHBondContact O-N 3.46Å; N50-V52 VanDerWaalsContact C-N 3.32Å; V52-R54 PolarHBondContact O-N 3.34Å; V52-E55 PolarHBondContact O-N 2.85Å; V52-I56 HydrophobicContact CG1-CD1 3.68Å; V52-I56 WeakPolarHBondContact O-CG1 3.18Å; V52-I56 PolarHBondContact O-N 3.38Å
53	L	89.7	Confident	86.3	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-68.2	-22	-177	-68.9	173.7	0	0	0	113.8	I19 V23 G49 N50 I67 I85	I19-L53 HydrophobicContact CG2-CD2 3.64Å; V23-L53 HydrophobicContact CG1-CD1 4.17Å; V23-L53 HydrophobicContact CG1-CD2 3.86Å; V23-L53 HydrophobicContact CG1-CG 3.82Å; G49-L53 WeakPolarHBondContact O-CB 3.39Å; G49-L53 VanDerWaalsContact O-CG 3.22Å; G49-L53 WeakPolarHBondContact O-CG 3.35Å; G49-L53 PolarHBondContact O-N 3.37Å; N50-L53 PolarHBondContact O-N 2.97Å; L53-I67 HydrophobicContact CB-CG1 4.23Å; L53-I67 HydrophobicContact CB-CG2 4.34Å; L53-I67 HydrophobicContact CD2-CG1 4.25Å; L53-I67 WeakPolarHBondContact O-CG2 3.39Å; L53-I85 HydrophobicContact CD1-CB 4.49Å; L53-I85 HydrophobicContact CD1-CD1 4.15Å; L53-I85 HydrophobicContact CD1-CG1 3.71Å; L53-I85 HydrophobicContact CD1-CG2 4.37Å
54	R	87.5	Confident	86.6	Confident	103 Å²	103	47.2 Å²	47.2	39%	0.389	24%	0.243	S	C	.	.	H	α-helix	trans	-73.5	-30.7	176.5	-81.1	-177.1	-76	-162.2	-4.2	113.4	D48 N50 A51 V52	D48-R54 IonicContact OD2-NH2 3.65Å; N50-R54 PolarHBondContact ND2-NH2 3.22Å; N50-R54 WeakPolarHBondContact O-CG 3.45Å; N50-R54 PolarHBondContact O-N 3.31Å; N50-R54 VanDerWaalsContact O-N 3.13Å; N50-R54 PolarHBondContact O-NE 3.04Å; A51-R54 PolarHBondContact O-N 3.36Å; V52-R54 PolarHBondContact O-N 3.34Å
55	E	86.6	Confident	87	Confident	96 Å²	96	46.5 Å²	46.5	45%	0.449	24%	0.24	S	C	.	.	H	α-helix	trans	-89	-15.2	-178.4	-57	-58.9	147.2	0	0	113	L36 V52	L36-E55 HydrophobicContact CB-CB 4.48Å; L36-E55 HydrophobicContact CD1-CB 3.95Å; L36-E55 HydrophobicContact CD1-CG 3.89Å; V52-E55 PolarHBondContact O-N 2.85Å
56	I	88.5	Confident	87.2	Confident	47 Å²	47	41.9 Å²	41.9	24%	0.241	22%	0.216	C	C	.	.			trans	-84.6	121.1	-178.9	-64.4	167.9	0	0	0	110.3	V22 L36 V52 V58	V22-I56 HydrophobicContact CG1-CD1 3.81Å; L36-I56 HydrophobicContact CD2-CG1 4.32Å; V52-I56 HydrophobicContact CG1-CD1 3.68Å; V52-I56 WeakPolarHBondContact O-CG1 3.18Å; V52-I56 PolarHBondContact O-N 3.38Å; I56-V58 HydrophobicContact CG2-CG1 3.69Å
57	E	88.6	Confident	87.6	Confident	175 Å²	175	41.8 Å²	41.8	82%	0.818	22%	0.215	S	C	*	.			trans	-84.4	120.5	167.7	-64.9	-170.5	166.9	0	0	110.7
58	V	89.2	Confident	88	Confident	26 Å²	26	46.7 Å²	46.7	16%	0.158	24%	0.237	C	C	.	.			trans	-118.5	134.1	177.6	-70.2	0	0	0	0	112.6	I19 I56 A63 K64 I67	I19-V58 HydrophobicContact CD1-CG1 3.58Å; I56-V58 HydrophobicContact CG2-CG1 3.69Å; V58-A63 HydrophobicContact CB-CB 3.87Å; V58-A63 HydrophobicContact CG1-CB 4.21Å; V58-A63 HydrophobicContact CG2-CB 3.71Å; V58-K64 HydrophobicContact CG2-CG 3.77Å; V58-K64 WeakPolarHBondContact O-CE 2.76Å; V58-I67 HydrophobicContact CG1-CD1 4.42Å; V58-I67 HydrophobicContact CG2-CD1 3.49Å; V58-I67 VanDerWaalsContact CG2-CD1 3.49Å
59	P	88.2	Confident	88.3	Confident	121 Å²	121	46.8 Å²	46.8	79%	0.786	24%	0.237	S	C	*	.			trans	-77.5	-36.3	-179.9	28.9	-33.4	0	0	0	112.4
60	H	89.3	Confident	88.5	Confident	51 Å²	51	46.8 Å²	46.8	24%	0.236	24%	0.237	C	C	.	.	S	Bend	trans	-74.5	130.6	-170.9	-164.7	-76.4	0	0	0	112.2	N12 A15 A62 A63 K64	N12-H60 PolarHBondContact OD1-CE1 3.43Å; N12-H60 VanDerWaalsContact OD1-CE1 3.27Å; A15-H60 HydrophobicContact CB-CB 3.93Å; A15-H60 VanDerWaalsContact CB-CG 3.45Å; A15-H60 VanDerWaalsContact CB-ND1 3.34Å; A15-H60 WeakPolarHBondContact CB-ND1 3.33Å; H60-A62 WeakPolarHBondContact ND1-CB 3.48Å; H60-A62 PolarHBondContact ND1-N 2.9Å; H60-A62 VanDerWaalsContact ND1-N 3.14Å; H60-A62 PolarHBondContact O-N 3.18Å; H60-A63 HydrophobicContact CB-CB 4.25Å; H60-A63 WeakPolarHBondContact O-CB 3.4Å; H60-A63 PolarHBondContact O-N 3.39Å; H60-A63 VanDerWaalsContact O-N 3.12Å; H60-K64 PolarHBondContact O-N 3.26Å; H60-K64 VanDerWaalsContact O-N 3.13Å
61	P	89.4	Confident	88.7	Confident	62 Å²	62	52 Å²	52	40%	0.403	26%	0.256	S	S	.	.	H	α-helix	trans	-57.6	-43.6	-178.3	-26.2	34.6	0	0	0	114	A63 K64 S65 I512	P61-A63 VanDerWaalsContact C-N 3.28Å; P61-A63 PolarHBondContact O-N 2.96Å; P61-K64 WeakPolarHBondContact O-CB 3.38Å; P61-K64 PolarHBondContact O-N 2.93Å; P61-S65 PolarHBondContact O-N 2.94Å; P61-S65 PolarHBondContact O-OG 2.81Å; P61-I512 HydrophobicContact CG-CD1 4.48Å; P61-I512 HydrophobicContact CG-CG2 4.18Å
62	A	87.1	Confident	89.1	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-57.9	-39.8	176.6	0	0	0	0	0	112.8	N12 A15 H60 S65 M66 L506	N12-A62 HydrophobicContact CB-CB 4.03Å; A15-A62 HydrophobicContact CB-CB 4.28Å; H60-A62 WeakPolarHBondContact ND1-CB 3.48Å; H60-A62 PolarHBondContact ND1-N 2.9Å; H60-A62 VanDerWaalsContact ND1-N 3.14Å; H60-A62 PolarHBondContact O-N 3.18Å; A62-S65 PolarHBondContact O-N 3.42Å; A62-M66 WeakPolarHBondContact O-CG 3.46Å; A62-M66 PolarHBondContact O-N 3.13Å; A62-L506 HydrophobicContact CB-CD2 3.64Å
63	A	89.1	Confident	89.2	Confident	4 Å²	4	55.6 Å²	55.6	3%	0.033	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-38.3	176	0	0	0	0	0	111.6	A15 I19 V58 H60 P61 M66 I67	A15-A63 HydrophobicContact CB-CB 4.43Å; I19-A63 HydrophobicContact CD1-CB 4.04Å; I19-A63 HydrophobicContact CG1-CB 3.61Å; V58-A63 HydrophobicContact CB-CB 3.87Å; V58-A63 HydrophobicContact CG1-CB 4.21Å; V58-A63 HydrophobicContact CG2-CB 3.71Å; H60-A63 HydrophobicContact CB-CB 4.25Å; H60-A63 WeakPolarHBondContact O-CB 3.4Å; H60-A63 PolarHBondContact O-N 3.39Å; H60-A63 VanDerWaalsContact O-N 3.12Å; P61-A63 VanDerWaalsContact C-N 3.28Å; P61-A63 PolarHBondContact O-N 2.96Å; A63-M66 WeakPolarHBondContact O-CB 3.31Å; A63-M66 PolarHBondContact O-N 3.29Å; A63-I67 WeakPolarHBondContact O-CG1 3.43Å; A63-I67 PolarHBondContact O-N 3.17Å; A63-I67 VanDerWaalsContact O-N 3.16Å
64	K	90.8	Very high	89.1	Confident	108 Å²	108	57.3 Å²	57.3	47%	0.47	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-44.3	172.9	-65.7	-176.1	-179.6	-178.5	0	111.7	V58 H60 P61 M66 I67 E68	V58-K64 HydrophobicContact CG2-CG 3.77Å; V58-K64 WeakPolarHBondContact O-CE 2.76Å; H60-K64 PolarHBondContact O-N 3.26Å; H60-K64 VanDerWaalsContact O-N 3.13Å; P61-K64 WeakPolarHBondContact O-CB 3.38Å; P61-K64 PolarHBondContact O-N 2.93Å; K64-M66 VanDerWaalsContact C-N 3.3Å; K64-M66 PolarHBondContact O-N 2.87Å; K64-I67 PolarHBondContact O-N 2.94Å; K64-I67 VanDerWaalsContact O-N 3.11Å; K64-E68 WeakPolarHBondContact O-CG 3.47Å; K64-E68 PolarHBondContact O-N 2.88Å
65	S	89.6	Confident	89.1	Confident	30 Å²	30	59.4 Å²	59.4	21%	0.21	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-42.2	176.3	-60.7	0	0	0	0	111.5	P61 A62 I67 E68 I69	P61-S65 PolarHBondContact O-N 2.94Å; P61-S65 PolarHBondContact O-OG 2.81Å; A62-S65 PolarHBondContact O-N 3.42Å; S65-I67 VanDerWaalsContact C-N 3.33Å; S65-I67 PolarHBondContact O-N 2.59Å; S65-E68 PolarHBondContact O-N 2.71Å; S65-I69 VanDerWaalsContact O-CD1 3.29Å; S65-I69 WeakPolarHBondContact O-CD1 3.28Å; S65-I69 VanDerWaalsContact O-CG1 3.28Å; S65-I69 WeakPolarHBondContact O-CG1 3.33Å; S65-I69 PolarHBondContact O-N 3.35Å
66	M	88.2	Confident	89	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-43.3	174.3	-67	-64	-71	0	0	112.1	A16 I19 A62 A63 K64 I69 S70 I85 T502 L506	A16-M66 HydrophobicContact CB-CG 4.1Å; A16-M66 HydrophobicContact CB-SD 4.29Å; I19-M66 HydrophobicContact CG2-CB 4.14Å; A62-M66 WeakPolarHBondContact O-CG 3.46Å; A62-M66 PolarHBondContact O-N 3.13Å; A63-M66 WeakPolarHBondContact O-CB 3.31Å; A63-M66 PolarHBondContact O-N 3.29Å; K64-M66 VanDerWaalsContact C-N 3.3Å; K64-M66 PolarHBondContact O-N 2.87Å; M66-I69 WeakPolarHBondContact O-CB 3.31Å; M66-I69 PolarHBondContact O-N 3.41Å; M66-S70 PolarHBondContact O-N 3.44Å; M66-I85 HydrophobicContact CB-CD1 4.24Å; M66-I85 HydrophobicContact CE-CD1 3.98Å; M66-I85 HydrophobicContact CE-CG2 4.15Å; M66-I85 WeakPolarHBondContact O-CD1 3.24Å; M66-T502 HydrophobicContact SD-CG2 3.53Å; M66-T502 VanDerWaalsContact SD-CG2 3.53Å; M66-L506 HydrophobicContact SD-CD1 4.3Å
67	I	90.7	Very high	88.9	Confident	12 Å²	12	58 Å²	58	6%	0.062	29%	0.294	C	S	.	.	H	α-helix	trans	-64.5	-41.9	177.4	-63.7	170.1	0	0	0	111.3	L53 V58 A63 K64 S65 I69 S70 R71	L53-I67 HydrophobicContact CB-CG1 4.23Å; L53-I67 HydrophobicContact CB-CG2 4.34Å; L53-I67 HydrophobicContact CD2-CG1 4.25Å; L53-I67 WeakPolarHBondContact O-CG2 3.39Å; V58-I67 HydrophobicContact CG1-CD1 4.42Å; V58-I67 HydrophobicContact CG2-CD1 3.49Å; V58-I67 VanDerWaalsContact CG2-CD1 3.49Å; A63-I67 WeakPolarHBondContact O-CG1 3.43Å; A63-I67 PolarHBondContact O-N 3.17Å; A63-I67 VanDerWaalsContact O-N 3.16Å; K64-I67 PolarHBondContact O-N 2.94Å; K64-I67 VanDerWaalsContact O-N 3.11Å; S65-I67 VanDerWaalsContact C-N 3.33Å; S65-I67 PolarHBondContact O-N 2.59Å; I67-I69 VanDerWaalsContact C-N 3.3Å; I67-I69 PolarHBondContact O-N 3.13Å; I67-S70 WeakPolarHBondContact O-CB 3.29Å; I67-S70 PolarHBondContact O-N 3.26Å; I67-R71 WeakPolarHBondContact O-CG 3.49Å; I67-R71 PolarHBondContact O-N 3.19Å; I67-R71 VanDerWaalsContact O-N 3.09Å
68	E	90.1	Very high	88.6	Confident	116 Å²	116	49.8 Å²	49.8	54%	0.542	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-36.3	176.7	-71.5	176	176.1	0	0	112.5	K64 S65 R71 T72	K64-E68 WeakPolarHBondContact O-CG 3.47Å; K64-E68 PolarHBondContact O-N 2.88Å; S65-E68 PolarHBondContact O-N 2.71Å; E68-R71 PolarHBondContact O-N 3.38Å; E68-T72 PolarHBondContact O-N 3.45Å; E68-T72 PolarHBondContact O-OG1 3.41Å
69	I	89.4	Confident	88.3	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.118	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-44.6	174.6	-74	156.4	0	0	0	111.1	S65 M66 I67 R71 T72 Q73 V84 T498 T502	S65-I69 VanDerWaalsContact O-CD1 3.29Å; S65-I69 WeakPolarHBondContact O-CD1 3.28Å; S65-I69 VanDerWaalsContact O-CG1 3.28Å; S65-I69 WeakPolarHBondContact O-CG1 3.33Å; S65-I69 PolarHBondContact O-N 3.35Å; M66-I69 WeakPolarHBondContact O-CB 3.31Å; M66-I69 PolarHBondContact O-N 3.41Å; I67-I69 VanDerWaalsContact C-N 3.3Å; I67-I69 PolarHBondContact O-N 3.13Å; I69-R71 VanDerWaalsContact C-N 3.28Å; I69-R71 PolarHBondContact O-N 3.03Å; I69-T72 PolarHBondContact O-N 3.14Å; I69-T72 VanDerWaalsContact O-N 3.16Å; I69-Q73 PolarHBondContact O-N 3.05Å; I69-V84 HydrophobicContact CG2-CG1 3.53Å; I69-T498 HydrophobicContact CG2-CG2 3.35Å; I69-T502 HydrophobicContact CD1-CG2 3.31Å; I69-T502 WeakPolarHBondContact CD1-OG1 3.46Å
70	S	89.7	Confident	88.1	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-55.5	-44.8	172.9	-179.5	0	0	0	0	111.4	N50 M66 I67 T72 Q73 D74	N50-S70 PolarHBondContact OD1-OG 3.43Å; M66-S70 PolarHBondContact O-N 3.44Å; I67-S70 WeakPolarHBondContact O-CB 3.29Å; I67-S70 PolarHBondContact O-N 3.26Å; S70-T72 VanDerWaalsContact C-N 3.33Å; S70-T72 PolarHBondContact O-N 3.24Å; S70-Q73 PolarHBondContact O-N 3.44Å; S70-D74 WeakPolarHBondContact O-CB 3.46Å; S70-D74 PolarHBondContact O-N 3.22Å
71	R	90	Very high	88	Confident	109 Å²	109	42.9 Å²	42.9	41%	0.411	22%	0.215	S	C	.	.	H	α-helix	trans	-64.1	-37.3	178.7	-69	175.4	-179.6	-172.4	-1	112.6	I67 E68 I69 Q75	I67-R71 WeakPolarHBondContact O-CG 3.49Å; I67-R71 PolarHBondContact O-N 3.19Å; I67-R71 VanDerWaalsContact O-N 3.09Å; E68-R71 PolarHBondContact O-N 3.38Å; I69-R71 VanDerWaalsContact C-N 3.28Å; I69-R71 PolarHBondContact O-N 3.03Å; R71-Q75 WeakPolarHBondContact O-CG 3.34Å; R71-Q75 PolarHBondContact O-N 3.46Å; R71-Q75 VanDerWaalsContact O-N 3.17Å
72	T	91.1	Very high	87.9	Confident	79 Å²	79	40.7 Å²	40.7	49%	0.485	20%	0.2	S	C	.	.	H	α-helix	trans	-69.6	-42.1	177.6	-54.5	0	0	0	0	110.6	E68 I69 S70 D74 Q75 E76	E68-T72 PolarHBondContact O-N 3.45Å; E68-T72 PolarHBondContact O-OG1 3.41Å; I69-T72 PolarHBondContact O-N 3.14Å; I69-T72 VanDerWaalsContact O-N 3.16Å; S70-T72 VanDerWaalsContact C-N 3.33Å; S70-T72 PolarHBondContact O-N 3.24Å; T72-D74 PolarHBondContact O-N 3.2Å; T72-Q75 PolarHBondContact O-N 3.35Å; T72-E76 WeakPolarHBondContact O-CG 3.3Å; T72-E76 PolarHBondContact O-N 3.13Å; T72-E76 VanDerWaalsContact O-N 3.08Å
73	Q	90.2	Very high	87.9	Confident	2 Å²	2	41 Å²	41	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-60.6	-45.6	175.5	-170.8	67.8	35.4	0	0	111.8	I69 S70 Q75 E76 T77 V84 T498	I69-Q73 PolarHBondContact O-N 3.05Å; S70-Q73 PolarHBondContact O-N 3.44Å; Q73-Q75 VanDerWaalsContact C-N 3.32Å; Q73-Q75 PolarHBondContact O-N 3.04Å; Q73-E76 PolarHBondContact O-N 3.13Å; Q73-T77 PolarHBondContact NE2-OG1 3.13Å; Q73-T77 PolarHBondContact O-N 3.45Å; Q73-T77 PolarHBondContact O-OG1 3.08Å; Q73-V84 HydrophobicContact CB-CG2 4.31Å; Q73-V84 HydrophobicContact CG-CB 4.33Å; Q73-V84 HydrophobicContact CG-CG2 3.63Å; Q73-T498 PolarHBondContact OE1-OG1 3.12Å; Q73-T498 VanDerWaalsContact OE1-OG1 3.13Å
74	D	88.5	Confident	87.9	Confident	38 Å²	38	40.9 Å²	40.9	20%	0.203	20%	0.201	C	C	.	.	H	α-helix	trans	-56.9	-43.8	176.5	-172.2	83.6	0	0	0	112	N50 S70 T72 G78 T81	N50-D74 WeakPolarHBondContact ND2-CB 3.36Å; N50-D74 PolarHBondContact ND2-OD1 3.39Å; N50-D74 PolarHBondContact ND2-OD2 2.91Å; N50-D74 VanDerWaalsContact ND2-OD2 3.17Å; S70-D74 WeakPolarHBondContact O-CB 3.46Å; S70-D74 PolarHBondContact O-N 3.22Å; T72-D74 PolarHBondContact O-N 3.2Å; D74-G78 WeakPolarHBondContact O-CA 3.39Å; D74-G78 PolarHBondContact O-N 3.45Å; D74-T81 HydrophobicContact CB-CG2 3.69Å
75	Q	86.9	Confident	87.8	Confident	146 Å²	146	35.7 Å²	35.7	68%	0.682	18%	0.179	S	C	*	.	H	α-helix	trans	-69.8	-35.4	179.4	-72.6	177.5	13.9	0	0	113.7	R71 T72 Q73	R71-Q75 WeakPolarHBondContact O-CG 3.34Å; R71-Q75 PolarHBondContact O-N 3.46Å; R71-Q75 VanDerWaalsContact O-N 3.17Å; T72-Q75 PolarHBondContact O-N 3.35Å; Q73-Q75 VanDerWaalsContact C-N 3.32Å; Q73-Q75 PolarHBondContact O-N 3.04Å
76	E	85.6	Confident	87.5	Confident	109 Å²	109	34.4 Å²	34.4	51%	0.509	17%	0.169	S	C	.	.	H	α-helix	trans	-79.7	-51.3	-177.1	-74.5	-62.5	149.6	0	0	112.1	T72 Q73 R389	T72-E76 WeakPolarHBondContact O-CG 3.3Å; T72-E76 PolarHBondContact O-N 3.13Å; T72-E76 VanDerWaalsContact O-N 3.08Å; Q73-E76 PolarHBondContact O-N 3.13Å; E76-R389 PolarHBondContact O-NH1 2.86Å; E76-R389 VanDerWaalsContact O-NH1 3.11Å
77	T	85.4	Confident	86.9	Confident	4 Å²	4	34.6 Å²	34.6	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-114.1	-16.6	-170.1	57.4	0	0	0	0	114.9	Q73 D79 H386 N390 V491 Q494	Q73-T77 PolarHBondContact NE2-OG1 3.13Å; Q73-T77 PolarHBondContact O-N 3.45Å; Q73-T77 PolarHBondContact O-OG1 3.08Å; T77-D79 PolarHBondContact O-N 3.04Å; T77-D79 PolarHBondContact OG1-O 3.49Å; T77-H386 WeakPolarHBondContact O-CB 3.34Å; T77-N390 PolarHBondContact O-ND2 3.23Å; T77-V491 HydrophobicContact CG2-CG2 4.43Å; T77-Q494 HydrophobicContact CG2-CB 4.09Å; T77-Q494 HydrophobicContact CG2-CG 4.11Å
78	G	81.5	Confident	85.4	Confident	3 Å²	3	34.1 Å²	34.1	3%	0.031	17%	0.168	C	C	.	.	S	Bend	trans	71.7	-36.8	-173.8	0	0	0	0	0	114.7	D74	D74-G78 WeakPolarHBondContact O-CA 3.39Å; D74-G78 PolarHBondContact O-N 3.45Å
79	D	84	Confident	83.6	Confident	44 Å²	44	29.4 Å²	29.4	24%	0.235	15%	0.147	C	C	.	.	S	Bend	trans	-111.8	167.3	177.9	-172	21.3	0	0	0	111.7	T77 V387 V491	T77-D79 PolarHBondContact O-N 3.04Å; T77-D79 PolarHBondContact OG1-O 3.49Å; D79-V387 HydrophobicContact CB-CG2 4.18Å; D79-V491 HydrophobicContact CB-CG1 4.25Å; D79-V491 WeakPolarHBondContact O-CG1 3.15Å
80	G	83.6	Confident	81.7	Confident	3 Å²	3	28.6 Å²	28.6	3%	0.031	14%	0.143	C	C	.	.			trans	85.5	7.8	176	0	0	0	0	0	114.5	S83 V84	G80-S83 PolarHBondContact O-N 3.35Å; G80-V84 WeakPolarHBondContact O-CG2 3.32Å; G80-V84 PolarHBondContact O-N 3.19Å
81	T	86.3	Confident	79.6	Confident	7 Å²	7	28.6 Å²	28.6	4%	0.043	14%	0.143	C	C	.	.	H	α-helix	trans	-57.8	-53.6	-179.9	54.9	0	0	0	0	111.8	N50 D74 S83 V84 I85	N50-T81 HydrophobicContact CB-CG2 3.97Å; D74-T81 HydrophobicContact CB-CG2 3.69Å; T81-S83 VanDerWaalsContact C-N 3.33Å; T81-S83 PolarHBondContact O-N 3.25Å; T81-V84 PolarHBondContact O-N 2.95Å; T81-I85 WeakPolarHBondContact O-CG1 3.26Å; T81-I85 PolarHBondContact O-N 3.41Å
82	T	88	Confident	77.4	Confident	15 Å²	15	23.4 Å²	23.4	9%	0.092	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-41.1	176.1	-51.5	0	0	0	0	111.6	V23 C26 L27 G49 I85 I86	V23-T82 HydrophobicContact CB-CG2 4.28Å; V23-T82 HydrophobicContact CG2-CG2 4.41Å; V23-T82 WeakPolarHBondContact O-CG2 3.43Å; C26-T82 HydrophobicContact CB-CG2 4.42Å; L27-T82 HydrophobicContact CB-CG2 4.16Å; L27-T82 HydrophobicContact CD1-CG2 4.39Å; G49-T82 WeakPolarHBondContact CA-OG1 3.11Å; T82-I85 PolarHBondContact O-N 2.88Å; T82-I86 HydrophobicContact CG2-CD1 3.73Å; T82-I86 HydrophobicContact CG2-CG1 4.41Å; T82-I86 VanDerWaalsContact O-CG1 3.3Å; T82-I86 WeakPolarHBondContact O-CG1 3.49Å; T82-I86 PolarHBondContact O-N 2.94Å
83	S	88	Confident	75.6	Confident	8 Å²	8	23.2 Å²	23.2	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-40.6	178.1	-58.3	0	0	0	0	111.8	G80 T81 I85 I86 L87	G80-S83 PolarHBondContact O-N 3.35Å; T81-S83 VanDerWaalsContact C-N 3.33Å; T81-S83 PolarHBondContact O-N 3.25Å; S83-I85 VanDerWaalsContact C-N 3.27Å; S83-I85 PolarHBondContact O-N 3.09Å; S83-I86 PolarHBondContact O-N 3.14Å; S83-L87 VanDerWaalsContact O-CB 3.25Å; S83-L87 WeakPolarHBondContact O-CB 3.31Å; S83-L87 WeakPolarHBondContact O-CD1 3.41Å; S83-L87 VanDerWaalsContact O-CG 3.3Å; S83-L87 WeakPolarHBondContact O-CG 3.31Å; S83-L87 PolarHBondContact O-N 3.47Å
84	V	88.5	Confident	74	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-33.1	174.9	168.4	0	0	0	0	111.8	I69 Q73 G80 T81 G88 V495 T498	I69-V84 HydrophobicContact CG2-CG1 3.53Å; Q73-V84 HydrophobicContact CB-CG2 4.31Å; Q73-V84 HydrophobicContact CG-CB 4.33Å; Q73-V84 HydrophobicContact CG-CG2 3.63Å; G80-V84 WeakPolarHBondContact O-CG2 3.32Å; G80-V84 PolarHBondContact O-N 3.19Å; T81-V84 PolarHBondContact O-N 2.95Å; V84-G88 WeakPolarHBondContact O-CA 3.4Å; V84-G88 PolarHBondContact O-N 3.26Å; V84-V495 HydrophobicContact CG2-CB 3.82Å; V84-V495 HydrophobicContact CG2-CG1 3.75Å; V84-V495 HydrophobicContact CG2-CG2 3.71Å; V84-T498 HydrophobicContact CG1-CG2 3.77Å
85	I	87.7	Confident	72.5	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-79.6	-36.2	179.4	-60.6	-66	0	0	0	111	I19 A20 V23 L53 M66 T81 T82 S83 N89	I19-I85 HydrophobicContact CG2-CG2 3.84Å; A20-I85 HydrophobicContact CB-CG2 4.16Å; V23-I85 HydrophobicContact CG2-CB 4.02Å; V23-I85 HydrophobicContact CG2-CG2 3.55Å; L53-I85 HydrophobicContact CD1-CB 4.49Å; L53-I85 HydrophobicContact CD1-CD1 4.15Å; L53-I85 HydrophobicContact CD1-CG1 3.71Å; L53-I85 HydrophobicContact CD1-CG2 4.37Å; M66-I85 HydrophobicContact CB-CD1 4.24Å; M66-I85 HydrophobicContact CE-CD1 3.98Å; M66-I85 HydrophobicContact CE-CG2 4.15Å; M66-I85 WeakPolarHBondContact O-CD1 3.24Å; T81-I85 WeakPolarHBondContact O-CG1 3.26Å; T81-I85 PolarHBondContact O-N 3.41Å; T82-I85 PolarHBondContact O-N 2.88Å; S83-I85 VanDerWaalsContact C-N 3.27Å; S83-I85 PolarHBondContact O-N 3.09Å; I85-N89 VanDerWaalsContact O-CB 3.23Å; I85-N89 WeakPolarHBondContact O-CB 3.35Å; I85-N89 PolarHBondContact O-N 3.34Å
86	I	84.6	Confident	71.2	Confident	2 Å²	2	17 Å²	17	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-69.8	-46.4	174.9	-64.4	166	0	0	0	110.7	R24 L27 T82 S83 N89 D90 I436 I437	R24-I86 HydrophobicContact CB-CG1 4.47Å; L27-I86 HydrophobicContact CB-CD1 3.69Å; L27-I86 HydrophobicContact CD1-CD1 4.43Å; L27-I86 HydrophobicContact CD2-CD1 3.74Å; L27-I86 HydrophobicContact CG-CD1 4.15Å; T82-I86 HydrophobicContact CG2-CD1 3.73Å; T82-I86 HydrophobicContact CG2-CG1 4.41Å; T82-I86 VanDerWaalsContact O-CG1 3.3Å; T82-I86 WeakPolarHBondContact O-CG1 3.49Å; T82-I86 PolarHBondContact O-N 2.94Å; S83-I86 PolarHBondContact O-N 3.14Å; I86-N89 CarbonylContact O-C 3.52Å; I86-N89 VanDerWaalsContact O-C 3.23Å; I86-N89 WeakPolarHBondContact O-CA 3.42Å; I86-N89 VanDerWaalsContact O-CB 3.3Å; I86-N89 WeakPolarHBondContact O-CB 3.34Å; I86-N89 PolarHBondContact O-N 2.9Å; I86-N89 VanDerWaalsContact O-N 3.15Å; I86-D90 PolarHBondContact O-N 2.83Å; I86-I436 HydrophobicContact CG2-CG1 4.25Å; I86-I436 HydrophobicContact CG2-CG2 3.76Å; I86-I437 HydrophobicContact CB-CD1 4.3Å; I86-I437 HydrophobicContact CG2-CD1 3.95Å
87	L	75.9	Confident	69.9	Low	6 Å²	6	13.4 Å²	13.4	3%	0.031	8%	0.077	C	C	.	.	H	α-helix	trans	-75.3	-27.1	174.2	-62.6	158.6	0	0	0	111.9	S83 N89 D90 A91 F434 I436 I437 V495 Y496 A499	S83-L87 VanDerWaalsContact O-CB 3.25Å; S83-L87 WeakPolarHBondContact O-CB 3.31Å; S83-L87 WeakPolarHBondContact O-CD1 3.41Å; S83-L87 VanDerWaalsContact O-CG 3.3Å; S83-L87 WeakPolarHBondContact O-CG 3.31Å; S83-L87 PolarHBondContact O-N 3.47Å; L87-N89 PolarHBondContact O-N 3.34Å; L87-D90 WeakPolarHBondContact CA-OD2 3.49Å; L87-D90 WeakPolarHBondContact CD2-OD2 3.32Å; L87-D90 CarbonylContact O-C 3.57Å; L87-D90 WeakPolarHBondContact O-CA 3.28Å; L87-D90 WeakPolarHBondContact O-CB 3.47Å; L87-D90 PolarHBondContact O-N 2.77Å; L87-A91 PolarHBondContact O-N 3.42Å; L87-A91 VanDerWaalsContact O-N 3.09Å; L87-F434 HydrophobicContact CD2-CD1 4.38Å; L87-I436 HydrophobicContact CD2-CG2 4.39Å; L87-I437 HydrophobicContact CD1-CD1 4.33Å; L87-I437 HydrophobicContact CD1-CG1 4.24Å; L87-I437 HydrophobicContact CD2-CD1 4.14Å; L87-I437 HydrophobicContact CD2-CG1 3.56Å; L87-I437 HydrophobicContact CG-CD1 3.95Å; L87-I437 HydrophobicContact CG-CG1 3.91Å; L87-V495 HydrophobicContact CD1-CG1 3.23Å; L87-Y496 HydrophobicContact CD1-CD1 3.98Å; L87-Y496 HydrophobicContact CD1-CE1 3.95Å; L87-A499 HydrophobicContact CB-CB 3.8Å
88	G	58.8	Low	68.6	Low	1 Å²	1	13.2 Å²	13.2	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-68.9	-24.2	168.4	0	0	0	0	0	110.5	V84 A91	V84-G88 WeakPolarHBondContact O-CA 3.4Å; V84-G88 PolarHBondContact O-N 3.26Å; G88-A91 WeakPolarHBondContact O-CA 3.42Å; G88-A91 WeakPolarHBondContact O-CB 2.98Å; G88-A91 PolarHBondContact O-N 2.88Å; G88-A91 VanDerWaalsContact O-N 3.15Å
89	N	51.6	Low	67.8	Low	17 Å²	17	16.7 Å²	16.7	9%	0.091	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-9.1	162.6	173.5	68.6	0	0	0	113	R17 A20 I85 I86 L87 A91 A92 E93	R17-N89 WeakPolarHBondContact CA-OD1 3.03Å; R17-N89 WeakPolarHBondContact CB-OD1 3.15Å; A20-N89 HydrophobicContact CB-CB 3.06Å; I85-N89 VanDerWaalsContact O-CB 3.23Å; I85-N89 WeakPolarHBondContact O-CB 3.35Å; I85-N89 PolarHBondContact O-N 3.34Å; I86-N89 CarbonylContact O-C 3.52Å; I86-N89 VanDerWaalsContact O-C 3.23Å; I86-N89 WeakPolarHBondContact O-CA 3.42Å; I86-N89 VanDerWaalsContact O-CB 3.3Å; I86-N89 WeakPolarHBondContact O-CB 3.34Å; I86-N89 PolarHBondContact O-N 2.9Å; I86-N89 VanDerWaalsContact O-N 3.15Å; L87-N89 PolarHBondContact O-N 3.34Å; N89-A91 PolarHBondContact O-N 3.1Å; N89-A92 VanDerWaalsContact C-N 3.25Å; N89-A92 HydrophobicContact CB-CB 4.39Å; N89-A92 CarbonylContact O-C 3.49Å; N89-A92 VanDerWaalsContact O-C 3.24Å; N89-A92 WeakPolarHBondContact O-CA 3.49Å; N89-A92 WeakPolarHBondContact O-CB 3.32Å; N89-A92 PolarHBondContact O-N 2.95Å; N89-A92 WeakPolarHBondContact OD1-CB 3.5Å; N89-E93 PolarHBondContact O-N 3.28Å
90	D	50	Low	67.1	Low	6 Å²	6	17.3 Å²	17.3	3%	0.032	10%	0.098	C	C	.	.	H	α-helix	trans	-67.7	-18.8	152.7	-67.3	-24.5	0	0	0	110.8	I86 L87 E93 I94 A433 I436	I86-D90 PolarHBondContact O-N 2.83Å; L87-D90 WeakPolarHBondContact CA-OD2 3.49Å; L87-D90 WeakPolarHBondContact CD2-OD2 3.32Å; L87-D90 CarbonylContact O-C 3.57Å; L87-D90 WeakPolarHBondContact O-CA 3.28Å; L87-D90 WeakPolarHBondContact O-CB 3.47Å; L87-D90 PolarHBondContact O-N 2.77Å; D90-E93 PolarHBondContact O-N 3.46Å; D90-I94 WeakPolarHBondContact O-CA 3.26Å; D90-I94 WeakPolarHBondContact O-CB 3.17Å; D90-I94 VanDerWaalsContact O-CD1 3.28Å; D90-I94 WeakPolarHBondContact O-CD1 3.47Å; D90-I94 WeakPolarHBondContact O-CG1 3.02Å; D90-I94 PolarHBondContact O-N 2.98Å; D90-A433 HydrophobicContact CB-CB 3.43Å; D90-A433 VanDerWaalsContact CB-CB 3.43Å; D90-A433 VanDerWaalsContact CG-CB 3.48Å; D90-A433 VanDerWaalsContact CG-O 3.26Å; D90-I436 WeakPolarHBondContact OD1-CG2 2.99Å; D90-I436 VanDerWaalsContact OD2-CG2 3.22Å; D90-I436 WeakPolarHBondContact OD2-CG2 3.4Å
91	A	45.2	Very low	66.5	Low	1 Å²	1	18.3 Å²	18.3	1%	0.008	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-46.9	155.3	0	0	0	0	0	109.5	L87 G88 N89 E93 I94 L95 A503	L87-A91 PolarHBondContact O-N 3.42Å; L87-A91 VanDerWaalsContact O-N 3.09Å; G88-A91 WeakPolarHBondContact O-CA 3.42Å; G88-A91 WeakPolarHBondContact O-CB 2.98Å; G88-A91 PolarHBondContact O-N 2.88Å; G88-A91 VanDerWaalsContact O-N 3.15Å; N89-A91 PolarHBondContact O-N 3.1Å; A91-E93 PolarHBondContact O-N 3.15Å; A91-I94 CarbonylContact O-C 3.47Å; A91-L95 HydrophobicContact CB-CD1 3.98Å; A91-L95 WeakPolarHBondContact O-CA 3.24Å; A91-L95 WeakPolarHBondContact O-CB 3.4Å; A91-L95 WeakPolarHBondContact O-CD1 3.47Å; A91-L95 WeakPolarHBondContact O-CG 3.21Å; A91-L95 PolarHBondContact O-N 3.33Å; A91-A503 HydrophobicContact CB-CB 3.12Å
92	A	45	Very low	65.7	Low	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.9	-29.8	176.6	0	0	0	0	0	113.3	I13 R17 N89 L95 N96	I13-A92 HydrophobicContact CG2-CB 4.06Å; R17-A92 HydrophobicContact CB-CB 4.27Å; N89-A92 VanDerWaalsContact C-N 3.25Å; N89-A92 HydrophobicContact CB-CB 4.39Å; N89-A92 CarbonylContact O-C 3.49Å; N89-A92 VanDerWaalsContact O-C 3.24Å; N89-A92 WeakPolarHBondContact O-CA 3.49Å; N89-A92 WeakPolarHBondContact O-CB 3.32Å; N89-A92 PolarHBondContact O-N 2.95Å; N89-A92 WeakPolarHBondContact OD1-CB 3.5Å; A92-L95 CarbonylContact O-C 3.58Å; A92-L95 PolarHBondContact O-N 3.05Å; A92-N96 WeakPolarHBondContact O-CA 3.34Å; A92-N96 WeakPolarHBondContact O-CB 3.41Å; A92-N96 PolarHBondContact O-N 3.46Å; A92-N96 PolarHBondContact O-ND2 3.09Å; A92-N96 PolarHBondContact O-OD1 3.12Å
93	E	53	Low	65	Low	75 Å²	75	22.4 Å²	22.4	35%	0.35	13%	0.126	S	C	.	.	H	α-helix	trans	-85.8	-34.4	176.4	-160.4	161.7	-174.2	0	0	112.2	N89 D90 A91 L95 N96 A97 A433	N89-E93 PolarHBondContact O-N 3.28Å; D90-E93 PolarHBondContact O-N 3.46Å; A91-E93 PolarHBondContact O-N 3.15Å; E93-L95 PolarHBondContact O-N 3.37Å; E93-N96 PolarHBondContact O-N 2.94Å; E93-A97 WeakPolarHBondContact O-CA 3.5Å; E93-A97 WeakPolarHBondContact O-CB 3.29Å; E93-A97 PolarHBondContact O-N 3.25Å; E93-A433 HydrophobicContact CB-CB 4.47Å
94	I	55.8	Low	64.3	Low	5 Å²	5	29 Å²	29	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-59.2	-40.3	159	-70.2	162.9	0	0	0	108.8	D90 A91 A97 T98 L115 V430 A433	D90-I94 WeakPolarHBondContact O-CA 3.26Å; D90-I94 WeakPolarHBondContact O-CB 3.17Å; D90-I94 VanDerWaalsContact O-CD1 3.28Å; D90-I94 WeakPolarHBondContact O-CD1 3.47Å; D90-I94 WeakPolarHBondContact O-CG1 3.02Å; D90-I94 PolarHBondContact O-N 2.98Å; A91-I94 CarbonylContact O-C 3.47Å; I94-A97 CarbonylContact O-C 3.51Å; I94-A97 PolarHBondContact O-N 3.47Å; I94-T98 HydrophobicContact CG2-CG2 4.11Å; I94-T98 WeakPolarHBondContact O-CA 3.45Å; I94-T98 WeakPolarHBondContact O-CB 3.38Å; I94-T98 WeakPolarHBondContact O-CG2 3.32Å; I94-T98 PolarHBondContact O-N 3.25Å; I94-T98 PolarHBondContact O-OG1 3.4Å; I94-T98 VanDerWaalsContact O-OG1 3.13Å; I94-L115 HydrophobicContact CD1-CD2 4.03Å; I94-L115 HydrophobicContact CG2-CD1 4.22Å; I94-L115 HydrophobicContact CG2-CD2 3.6Å; I94-L115 HydrophobicContact CG2-CG 4.44Å; I94-V430 HydrophobicContact CD1-CB 4.31Å; I94-V430 HydrophobicContact CD1-CG2 3.7Å; I94-V430 HydrophobicContact CG1-CG2 4.05Å; I94-A433 HydrophobicContact CD1-CB 4.44Å; I94-A433 HydrophobicContact CG1-CB 3.93Å
95	L	56.9	Low	63.6	Low	2 Å²	2	31.1 Å²	31.1	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-76.1	-34.9	-177.7	-78.6	159.8	0	0	0	110.9	I13 A91 A92 E93 T98 E99 L507	I13-L95 HydrophobicContact CD1-CB 3.64Å; I13-L95 HydrophobicContact CD1-CD1 4.28Å; I13-L95 HydrophobicContact CD1-CD2 3.84Å; I13-L95 HydrophobicContact CD1-CG 4.1Å; I13-L95 HydrophobicContact CG1-CB 3.64Å; I13-L95 HydrophobicContact CG1-CD1 3.58Å; I13-L95 HydrophobicContact CG1-CD2 4.09Å; I13-L95 HydrophobicContact CG1-CG 3.92Å; I13-L95 HydrophobicContact CG2-CB 4.13Å; A91-L95 HydrophobicContact CB-CD1 3.98Å; A91-L95 WeakPolarHBondContact O-CA 3.24Å; A91-L95 WeakPolarHBondContact O-CB 3.4Å; A91-L95 WeakPolarHBondContact O-CD1 3.47Å; A91-L95 WeakPolarHBondContact O-CG 3.21Å; A91-L95 PolarHBondContact O-N 3.33Å; A92-L95 CarbonylContact O-C 3.58Å; A92-L95 PolarHBondContact O-N 3.05Å; E93-L95 PolarHBondContact O-N 3.37Å; L95-T98 VanDerWaalsContact CA-OG1 3.24Å; L95-T98 WeakPolarHBondContact CA-OG1 3.28Å; L95-T98 CarbonylContact O-C 3.23Å; L95-T98 PolarHBondContact O-N 3.41Å; L95-T98 PolarHBondContact O-OG1 2.86Å; L95-T98 VanDerWaalsContact O-OG1 3.07Å; L95-E99 VanDerWaalsContact O-CA 3.29Å; L95-E99 WeakPolarHBondContact O-CA 3.28Å; L95-E99 VanDerWaalsContact O-CB 3.3Å; L95-E99 WeakPolarHBondContact O-CB 3.45Å; L95-E99 PolarHBondContact O-N 2.9Å; L95-L507 HydrophobicContact CD2-CD1 3.76Å; L95-L507 HydrophobicContact CD2-CD2 3.1Å; L95-L507 HydrophobicContact CD2-CG 3.25Å; L95-L507 HydrophobicContact CG-CD2 4.5Å; L95-L507 HydrophobicContact CG-CG 4.31Å
96	N	59.2	Low	63.1	Low	48 Å²	48	32.2 Å²	32.2	26%	0.257	18%	0.183	S	C	.	.	H	α-helix	trans	-74.2	-36	172.4	-72.2	-23.8	0	0	0	109.7	A92 E93 T98 E99 P100	A92-N96 WeakPolarHBondContact O-CA 3.34Å; A92-N96 WeakPolarHBondContact O-CB 3.41Å; A92-N96 PolarHBondContact O-N 3.46Å; A92-N96 PolarHBondContact O-ND2 3.09Å; A92-N96 PolarHBondContact O-OD1 3.12Å; E93-N96 PolarHBondContact O-N 2.94Å; N96-T98 VanDerWaalsContact C-N 3.28Å; N96-E99 WeakPolarHBondContact O-CB 3.36Å; N96-E99 PolarHBondContact O-N 3.39Å; N96-P100 WeakPolarHBondContact O-CD 3.25Å
97	A	57.9	Low	63	Low	33 Å²	33	37.5 Å²	37.5	27%	0.273	21%	0.208	S	C	.	.	H	α-helix	trans	-71.8	-28.6	170.8	0	0	0	0	0	110.6	E93 I94 P100 F101 A429	E93-A97 WeakPolarHBondContact O-CA 3.5Å; E93-A97 WeakPolarHBondContact O-CB 3.29Å; E93-A97 PolarHBondContact O-N 3.25Å; I94-A97 CarbonylContact O-C 3.51Å; I94-A97 PolarHBondContact O-N 3.47Å; A97-P100 WeakPolarHBondContact O-CD 3.29Å; A97-F101 WeakPolarHBondContact O-CD2 3.47Å; A97-F101 WeakPolarHBondContact O-CE2 3.45Å; A97-F101 WeakPolarHBondContact O-CZ 3.44Å; A97-A429 HydrophobicContact CB-CB 3.47Å; A97-A429 VanDerWaalsContact CB-CB 3.47Å
98	T	58.6	Low	63.3	Low	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	-89.3	-8.1	170.8	75.8	0	0	0	0	114.2	I94 L95 N96 P100 F101 L102 I111	I94-T98 HydrophobicContact CG2-CG2 4.11Å; I94-T98 WeakPolarHBondContact O-CA 3.45Å; I94-T98 WeakPolarHBondContact O-CB 3.38Å; I94-T98 WeakPolarHBondContact O-CG2 3.32Å; I94-T98 PolarHBondContact O-N 3.25Å; I94-T98 PolarHBondContact O-OG1 3.4Å; I94-T98 VanDerWaalsContact O-OG1 3.13Å; L95-T98 VanDerWaalsContact CA-OG1 3.24Å; L95-T98 WeakPolarHBondContact CA-OG1 3.28Å; L95-T98 CarbonylContact O-C 3.23Å; L95-T98 PolarHBondContact O-N 3.41Å; L95-T98 PolarHBondContact O-OG1 2.86Å; L95-T98 VanDerWaalsContact O-OG1 3.07Å; N96-T98 VanDerWaalsContact C-N 3.28Å; T98-P100 VanDerWaalsContact C-N 3.32Å; T98-F101 HydrophobicContact CG2-CD2 3.78Å; T98-F101 HydrophobicContact CG2-CE2 4.32Å; T98-F101 CarbonylContact O-C 3.54Å; T98-F101 VanDerWaalsContact O-CA 3.28Å; T98-F101 WeakPolarHBondContact O-CA 3.42Å; T98-F101 WeakPolarHBondContact O-CB 3.4Å; T98-F101 PolarHBondContact O-N 3.06Å; T98-L102 WeakPolarHBondContact O-CG 3.4Å; T98-L102 PolarHBondContact O-N 2.84Å; T98-I111 HydrophobicContact CG2-CD1 4.23Å; T98-I111 HydrophobicContact CG2-CG1 4.38Å; T98-I111 HydrophobicContact CG2-CG2 3.72Å
99	E	65.5	Low	64.7	Low	76 Å²	76	41 Å²	41	36%	0.355	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-43	177.3	175.5	-169.9	-179	0	0	108.2	L10 L95 N96 F101 L102 T103	L10-E99 HydrophobicContact CD2-CG 3.96Å; L95-E99 VanDerWaalsContact O-CA 3.29Å; L95-E99 WeakPolarHBondContact O-CA 3.28Å; L95-E99 VanDerWaalsContact O-CB 3.3Å; L95-E99 WeakPolarHBondContact O-CB 3.45Å; L95-E99 PolarHBondContact O-N 2.9Å; N96-E99 WeakPolarHBondContact O-CB 3.36Å; N96-E99 PolarHBondContact O-N 3.39Å; E99-F101 VanDerWaalsContact C-N 3.28Å; E99-F101 PolarHBondContact O-N 3.25Å; E99-L102 PolarHBondContact O-N 2.89Å; E99-T103 VanDerWaalsContact O-CB 3.22Å; E99-T103 WeakPolarHBondContact O-CB 3.48Å; E99-T103 PolarHBondContact O-N 3.24Å; E99-T103 PolarHBondContact O-OG1 2.96Å
100	P	68.5	Low	66.3	Low	57 Å²	57	44.6 Å²	44.6	37%	0.37	25%	0.245	S	C	.	.	H	α-helix	trans	-52.7	-42.6	164.1	-28.4	33.7	0	0	0	113	N96 A97 T98 T103 Q104	N96-P100 WeakPolarHBondContact O-CD 3.25Å; A97-P100 WeakPolarHBondContact O-CD 3.29Å; T98-P100 VanDerWaalsContact C-N 3.32Å; P100-T103 PolarHBondContact O-N 2.83Å; P100-Q104 WeakPolarHBondContact O-CB 3.42Å; P100-Q104 WeakPolarHBondContact O-CG 3.39Å; P100-Q104 PolarHBondContact O-N 3.37Å
101	F	71	Confident	67.9	Low	25 Å²	25	44.3 Å²	44.3	11%	0.11	24%	0.244	C	C	.	.	H	α-helix	trans	-70.1	-39.7	-179.7	-52.6	-42.4	0	0	0	112.6	A97 T98 E99 Q104 G105 M106 F425	A97-F101 WeakPolarHBondContact O-CD2 3.47Å; A97-F101 WeakPolarHBondContact O-CE2 3.45Å; A97-F101 WeakPolarHBondContact O-CZ 3.44Å; T98-F101 HydrophobicContact CG2-CD2 3.78Å; T98-F101 HydrophobicContact CG2-CE2 4.32Å; T98-F101 CarbonylContact O-C 3.54Å; T98-F101 VanDerWaalsContact O-CA 3.28Å; T98-F101 WeakPolarHBondContact O-CA 3.42Å; T98-F101 WeakPolarHBondContact O-CB 3.4Å; T98-F101 PolarHBondContact O-N 3.06Å; E99-F101 VanDerWaalsContact C-N 3.28Å; E99-F101 PolarHBondContact O-N 3.25Å; F101-Q104 CarbonylContact O-C 3.23Å; F101-Q104 PolarHBondContact O-N 2.91Å; F101-G105 PolarHBondContact O-N 3.2Å; F101-G105 VanDerWaalsContact O-N 3.1Å; F101-M106 HydrophobicContact CB-CB 4.07Å; F101-M106 HydrophobicContact CB-CE 3.97Å; F101-M106 HydrophobicContact CB-SD 4.07Å; F101-M106 HydrophobicContact CD1-CE 4.36Å; F101-M106 HydrophobicContact CG-CE 4.13Å; F101-M106 VanDerWaalsContact O-CB 3.24Å; F101-M106 WeakPolarHBondContact O-CB 3.3Å; F101-M106 PolarHBondContact O-N 3.49Å; F101-F425 HydrophobicContact CD1-CB 4.43Å; F101-F425 HydrophobicContact CD2-CB 4.31Å; F101-F425 HydrophobicContact CE1-CB 3.72Å; F101-F425 HydrophobicContact CE1-CD1 4.06Å; F101-F425 AromaticContact CE1-CG 3.88Å; F101-F425 HydrophobicContact CE1-CG 3.88Å; F101-F425 HydrophobicContact CE2-CB 3.64Å; F101-F425 HydrophobicContact CZ-CB 3.37Å; F101-F425 HydrophobicContact CZ-CD1 4.11Å; F101-F425 AromaticContact CZ-CG 3.95Å; F101-F425 HydrophobicContact CZ-CG 3.95Å
102	L	70.9	Confident	70	Confident	10 Å²	10	44.6 Å²	44.6	5%	0.052	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-41.2	173.1	-69.6	173.9	0	0	0	110.6	R6 T98 E99 G105 P108 I111 L507	R6-L102 PolarHBondContact NH1-O 3.47Å; T98-L102 WeakPolarHBondContact O-CG 3.4Å; T98-L102 PolarHBondContact O-N 2.84Å; E99-L102 PolarHBondContact O-N 2.89Å; L102-G105 PolarHBondContact O-N 3.03Å; L102-G105 VanDerWaalsContact O-N 3.16Å; L102-P108 HydrophobicContact CD2-CG 3.92Å; L102-I111 HydrophobicContact CD2-CD1 3.7Å; L102-I111 HydrophobicContact CG-CD1 3.99Å; L102-L507 HydrophobicContact CD1-CD2 4.33Å
103	T	71.8	Confident	72.1	Confident	97 Å²	97	51.8 Å²	51.8	60%	0.595	27%	0.272	S	S	*	.	H	α-helix	trans	-67.2	-38	176	-53.4	0	0	0	0	111.1	E99 P100 G105	E99-T103 VanDerWaalsContact O-CB 3.22Å; E99-T103 WeakPolarHBondContact O-CB 3.48Å; E99-T103 PolarHBondContact O-N 3.24Å; E99-T103 PolarHBondContact O-OG1 2.96Å; P100-T103 PolarHBondContact O-N 2.83Å; T103-G105 PolarHBondContact O-N 3Å
104	Q	72.9	Confident	73.8	Confident	148 Å²	148	48.2 Å²	48.2	69%	0.692	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-5.1	173.5	-73.6	167.2	15.5	0	0	113.5	P100 F101	P100-Q104 WeakPolarHBondContact O-CB 3.42Å; P100-Q104 WeakPolarHBondContact O-CG 3.39Å; P100-Q104 PolarHBondContact O-N 3.37Å; F101-Q104 CarbonylContact O-C 3.23Å; F101-Q104 PolarHBondContact O-N 2.91Å
105	G	73.9	Confident	75.3	Confident	45 Å²	45	48 Å²	48	46%	0.464	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	11.8	173.6	0	0	0	0	0	115.9	F101 L102 T103 H107	F101-G105 PolarHBondContact O-N 3.2Å; F101-G105 VanDerWaalsContact O-N 3.1Å; L102-G105 PolarHBondContact O-N 3.03Å; L102-G105 VanDerWaalsContact O-N 3.16Å; T103-G105 PolarHBondContact O-N 3Å; G105-H107 PolarHBondContact O-N 3.1Å
106	M	78.2	Confident	77	Confident	22 Å²	22	52 Å²	52	11%	0.108	27%	0.273	C	S	.	.			trans	-65.6	127.6	172	-169.5	179.9	-63	0	0	110.1	F101 H110 I111 E422	F101-M106 HydrophobicContact CB-CB 4.07Å; F101-M106 HydrophobicContact CB-CE 3.97Å; F101-M106 HydrophobicContact CB-SD 4.07Å; F101-M106 HydrophobicContact CD1-CE 4.36Å; F101-M106 HydrophobicContact CG-CE 4.13Å; F101-M106 VanDerWaalsContact O-CB 3.24Å; F101-M106 WeakPolarHBondContact O-CB 3.3Å; F101-M106 PolarHBondContact O-N 3.49Å; M106-H110 HydrophobicContact CG-CB 4.2Å; M106-H110 HydrophobicContact SD-CB 4.49Å; M106-I111 HydrophobicContact CG-CG1 4.31Å; M106-I111 HydrophobicContact SD-CD1 4.41Å; M106-I111 HydrophobicContact SD-CG1 3.72Å; M106-E422 HydrophobicContact CE-CB 3.55Å; M106-E422 HydrophobicContact CE-CG 3.74Å; M106-E422 HydrophobicContact SD-CB 4.33Å
107	H	82.7	Confident	78.5	Confident	114 Å²	114	51.4 Å²	51.4	53%	0.528	28%	0.275	S	S	.	.			trans	-69.8	134.6	179.9	-166.8	-88	0	0	0	110.6	G105 V109 H110	G105-H107 PolarHBondContact O-N 3.1Å; H107-V109 VanDerWaalsContact CE1-CG2 3.43Å; H107-V109 WeakPolarHBondContact CE1-CG2 3.28Å; H107-V109 WeakPolarHBondContact ND1-CB 3.37Å; H107-V109 WeakPolarHBondContact ND1-CG2 3.47Å; H107-V109 PolarHBondContact ND1-N 2.88Å; H107-V109 PolarHBondContact O-N 3.07Å; H107-H110 PolarHBondContact O-N 3.37Å
108	P	82.7	Confident	80	Confident	21 Å²	21	49.8 Å²	49.8	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-50.4	-32.8	-178	-28.8	32.4	0	0	0	114.7	Q9 L102 H110 I111 I112	Q9-P108 VanDerWaalsContact NE2-CG 3.33Å; L102-P108 HydrophobicContact CD2-CG 3.92Å; P108-H110 VanDerWaalsContact C-N 3.28Å; P108-H110 PolarHBondContact O-N 3.31Å; P108-I111 WeakPolarHBondContact O-CB 3.49Å; P108-I111 PolarHBondContact O-N 3.32Å; P108-I111 VanDerWaalsContact O-N 3.16Å; P108-I112 WeakPolarHBondContact O-CD1 3.43Å; P108-I112 VanDerWaalsContact O-CG1 3.28Å; P108-I112 WeakPolarHBondContact O-CG1 3.38Å; P108-I112 PolarHBondContact O-N 3.03Å
109	V	87.1	Confident	81.6	Confident	60 Å²	60	50.6 Å²	50.6	36%	0.364	27%	0.266	S	S	.	.	H	α-helix	trans	-59.1	-35.4	177.1	174.5	0	0	0	0	113	H107 R113	H107-V109 VanDerWaalsContact CE1-CG2 3.43Å; H107-V109 WeakPolarHBondContact CE1-CG2 3.28Å; H107-V109 WeakPolarHBondContact ND1-CB 3.37Å; H107-V109 WeakPolarHBondContact ND1-CG2 3.47Å; H107-V109 PolarHBondContact ND1-N 2.88Å; H107-V109 PolarHBondContact O-N 3.07Å; V109-R113 WeakPolarHBondContact O-CG 3.45Å; V109-R113 PolarHBondContact O-N 3.06Å
110	H	85.6	Confident	82.9	Confident	91 Å²	91	51.4 Å²	51.4	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-68.4	-41.1	176.7	-68.3	-67.4	0	0	0	111.3	M106 H107 P108 R113 A114	M106-H110 HydrophobicContact CG-CB 4.2Å; M106-H110 HydrophobicContact SD-CB 4.49Å; H107-H110 PolarHBondContact O-N 3.37Å; P108-H110 VanDerWaalsContact C-N 3.28Å; P108-H110 PolarHBondContact O-N 3.31Å; H110-R113 PolarHBondContact O-N 3.31Å; H110-A114 PolarHBondContact O-N 2.99Å; H110-A114 VanDerWaalsContact O-N 3.08Å
111	I	84.6	Confident	84.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-49.2	174.8	-58.6	167	0	0	0	109.6	T98 L102 M106 P108 R113 A114 L115 V426 L507	T98-I111 HydrophobicContact CG2-CD1 4.23Å; T98-I111 HydrophobicContact CG2-CG1 4.38Å; T98-I111 HydrophobicContact CG2-CG2 3.72Å; L102-I111 HydrophobicContact CD2-CD1 3.7Å; L102-I111 HydrophobicContact CG-CD1 3.99Å; M106-I111 HydrophobicContact CG-CG1 4.31Å; M106-I111 HydrophobicContact SD-CD1 4.41Å; M106-I111 HydrophobicContact SD-CG1 3.72Å; P108-I111 WeakPolarHBondContact O-CB 3.49Å; P108-I111 PolarHBondContact O-N 3.32Å; P108-I111 VanDerWaalsContact O-N 3.16Å; I111-R113 PolarHBondContact O-N 2.92Å; I111-A114 PolarHBondContact O-N 3.36Å; I111-A114 VanDerWaalsContact O-N 3.13Å; I111-L115 HydrophobicContact CG2-CD1 3.96Å; I111-L115 HydrophobicContact CG2-CG 4.31Å; I111-L115 WeakPolarHBondContact O-CG 3.41Å; I111-L115 PolarHBondContact O-N 3Å; I111-V426 HydrophobicContact CG1-CG2 4.35Å; I111-V426 HydrophobicContact CG2-CG1 4.2Å; I111-V426 HydrophobicContact CG2-CG2 4.36Å; I111-L507 HydrophobicContact CB-CD1 4.4Å; I111-L507 HydrophobicContact CG2-CD1 3.74Å
112	I	87.5	Confident	85	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.041	26%	0.264	C	S	.	.	H	α-helix	trans	-56.7	-46.8	178.8	-70	160.6	0	0	0	111.7	P108 A114 L115 Q116 I504 L507 R508	P108-I112 WeakPolarHBondContact O-CD1 3.43Å; P108-I112 VanDerWaalsContact O-CG1 3.28Å; P108-I112 WeakPolarHBondContact O-CG1 3.38Å; P108-I112 PolarHBondContact O-N 3.03Å; I112-A114 VanDerWaalsContact C-N 3.33Å; I112-A114 PolarHBondContact O-N 3.01Å; I112-L115 PolarHBondContact O-N 3.21Å; I112-Q116 WeakPolarHBondContact O-CG 3.35Å; I112-Q116 PolarHBondContact O-N 2.98Å; I112-I504 HydrophobicContact CB-CG2 4.44Å; I112-I504 HydrophobicContact CG1-CG2 4.19Å; I112-I504 HydrophobicContact CG2-CB 4.45Å; I112-I504 HydrophobicContact CG2-CG1 4.2Å; I112-I504 HydrophobicContact CG2-CG2 3.57Å; I112-L507 HydrophobicContact CD1-CB 4.26Å; I112-L507 HydrophobicContact CG1-CB 4.17Å; I112-L507 HydrophobicContact CG1-CD1 4.21Å; I112-R508 HydrophobicContact CD1-CG 3.48Å; I112-R508 VanDerWaalsContact CD1-CG 3.48Å
113	R	89.8	Confident	86	Confident	151 Å²	151	50.8 Å²	50.8	57%	0.57	27%	0.272	S	S	*	.	H	α-helix	trans	-62.9	-40	178.5	-75.4	178.9	179.7	175.2	1.7	111.9	V109 H110 I111 Q116 A117	V109-R113 WeakPolarHBondContact O-CG 3.45Å; V109-R113 PolarHBondContact O-N 3.06Å; H110-R113 PolarHBondContact O-N 3.31Å; I111-R113 PolarHBondContact O-N 2.92Å; R113-Q116 PolarHBondContact O-N 3.18Å; R113-A117 PolarHBondContact O-N 3.44Å; R113-A117 VanDerWaalsContact O-N 3.13Å
114	A	88.3	Confident	86.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-38.6	176.9	0	0	0	0	0	111.9	H110 I111 I112 A117 A118 Q423 V426	H110-A114 PolarHBondContact O-N 2.99Å; H110-A114 VanDerWaalsContact O-N 3.08Å; I111-A114 PolarHBondContact O-N 3.36Å; I111-A114 VanDerWaalsContact O-N 3.13Å; I112-A114 VanDerWaalsContact C-N 3.33Å; I112-A114 PolarHBondContact O-N 3.01Å; A114-A117 PolarHBondContact O-N 3.43Å; A114-A118 WeakPolarHBondContact O-CB 3.22Å; A114-A118 PolarHBondContact O-N 3.31Å; A114-Q423 HydrophobicContact CB-CB 4.17Å; A114-Q423 HydrophobicContact CB-CG 4.09Å; A114-V426 HydrophobicContact CB-CB 3.7Å; A114-V426 HydrophobicContact CB-CG1 3.74Å; A114-V426 HydrophobicContact CB-CG2 4.01Å
115	L	88.4	Confident	87.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-42.3	175.1	-70.6	174	0	0	0	112.8	I94 I111 I112 A117 A118 L119 V426 V430 I500 A503 I504 L507	I94-L115 HydrophobicContact CD1-CD2 4.03Å; I94-L115 HydrophobicContact CG2-CD1 4.22Å; I94-L115 HydrophobicContact CG2-CD2 3.6Å; I94-L115 HydrophobicContact CG2-CG 4.44Å; I111-L115 HydrophobicContact CG2-CD1 3.96Å; I111-L115 HydrophobicContact CG2-CG 4.31Å; I111-L115 WeakPolarHBondContact O-CG 3.41Å; I111-L115 PolarHBondContact O-N 3Å; I112-L115 PolarHBondContact O-N 3.21Å; L115-A117 VanDerWaalsContact C-N 3.32Å; L115-A117 PolarHBondContact O-N 2.79Å; L115-A118 PolarHBondContact O-N 3.07Å; L115-L119 WeakPolarHBondContact O-CB 3.4Å; L115-L119 PolarHBondContact O-N 3.2Å; L115-V426 HydrophobicContact CD2-CG1 3.8Å; L115-V426 HydrophobicContact CG-CG1 3.94Å; L115-V430 HydrophobicContact CD2-CG2 3.48Å; L115-V430 VanDerWaalsContact CD2-CG2 3.48Å; L115-I500 HydrophobicContact CB-CG2 3.95Å; L115-A503 HydrophobicContact CD1-CB 4.3Å; L115-I504 HydrophobicContact CB-CD1 4.1Å; L115-I504 HydrophobicContact CB-CG1 4.03Å; L115-I504 HydrophobicContact CD1-CG1 4.13Å; L115-L507 HydrophobicContact CD1-CD1 3.91Å
116	Q	91.4	Very high	88.4	Confident	87 Å²	87	40.4 Å²	40.4	41%	0.407	21%	0.212	S	C	.	.	H	α-helix	trans	-62.3	-40.2	175.4	-71.1	179.1	-34.2	0	0	112.2	I112 R113 T120 I504	I112-Q116 WeakPolarHBondContact O-CG 3.35Å; I112-Q116 PolarHBondContact O-N 2.98Å; R113-Q116 PolarHBondContact O-N 3.18Å; Q116-T120 PolarHBondContact O-N 2.99Å; Q116-T120 VanDerWaalsContact O-N 3.14Å; Q116-T120 PolarHBondContact O-OG1 3.16Å; Q116-I504 HydrophobicContact CG-CD1 3.5Å
117	A	91.8	Very high	88.8	Confident	34 Å²	34	41.9 Å²	41.9	28%	0.281	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-46.2	175.6	0	0	0	0	0	111.3	R113 A114 L115 L119 T120 D121 Y427	R113-A117 PolarHBondContact O-N 3.44Å; R113-A117 VanDerWaalsContact O-N 3.13Å; A114-A117 PolarHBondContact O-N 3.43Å; L115-A117 VanDerWaalsContact C-N 3.32Å; L115-A117 PolarHBondContact O-N 2.79Å; A117-L119 VanDerWaalsContact C-N 3.33Å; A117-L119 PolarHBondContact O-N 3.36Å; A117-T120 WeakPolarHBondContact O-CB 3.4Å; A117-T120 PolarHBondContact O-N 3.28Å; A117-D121 VanDerWaalsContact O-CG 3.26Å; A117-D121 PolarHBondContact O-N 3.32Å; A117-D121 VanDerWaalsContact O-N 3.09Å; A117-Y427 HydrophobicContact CB-CE2 4.28Å; A117-Y427 VanDerWaalsContact CB-OH 3.26Å; A117-Y427 WeakPolarHBondContact CB-OH 3.48Å; A117-Y427 PolarHBondContact O-OH 2.69Å
118	A	90	Very high	88.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.5	-41.8	177.2	0	0	0	0	0	111.9	A114 L115 T120 D121 V122 Y427 V430	A114-A118 WeakPolarHBondContact O-CB 3.22Å; A114-A118 PolarHBondContact O-N 3.31Å; L115-A118 PolarHBondContact O-N 3.07Å; A118-T120 PolarHBondContact O-N 2.89Å; A118-D121 WeakPolarHBondContact O-CB 3.28Å; A118-D121 PolarHBondContact O-N 2.91Å; A118-V122 VanDerWaalsContact O-CG2 3.31Å; A118-V122 WeakPolarHBondContact O-CG2 3.32Å; A118-V122 PolarHBondContact O-N 3.49Å; A118-Y427 HydrophobicContact CB-CD1 4.37Å; A118-Y427 HydrophobicContact CB-CD2 4.35Å; A118-Y427 HydrophobicContact CB-CE1 4.06Å; A118-Y427 HydrophobicContact CB-CE2 4.04Å; A118-Y427 PolarHBondContact N-OH 3.09Å; A118-V430 HydrophobicContact CB-CG1 4.39Å; A118-V430 HydrophobicContact CB-CG2 4.23Å
119	L	91.4	Very high	88.8	Confident	16 Å²	16	49.4 Å²	49.4	8%	0.084	26%	0.256	C	S	.	.	H	α-helix	trans	-59.6	-45.6	175	173	59.5	0	0	0	112	L115 A117 D121 V122 V123 K497 I500 E501	L115-L119 WeakPolarHBondContact O-CB 3.4Å; L115-L119 PolarHBondContact O-N 3.2Å; A117-L119 VanDerWaalsContact C-N 3.33Å; A117-L119 PolarHBondContact O-N 3.36Å; L119-D121 PolarHBondContact O-N 2.98Å; L119-V122 PolarHBondContact O-N 3.44Å; L119-V123 HydrophobicContact CD1-CG2 3.74Å; L119-V123 HydrophobicContact CG-CG2 4.39Å; L119-V123 VanDerWaalsContact O-CG2 3.31Å; L119-V123 WeakPolarHBondContact O-CG2 3.41Å; L119-V123 PolarHBondContact O-N 3.02Å; L119-K497 HydrophobicContact CD1-CB 4.19Å; L119-K497 HydrophobicContact CD2-CG 4.29Å; L119-I500 HydrophobicContact CB-CB 4.34Å; L119-I500 HydrophobicContact CB-CD1 3.84Å; L119-I500 HydrophobicContact CB-CG2 3.99Å; L119-I500 HydrophobicContact CD1-CB 4.43Å; L119-I500 HydrophobicContact CD1-CD1 3.93Å; L119-I500 HydrophobicContact CD2-CB 4.33Å; L119-I500 HydrophobicContact CD2-CG2 4.31Å; L119-I500 HydrophobicContact CG-CD1 4.43Å; L119-E501 HydrophobicContact CD2-CG 4.28Å
120	T	93.6	Very high	88.6	Confident	94 Å²	94	47.2 Å²	47.2	58%	0.577	24%	0.242	S	C	*	.	H	α-helix	trans	-59.5	-41.3	178.9	-55.4	0	0	0	0	110.9	Q116 A117 A118 A124	Q116-T120 PolarHBondContact O-N 2.99Å; Q116-T120 VanDerWaalsContact O-N 3.14Å; Q116-T120 PolarHBondContact O-OG1 3.16Å; A117-T120 WeakPolarHBondContact O-CB 3.4Å; A117-T120 PolarHBondContact O-N 3.28Å; A118-T120 PolarHBondContact O-N 2.89Å; T120-A124 WeakPolarHBondContact O-CB 3.02Å; T120-A124 PolarHBondContact O-N 2.85Å
121	D	91.8	Very high	88.4	Confident	42 Å²	42	43.8 Å²	43.8	23%	0.225	23%	0.231	C	C	.	.	H	α-helix	trans	-66.7	-42.6	178.2	-64.6	-35.7	0	0	0	112.7	A117 A118 L119 H125 K415 Y427	A117-D121 VanDerWaalsContact O-CG 3.26Å; A117-D121 PolarHBondContact O-N 3.32Å; A117-D121 VanDerWaalsContact O-N 3.09Å; A118-D121 WeakPolarHBondContact O-CB 3.28Å; A118-D121 PolarHBondContact O-N 2.91Å; L119-D121 PolarHBondContact O-N 2.98Å; D121-H125 WeakPolarHBondContact O-CB 3.2Å; D121-H125 PolarHBondContact O-N 2.88Å; D121-K415 HydrophobicContact CB-CD 4.4Å; D121-K415 IonicContact OD1-NZ 2.62Å; D121-K415 PolarHBondContact OD1-NZ 2.91Å; D121-K415 WeakPolarHBondContact OD2-CE 3.14Å; D121-K415 IonicContact OD2-NZ 2.86Å; D121-K415 PolarHBondContact OD2-NZ 2.96Å; D121-Y427 WeakPolarHBondContact OD2-CE1 2.9Å; D121-Y427 PolarHBondContact OD2-OH 3.46Å
122	V	91.2	Very high	88.5	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-50.9	176.3	167.6	0	0	0	0	110.8	A118 L119 A124 H125 C126 L408 I412 F434 Y496	A118-V122 VanDerWaalsContact O-CG2 3.31Å; A118-V122 WeakPolarHBondContact O-CG2 3.32Å; A118-V122 PolarHBondContact O-N 3.49Å; L119-V122 PolarHBondContact O-N 3.44Å; V122-A124 PolarHBondContact O-N 3.16Å; V122-H125 PolarHBondContact O-N 2.72Å; V122-C126 PolarHBondContact O-N 3.32Å; V122-C126 PolarHBondContact O-SG 3.41Å; V122-L408 HydrophobicContact CG1-CD1 4.14Å; V122-L408 HydrophobicContact CG1-CD2 4.27Å; V122-I412 HydrophobicContact CG2-CD1 3.32Å; V122-I412 HydrophobicContact CG2-CG1 3.98Å; V122-F434 HydrophobicContact CG1-CZ 4.06Å; V122-F434 HydrophobicContact CG2-CE2 3.97Å; V122-F434 HydrophobicContact CG2-CZ 3.99Å; V122-Y496 HydrophobicContact CG1-CD2 3.77Å; V122-Y496 HydrophobicContact CG1-CG 4.27Å
123	V	91.6	Very high	88.5	Confident	36 Å²	36	52.7 Å²	52.7	22%	0.218	28%	0.28	C	S	.	.	H	α-helix	trans	-63.6	-42.4	-177.6	174.2	0	0	0	0	111.1	L119 N127 V493	L119-V123 HydrophobicContact CD1-CG2 3.74Å; L119-V123 HydrophobicContact CG-CG2 4.39Å; L119-V123 VanDerWaalsContact O-CG2 3.31Å; L119-V123 WeakPolarHBondContact O-CG2 3.41Å; L119-V123 PolarHBondContact O-N 3.02Å; V123-N127 WeakPolarHBondContact O-CB 3.42Å; V123-N127 PolarHBondContact O-N 3.01Å; V123-N127 VanDerWaalsContact O-N 3.15Å; V123-N127 PolarHBondContact O-ND2 3.5Å; V123-N127 VanDerWaalsContact O-ND2 3.1Å; V123-V493 HydrophobicContact CG1-CG1 4.03Å; V123-V493 HydrophobicContact CG2-CG1 4.22Å
124	A	91.6	Very high	88.3	Confident	44 Å²	44	46.3 Å²	46.3	36%	0.364	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-46.2	175.4	0	0	0	0	0	111.3	T120 V122 C126 N127 D128	T120-A124 WeakPolarHBondContact O-CB 3.02Å; T120-A124 PolarHBondContact O-N 2.85Å; V122-A124 PolarHBondContact O-N 3.16Å; A124-C126 PolarHBondContact O-N 3.1Å; A124-N127 PolarHBondContact O-N 3.3Å; A124-D128 WeakPolarHBondContact O-CB 2.99Å; A124-D128 VanDerWaalsContact O-CG 3.32Å; A124-D128 PolarHBondContact O-N 3.4Å
125	H	89.5	Confident	88.3	Confident	28 Å²	28	50.4 Å²	50.4	13%	0.13	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-43.8	-179.2	-164.5	90.2	0	0	0	112.9	D121 V122 N127 K129 M130 L408	D121-H125 WeakPolarHBondContact O-CB 3.2Å; D121-H125 PolarHBondContact O-N 2.88Å; V122-H125 PolarHBondContact O-N 2.72Å; H125-N127 VanDerWaalsContact C-N 3.35Å; H125-N127 PolarHBondContact O-N 3.35Å; H125-K129 PolarHBondContact O-N 3.1Å; H125-M130 PolarHBondContact O-N 2.79Å; H125-L408 HydrophobicContact CB-CD2 4.37Å
126	C	88	Confident	88	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-58.3	-45.1	175.8	-71.4	0	0	0	0	112.2	V122 A124 G131 L489 V493	V122-C126 PolarHBondContact O-N 3.32Å; V122-C126 PolarHBondContact O-SG 3.41Å; A124-C126 PolarHBondContact O-N 3.1Å; C126-G131 PolarHBondContact O-N 2.58Å; C126-L489 HydrophobicContact CB-CD1 3.93Å; C126-V493 HydrophobicContact CB-CG2 3.84Å
127	N	85.4	Confident	87.6	Confident	53 Å²	53	54.2 Å²	54.2	28%	0.283	30%	0.302	S	S	.	.	I	π-helix	trans	-72.8	-37.8	-175.8	-75.9	-35.5	0	0	0	113.3	V123 A124 H125 K396	V123-N127 WeakPolarHBondContact O-CB 3.42Å; V123-N127 PolarHBondContact O-N 3.01Å; V123-N127 VanDerWaalsContact O-N 3.15Å; V123-N127 PolarHBondContact O-ND2 3.5Å; V123-N127 VanDerWaalsContact O-ND2 3.1Å; A124-N127 PolarHBondContact O-N 3.3Å; H125-N127 VanDerWaalsContact C-N 3.35Å; H125-N127 PolarHBondContact O-N 3.35Å; N127-K396 PolarHBondContact O-NZ 2.91Å
128	D	84.5	Confident	87.4	Confident	134 Å²	134	55.1 Å²	55.1	72%	0.717	30%	0.302	S	S	*	.	I	π-helix	trans	-92.9	-35.9	-169.4	-66.6	-16.3	0	0	0	113.4	A124	A124-D128 WeakPolarHBondContact O-CB 2.99Å; A124-D128 VanDerWaalsContact O-CG 3.32Å; A124-D128 PolarHBondContact O-N 3.4Å
129	K	81.9	Confident	87.1	Confident	158 Å²	158	58.3 Å²	58.3	69%	0.687	32%	0.316	S	S	*	.	I	π-helix	trans	-117	-39.3	-166.6	-66.7	-175.3	177.2	-175.5	0	114.8	H125	H125-K129 PolarHBondContact O-N 3.1Å
130	M	82.9	Confident	86.9	Confident	15 Å²	15	64.2 Å²	64.2	7%	0.074	34%	0.344	C	S	.	.	I	π-helix	trans	-93.3	-23.9	-172.6	-61.6	179	69.7	0	0	114	H125 K132 L398 A404 A407 L408	H125-M130 PolarHBondContact O-N 2.79Å; M130-K132 PolarHBondContact O-N 3.5Å; M130-K132 VanDerWaalsContact O-N 3.13Å; M130-L398 HydrophobicContact CB-CD2 3.4Å; M130-L398 VanDerWaalsContact CB-CD2 3.4Å; M130-A404 HydrophobicContact CE-CB 3.99Å; M130-A407 HydrophobicContact CE-CB 3.57Å; M130-A407 HydrophobicContact SD-CB 4.4Å; M130-L408 HydrophobicContact SD-CD2 3.85Å; M130-L408 HydrophobicContact SD-CG 3.97Å
131	G	80.2	Confident	86.5	Confident	19 Å²	19	63.1 Å²	63.1	20%	0.196	33%	0.332	C	S	.	.			trans	-68.3	107.4	-174.5	0	0	0	0	0	113.4	C126 V397	C126-G131 PolarHBondContact O-N 2.58Å; G131-V397 WeakPolarHBondContact CA-O 3.38Å
132	K	86.7	Confident	86.3	Confident	107 Å²	107	61.1 Å²	61.1	47%	0.465	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	127.8	170.5	-178.6	-177.6	175.1	-172.8	0	109.8	M130 K396 V397 W486	M130-K132 PolarHBondContact O-N 3.5Å; M130-K132 VanDerWaalsContact O-N 3.13Å; K132-K396 CarbonylContact O-C 3.55Å; K132-K396 WeakPolarHBondContact O-CA 3.38Å; K132-V397 HydrophobicContact CB-CG2 4.14Å; K132-V397 PolarHBondContact N-O 3.46Å; K132-V397 PolarHBondContact O-N 2.82Å; K132-W486 HydrophobicContact CB-CZ3 4.43Å; K132-W486 HydrophobicContact CD-CH2 3.4Å; K132-W486 VanDerWaalsContact CD-CH2 3.4Å; K132-W486 HydrophobicContact CD-CZ2 3.98Å; K132-W486 HydrophobicContact CD-CZ3 3.83Å
133	C	88	Confident	86.1	Confident	88 Å²	88	62.1 Å²	62.1	60%	0.595	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	135.2	175.2	-64.2	0	0	0	0	111	P395	C133-P395 CarbonylContact C-O 3.58Å; C133-P395 VanDerWaalsContact CA-O 3.24Å; C133-P395 WeakPolarHBondContact CA-O 3.31Å
134	I	87	Confident	85.9	Confident	16 Å²	16	63.1 Å²	63.1	8%	0.082	33%	0.329	C	S	.	.			trans	-108.8	147	175.9	-72.6	-172.5	0	0	0	110	I136 E141 V145 P395 V397	I134-I136 PolarHBondContact O-N 3.47Å; I134-E141 HydrophobicContact CG2-CB 3.95Å; I134-V145 HydrophobicContact CD1-CG2 3.31Å; I134-P395 PolarHBondContact N-O 2.98Å; I134-V397 HydrophobicContact CD1-CB 4.01Å; I134-V397 HydrophobicContact CD1-CG1 3.31Å; I134-V397 HydrophobicContact CD1-CG2 3.52Å; I134-V397 HydrophobicContact CG1-CG1 4.07Å; I134-V397 HydrophobicContact CG1-CG2 3.78Å
135	N	86.7	Confident	85.6	Confident	86 Å²	86	61 Å²	61	46%	0.46	31%	0.311	S	S	.	.			trans	-83.9	108.3	172.1	-173.5	0.1	0	0	0	110.9	N137 N138 E141	N135-N137 PolarHBondContact O-N 2.59Å; N135-N137 VanDerWaalsContact O-N 3.12Å; N135-N137 WeakPolarHBondContact OD1-CB 3.24Å; N135-N137 PolarHBondContact OD1-N 2.66Å; N135-N137 VanDerWaalsContact OD1-N 3.09Å; N135-N138 HydrophobicContact CB-CB 4.17Å; N135-N138 PolarHBondContact O-N 3.07Å; N135-E141 PolarHBondContact N-OE2 3.13Å; N135-E141 VanDerWaalsContact N-OE2 3.12Å
136	I	82.4	Confident	85.5	Confident	22 Å²	22	59.7 Å²	59.7	11%	0.113	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.7	179.2	-54.9	164.4	0	0	0	112.2	I134 N138 F392 P395	I134-I136 PolarHBondContact O-N 3.47Å; I136-N138 VanDerWaalsContact C-N 3.32Å; I136-F392 HydrophobicContact CG2-CD1 3.89Å; I136-F392 HydrophobicContact CG2-CD2 3.73Å; I136-F392 HydrophobicContact CG2-CE1 3.64Å; I136-F392 HydrophobicContact CG2-CE2 3.5Å; I136-F392 VanDerWaalsContact CG2-CE2 3.5Å; I136-F392 HydrophobicContact CG2-CG 3.93Å; I136-F392 HydrophobicContact CG2-CZ 3.44Å; I136-F392 VanDerWaalsContact CG2-CZ 3.44Å; I136-P395 HydrophobicContact CD1-CB 3.8Å; I136-P395 HydrophobicContact CD1-CG 4.19Å; I136-P395 HydrophobicContact CG1-CB 3.74Å
137	N	83.7	Confident	85.5	Confident	146 Å²	146	65 Å²	65	78%	0.781	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-15.2	179.8	-61.2	-39.9	0	0	0	112.9	N135 E139	N135-N137 PolarHBondContact O-N 2.59Å; N135-N137 VanDerWaalsContact O-N 3.12Å; N135-N137 WeakPolarHBondContact OD1-CB 3.24Å; N135-N137 PolarHBondContact OD1-N 2.66Å; N135-N137 VanDerWaalsContact OD1-N 3.09Å; N137-E139 PolarHBondContact O-N 3.36Å
138	N	86.7	Confident	85.4	Confident	53 Å²	53	63.2 Å²	63.2	28%	0.283	32%	0.317	S	S	.	.			trans	-86.2	104.7	174.8	-172	-2.2	0	0	0	109.1	N135 I136 E140 E141 L142	N135-N138 HydrophobicContact CB-CB 4.17Å; N135-N138 PolarHBondContact O-N 3.07Å; I136-N138 VanDerWaalsContact C-N 3.32Å; N138-E140 VanDerWaalsContact C-N 3.28Å; N138-E140 PolarHBondContact O-N 3.34Å; N138-E140 PolarHBondContact OD1-N 3.24Å; N138-E141 HydrophobicContact CB-CB 4.23Å; N138-E141 HydrophobicContact CB-CG 4.33Å; N138-E141 WeakPolarHBondContact ND2-CG 3.29Å; N138-E141 PolarHBondContact ND2-OE1 3.32Å; N138-E141 PolarHBondContact O-N 2.68Å; N138-L142 PolarHBondContact O-N 2.82Å
139	E	85.2	Confident	85.2	Confident	66 Å²	66	57.6 Å²	57.6	31%	0.308	29%	0.288	S	S	.	.	H	α-helix	trans	-62.6	-35.4	-176.7	-171.4	163.9	150.7	0	0	112.5	N137 L142 L143 H164 K171	N137-E139 PolarHBondContact O-N 3.36Å; E139-L142 PolarHBondContact O-N 3.01Å; E139-L143 HydrophobicContact CG-CD1 3.96Å; E139-L143 HydrophobicContact CG-CG 4.2Å; E139-L143 WeakPolarHBondContact O-CB 3.44Å; E139-L143 WeakPolarHBondContact O-CG 3.3Å; E139-L143 PolarHBondContact O-N 2.9Å; E139-H164 IonicContact OE1-CE1 3.48Å; E139-H164 IonicContact OE1-ND1 3.8Å; E139-H164 PolarHBondContact OE1-ND1 3.46Å; E139-K171 IonicContact OE2-NZ 2.74Å; E139-K171 PolarHBondContact OE2-NZ 2.7Å
140	E	86.5	Confident	85.1	Confident	140 Å²	140	50.2 Å²	50.2	65%	0.654	26%	0.256	S	S	*	.	H	α-helix	trans	-65.2	-44	179.7	-64.6	-172.7	165.1	0	0	112.1	N138 L142 L143 H144	N138-E140 VanDerWaalsContact C-N 3.28Å; N138-E140 PolarHBondContact O-N 3.34Å; N138-E140 PolarHBondContact OD1-N 3.24Å; E140-L142 VanDerWaalsContact C-N 3.33Å; E140-L142 PolarHBondContact O-N 3.22Å; E140-L143 PolarHBondContact O-N 3.48Å; E140-H144 PolarHBondContact O-CD2 2.63Å; E140-H144 PolarHBondContact O-N 2.77Å
141	E	85.1	Confident	84.7	Confident	72 Å²	72	51 Å²	51	34%	0.336	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-43.1	176.1	-79.3	175	-140.9	0	0	111.4	I134 N135 N138 H144 V145	I134-E141 HydrophobicContact CG2-CB 3.95Å; N135-E141 PolarHBondContact N-OE2 3.13Å; N135-E141 VanDerWaalsContact N-OE2 3.12Å; N138-E141 HydrophobicContact CB-CB 4.23Å; N138-E141 HydrophobicContact CB-CG 4.33Å; N138-E141 WeakPolarHBondContact ND2-CG 3.29Å; N138-E141 PolarHBondContact ND2-OE1 3.32Å; N138-E141 PolarHBondContact O-N 2.68Å; E141-H144 PolarHBondContact O-N 3.3Å; E141-V145 PolarHBondContact O-N 3.32Å
142	L	86.9	Confident	84.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.2	-44.8	177.2	-177.1	64.8	0	0	0	111.2	N138 E139 E140 H144 V145 V146 V167 V388 V391 F392	N138-L142 PolarHBondContact O-N 2.82Å; E139-L142 PolarHBondContact O-N 3.01Å; E140-L142 VanDerWaalsContact C-N 3.33Å; E140-L142 PolarHBondContact O-N 3.22Å; L142-H144 VanDerWaalsContact C-N 3.27Å; L142-H144 PolarHBondContact O-N 3.46Å; L142-V145 PolarHBondContact O-N 2.68Å; L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.21Å; L142-V146 PolarHBondContact O-N 2.7Å; L142-V167 HydrophobicContact CD2-CB 4.25Å; L142-V167 HydrophobicContact CD2-CG1 3.63Å; L142-V167 HydrophobicContact CD2-CG2 3.65Å; L142-V167 HydrophobicContact CG-CG2 4.03Å; L142-V388 HydrophobicContact CD2-CG1 4.38Å; L142-V391 HydrophobicContact CD1-CB 4.12Å; L142-V391 HydrophobicContact CD1-CG1 3.76Å; L142-F392 HydrophobicContact CD1-CE2 4.45Å; L142-F392 HydrophobicContact CD2-CE2 3.75Å
143	L	87.5	Confident	83.1	Confident	21 Å²	21	48.6 Å²	48.6	11%	0.11	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-35.1	176.7	-71.2	171.4	0	0	0	112	E139 E140 V146 R147 M163 H164 V167	E139-L143 HydrophobicContact CG-CD1 3.96Å; E139-L143 HydrophobicContact CG-CG 4.2Å; E139-L143 WeakPolarHBondContact O-CB 3.44Å; E139-L143 WeakPolarHBondContact O-CG 3.3Å; E139-L143 PolarHBondContact O-N 2.9Å; E140-L143 PolarHBondContact O-N 3.48Å; L143-V146 PolarHBondContact O-N 2.78Å; L143-R147 WeakPolarHBondContact O-CB 2.9Å; L143-R147 PolarHBondContact O-N 3.35Å; L143-M163 HydrophobicContact CD2-CB 3.66Å; L143-H164 VanDerWaalsContact CD1-CE1 3.48Å; L143-H164 WeakPolarHBondContact CD1-CE1 3.44Å; L143-V167 HydrophobicContact CD2-CG2 4.22Å
144	H	86.6	Confident	82.1	Confident	57 Å²	57	45.3 Å²	45.3	26%	0.264	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-41.7	174.5	-75.7	-55.4	0	0	0	112.9	E140 E141 L142 S148 N484	E140-H144 PolarHBondContact O-CD2 2.63Å; E140-H144 PolarHBondContact O-N 2.77Å; E141-H144 PolarHBondContact O-N 3.3Å; L142-H144 VanDerWaalsContact C-N 3.27Å; L142-H144 PolarHBondContact O-N 3.46Å; H144-S148 PolarHBondContact O-N 3.35Å; H144-S148 PolarHBondContact O-OG 3.37Å; H144-N484 HydrophobicContact CB-CB 4.29Å
145	V	86.9	Confident	81.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.4	-48.4	176	-177.2	0	0	0	0	110.5	I134 E141 L142 R147 S148 C149 V387 V391 V397 W486 P488	I134-V145 HydrophobicContact CD1-CG2 3.31Å; E141-V145 PolarHBondContact O-N 3.32Å; L142-V145 PolarHBondContact O-N 2.68Å; V145-R147 VanDerWaalsContact C-N 3.33Å; V145-R147 PolarHBondContact O-N 3.12Å; V145-S148 WeakPolarHBondContact O-CB 3.32Å; V145-S148 PolarHBondContact O-N 2.98Å; V145-S148 VanDerWaalsContact O-N 3.1Å; V145-C149 PolarHBondContact O-N 3.37Å; V145-V387 HydrophobicContact CG1-CG1 4.25Å; V145-V391 HydrophobicContact CG1-CG2 3.81Å; V145-V397 HydrophobicContact CG1-CG1 4.32Å; V145-V397 HydrophobicContact CG2-CG1 3.97Å; V145-W486 HydrophobicContact CG2-CB 4.18Å; V145-P488 HydrophobicContact CG1-CG 4.07Å
146	V	86.9	Confident	80.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-41.2	-179.1	-177	0	0	0	0	111	L142 L143 S148 C149 I150 M163 A384 V387 V388	L142-V146 VanDerWaalsContact O-CG2 3.31Å; L142-V146 WeakPolarHBondContact O-CG2 3.21Å; L142-V146 PolarHBondContact O-N 2.7Å; L143-V146 PolarHBondContact O-N 2.78Å; V146-S148 VanDerWaalsContact C-N 3.27Å; V146-S148 PolarHBondContact O-N 3.42Å; V146-C149 PolarHBondContact O-N 2.74Å; V146-I150 HydrophobicContact CG1-CD1 3.39Å; V146-I150 HydrophobicContact CG1-CG1 4.26Å; V146-I150 WeakPolarHBondContact O-CB 3.49Å; V146-I150 WeakPolarHBondContact O-CG1 3.22Å; V146-I150 PolarHBondContact O-N 2.98Å; V146-M163 HydrophobicContact CB-CG 4.32Å; V146-M163 HydrophobicContact CG1-CB 4.34Å; V146-M163 HydrophobicContact CG1-CG 3.73Å; V146-M163 HydrophobicContact CG1-SD 4.46Å; V146-A384 HydrophobicContact CG1-CB 4.3Å; V146-V387 HydrophobicContact CG2-CG1 4.3Å; V146-V388 HydrophobicContact CG1-CG2 4.49Å; V146-V388 HydrophobicContact CG2-CG2 3.35Å
147	R	87.1	Confident	79.9	Confident	113 Å²	113	50 Å²	50	43%	0.426	28%	0.282	S	S	.	.	H	α-helix	trans	-58.1	-39.7	173.8	-176.9	176.2	-66.8	-172.8	-0.5	112.1	L143 V145 G151 M159 M163	L143-R147 WeakPolarHBondContact O-CB 2.9Å; L143-R147 PolarHBondContact O-N 3.35Å; V145-R147 VanDerWaalsContact C-N 3.33Å; V145-R147 PolarHBondContact O-N 3.12Å; R147-G151 WeakPolarHBondContact O-CA 3.19Å; R147-G151 PolarHBondContact O-N 3.21Å; R147-M159 HydrophobicContact CG-SD 3.79Å; R147-M163 HydrophobicContact CB-SD 3.62Å; R147-M163 HydrophobicContact CG-SD 4.36Å
148	S	83.7	Confident	79.7	Confident	14 Å²	14	45.6 Å²	45.6	10%	0.098	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-43.5	-178.9	-59.9	0	0	0	0	111.7	H144 V145 V146 N484 M485 W486	H144-S148 PolarHBondContact O-N 3.35Å; H144-S148 PolarHBondContact O-OG 3.37Å; V145-S148 WeakPolarHBondContact O-CB 3.32Å; V145-S148 PolarHBondContact O-N 2.98Å; V145-S148 VanDerWaalsContact O-N 3.1Å; V146-S148 VanDerWaalsContact C-N 3.27Å; V146-S148 PolarHBondContact O-N 3.42Å; S148-N484 PolarHBondContact OG-O 3.42Å; S148-M485 WeakPolarHBondContact OG-CA 3.4Å; S148-W486 WeakPolarHBondContact CB-O 3.41Å; S148-W486 PolarHBondContact OG-N 3.43Å
149	C	81	Confident	79.4	Confident	16 Å²	16	44 Å²	44	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-75.8	-39.7	-178.3	-58.8	0	0	0	0	113	V145 V146 V387	V145-C149 PolarHBondContact O-N 3.37Å; V146-C149 PolarHBondContact O-N 2.74Å; C149-V387 HydrophobicContact CB-CG1 4.23Å; C149-V387 HydrophobicContact CB-CG2 3.71Å
150	I	80.4	Confident	79.4	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-83.1	-17.9	-176.2	-62.2	174.6	0	0	0	112.4	V146 S152 N153 I154 M159 V162 M163 A384	V146-I150 HydrophobicContact CG1-CD1 3.39Å; V146-I150 HydrophobicContact CG1-CG1 4.26Å; V146-I150 WeakPolarHBondContact O-CB 3.49Å; V146-I150 WeakPolarHBondContact O-CG1 3.22Å; V146-I150 PolarHBondContact O-N 2.98Å; I150-S152 PolarHBondContact O-N 2.99Å; I150-N153 PolarHBondContact O-N 3.36Å; I150-N153 VanDerWaalsContact O-N 3.08Å; I150-I154 HydrophobicContact CG2-CB 4.38Å; I150-I154 HydrophobicContact CG2-CD1 3.14Å; I150-I154 HydrophobicContact CG2-CG1 3.52Å; I150-M159 HydrophobicContact CG2-CG 4.47Å; I150-V162 HydrophobicContact CD1-CG1 4.47Å; I150-M163 HydrophobicContact CD1-CG 4.41Å; I150-A384 HydrophobicContact CD1-CB 3.24Å; I150-A384 HydrophobicContact CG1-CB 4.27Å
151	G	73.3	Confident	79.4	Confident	33 Å²	33	39.8 Å²	39.8	34%	0.34	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-26.8	-169.2	0	0	0	0	0	116	R147	R147-G151 WeakPolarHBondContact O-CA 3.19Å; R147-G151 PolarHBondContact O-N 3.21Å
152	S	68.1	Low	79.4	Confident	42 Å²	42	36.3 Å²	36.3	29%	0.294	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-21.1	-177	57.3	0	0	0	0	115	G28 I150	G28-S152 WeakPolarHBondContact O-CB 3.42Å; I150-S152 PolarHBondContact O-N 2.99Å
153	N	65.3	Low	79.4	Confident	33 Å²	33	36.4 Å²	36.4	18%	0.176	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-10.5	-162.7	-65.1	-16.9	0	0	0	114.4	S47 I150 N380	S47-N153 PolarHBondContact OG-OD1 3.36Å; I150-N153 PolarHBondContact O-N 3.36Å; I150-N153 VanDerWaalsContact O-N 3.08Å; N153-N380 WeakPolarHBondContact CB-OD1 3.35Å
154	I	67.3	Low	79.5	Confident	19 Å²	19	39 Å²	39	10%	0.097	23%	0.225	C	C	.	.	S	Bend	trans	-125.9	143.2	-173.7	-44.2	-173.3	0	0	0	112	I150 W158 V162 N380	I150-I154 HydrophobicContact CG2-CB 4.38Å; I150-I154 HydrophobicContact CG2-CD1 3.14Å; I150-I154 HydrophobicContact CG2-CG1 3.52Å; I154-W158 HydrophobicContact CG2-CB 3.61Å; I154-W158 HydrophobicContact CG2-CD2 4.32Å; I154-W158 HydrophobicContact CG2-CE3 3.88Å; I154-W158 HydrophobicContact CG2-CG 4.29Å; I154-V162 HydrophobicContact CD1-CG1 4.48Å; I154-N380 HydrophobicContact CD1-CB 3.48Å; I154-N380 VanDerWaalsContact CD1-CB 3.48Å; I154-N380 HydrophobicContact CG1-CB 3.85Å
155	S	67.5	Low	79.7	Confident	55 Å²	55	36.9 Å²	36.9	39%	0.385	22%	0.215	S	C	.	.			trans	-53.4	143.2	159.7	76.8	0	0	0	0	112.1	A157 W158 M159	S155-A157 PolarHBondContact O-N 3.05Å; S155-A157 VanDerWaalsContact O-N 3.12Å; S155-W158 PolarHBondContact O-N 3.19Å; S155-M159 PolarHBondContact O-N 3.46Å
156	S	70.7	Confident	79.9	Confident	98 Å²	98	36.9 Å²	36.9	69%	0.685	22%	0.215	S	C	*	.	H	α-helix	trans	-57.9	-29.9	-177.2	55.1	0	0	0	0	113.7
157	A	71.5	Confident	80.1	Confident	68 Å²	68	36.9 Å²	36.9	56%	0.562	22%	0.215	S	C	*	.	H	α-helix	trans	-65.8	-41.7	-178.8	0	0	0	0	0	112.5	S155	S155-A157 PolarHBondContact O-N 3.05Å; S155-A157 VanDerWaalsContact O-N 3.12Å
158	W	78.6	Confident	80.3	Confident	55 Å²	55	34.6 Å²	34.6	21%	0.208	21%	0.212	C	C	.	.	H	α-helix	trans	-82.9	-27.2	-175.5	-50.2	-14	0	0	0	111.9	I154 S155 N160 I161 V162 I199 I373 M377	I154-W158 HydrophobicContact CG2-CB 3.61Å; I154-W158 HydrophobicContact CG2-CD2 4.32Å; I154-W158 HydrophobicContact CG2-CE3 3.88Å; I154-W158 HydrophobicContact CG2-CG 4.29Å; S155-W158 PolarHBondContact O-N 3.19Å; W158-N160 VanDerWaalsContact C-N 3.31Å; W158-N160 PolarHBondContact O-N 3.34Å; W158-I161 PolarHBondContact O-N 3.28Å; W158-I161 VanDerWaalsContact O-N 3.16Å; W158-V162 WeakPolarHBondContact O-CG2 3.22Å; W158-V162 PolarHBondContact O-N 2.65Å; W158-I199 HydrophobicContact CD2-CD1 4.03Å; W158-I199 HydrophobicContact CG-CD1 4.32Å; W158-I199 HydrophobicContact CG-CG2 4.2Å; W158-I199 HydrophobicContact CH2-CD1 4.45Å; W158-I199 HydrophobicContact CZ2-CD1 3.49Å; W158-I199 VanDerWaalsContact CZ2-CD1 3.49Å; W158-I373 HydrophobicContact CH2-CB 4.35Å; W158-I373 HydrophobicContact CH2-CD1 4.35Å; W158-I373 HydrophobicContact CH2-CG1 4.19Å; W158-I373 HydrophobicContact CH2-CG2 3.29Å; W158-I373 HydrophobicContact CZ2-CG2 3.97Å; W158-I373 HydrophobicContact CZ3-CG2 3.68Å; W158-M377 HydrophobicContact CE3-CG 3.93Å; W158-M377 HydrophobicContact CE3-SD 4.46Å; W158-M377 HydrophobicContact CZ3-CG 4.15Å
159	M	81.8	Confident	80.7	Confident	19 Å²	19	34 Å²	34	9%	0.094	21%	0.207	C	C	.	.	H	α-helix	trans	-54.1	-46.2	-177.4	-168.1	-177.9	-67.1	0	0	111.9	R147 I150 S155 I161 V162 M163	R147-M159 HydrophobicContact CG-SD 3.79Å; I150-M159 HydrophobicContact CG2-CG 4.47Å; S155-M159 PolarHBondContact O-N 3.46Å; M159-I161 PolarHBondContact O-N 3.26Å; M159-V162 PolarHBondContact O-N 2.99Å; M159-M163 HydrophobicContact CG-CE 3.94Å; M159-M163 HydrophobicContact CG-CG 4.23Å; M159-M163 HydrophobicContact CG-SD 3.99Å; M159-M163 WeakPolarHBondContact O-CB 2.89Å; M159-M163 WeakPolarHBondContact O-CG 3.02Å; M159-M163 PolarHBondContact O-N 3.17Å
160	N	85.1	Confident	81.2	Confident	74 Å²	74	33.2 Å²	33.2	40%	0.396	20%	0.202	S	C	.	.	H	α-helix	trans	-60.4	-45.3	-179.8	-69.6	-25.6	0	0	0	112.2	W158 M163 H164	W158-N160 VanDerWaalsContact C-N 3.31Å; W158-N160 PolarHBondContact O-N 3.34Å; N160-M163 PolarHBondContact O-N 2.74Å; N160-M163 VanDerWaalsContact OD1-CE 3.3Å; N160-M163 WeakPolarHBondContact OD1-CE 3.18Å; N160-H164 PolarHBondContact O-CD2 2.84Å; N160-H164 PolarHBondContact O-N 3.47Å; N160-H164 VanDerWaalsContact O-N 3.1Å
161	I	85.4	Confident	81.6	Confident	43 Å²	43	36.8 Å²	36.8	22%	0.221	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-47.8	-179.4	-54.8	172.1	0	0	0	109.8	W158 M159 M163 H164 M165 I199 E200	W158-I161 PolarHBondContact O-N 3.28Å; W158-I161 VanDerWaalsContact O-N 3.16Å; M159-I161 PolarHBondContact O-N 3.26Å; I161-M163 PolarHBondContact O-N 2.77Å; I161-H164 PolarHBondContact O-N 2.87Å; I161-M165 HydrophobicContact CG2-CE 3.83Å; I161-M165 HydrophobicContact CG2-CG 4.39Å; I161-M165 HydrophobicContact CG2-SD 4.11Å; I161-M165 VanDerWaalsContact O-CB 3.32Å; I161-M165 WeakPolarHBondContact O-CB 3.11Å; I161-M165 VanDerWaalsContact O-CG 3.24Å; I161-M165 WeakPolarHBondContact O-CG 3.4Å; I161-M165 PolarHBondContact O-N 3.31Å; I161-I199 HydrophobicContact CD1-CG2 4.19Å; I161-E200 HydrophobicContact CD1-CG 4.26Å
162	V	85.9	Confident	82.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.1	-44	179.3	172.4	0	0	0	0	111.5	I150 I154 W158 M159 M165 A166 L381 A384	I150-V162 HydrophobicContact CD1-CG1 4.47Å; I154-V162 HydrophobicContact CD1-CG1 4.48Å; W158-V162 WeakPolarHBondContact O-CG2 3.22Å; W158-V162 PolarHBondContact O-N 2.65Å; M159-V162 PolarHBondContact O-N 2.99Å; V162-M165 HydrophobicContact CG2-CE 4.37Å; V162-M165 PolarHBondContact O-N 2.75Å; V162-A166 VanDerWaalsContact O-CB 3.3Å; V162-A166 WeakPolarHBondContact O-CB 3.5Å; V162-A166 PolarHBondContact O-N 3.37Å; V162-L381 HydrophobicContact CG1-CB 4.18Å; V162-L381 HydrophobicContact CG1-CD1 3.89Å; V162-A384 HydrophobicContact CG1-CB 3.99Å
163	M	87.1	Confident	83.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-62.2	-51.5	179.8	-72.5	-173.1	-57.5	0	0	112	L143 V146 R147 I150 M159 N160 I161 M165 A166 V167	L143-M163 HydrophobicContact CD2-CB 3.66Å; V146-M163 HydrophobicContact CB-CG 4.32Å; V146-M163 HydrophobicContact CG1-CB 4.34Å; V146-M163 HydrophobicContact CG1-CG 3.73Å; V146-M163 HydrophobicContact CG1-SD 4.46Å; R147-M163 HydrophobicContact CB-SD 3.62Å; R147-M163 HydrophobicContact CG-SD 4.36Å; I150-M163 HydrophobicContact CD1-CG 4.41Å; M159-M163 HydrophobicContact CG-CE 3.94Å; M159-M163 HydrophobicContact CG-CG 4.23Å; M159-M163 HydrophobicContact CG-SD 3.99Å; M159-M163 WeakPolarHBondContact O-CB 2.89Å; M159-M163 WeakPolarHBondContact O-CG 3.02Å; M159-M163 PolarHBondContact O-N 3.17Å; N160-M163 PolarHBondContact O-N 2.74Å; N160-M163 VanDerWaalsContact OD1-CE 3.3Å; N160-M163 WeakPolarHBondContact OD1-CE 3.18Å; I161-M163 PolarHBondContact O-N 2.77Å; M163-M165 PolarHBondContact O-N 3.05Å; M163-A166 PolarHBondContact O-N 3.44Å; M163-V167 WeakPolarHBondContact O-CG2 3.44Å; M163-V167 PolarHBondContact O-N 3.44Å
164	H	89.1	Confident	84.3	Confident	76 Å²	76	35.2 Å²	35.2	35%	0.352	20%	0.199	S	C	.	.	H	α-helix	trans	-63.1	-43.2	179.1	-73.5	-69.9	0	0	0	111.4	E139 L143 N160 I161 A166 V167 D168	E139-H164 IonicContact OE1-CE1 3.48Å; E139-H164 IonicContact OE1-ND1 3.8Å; E139-H164 PolarHBondContact OE1-ND1 3.46Å; L143-H164 VanDerWaalsContact CD1-CE1 3.48Å; L143-H164 WeakPolarHBondContact CD1-CE1 3.44Å; N160-H164 PolarHBondContact O-CD2 2.84Å; N160-H164 PolarHBondContact O-N 3.47Å; N160-H164 VanDerWaalsContact O-N 3.1Å; I161-H164 PolarHBondContact O-N 2.87Å; H164-A166 VanDerWaalsContact C-N 3.33Å; H164-A166 PolarHBondContact O-N 2.97Å; H164-V167 PolarHBondContact O-N 3.27Å; H164-D168 WeakPolarHBondContact O-CB 3.3Å; H164-D168 PolarHBondContact O-N 2.95Å
165	M	91	Very high	85.1	Confident	12 Å²	12	36.5 Å²	36.5	6%	0.059	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-42.9	175.8	-76.6	-168.8	-52.8	0	0	112.6	I161 V162 M163 A169 L364 L366	I161-M165 HydrophobicContact CG2-CE 3.83Å; I161-M165 HydrophobicContact CG2-CG 4.39Å; I161-M165 HydrophobicContact CG2-SD 4.11Å; I161-M165 VanDerWaalsContact O-CB 3.32Å; I161-M165 WeakPolarHBondContact O-CB 3.11Å; I161-M165 VanDerWaalsContact O-CG 3.24Å; I161-M165 WeakPolarHBondContact O-CG 3.4Å; I161-M165 PolarHBondContact O-N 3.31Å; V162-M165 HydrophobicContact CG2-CE 4.37Å; V162-M165 PolarHBondContact O-N 2.75Å; M163-M165 PolarHBondContact O-N 3.05Å; M165-A169 WeakPolarHBondContact O-CB 3.13Å; M165-A169 PolarHBondContact O-N 3.46Å; M165-L364 HydrophobicContact CB-CD2 3.93Å; M165-L364 HydrophobicContact CG-CD2 4.44Å; M165-L364 HydrophobicContact SD-CD2 4.41Å; M165-L366 HydrophobicContact CE-CD2 3.89Å
166	A	91.6	Very high	85.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-45	179.5	0	0	0	0	0	111.8	V162 M163 H164 A169 I170 L381 A384 L385 V388	V162-A166 VanDerWaalsContact O-CB 3.3Å; V162-A166 WeakPolarHBondContact O-CB 3.5Å; V162-A166 PolarHBondContact O-N 3.37Å; M163-A166 PolarHBondContact O-N 3.44Å; H164-A166 VanDerWaalsContact C-N 3.33Å; H164-A166 PolarHBondContact O-N 2.97Å; A166-A169 PolarHBondContact O-N 2.94Å; A166-I170 WeakPolarHBondContact O-CG1 3.35Å; A166-I170 PolarHBondContact O-N 3.35Å; A166-L381 HydrophobicContact CB-CD1 4.27Å; A166-A384 HydrophobicContact CB-CB 3.62Å; A166-L385 HydrophobicContact CB-CD2 3.99Å; A166-L385 HydrophobicContact CB-CG 4.24Å; A166-V388 HydrophobicContact CB-CG2 4.41Å
167	V	91.2	Very high	86.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.4	-48.4	177.3	170.6	0	0	0	0	111	L142 L143 M163 H164 I170 K171 V388	L142-V167 HydrophobicContact CD2-CB 4.25Å; L142-V167 HydrophobicContact CD2-CG1 3.63Å; L142-V167 HydrophobicContact CD2-CG2 3.65Å; L142-V167 HydrophobicContact CG-CG2 4.03Å; L143-V167 HydrophobicContact CD2-CG2 4.22Å; M163-V167 WeakPolarHBondContact O-CG2 3.44Å; M163-V167 PolarHBondContact O-N 3.44Å; H164-V167 PolarHBondContact O-N 3.27Å; V167-I170 PolarHBondContact O-N 3.45Å; V167-K171 HydrophobicContact CG1-CD 3.97Å; V167-K171 VanDerWaalsContact CG1-CE 3.44Å; V167-K171 HydrophobicContact CG1-CG 4.47Å; V167-K171 WeakPolarHBondContact O-CB 3.31Å; V167-K171 WeakPolarHBondContact O-CG 3.34Å; V167-K171 PolarHBondContact O-N 3.25Å; V167-V388 HydrophobicContact CG2-CG2 4Å
168	D	90.8	Very high	86.5	Confident	66 Å²	66	39.7 Å²	39.7	35%	0.353	21%	0.21	S	C	.	.	H	α-helix	trans	-66.6	-39.6	-179.5	-72	-18	0	0	0	112.1	H164 K171 L172 L204	H164-D168 WeakPolarHBondContact O-CB 3.3Å; H164-D168 PolarHBondContact O-N 2.95Å; D168-K171 PolarHBondContact O-N 3.09Å; D168-L172 VanDerWaalsContact O-CG 3.29Å; D168-L172 WeakPolarHBondContact O-CG 3.29Å; D168-L172 PolarHBondContact O-N 3.47Å; D168-L172 VanDerWaalsContact O-N 3.09Å; D168-L204 HydrophobicContact CB-CD2 3.36Å
169	A	92.3	Very high	86.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-46.9	175.6	0	0	0	0	0	112	M165 A166 L172 V173 L204 L364 L385	M165-A169 WeakPolarHBondContact O-CB 3.13Å; M165-A169 PolarHBondContact O-N 3.46Å; A166-A169 PolarHBondContact O-N 2.94Å; A169-L172 PolarHBondContact O-N 3.17Å; A169-V173 WeakPolarHBondContact O-CG2 3.39Å; A169-V173 PolarHBondContact O-N 3.19Å; A169-L204 HydrophobicContact CB-CD1 3.9Å; A169-L364 HydrophobicContact CB-CD1 4.24Å; A169-L364 HydrophobicContact CB-CD2 4.29Å; A169-L385 HydrophobicContact CB-CD2 3.85Å
170	I	91.6	Very high	86.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.6	-41	179.9	-63.3	-61.7	0	0	0	111.2	A166 V167 L172 V173 T174 I183 I185 L385 V388 R389 F392	A166-I170 WeakPolarHBondContact O-CG1 3.35Å; A166-I170 PolarHBondContact O-N 3.35Å; V167-I170 PolarHBondContact O-N 3.45Å; I170-L172 PolarHBondContact O-N 3.15Å; I170-V173 PolarHBondContact O-N 2.96Å; I170-T174 WeakPolarHBondContact O-CB 3.25Å; I170-T174 PolarHBondContact O-N 3.24Å; I170-T174 PolarHBondContact O-OG1 3.15Å; I170-I183 HydrophobicContact CD1-CG2 3.91Å; I170-I183 HydrophobicContact CG2-CD1 3.95Å; I170-I183 HydrophobicContact CG2-CG2 4.24Å; I170-I185 HydrophobicContact CD1-CD1 4.09Å; I170-I185 HydrophobicContact CD1-CG1 3.76Å; I170-L385 HydrophobicContact CD1-CB 4.43Å; I170-L385 HydrophobicContact CD1-CD2 3.97Å; I170-L385 HydrophobicContact CG1-CD2 3.97Å; I170-V388 HydrophobicContact CB-CB 4.45Å; I170-V388 HydrophobicContact CB-CG1 3.66Å; I170-V388 HydrophobicContact CG1-CB 3.98Å; I170-V388 HydrophobicContact CG1-CG1 3.74Å; I170-V388 HydrophobicContact CG2-CG1 3.8Å; I170-R389 HydrophobicContact CD1-CB 4.45Å; I170-F392 HydrophobicContact CG2-CD1 4.38Å; I170-F392 HydrophobicContact CG2-CD2 4.23Å; I170-F392 HydrophobicContact CG2-CE2 4.46Å; I170-F392 HydrophobicContact CG2-CG 4.18Å
171	K	89	Confident	86.2	Confident	79 Å²	79	47.6 Å²	47.6	34%	0.343	25%	0.252	S	S	.	.	H	α-helix	trans	-55.9	-39.5	174.3	-77.1	173.8	-178.9	170.3	0	111.7	E139 V167 D168 F392	E139-K171 IonicContact OE2-NZ 2.74Å; E139-K171 PolarHBondContact OE2-NZ 2.7Å; V167-K171 HydrophobicContact CG1-CD 3.97Å; V167-K171 VanDerWaalsContact CG1-CE 3.44Å; V167-K171 HydrophobicContact CG1-CG 4.47Å; V167-K171 WeakPolarHBondContact O-CB 3.31Å; V167-K171 WeakPolarHBondContact O-CG 3.34Å; V167-K171 PolarHBondContact O-N 3.25Å; D168-K171 PolarHBondContact O-N 3.09Å; K171-F392 HydrophobicContact CG-CE1 4.37Å; K171-F392 HydrophobicContact CG-CZ 3.81Å
172	L	87.8	Confident	86.1	Confident	48 Å²	48	51.1 Å²	51.1	25%	0.251	27%	0.268	S	S	.	.	H	α-helix	trans	-72.6	-39.4	178.2	-70.9	171.3	0	0	0	113.8	D168 A169 I170 L204 K206 C362	D168-L172 VanDerWaalsContact O-CG 3.29Å; D168-L172 WeakPolarHBondContact O-CG 3.29Å; D168-L172 PolarHBondContact O-N 3.47Å; D168-L172 VanDerWaalsContact O-N 3.09Å; A169-L172 PolarHBondContact O-N 3.17Å; I170-L172 PolarHBondContact O-N 3.15Å; L172-L204 HydrophobicContact CD1-CD2 3.74Å; L172-L204 HydrophobicContact CD1-CG 4.36Å; L172-K206 HydrophobicContact CD1-CD 4.41Å; L172-K206 HydrophobicContact CD1-CG 3.85Å; L172-K206 HydrophobicContact CD2-CD 4.35Å; L172-C362 HydrophobicContact CD1-CB 4.45Å
173	V	88.4	Confident	86.2	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-84.5	-16.9	-175	171	0	0	0	0	112.6	A169 I170 I175 Y188 V189	A169-V173 WeakPolarHBondContact O-CG2 3.39Å; A169-V173 PolarHBondContact O-N 3.19Å; I170-V173 PolarHBondContact O-N 2.96Å; V173-I175 PolarHBondContact O-N 3.33Å; V173-Y188 HydrophobicContact CG1-CD2 4.16Å; V173-Y188 HydrophobicContact CG1-CG 4.4Å; V173-V189 HydrophobicContact CB-CG2 4.41Å; V173-V189 HydrophobicContact CG2-CG2 3.8Å
174	T	86.5	Confident	86.1	Confident	25 Å²	25	54.3 Å²	54.3	15%	0.153	29%	0.285	C	S	.	.			trans	-63.5	121.8	178.5	-62.3	0	0	0	0	110.7	I170 K181 I183 F392	I170-T174 WeakPolarHBondContact O-CB 3.25Å; I170-T174 PolarHBondContact O-N 3.24Å; I170-T174 PolarHBondContact O-OG1 3.15Å; T174-K181 HydrophobicContact CG2-CB 4.19Å; T174-K181 HydrophobicContact CG2-CD 4.07Å; T174-K181 HydrophobicContact CG2-CG 4.33Å; T174-I183 HydrophobicContact CG2-CD1 4.42Å; T174-I183 HydrophobicContact CG2-CG1 4.18Å; T174-F392 HydrophobicContact CG2-CD1 4.48Å
175	I	84.2	Confident	86.1	Confident	47 Å²	47	51 Å²	51	24%	0.241	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	115.5	172.2	-58.2	172.1	0	0	0	107.7	V173 T177 Q182 K360	V173-I175 PolarHBondContact O-N 3.33Å; I175-T177 HydrophobicContact CG2-CG2 4.03Å; I175-T177 PolarHBondContact O-N 2.98Å; I175-Q182 PolarHBondContact N-O 3.34Å; I175-Q182 PolarHBondContact O-N 3.05Å; I175-K360 HydrophobicContact CD1-CD 4.36Å
176	D	81.9	Confident	85.8	Confident	120 Å²	120	59.2 Å²	59.2	64%	0.642	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	114.4	169.8	-66	-44.6	0	0	0	108.8	K181	D176-K181 WeakPolarHBondContact OD1-CE 3.49Å; D176-K181 WeakPolarHBondContact OD1-CG 3.18Å
177	T	81	Confident	85.6	Confident	35 Å²	35	66.9 Å²	66.9	22%	0.215	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	159.2	172.6	73.7	0	0	0	0	109.9	I175 F179 G180 Q182	I175-T177 HydrophobicContact CG2-CG2 4.03Å; I175-T177 PolarHBondContact O-N 2.98Å; T177-F179 PolarHBondContact O-N 3.32Å; T177-G180 WeakPolarHBondContact CA-O 3.41Å; T177-G180 WeakPolarHBondContact CB-O 3.12Å; T177-G180 PolarHBondContact N-O 3.18Å; T177-G180 PolarHBondContact O-N 3.39Å; T177-G180 VanDerWaalsContact O-O 3.07Å; T177-G180 PolarHBondContact OG1-O 3.05Å; T177-Q182 HydrophobicContact CG2-CB 4.42Å; T177-Q182 HydrophobicContact CG2-CG 4Å
178	P	77	Confident	85.5	Confident	133 Å²	133	68.9 Å²	68.9	86%	0.864	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.9	176.2	-26.4	35.3	0	0	0	114.5
179	F	76.9	Confident	85.6	Confident	201 Å²	201	66.1 Å²	66.1	88%	0.882	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	0.4	179.5	-58.1	-74.8	0	0	0	113.7	T177	T177-F179 PolarHBondContact O-N 3.32Å
180	G	79.1	Confident	85.6	Confident	38 Å²	38	67.6 Å²	67.6	39%	0.392	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	127.5	-175.9	-176.5	0	0	0	0	0	113.1	T177	T177-G180 WeakPolarHBondContact CA-O 3.41Å; T177-G180 WeakPolarHBondContact CB-O 3.12Å; T177-G180 PolarHBondContact N-O 3.18Å; T177-G180 PolarHBondContact O-N 3.39Å; T177-G180 VanDerWaalsContact O-O 3.07Å; T177-G180 PolarHBondContact OG1-O 3.05Å
181	K	82.6	Confident	85.7	Confident	74 Å²	74	68.8 Å²	68.8	32%	0.322	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	129.3	178.5	-61.5	-170.4	173	179.3	0	110	T174 D176 L393	T174-K181 HydrophobicContact CG2-CB 4.19Å; T174-K181 HydrophobicContact CG2-CD 4.07Å; T174-K181 HydrophobicContact CG2-CG 4.33Å; D176-K181 WeakPolarHBondContact OD1-CE 3.49Å; D176-K181 WeakPolarHBondContact OD1-CG 3.18Å; K181-L393 HydrophobicContact CB-CD2 4.4Å; K181-L393 VanDerWaalsContact O-CD2 3.22Å; K181-L393 WeakPolarHBondContact O-CD2 3.43Å
182	Q	84.3	Confident	85.9	Confident	118 Å²	118	66.1 Å²	66.1	55%	0.551	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.7	171.8	-67.9	-171.5	-4	0	0	109.7	I175 T177	I175-Q182 PolarHBondContact N-O 3.34Å; I175-Q182 PolarHBondContact O-N 3.05Å; T177-Q182 HydrophobicContact CG2-CB 4.42Å; T177-Q182 HydrophobicContact CG2-CG 4Å
183	I	86.6	Confident	86.2	Confident	15 Å²	15	68 Å²	68	8%	0.077	34%	0.335	C	S	.	.			trans	-133.5	110.5	-178.3	-55.5	172.7	0	0	0	107.7	I170 T174 I185 R389 F392	I170-I183 HydrophobicContact CD1-CG2 3.91Å; I170-I183 HydrophobicContact CG2-CD1 3.95Å; I170-I183 HydrophobicContact CG2-CG2 4.24Å; T174-I183 HydrophobicContact CG2-CD1 4.42Å; T174-I183 HydrophobicContact CG2-CG1 4.18Å; I183-I185 HydrophobicContact CG2-CG1 4.2Å; I183-R389 HydrophobicContact CB-CG 4.15Å; I183-R389 HydrophobicContact CD1-CG 4.38Å; I183-R389 HydrophobicContact CG2-CB 4.2Å; I183-R389 HydrophobicContact CG2-CG 4.04Å; I183-R389 PolarHBondContact O-NE 2.98Å; I183-F392 HydrophobicContact CD1-CB 3.59Å; I183-F392 HydrophobicContact CD1-CD1 4.46Å; I183-F392 HydrophobicContact CD1-CG 4.29Å
184	D	86.2	Confident	86.3	Confident	52 Å²	52	68.1 Å²	68.1	28%	0.278	34%	0.336	S	S	.	.			trans	-113.3	94.5	175.2	-173.6	-18.4	0	0	0	109.7	K186 R187 Y188	D184-K186 PolarHBondContact OD1-N 3.47Å; D184-R187 PolarHBondContact OD1-N 3.46Å; D184-R187 WeakPolarHBondContact OD2-CB 3.48Å; D184-R187 WeakPolarHBondContact OD2-CD 2.95Å; D184-R187 VanDerWaalsContact OD2-CG 3.25Å; D184-R187 WeakPolarHBondContact OD2-CG 3.4Å; D184-R187 IonicContact OD2-NE 3.65Å; D184-Y188 HydrophobicContact CB-CD2 3.9Å; D184-Y188 HydrophobicContact CB-CE2 4.06Å; D184-Y188 PolarHBondContact O-N 3.25Å
185	I	87.2	Confident	86.6	Confident	8 Å²	8	69.9 Å²	69.9	4%	0.041	35%	0.348	C	S	.	.	H	α-helix	trans	-65.5	-46.9	179.6	-57	168.2	0	0	0	109.7	I170 I183 R187 Y188 V189 L385 R389	I170-I185 HydrophobicContact CD1-CD1 4.09Å; I170-I185 HydrophobicContact CD1-CG1 3.76Å; I183-I185 HydrophobicContact CG2-CG1 4.2Å; I185-R187 PolarHBondContact O-N 3.47Å; I185-Y188 PolarHBondContact O-N 2.89Å; I185-V189 HydrophobicContact CG2-CB 4.04Å; I185-V189 HydrophobicContact CG2-CG2 4.19Å; I185-V189 WeakPolarHBondContact O-CA 3.32Å; I185-V189 WeakPolarHBondContact O-CB 3.36Å; I185-V189 PolarHBondContact O-N 3.42Å; I185-L385 HydrophobicContact CD1-CB 4.02Å; I185-L385 WeakPolarHBondContact CD1-O 3.46Å; I185-L385 HydrophobicContact CG2-CB 4.12Å; I185-L385 HydrophobicContact CG2-CD1 3.99Å; I185-R389 HydrophobicContact CD1-CB 3.84Å; I185-R389 HydrophobicContact CD1-CG 4.31Å
186	K	86.1	Confident	86.8	Confident	183 Å²	183	69 Å²	69	80%	0.796	35%	0.35	S	S	*	.	H	α-helix	trans	-61	-41.5	-171.9	-173.9	174.6	-176.5	173.3	0	112.5	D184 R312	D184-K186 PolarHBondContact OD1-N 3.47Å; K186-R312 PolarHBondContact O-NH2 3.03Å
187	R	86.1	Confident	87	Confident	161 Å²	161	64.9 Å²	64.9	61%	0.608	34%	0.336	S	S	*	.	H	α-helix	trans	-85.2	-38.6	-178.9	-64.2	-172	-176.6	171.8	-2.6	112.9	D184 I185 R312	D184-R187 PolarHBondContact OD1-N 3.46Å; D184-R187 WeakPolarHBondContact OD2-CB 3.48Å; D184-R187 WeakPolarHBondContact OD2-CD 2.95Å; D184-R187 VanDerWaalsContact OD2-CG 3.25Å; D184-R187 WeakPolarHBondContact OD2-CG 3.4Å; D184-R187 IonicContact OD2-NE 3.65Å; I185-R187 PolarHBondContact O-N 3.47Å; R187-R312 WeakPolarHBondContact O-CD 3.37Å; R187-R312 WeakPolarHBondContact O-CG 3.43Å; R187-R312 PolarHBondContact O-NE 2.86Å; R187-R312 PolarHBondContact O-NH2 3.28Å
188	Y	90.2	Very high	87.3	Confident	42 Å²	42	69.1 Å²	69.1	17%	0.165	35%	0.353	C	S	.	.	H	α-helix	trans	-108	-11.4	-168.1	-57.7	-46.8	0	0	0	115.5	V173 D184 I185 K315 A361 C362	V173-Y188 HydrophobicContact CG1-CD2 4.16Å; V173-Y188 HydrophobicContact CG1-CG 4.4Å; D184-Y188 HydrophobicContact CB-CD2 3.9Å; D184-Y188 HydrophobicContact CB-CE2 4.06Å; D184-Y188 PolarHBondContact O-N 3.25Å; I185-Y188 PolarHBondContact O-N 2.89Å; Y188-K315 HydrophobicContact CD1-CG 4.17Å; Y188-K315 HydrophobicContact CE1-CD 4.37Å; Y188-K315 HydrophobicContact CE1-CG 3.67Å; Y188-K315 VanDerWaalsContact OH-CE 3.31Å; Y188-K315 WeakPolarHBondContact OH-CE 3.5Å; Y188-A361 HydrophobicContact CD1-CB 4.24Å; Y188-A361 CarbonylContact O-C 3.51Å; Y188-A361 VanDerWaalsContact O-CA 3.25Å; Y188-A361 WeakPolarHBondContact O-CA 3.48Å; Y188-A361 WeakPolarHBondContact O-CB 3.22Å; Y188-C362 PolarHBondContact O-N 3.43Å
189	V	92.6	Very high	87.7	Confident	8 Å²	8	63.8 Å²	63.8	5%	0.048	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	109.7	170.6	-174	0	0	0	0	108.6	V173 I185 L364 L385	V173-V189 HydrophobicContact CB-CG2 4.41Å; V173-V189 HydrophobicContact CG2-CG2 3.8Å; I185-V189 HydrophobicContact CG2-CB 4.04Å; I185-V189 HydrophobicContact CG2-CG2 4.19Å; I185-V189 WeakPolarHBondContact O-CA 3.32Å; I185-V189 WeakPolarHBondContact O-CB 3.36Å; I185-V189 PolarHBondContact O-N 3.42Å; V189-L364 HydrophobicContact CG1-CD1 3.44Å; V189-L364 VanDerWaalsContact CG1-CD1 3.44Å; V189-L364 HydrophobicContact CG1-CG 4.06Å; V189-L385 HydrophobicContact CG1-CD1 3.99Å; V189-L385 HydrophobicContact CG1-CD2 4.49Å
190	R	93.1	Very high	88.1	Confident	31 Å²	31	61 Å²	61	12%	0.117	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	138.6	171.2	177	179.2	175.9	153.7	-5.4	109.4	E192 V209 D309 C362 T363 L364	R190-E192 IonicContact CZ-OE2 2.95Å; R190-E192 IonicContact NE-OE2 2.65Å; R190-E192 PolarHBondContact NE-OE2 2.93Å; R190-E192 IonicContact NH2-OE1 3.64Å; R190-E192 IonicContact NH2-OE2 3.12Å; R190-E192 PolarHBondContact NH2-OE2 3.36Å; R190-V209 PolarHBondContact NE-O 3.37Å; R190-V209 PolarHBondContact NH1-O 3.09Å; R190-V209 PolarHBondContact NH2-O 3.47Å; R190-D309 IonicContact CZ-OD1 2.86Å; R190-D309 IonicContact CZ-OD2 2.8Å; R190-D309 IonicContact NH1-OD1 3.56Å; R190-D309 PolarHBondContact NH1-OD1 2.89Å; R190-D309 IonicContact NH1-OD2 3.9Å; R190-D309 PolarHBondContact NH1-OD2 3.22Å; R190-C362 PolarHBondContact N-O 2.93Å; R190-T363 HydrophobicContact CB-CG2 4.09Å; R190-T363 HydrophobicContact CG-CG2 4.01Å; R190-T363 CarbonylContact O-C 3.55Å; R190-T363 VanDerWaalsContact O-CA 3.27Å; R190-T363 WeakPolarHBondContact O-CA 3.36Å; R190-L364 PolarHBondContact O-N 3.02Å
191	V	93.7	Very high	88.7	Confident	25 Å²	25	63.4 Å²	63.4	15%	0.152	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.8	166.5	-174.5	0	0	0	0	108.4	K193 L364 L366 D378 L381	V191-K193 HydrophobicContact CG1-CG 4.37Å; V191-L364 WeakPolarHBondContact CA-O 3.46Å; V191-L364 HydrophobicContact CG2-CB 4.35Å; V191-L364 HydrophobicContact CG2-CD1 4.43Å; V191-L366 HydrophobicContact CG1-CD1 3.53Å; V191-L366 HydrophobicContact CG1-CG 3.88Å; V191-D378 WeakPolarHBondContact CG1-OD1 3.25Å; V191-L381 HydrophobicContact CG1-CD2 4.27Å; V191-L381 HydrophobicContact CG2-CD2 4.03Å
192	E	93	Very high	89	Confident	24 Å²	24	60.3 Å²	60.3	11%	0.112	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	116.3	174.7	-167.1	67.9	-171.1	0	0	109.2	R190 V194 F350 T363 L364 L365 L366	R190-E192 IonicContact CZ-OE2 2.95Å; R190-E192 IonicContact NE-OE2 2.65Å; R190-E192 PolarHBondContact NE-OE2 2.93Å; R190-E192 IonicContact NH2-OE1 3.64Å; R190-E192 IonicContact NH2-OE2 3.12Å; R190-E192 PolarHBondContact NH2-OE2 3.36Å; E192-V194 HydrophobicContact CG-CG2 4.13Å; E192-F350 HydrophobicContact CG-CE1 4.21Å; E192-T363 HydrophobicContact CB-CG2 3.92Å; E192-L364 PolarHBondContact N-O 2.89Å; E192-L365 HydrophobicContact CB-CD1 4.19Å; E192-L365 HydrophobicContact CG-CD1 4.3Å; E192-L366 PolarHBondContact O-N 2.93Å
193	K	92.7	Very high	89.4	Confident	87 Å²	87	59 Å²	59	38%	0.378	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.5	-178.6	-68.3	174.3	-74	-152.2	0	109.3	V191 L366 L374 D378	V191-K193 HydrophobicContact CG1-CG 4.37Å; K193-L366 HydrophobicContact CG-CD1 4.45Å; K193-L374 HydrophobicContact CB-CB 4.49Å; K193-L374 HydrophobicContact CB-CD1 4.41Å; K193-L374 HydrophobicContact CD-CB 4.45Å; K193-L374 HydrophobicContact CG-CB 4.49Å; K193-D378 HydrophobicContact CD-CB 3.94Å; K193-D378 IonicContact NZ-OD2 3.69Å; K193-D378 PolarHBondContact NZ-OD2 3.03Å
194	V	92.2	Very high	89.7	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.024	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	113	179.4	-172.8	0	0	0	0	109.5	E192 I345 F350 L365 L366	E192-V194 HydrophobicContact CG-CG2 4.13Å; V194-I345 HydrophobicContact CG1-CB 4.4Å; V194-I345 HydrophobicContact CG1-CG2 3.75Å; V194-F350 HydrophobicContact CB-CZ 4.39Å; V194-F350 HydrophobicContact CG1-CE2 3.93Å; V194-F350 HydrophobicContact CG1-CZ 3.92Å; V194-F350 HydrophobicContact CG2-CE1 3.78Å; V194-F350 HydrophobicContact CG2-CE2 4.13Å; V194-F350 HydrophobicContact CG2-CZ 3.53Å; V194-L365 HydrophobicContact CB-CD1 4.35Å; V194-L365 HydrophobicContact CG2-CD1 3.53Å; V194-L366 PolarHBondContact N-O 3.14Å
195	P	91.1	Very high	90.1	Very high	62 Å²	62	58.1 Å²	58.1	40%	0.403	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	147.8	-179.4	27.4	-33.8	0	0	0	111.8	R367 K371 L374	P195-R367 PolarHBondContact O-NH1 3.28Å; P195-K371 HydrophobicContact CB-CG 4.38Å; P195-L374 HydrophobicContact CB-CD1 4.39Å
196	G	88.8	Confident	90.3	Very high	27 Å²	27	62 Å²	62	28%	0.278	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	88.3	178.7	-175.8	0	0	0	0	0	113.6	R367 G368	G196-R367 VanDerWaalsContact O-CZ 3.24Å; G196-R367 PolarHBondContact O-NE 3.21Å; G196-R367 PolarHBondContact O-NH1 2.95Å; G196-G368 CarbonylContact C-O 3.59Å; G196-G368 WeakPolarHBondContact CA-O 3.32Å; G196-G368 PolarHBondContact N-O 2.99Å; G196-G368 PolarHBondContact O-N 3.27Å
197	G	86.4	Confident	90.7	Very high	34 Å²	34	53.3 Å²	53.3	35%	0.351	26%	0.262	S	S	.	.	S	Bend	trans	76.9	179.6	-174.2	0	0	0	0	0	113.3	E201	G197-E201 WeakPolarHBondContact CA-OE2 3.36Å
198	Q	87.1	Confident	91.1	Very high	125 Å²	125	45.7 Å²	45.7	58%	0.584	23%	0.234	S	C	*	.			trans	-91.9	158.4	172	-65.6	-176.5	-31.7	0	0	111.2	E200 E201 R367	Q198-E200 VanDerWaalsContact C-N 3.26Å; Q198-E200 PolarHBondContact O-N 2.97Å; Q198-E201 HydrophobicContact CB-CG 4.38Å; Q198-E201 PolarHBondContact N-OE1 3.39Å; Q198-E201 VanDerWaalsContact N-OE1 3.16Å; Q198-E201 WeakPolarHBondContact O-CB 3.48Å; Q198-E201 PolarHBondContact O-N 2.65Å; Q198-E201 VanDerWaalsContact O-N 3.12Å; Q198-R367 VanDerWaalsContact O-CB 3.3Å; Q198-R367 WeakPolarHBondContact O-CB 3.3Å
199	I	84.8	Confident	91.3	Very high	21 Å²	21	43.7 Å²	43.7	11%	0.108	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-69.5	-30.3	-177.8	-64.5	171.4	0	0	0	110.6	W158 I161 E201 S202 M377	W158-I199 HydrophobicContact CD2-CD1 4.03Å; W158-I199 HydrophobicContact CG-CD1 4.32Å; W158-I199 HydrophobicContact CG-CG2 4.2Å; W158-I199 HydrophobicContact CH2-CD1 4.45Å; W158-I199 HydrophobicContact CZ2-CD1 3.49Å; W158-I199 VanDerWaalsContact CZ2-CD1 3.49Å; I161-I199 HydrophobicContact CD1-CG2 4.19Å; I199-E201 PolarHBondContact O-N 3.04Å; I199-S202 WeakPolarHBondContact O-CB 3.39Å; I199-S202 PolarHBondContact O-N 2.96Å; I199-S202 PolarHBondContact O-OG 2.98Å; I199-M377 HydrophobicContact CD1-SD 4.45Å; I199-M377 HydrophobicContact CG1-SD 4.42Å; I199-M377 HydrophobicContact CG2-CE 3.66Å; I199-M377 HydrophobicContact CG2-SD 4.28Å
200	E	87	Confident	91.4	Very high	143 Å²	143	43.5 Å²	43.5	67%	0.668	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-64.9	-17.1	173.2	-60.3	108.2	162.8	0	0	113.8	I161 Q198 S202	I161-E200 HydrophobicContact CD1-CG 4.26Å; Q198-E200 VanDerWaalsContact C-N 3.26Å; Q198-E200 PolarHBondContact O-N 2.97Å; E200-S202 PolarHBondContact O-N 3.44Å
201	E	89.8	Confident	91.4	Very high	87 Å²	87	45 Å²	45	41%	0.407	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-75	-10.5	173.1	-63	172.2	-156.6	0	0	112.7	G197 Q198 I199 K203 R367	G197-E201 WeakPolarHBondContact CA-OE2 3.36Å; Q198-E201 HydrophobicContact CB-CG 4.38Å; Q198-E201 PolarHBondContact N-OE1 3.39Å; Q198-E201 VanDerWaalsContact N-OE1 3.16Å; Q198-E201 WeakPolarHBondContact O-CB 3.48Å; Q198-E201 PolarHBondContact O-N 2.65Å; Q198-E201 VanDerWaalsContact O-N 3.12Å; I199-E201 PolarHBondContact O-N 3.04Å; E201-K203 PolarHBondContact O-N 3.46Å; E201-R367 HydrophobicContact CB-CB 4.06Å; E201-R367 HydrophobicContact CB-CG 3.92Å; E201-R367 IonicContact OE2-CZ 3.18Å; E201-R367 IonicContact OE2-NE 2.68Å; E201-R367 PolarHBondContact OE2-NE 3.49Å; E201-R367 IonicContact OE2-NH2 3.98Å; E201-R367 PolarHBondContact OE2-NH2 3.35Å
202	S	90.4	Very high	91.4	Very high	9 Å²	9	47.9 Å²	47.9	6%	0.063	25%	0.245	C	C	.	.			trans	-65.8	129.8	176.7	-56.1	0	0	0	0	110	I199 E200 L365 R367	I199-S202 WeakPolarHBondContact O-CB 3.39Å; I199-S202 PolarHBondContact O-N 2.96Å; I199-S202 PolarHBondContact O-OG 2.98Å; E200-S202 PolarHBondContact O-N 3.44Å; S202-L365 CarbonylContact C-O 3.56Å; S202-L365 WeakPolarHBondContact CA-O 3.49Å; S202-L365 WeakPolarHBondContact CB-O 3.35Å; S202-R367 PolarHBondContact OG-N 2.9Å; S202-R367 PolarHBondContact OG-O 3.24Å
203	K	92.2	Very high	91.4	Very high	92 Å²	92	49.1 Å²	49.1	40%	0.4	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.3	-173.4	63	-175.5	-179.8	-173.6	0	112.4	E201 I205 L365	E201-K203 PolarHBondContact O-N 3.46Å; K203-I205 HydrophobicContact CD-CG1 4.49Å; K203-I205 HydrophobicContact CG-CD1 4.41Å; K203-I205 HydrophobicContact CG-CG1 4.1Å; K203-L365 HydrophobicContact CG-CB 4.49Å; K203-L365 HydrophobicContact CG-CD2 4.45Å; K203-L365 PolarHBondContact N-O 3.32Å; K203-L365 PolarHBondContact O-N 3.04Å
204	L	93.4	Very high	91.3	Very high	38 Å²	38	45.6 Å²	45.6	20%	0.199	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.2	166.7	175.7	71.3	0	0	0	109.6	D168 A169 L172 C362 L364	D168-L204 HydrophobicContact CB-CD2 3.36Å; A169-L204 HydrophobicContact CB-CD1 3.9Å; L172-L204 HydrophobicContact CD1-CD2 3.74Å; L172-L204 HydrophobicContact CD1-CG 4.36Å; L204-C362 HydrophobicContact CD1-CB 3.78Å; L204-L364 HydrophobicContact CB-CD2 4.1Å; L204-L364 HydrophobicContact CD1-CD2 3.46Å; L204-L364 VanDerWaalsContact CD1-CD2 3.46Å; L204-L364 HydrophobicContact CD1-CG 4.14Å; L204-L364 HydrophobicContact CG-CD2 4.37Å
205	I	93.1	Very high	91.1	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.051	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122	175.9	-62.2	167.8	0	0	0	107.9	K203 G207 V209 F352 I354 C362 T363 L365	K203-I205 HydrophobicContact CD-CG1 4.49Å; K203-I205 HydrophobicContact CG-CD1 4.41Å; K203-I205 HydrophobicContact CG-CG1 4.1Å; I205-G207 PolarHBondContact O-N 2.84Å; I205-V209 HydrophobicContact CB-CG2 4.37Å; I205-V209 HydrophobicContact CD1-CG2 3.48Å; I205-V209 VanDerWaalsContact CD1-CG2 3.48Å; I205-V209 HydrophobicContact CG2-CG2 4.21Å; I205-F352 HydrophobicContact CD1-CD1 3.86Å; I205-F352 HydrophobicContact CD1-CE1 3.54Å; I205-I354 HydrophobicContact CG2-CG1 4.3Å; I205-C362 WeakPolarHBondContact O-CA 3.38Å; I205-C362 WeakPolarHBondContact O-CB 3.23Å; I205-T363 WeakPolarHBondContact CB-O 3.28Å; I205-T363 PolarHBondContact N-O 3.25Å; I205-T363 PolarHBondContact O-N 3.09Å; I205-L365 HydrophobicContact CD1-CB 3.9Å; I205-L365 HydrophobicContact CD1-CD2 4.11Å
206	K	93.3	Very high	91	Very high	90 Å²	90	48.1 Å²	48.1	39%	0.391	25%	0.245	S	C	.	.	S	Bend	trans	-74	70	175.6	-62	-172.4	179.4	-178.9	0	110.5	L172 N355 A359	L172-K206 HydrophobicContact CD1-CD 4.41Å; L172-K206 HydrophobicContact CD1-CG 3.85Å; L172-K206 HydrophobicContact CD2-CD 4.35Å; K206-N355 PolarHBondContact O-N 3.34Å; K206-A359 HydrophobicContact CB-CB 3.96Å
207	G	92.9	Very high	91	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.1	-160.8	-172	0	0	0	0	0	114.1	I205 V353 A361 C362 T363	I205-G207 PolarHBondContact O-N 2.84Å; G207-V353 CarbonylContact C-O 3.51Å; G207-V353 WeakPolarHBondContact CA-O 3.44Å; G207-A361 PolarHBondContact N-O 3.33Å; G207-C362 CarbonylContact O-C 3.51Å; G207-C362 VanDerWaalsContact O-C 3.23Å; G207-C362 WeakPolarHBondContact O-CA 3.2Å; G207-T363 PolarHBondContact O-N 3.47Å; G207-T363 PolarHBondContact O-OG1 3.11Å
208	V	94.4	Very high	91.2	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	131.6	-179.6	-171.4	0	0	0	0	110.1	L210 R312 L313 V316 V353 T363	V208-L210 HydrophobicContact CG1-CD2 3.92Å; V208-L210 HydrophobicContact CG1-CG 4.11Å; V208-R312 HydrophobicContact CG2-CB 3.7Å; V208-L313 HydrophobicContact CB-CD2 3.78Å; V208-L313 HydrophobicContact CB-CG 4.3Å; V208-L313 HydrophobicContact CG1-CD2 4.24Å; V208-L313 HydrophobicContact CG1-CG 4.34Å; V208-L313 HydrophobicContact CG2-CD2 3.9Å; V208-L313 HydrophobicContact CG2-CG 4.16Å; V208-V316 HydrophobicContact CG2-CG2 3.95Å; V208-V353 PolarHBondContact N-O 3.39Å; V208-V353 PolarHBondContact O-N 2.63Å; V208-T363 WeakPolarHBondContact CA-OG1 3.44Å
209	V	94.9	Very high	91.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.6	168.6	-173.7	0	0	0	0	109.4	R190 I205 F350 T351 F352 T363	R190-V209 PolarHBondContact NE-O 3.37Å; R190-V209 PolarHBondContact NH1-O 3.09Å; R190-V209 PolarHBondContact NH2-O 3.47Å; I205-V209 HydrophobicContact CB-CG2 4.37Å; I205-V209 HydrophobicContact CD1-CG2 3.48Å; I205-V209 VanDerWaalsContact CD1-CG2 3.48Å; I205-V209 HydrophobicContact CG2-CG2 4.21Å; V209-F350 HydrophobicContact CG1-CB 4.12Å; V209-F350 HydrophobicContact CG1-CD1 3.98Å; V209-F350 HydrophobicContact CG1-CG 4.45Å; V209-T351 CarbonylContact C-O 3.56Å; V209-T351 VanDerWaalsContact CA-O 3.31Å; V209-T351 WeakPolarHBondContact CA-O 2.83Å; V209-F352 HydrophobicContact CB-CD1 4.42Å; V209-F352 HydrophobicContact CB-CE1 4.28Å; V209-F352 HydrophobicContact CG1-CD1 4.16Å; V209-F352 HydrophobicContact CG1-CE1 3.72Å; V209-F352 HydrophobicContact CG1-CE2 4.48Å; V209-F352 HydrophobicContact CG1-CZ 3.88Å; V209-F352 HydrophobicContact CG2-CD1 3.55Å; V209-F352 HydrophobicContact CG2-CE1 3.53Å; V209-F352 HydrophobicContact CG2-CZ 4.5Å; V209-T363 HydrophobicContact CB-CG2 3.86Å; V209-T363 HydrophobicContact CG2-CG2 3.83Å; V209-T363 PolarHBondContact N-OG1 3.15Å
210	L	94.8	Very high	91.8	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.6	179.4	-58.1	168.5	0	0	0	110.2	V208 K212 F281 I305 D309 L313 F350 T351	V208-L210 HydrophobicContact CG1-CD2 3.92Å; V208-L210 HydrophobicContact CG1-CG 4.11Å; L210-K212 HydrophobicContact CB-CB 4.5Å; L210-K212 PolarHBondContact O-N 2.85Å; L210-F281 HydrophobicContact CD1-CD1 4.23Å; L210-F281 HydrophobicContact CD1-CE1 3.73Å; L210-I305 HydrophobicContact CD2-CG2 4.39Å; L210-D309 HydrophobicContact CD2-CB 3.74Å; L210-L313 HydrophobicContact CD1-CD1 4.21Å; L210-F350 CarbonylContact O-C 3.41Å; L210-F350 WeakPolarHBondContact O-CA 3.4Å; L210-T351 PolarHBondContact N-O 2.88Å; L210-T351 PolarHBondContact O-N 3.16Å
211	N	93.3	Very high	92.1	Very high	62 Å²	62	46.7 Å²	46.7	33%	0.332	25%	0.245	S	C	.	.	S	Bend	trans	-78.2	69.2	168.5	-168.2	-16.5	0	0	0	110.5	E348 F350	N211-E348 PolarHBondContact ND2-OE2 3.4Å; N211-F350 HydrophobicContact CB-CD1 4.02Å; N211-F350 HydrophobicContact CB-CE1 3.7Å; N211-F350 HydrophobicContact CB-CZ 4.48Å
212	K	93.3	Very high	92.3	Very high	87 Å²	87	50.3 Å²	50.3	38%	0.378	26%	0.255	S	S	.	.			trans	-147.4	141.1	178.5	-62.9	-63.5	171.5	-163.2	0	109.5	L210 I302 R304 Y349 T351	L210-K212 HydrophobicContact CB-CB 4.5Å; L210-K212 PolarHBondContact O-N 2.85Å; K212-I302 HydrophobicContact CB-CG2 3.78Å; K212-I302 HydrophobicContact CG-CG2 4.19Å; K212-R304 WeakPolarHBondContact CE-O 3.22Å; K212-Y349 PolarHBondContact N-O 3.32Å; K212-T351 PolarHBondContact O-OG1 3.11Å
213	D	92.7	Very high	92.5	Very high	49 Å²	49	50.8 Å²	50.8	26%	0.262	26%	0.256	S	S	.	.			trans	-99.7	168.3	170.5	-161.6	4.8	0	0	0	110.6	R221 Y349	D213-R221 IonicContact OD1-NH2 3.27Å; D213-R221 IonicContact OD2-NH2 2.74Å; D213-R221 PolarHBondContact OD2-NH2 3.05Å; D213-R221 VanDerWaalsContact OD2-NH2 3.12Å; D213-Y349 HydrophobicContact CB-CD2 4.37Å; D213-Y349 HydrophobicContact CB-CG 4.27Å; D213-Y349 WeakPolarHBondContact OD2-CD2 3.32Å
214	I	90.9	Very high	92.5	Very high	13 Å²	13	54 Å²	54	7%	0.067	27%	0.271	C	S	.	.			trans	-63.3	152	165.6	44	167	0	0	0	111.2	H216 M219 R221 I342	I214-H216 WeakPolarHBondContact CD1-O 3.15Å; I214-M219 HydrophobicContact CB-CB 4.34Å; I214-M219 HydrophobicContact CB-SD 4.43Å; I214-M219 HydrophobicContact CD1-CB 4.07Å; I214-M219 WeakPolarHBondContact CD1-O 3.45Å; I214-M219 HydrophobicContact CG2-CB 4.24Å; I214-R221 HydrophobicContact CD1-CG 3.37Å; I214-R221 HydrophobicContact CG1-CG 4.19Å; I214-I342 HydrophobicContact CB-CD1 4.06Å; I214-I342 HydrophobicContact CG1-CD1 3.93Å; I214-I342 HydrophobicContact CG2-CD1 3.52Å
215	L	88.6	Confident	92.5	Very high	40 Å²	40	57.7 Å²	57.7	21%	0.209	29%	0.29	C	S	.	.	S	Bend	trans	-74.7	-33.7	-178	-66	177.1	0	0	0	114.1	M219 V286 Q291 V301 R303	L215-M219 HydrophobicContact CB-CE 4.41Å; L215-M219 HydrophobicContact CB-SD 4.44Å; L215-V286 HydrophobicContact CD1-CB 3.8Å; L215-V286 HydrophobicContact CD1-CG1 3.91Å; L215-V286 HydrophobicContact CD1-CG2 4.28Å; L215-Q291 HydrophobicContact CB-CG 4.08Å; L215-Q291 HydrophobicContact CD1-CG 3.7Å; L215-V301 HydrophobicContact CD1-CB 4.06Å; L215-V301 HydrophobicContact CD1-CG1 3.91Å; L215-R303 HydrophobicContact CD1-CB 4.37Å; L215-R303 HydrophobicContact CD1-CG 4.43Å; L215-R303 VanDerWaalsContact CD2-CD 3.45Å; L215-R303 HydrophobicContact CD2-CG 3.77Å; L215-R303 VanDerWaalsContact CD2-NE 3.3Å
216	H	90.2	Very high	92.6	Very high	80 Å²	80	57.2 Å²	57.2	37%	0.37	29%	0.288	S	S	.	.	S	Bend	trans	-133	135.6	-173.8	-170.8	-87.3	0	0	0	111.1	I214 S218 M219 V295	I214-H216 WeakPolarHBondContact CD1-O 3.15Å; H216-S218 PolarHBondContact CE1-OG 3.25Å; H216-S218 WeakPolarHBondContact ND1-CB 2.82Å; H216-S218 PolarHBondContact ND1-N 3.15Å; H216-S218 PolarHBondContact ND1-OG 2.74Å; H216-S218 PolarHBondContact O-N 2.85Å; H216-S218 VanDerWaalsContact O-N 3.12Å; H216-M219 HydrophobicContact CB-CE 4.16Å; H216-M219 HydrophobicContact CB-CG 4.13Å; H216-M219 HydrophobicContact CB-SD 4.29Å; H216-M219 WeakPolarHBondContact O-CB 2.86Å; H216-M219 PolarHBondContact O-N 3.05Å; H216-V295 HydrophobicContact CB-CG2 3.81Å
217	A	88.6	Confident	92.7	Very high	92 Å²	92	56.3 Å²	56.3	76%	0.76	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-28.2	-173.5	0	0	0	0	0	114.2	M219	A217-M219 VanDerWaalsContact C-N 3.28Å; A217-M219 PolarHBondContact O-N 2.95Å
218	S	90	Very high	92.8	Very high	80 Å²	80	56.3 Å²	56.3	56%	0.559	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-8.6	176.3	-49	0	0	0	0	114.2	H216	H216-S218 PolarHBondContact CE1-OG 3.25Å; H216-S218 WeakPolarHBondContact ND1-CB 2.82Å; H216-S218 PolarHBondContact ND1-N 3.15Å; H216-S218 PolarHBondContact ND1-OG 2.74Å; H216-S218 PolarHBondContact O-N 2.85Å; H216-S218 VanDerWaalsContact O-N 3.12Å
219	M	91.4	Very high	92.9	Very high	5 Å²	5	56.3 Å²	56.3	3%	0.025	28%	0.282	C	S	.	.	S	Bend	trans	-71.6	141.4	176.2	-68.8	178.2	175.8	0	0	110.6	I214 L215 H216 A217 R221 V295 V301	I214-M219 HydrophobicContact CB-CB 4.34Å; I214-M219 HydrophobicContact CB-SD 4.43Å; I214-M219 HydrophobicContact CD1-CB 4.07Å; I214-M219 WeakPolarHBondContact CD1-O 3.45Å; I214-M219 HydrophobicContact CG2-CB 4.24Å; L215-M219 HydrophobicContact CB-CE 4.41Å; L215-M219 HydrophobicContact CB-SD 4.44Å; H216-M219 HydrophobicContact CB-CE 4.16Å; H216-M219 HydrophobicContact CB-CG 4.13Å; H216-M219 HydrophobicContact CB-SD 4.29Å; H216-M219 WeakPolarHBondContact O-CB 2.86Å; H216-M219 PolarHBondContact O-N 3.05Å; A217-M219 VanDerWaalsContact C-N 3.28Å; A217-M219 PolarHBondContact O-N 2.95Å; M219-R221 PolarHBondContact O-N 3.3Å; M219-V295 HydrophobicContact CE-CG2 3.44Å; M219-V295 VanDerWaalsContact CE-CG2 3.44Å; M219-V295 HydrophobicContact CG-CG2 3.78Å; M219-V295 HydrophobicContact SD-CG2 4.45Å; M219-V301 HydrophobicContact CE-CB 4.12Å; M219-V301 HydrophobicContact CE-CG2 3.92Å; M219-V301 HydrophobicContact SD-CB 4.41Å; M219-V301 PolarHBondContact SD-N 3.34Å
220	P	91.9	Very high	93	Very high	41 Å²	41	56.3 Å²	56.3	27%	0.266	28%	0.282	S	S	.	.			trans	-57.6	121.9	175.7	-24.9	33.1	0	0	0	112.6	I223 N298 S300	P220-I223 HydrophobicContact CB-CD1 4.25Å; P220-I223 HydrophobicContact CB-CG1 3.98Å; P220-N298 HydrophobicContact CG-CB 4.41Å; P220-S300 WeakPolarHBondContact CD-OG 3.47Å; P220-S300 PolarHBondContact O-OG 2.94Å
221	R	93.4	Very high	93.1	Very high	101 Å²	101	56.2 Å²	56.2	38%	0.381	28%	0.281	S	S	.	.	S	Bend	trans	-83	-11.9	175.9	-76.2	-173.6	162	-171.6	-9.1	114.5	D213 I214 M219 Y341 I342	D213-R221 IonicContact OD1-NH2 3.27Å; D213-R221 IonicContact OD2-NH2 2.74Å; D213-R221 PolarHBondContact OD2-NH2 3.05Å; D213-R221 VanDerWaalsContact OD2-NH2 3.12Å; I214-R221 HydrophobicContact CD1-CG 3.37Å; I214-R221 HydrophobicContact CG1-CG 4.19Å; M219-R221 PolarHBondContact O-N 3.3Å; R221-Y341 CarbonylContact O-C 3.6Å; R221-Y341 VanDerWaalsContact O-CA 3.22Å; R221-Y341 WeakPolarHBondContact O-CA 3.38Å; R221-I342 PolarHBondContact O-N 3.3Å
222	R	94.8	Very high	93.1	Very high	163 Å²	163	55.2 Å²	55.2	62%	0.615	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144	127.1	178.7	-174.4	168.2	-173.7	167.4	8.2	110.3	E339 F340	R222-E339 IonicContact CZ-OE1 3.72Å; R222-E339 IonicContact NE-OE1 2.75Å; R222-E339 PolarHBondContact NE-OE1 3.32Å; R222-E339 IonicContact NH2-OE1 2.74Å; R222-E339 PolarHBondContact NH2-OE1 2.91Å; R222-E339 IonicContact NH2-OE2 3.74Å; R222-E339 PolarHBondContact NH2-OE2 3.44Å; R222-F340 CarbonylContact C-O 3.51Å; R222-F340 VanDerWaalsContact CA-O 3.24Å; R222-F340 WeakPolarHBondContact CA-O 3.48Å
223	I	94.3	Very high	93.1	Very high	19 Å²	19	51.4 Å²	51.4	10%	0.097	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	124	-176.8	-55.1	166.9	0	0	0	107.7	P220 P226 N278 F340	P220-I223 HydrophobicContact CB-CD1 4.25Å; P220-I223 HydrophobicContact CB-CG1 3.98Å; I223-P226 HydrophobicContact CB-CB 4.27Å; I223-P226 HydrophobicContact CG2-CB 3.83Å; I223-N278 HydrophobicContact CD1-CB 4.16Å; I223-N278 HydrophobicContact CG2-CB 4.05Å; I223-F340 HydrophobicContact CB-CB 4.35Å; I223-F340 HydrophobicContact CB-CD1 4.14Å; I223-F340 HydrophobicContact CD1-CD1 3.8Å; I223-F340 HydrophobicContact CD1-CE1 4.16Å; I223-F340 HydrophobicContact CG1-CD1 3.93Å; I223-F340 PolarHBondContact N-O 2.97Å; I223-F340 PolarHBondContact O-N 3.16Å
224	K	93.5	Very high	93.1	Very high	161 Å²	161	49.1 Å²	49.1	70%	0.7	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	136.1	171.3	-68	-172.9	176.2	-175.1	0	109.4
225	N	92.3	Very high	93.2	Very high	114 Å²	114	48.6 Å²	48.6	61%	0.61	25%	0.246	S	C	*	.	S	Bend	trans	46.8	59.3	-176	-56.7	-50.3	0	0	0	113	A337 S338	N225-A337 WeakPolarHBondContact CA-O 3.33Å; N225-S338 PolarHBondContact N-O 3.38Å; N225-S338 PolarHBondContact OD1-O 2.87Å
226	P	94.6	Very high	93.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.			trans	-64.7	138	-175.8	29.1	-36	0	0	0	111.4	I223 V228 L279 A337 F340	I223-P226 HydrophobicContact CB-CB 4.27Å; I223-P226 HydrophobicContact CG2-CB 3.83Å; P226-V228 HydrophobicContact CB-CG2 4.12Å; P226-V228 HydrophobicContact CG-CG2 4.13Å; P226-L279 HydrophobicContact CB-CB 4.41Å; P226-L279 HydrophobicContact CB-CD2 4.47Å; P226-A337 HydrophobicContact CG-CB 3.84Å; P226-F340 HydrophobicContact CB-CB 4.26Å; P226-F340 HydrophobicContact CG-CB 3.89Å
227	R	95.7	Very high	93.3	Very high	72 Å²	72	50.3 Å²	50.3	27%	0.272	25%	0.252	S	S	.	.			trans	-84.2	114.1	164	-64.5	-172.6	69.5	-143.8	1.6	109.2	L275 K276 N278 L279 V333 G334 T335	R227-L275 PolarHBondContact NH1-O 3.11Å; R227-L275 PolarHBondContact NH2-O 3.02Å; R227-L275 VanDerWaalsContact NH2-O 3.09Å; R227-K276 PolarHBondContact NH1-O 2.97Å; R227-N278 PolarHBondContact N-OD1 3.18Å; R227-N278 PolarHBondContact O-N 2.78Å; R227-L279 PolarHBondContact O-N 3.29Å; R227-L279 VanDerWaalsContact O-N 3.08Å; R227-V333 HydrophobicContact CB-CG1 3.96Å; R227-G334 WeakPolarHBondContact CA-O 3.42Å; R227-T335 HydrophobicContact CG-CG2 4.39Å
228	V	95.8	Very high	93	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	134.5	-168.1	-172.9	0	0	0	0	111.1	P226 L230 L279 F281 T317 G334	P226-V228 HydrophobicContact CB-CG2 4.12Å; P226-V228 HydrophobicContact CG-CG2 4.13Å; V228-L230 HydrophobicContact CG1-CD2 3.94Å; V228-L279 WeakPolarHBondContact CA-O 3.22Å; V228-L279 HydrophobicContact CG2-CB 4.41Å; V228-L279 HydrophobicContact CG2-CD2 4.19Å; V228-F281 HydrophobicContact CG1-CD2 3.47Å; V228-F281 VanDerWaalsContact CG1-CD2 3.47Å; V228-F281 HydrophobicContact CG1-CE2 3.61Å; V228-T317 HydrophobicContact CB-CG2 4.04Å; V228-T317 HydrophobicContact CG1-CG2 4.04Å; V228-T317 HydrophobicContact CG2-CG2 3.88Å; V228-G334 PolarHBondContact N-O 3.22Å; V228-G334 PolarHBondContact O-N 3.44Å
229	I	96.6	Very high	92.6	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.1	169.1	-66.3	-179.5	0	0	0	109.2	L231 I272 L275 P277 L279 V280 F281 L328 V333	I229-L231 HydrophobicContact CG2-CD2 4.3Å; I229-L231 HydrophobicContact CG2-CG 4.08Å; I229-I272 HydrophobicContact CD1-CG2 4.32Å; I229-L275 HydrophobicContact CD1-CB 4.32Å; I229-L275 HydrophobicContact CD1-CD1 4.11Å; I229-P277 HydrophobicContact CD1-CB 3.69Å; I229-P277 HydrophobicContact CD1-CG 3.74Å; I229-P277 HydrophobicContact CG1-CB 3.92Å; I229-P277 HydrophobicContact CG1-CG 4.47Å; I229-L279 PolarHBondContact N-O 3.14Å; I229-V280 HydrophobicContact CB-CG2 4.44Å; I229-F281 PolarHBondContact O-N 2.99Å; I229-L328 HydrophobicContact CD1-CD1 4.3Å; I229-L328 HydrophobicContact CG2-CD1 4.03Å; I229-L328 HydrophobicContact CG2-CD2 3.78Å; I229-V333 HydrophobicContact CD1-CG2 4.32Å; I229-V333 HydrophobicContact CG1-CG2 4.21Å
230	L	96.8	Very high	91.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.1	178.1	-55.1	-179	0	0	0	109.9	V228 F281 L313 A314 A319 I321 V322	V228-L230 HydrophobicContact CG1-CD2 3.94Å; L230-F281 HydrophobicContact CD2-CB 3.64Å; L230-F281 HydrophobicContact CD2-CD2 3.63Å; L230-F281 HydrophobicContact CD2-CG 4Å; L230-L313 HydrophobicContact CD1-CB 4Å; L230-L313 HydrophobicContact CD2-CB 3.97Å; L230-L313 HydrophobicContact CD2-CD1 4.12Å; L230-A314 HydrophobicContact CD1-CB 3.72Å; L230-A319 HydrophobicContact CD1-CB 3.84Å; L230-A319 HydrophobicContact CG-CB 3.78Å; L230-I321 HydrophobicContact CB-CG1 4.17Å; L230-I321 HydrophobicContact CD1-CG1 4.09Å; L230-V322 PolarHBondContact O-N 3.35Å; L230-V322 VanDerWaalsContact O-N 3.1Å
231	L	96.1	Very high	91.5	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.2	-179.8	-65.8	173	0	0	0	111.3	I229 L235 I272 V280 F281 C282 E283 V322 P325 L328	I229-L231 HydrophobicContact CG2-CD2 4.3Å; I229-L231 HydrophobicContact CG2-CG 4.08Å; L231-L235 HydrophobicContact CD1-CD2 3.97Å; L231-I272 HydrophobicContact CD1-CD1 3.77Å; L231-V280 HydrophobicContact CD1-CG1 4.06Å; L231-F281 PolarHBondContact N-O 3.3Å; L231-C282 CarbonylContact O-C 3.21Å; L231-C282 WeakPolarHBondContact O-CA 3.39Å; L231-E283 PolarHBondContact O-N 3.45Å; L231-V322 VanDerWaalsContact CA-O 3.31Å; L231-V322 WeakPolarHBondContact CA-O 3.29Å; L231-V322 HydrophobicContact CD2-CB 4.42Å; L231-P325 HydrophobicContact CD1-CG 4.16Å; L231-P325 HydrophobicContact CD2-CG 4.42Å; L231-L328 HydrophobicContact CD2-CD1 4.23Å; L231-L328 HydrophobicContact CD2-CD2 4.14Å; L231-L328 HydrophobicContact CD2-CG 4.4Å
232	D	94.9	Very high	91.1	Very high	42 Å²	42	68.4 Å²	68.4	23%	0.225	32%	0.317	C	S	.	.	S	Bend	trans	-78.3	-33.3	170.5	-166.2	-21.6	0	0	0	111.1	K284 R307 I321 V322	D232-K284 VanDerWaalsContact O-CG 3.32Å; D232-K284 WeakPolarHBondContact O-CG 3.39Å; D232-R307 VanDerWaalsContact CG-NH1 3.35Å; D232-R307 IonicContact OD2-CZ 3.51Å; D232-R307 IonicContact OD2-NH1 3.22Å; D232-R307 PolarHBondContact OD2-NH1 3.36Å; D232-I321 HydrophobicContact CB-CG2 4.18Å; D232-V322 PolarHBondContact N-O 3.24Å
233	S	92.8	Very high	90.4	Very high	7 Å²	7	70.4 Å²	70.4	5%	0.049	33%	0.333	C	S	.	.	S	Bend	trans	-76.6	170.2	177.4	66.9	0	0	0	0	113	H323	S233-H323 WeakPolarHBondContact CB-O 3.33Å; S233-H323 PolarHBondContact OG-O 3.12Å
234	G	92.2	Very high	89.4	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.01	35%	0.347	C	S	.	.			trans	-92.8	161.2	169.2	0	0	0	0	0	111	E236 G285	G234-E236 PolarHBondContact O-N 3.28Å; G234-G285 CarbonylContact C-O 3.39Å; G234-G285 WeakPolarHBondContact CA-O 3.35Å
235	L	93.2	Very high	88.7	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-98.5	69.9	170.8	-59.8	177.9	0	0	0	109.1	L231 I272 G285 V286 S287 A290 L294 P325	L231-L235 HydrophobicContact CD1-CD2 3.97Å; L235-I272 HydrophobicContact CD1-CD1 3.95Å; L235-I272 HydrophobicContact CD2-CD1 3.67Å; L235-I272 HydrophobicContact CG-CD1 4.47Å; L235-G285 PolarHBondContact N-O 3.15Å; L235-V286 HydrophobicContact CB-CB 4.49Å; L235-V286 HydrophobicContact CB-CG1 4.12Å; L235-V286 HydrophobicContact CB-CG2 4.32Å; L235-V286 HydrophobicContact CD1-CG1 4.35Å; L235-V286 HydrophobicContact CD1-CG2 4.42Å; L235-V286 HydrophobicContact CG-CG2 4.47Å; L235-S287 WeakPolarHBondContact O-CB 3.33Å; L235-S287 PolarHBondContact O-N 2.81Å; L235-S287 PolarHBondContact O-OG 3.4Å; L235-A290 HydrophobicContact CB-CB 3.79Å; L235-L294 HydrophobicContact CD1-CD1 3.76Å; L235-P325 HydrophobicContact CD2-CG 3.91Å
236	E	91.7	Very high	87.8	Confident	82 Å²	82	69.7 Å²	69.7	38%	0.383	35%	0.346	S	S	.	.	S	Bend	trans	-144.9	160.3	-178.1	63.7	-169.6	178.4	0	0	110.3	G234 H238	G234-E236 PolarHBondContact O-N 3.28Å; E236-H238 PolarHBondContact O-N 2.78Å
237	F	88.8	Confident	87	Confident	74 Å²	74	78.3 Å²	78.3	33%	0.325	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-68.9	116.7	177.8	-173.9	-99.1	0	0	0	110.6	E261 A264 V265	F237-E261 HydrophobicContact CB-CG 3.86Å; F237-E261 HydrophobicContact CD2-CB 4.18Å; F237-E261 HydrophobicContact CD2-CG 4.37Å; F237-E261 HydrophobicContact CG-CB 4.26Å; F237-E261 HydrophobicContact CG-CG 4.13Å; F237-A264 HydrophobicContact CD2-CB 3.69Å; F237-A264 HydrophobicContact CE2-CB 3.83Å; F237-V265 HydrophobicContact CB-CG2 4.46Å
238	H	82.8	Confident	86.2	Confident	89 Å²	89	78.1 Å²	78.1	41%	0.412	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-81.6	136	179.3	-65.8	-54.3	0	0	0	111.3	E236	E236-H238 PolarHBondContact O-N 2.78Å
239	K	80.5	Confident	85.5	Confident	192 Å²	192	82.9 Å²	82.9	84%	0.835	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-72.5	140.2	167.6	-66	-176.9	179.3	-177.9	0	108.9
240	F	78.3	Confident	85	Confident	129 Å²	129	87.7 Å²	87.7	57%	0.566	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-60.3	140	173.6	-60.9	-78.4	0	0	0	110.6	S242 A244 F246	F240-S242 VanDerWaalsContact C-N 3.26Å; F240-S242 PolarHBondContact O-N 3.38Å; F240-A244 HydrophobicContact CB-CB 4.37Å; F240-A244 HydrophobicContact CD2-CB 4.32Å; F240-F246 HydrophobicContact CD2-CE2 4.47Å; F240-F246 HydrophobicContact CD2-CZ 4.19Å; F240-F246 HydrophobicContact CE2-CZ 4.08Å
241	E	82.2	Confident	84.5	Confident	209 Å²	209	95.6 Å²	95.6	98%	0.977	49%	0.493	S	S	*	.	S	Bend	trans	-67.1	-30.2	175.6	-65.5	-174.1	160.7	0	0	112
242	S	85.6	Confident	84.1	Confident	81 Å²	81	99.1 Å²	99.1	57%	0.566	52%	0.522	S	S	*	.	S	Bend	trans	-66.5	147.9	170.5	57.6	0	0	0	0	111	F240 A244	F240-S242 VanDerWaalsContact C-N 3.26Å; F240-S242 PolarHBondContact O-N 3.38Å; S242-A244 PolarHBondContact O-N 3.42Å
243	Q	79.9	Confident	83.7	Confident	204 Å²	204	99.2 Å²	99.2	95%	0.953	53%	0.526	S	S	*	.			trans	-63.9	82.3	171.5	-67.4	-177.5	-5.6	0	0	110.8
244	A	74.2	Confident	83.4	Confident	48 Å²	48	101.9 Å²	101.9	40%	0.397	54%	0.542	S	S	.	.			trans	-91.1	105.6	173.6	0	0	0	0	0	108.6	F240 S242 F246	F240-A244 HydrophobicContact CB-CB 4.37Å; F240-A244 HydrophobicContact CD2-CB 4.32Å; S242-A244 PolarHBondContact O-N 3.42Å; A244-F246 HydrophobicContact CB-CE2 3.76Å; A244-F246 HydrophobicContact CB-CZ 4.11Å
245	S	77	Confident	83.3	Confident	105 Å²	105	105.4 Å²	105.4	73%	0.734	56%	0.564	S	S	*	*			trans	-86.8	122.7	168	54.4	0	0	0	0	109.2
246	F	73.8	Confident	83	Confident	127 Å²	127	108.5 Å²	108.5	56%	0.557	59%	0.585	S	S	*	*			trans	-103.3	116	171.6	-64.2	-83.8	0	0	0	108.6	F240 A244 M257	F240-F246 HydrophobicContact CD2-CE2 4.47Å; F240-F246 HydrophobicContact CD2-CZ 4.19Å; F240-F246 HydrophobicContact CE2-CZ 4.08Å; A244-F246 HydrophobicContact CB-CE2 3.76Å; A244-F246 HydrophobicContact CB-CZ 4.11Å; F246-M257 HydrophobicContact CB-CE 3.92Å; F246-M257 HydrophobicContact CD1-CE 4.25Å; F246-M257 HydrophobicContact CD2-CE 4.49Å; F246-M257 HydrophobicContact CG-CE 3.97Å
247	E	78.9	Confident	82.8	Confident	181 Å²	181	108.3 Å²	108.3	85%	0.846	59%	0.585	S	S	*	*			trans	-98.8	114.4	172.2	-69.8	-175.5	175.7	0	0	109.2
248	C	78.7	Confident	82.8	Confident	68 Å²	68	109.5 Å²	109.5	46%	0.459	59%	0.594	S	S	.	*			trans	-95.1	101.8	175.6	-67	0	0	0	0	109.7	V254 M257	C248-V254 HydrophobicContact CB-CG2 4.18Å; C248-M257 PolarHBondContact SG-SD 2.92Å
249	S	80.5	Confident	83.2	Confident	99 Å²	99	109.5 Å²	109.5	69%	0.692	60%	0.595	S	S	*	*			trans	-82.6	-34.4	172.3	52.3	0	0	0	0	113
250	D	86.5	Confident	83.6	Confident	102 Å²	102	103.6 Å²	103.6	55%	0.545	58%	0.575	S	S	.	*	S	Bend	trans	-128.6	151.4	-167.8	-58.2	-64.3	0	0	0	112.1	A252 S253	D250-A252 PolarHBondContact O-N 3.25Å; D250-S253 WeakPolarHBondContact O-CB 3.25Å; D250-S253 PolarHBondContact O-N 3.22Å
251	M	86.6	Confident	84.2	Confident	166 Å²	166	100.9 Å²	100.9	82%	0.818	56%	0.564	S	S	*	*	H	α-helix	trans	-58.1	-31.9	175.6	-72	-65.8	-171.7	0	0	112.5	S253 V254 T255	M251-S253 VanDerWaalsContact C-N 3.3Å; M251-S253 PolarHBondContact O-N 2.87Å; M251-V254 PolarHBondContact O-N 2.95Å; M251-T255 PolarHBondContact O-N 3.47Å; M251-T255 PolarHBondContact O-OG1 3.41Å
252	A	87.8	Confident	84.7	Confident	74 Å²	74	95.2 Å²	95.2	61%	0.612	54%	0.537	S	S	*	.	H	α-helix	trans	-62.9	-35.6	176.5	0	0	0	0	0	112.6	D250 V254 T255 S256	D250-A252 PolarHBondContact O-N 3.25Å; A252-V254 VanDerWaalsContact C-N 3.34Å; A252-T255 PolarHBondContact O-N 2.93Å; A252-S256 PolarHBondContact O-N 3.1Å
253	S	85.4	Confident	85	Confident	45 Å²	45	97.3 Å²	97.3	32%	0.315	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-40	177	-55	0	0	0	0	111	D250 M251 S256 M257	D250-S253 WeakPolarHBondContact O-CB 3.25Å; D250-S253 PolarHBondContact O-N 3.22Å; M251-S253 VanDerWaalsContact C-N 3.3Å; M251-S253 PolarHBondContact O-N 2.87Å; S253-S256 PolarHBondContact O-N 3.25Å; S253-M257 VanDerWaalsContact O-CG 3.3Å; S253-M257 WeakPolarHBondContact O-CG 3.06Å; S253-M257 PolarHBondContact O-N 3.36Å
254	V	86.1	Confident	85.6	Confident	62 Å²	62	89 Å²	89	38%	0.376	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-45.5	176.2	-178.6	0	0	0	0	111	C248 M251 A252 S256 M257 L258	C248-V254 HydrophobicContact CB-CG2 4.18Å; M251-V254 PolarHBondContact O-N 2.95Å; A252-V254 VanDerWaalsContact C-N 3.34Å; V254-S256 PolarHBondContact O-N 3.2Å; V254-M257 PolarHBondContact O-N 3.22Å; V254-L258 HydrophobicContact CG1-CD1 4.44Å; V254-L258 WeakPolarHBondContact O-CG 3.43Å; V254-L258 PolarHBondContact O-N 3.01Å; V254-L258 VanDerWaalsContact O-N 3.08Å
255	T	90.3	Very high	86.5	Confident	76 Å²	76	86.8 Å²	86.8	47%	0.466	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-44.6	177.2	-52.7	0	0	0	0	111.9	M251 A252 M257 L258 E259	M251-T255 PolarHBondContact O-N 3.47Å; M251-T255 PolarHBondContact O-OG1 3.41Å; A252-T255 PolarHBondContact O-N 2.93Å; T255-M257 VanDerWaalsContact C-N 3.29Å; T255-M257 PolarHBondContact O-N 3.06Å; T255-L258 PolarHBondContact O-N 3.09Å; T255-E259 WeakPolarHBondContact O-CG 3.4Å; T255-E259 PolarHBondContact O-N 3.27Å
256	S	87.7	Confident	87.4	Confident	65 Å²	65	86.2 Å²	86.2	46%	0.455	47%	0.468	S	S	.	.	H	α-helix	trans	-60.4	-37.7	177.1	-175.8	0	0	0	0	112.5	A252 S253 V254 E259 T260	A252-S256 PolarHBondContact O-N 3.1Å; S253-S256 PolarHBondContact O-N 3.25Å; V254-S256 PolarHBondContact O-N 3.2Å; S256-E259 PolarHBondContact O-N 3.42Å; S256-T260 WeakPolarHBondContact O-CB 3.22Å; S256-T260 PolarHBondContact O-N 2.77Å; S256-T260 PolarHBondContact O-OG1 3.37Å
257	M	86.5	Confident	88.3	Confident	78 Å²	78	82.7 Å²	82.7	38%	0.384	46%	0.463	S	S	.	.	H	α-helix	trans	-65.1	-45.4	175.2	-71.6	177.6	76.3	0	0	112	F246 C248 S253 V254 T255 E259 T260 E261	F246-M257 HydrophobicContact CB-CE 3.92Å; F246-M257 HydrophobicContact CD1-CE 4.25Å; F246-M257 HydrophobicContact CD2-CE 4.49Å; F246-M257 HydrophobicContact CG-CE 3.97Å; C248-M257 PolarHBondContact SG-SD 2.92Å; S253-M257 VanDerWaalsContact O-CG 3.3Å; S253-M257 WeakPolarHBondContact O-CG 3.06Å; S253-M257 PolarHBondContact O-N 3.36Å; V254-M257 PolarHBondContact O-N 3.22Å; T255-M257 VanDerWaalsContact C-N 3.29Å; T255-M257 PolarHBondContact O-N 3.06Å; M257-E259 VanDerWaalsContact C-N 3.34Å; M257-E259 PolarHBondContact O-N 3.34Å; M257-T260 WeakPolarHBondContact O-CB 3.25Å; M257-T260 PolarHBondContact O-N 3.1Å; M257-T260 VanDerWaalsContact O-N 3.14Å; M257-E261 PolarHBondContact O-N 3.49Å
258	L	88.8	Confident	89	Confident	99 Å²	99	75.8 Å²	75.8	52%	0.518	43%	0.431	S	S	.	.	H	α-helix	trans	-62.3	-41.4	176.7	-67.2	173.5	0	0	0	111.8	V254 T255 T260 E261 E262	V254-L258 HydrophobicContact CG1-CD1 4.44Å; V254-L258 WeakPolarHBondContact O-CG 3.43Å; V254-L258 PolarHBondContact O-N 3.01Å; V254-L258 VanDerWaalsContact O-N 3.08Å; T255-L258 PolarHBondContact O-N 3.09Å; L258-T260 VanDerWaalsContact C-N 3.29Å; L258-T260 PolarHBondContact O-N 3.48Å; L258-E261 PolarHBondContact O-N 3.37Å; L258-E262 PolarHBondContact O-N 3Å
259	E	91.8	Very high	89.8	Confident	89 Å²	89	72.6 Å²	72.6	42%	0.416	41%	0.409	S	S	.	.	H	α-helix	trans	-63.5	-35.9	174	-73.6	-176.1	-162.6	0	0	112.6	T255 S256 M257 K263	T255-E259 WeakPolarHBondContact O-CG 3.4Å; T255-E259 PolarHBondContact O-N 3.27Å; S256-E259 PolarHBondContact O-N 3.42Å; M257-E259 VanDerWaalsContact C-N 3.34Å; M257-E259 PolarHBondContact O-N 3.34Å; E259-K263 WeakPolarHBondContact O-CB 3.06Å; E259-K263 WeakPolarHBondContact O-CD 3.05Å; E259-K263 WeakPolarHBondContact O-CG 3.34Å; E259-K263 PolarHBondContact O-N 2.65Å; E259-K263 IonicContact OE2-NZ 2.93Å; E259-K263 PolarHBondContact OE2-NZ 3.12Å
260	T	89.6	Confident	90.4	Very high	69 Å²	69	71 Å²	71	42%	0.423	39%	0.393	S	S	.	.	H	α-helix	trans	-69.3	-42.3	178	-58.4	0	0	0	0	110.8	S256 M257 L258 K263 A264	S256-T260 WeakPolarHBondContact O-CB 3.22Å; S256-T260 PolarHBondContact O-N 2.77Å; S256-T260 PolarHBondContact O-OG1 3.37Å; M257-T260 WeakPolarHBondContact O-CB 3.25Å; M257-T260 PolarHBondContact O-N 3.1Å; M257-T260 VanDerWaalsContact O-N 3.14Å; L258-T260 VanDerWaalsContact C-N 3.29Å; L258-T260 PolarHBondContact O-N 3.48Å; T260-K263 PolarHBondContact O-N 2.94Å; T260-A264 WeakPolarHBondContact O-CB 2.95Å; T260-A264 PolarHBondContact O-N 3.39Å
261	E	89.8	Confident	90.8	Very high	71 Å²	71	67.8 Å²	67.8	33%	0.332	38%	0.379	S	S	.	.	H	α-helix	trans	-58.1	-49	172.1	169.9	167.6	-159.5	0	0	111.1	F237 M257 L258 K263 A264 V265	F237-E261 HydrophobicContact CB-CG 3.86Å; F237-E261 HydrophobicContact CD2-CB 4.18Å; F237-E261 HydrophobicContact CD2-CG 4.37Å; F237-E261 HydrophobicContact CG-CB 4.26Å; F237-E261 HydrophobicContact CG-CG 4.13Å; M257-E261 PolarHBondContact O-N 3.49Å; L258-E261 PolarHBondContact O-N 3.37Å; E261-K263 PolarHBondContact O-N 3.16Å; E261-A264 PolarHBondContact O-N 3.47Å; E261-V265 WeakPolarHBondContact O-CG2 3.07Å; E261-V265 PolarHBondContact O-N 3.22Å
262	E	92.7	Very high	91.2	Very high	90 Å²	90	59.9 Å²	59.9	42%	0.421	34%	0.34	S	S	.	.	H	α-helix	trans	-61.1	-45.2	177.8	-170.1	-177.1	168.7	0	0	111.8	L258 A264 V265 K266 L289 F293	L258-E262 PolarHBondContact O-N 3Å; E262-A264 PolarHBondContact O-N 2.97Å; E262-V265 PolarHBondContact O-N 3.43Å; E262-K266 WeakPolarHBondContact O-CB 3.29Å; E262-K266 PolarHBondContact O-N 3.43Å; E262-L289 HydrophobicContact CB-CD1 4.47Å; E262-F293 HydrophobicContact CG-CE2 4.39Å; E262-F293 HydrophobicContact CG-CZ 4.09Å
263	K	93.3	Very high	91.5	Very high	126 Å²	126	57.9 Å²	57.9	55%	0.548	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-42	177.4	-75.6	165.6	-169.6	158.1	0	112.1	E259 T260 E261 K266 A267	E259-K263 WeakPolarHBondContact O-CB 3.06Å; E259-K263 WeakPolarHBondContact O-CD 3.05Å; E259-K263 WeakPolarHBondContact O-CG 3.34Å; E259-K263 PolarHBondContact O-N 2.65Å; E259-K263 IonicContact OE2-NZ 2.93Å; E259-K263 PolarHBondContact OE2-NZ 3.12Å; T260-K263 PolarHBondContact O-N 2.94Å; E261-K263 PolarHBondContact O-N 3.16Å; K263-K266 PolarHBondContact O-N 3.44Å; K263-A267 WeakPolarHBondContact O-CB 3.39Å; K263-A267 PolarHBondContact O-N 3.21Å
264	A	91.9	Very high	91.9	Very high	30 Å²	30	63.1 Å²	63.1	25%	0.248	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-47.4	179.6	0	0	0	0	0	111.8	F237 T260 E261 E262 K266 A267 M268	F237-A264 HydrophobicContact CD2-CB 3.69Å; F237-A264 HydrophobicContact CE2-CB 3.83Å; T260-A264 WeakPolarHBondContact O-CB 2.95Å; T260-A264 PolarHBondContact O-N 3.39Å; E261-A264 PolarHBondContact O-N 3.47Å; E262-A264 PolarHBondContact O-N 2.97Å; A264-K266 VanDerWaalsContact C-N 3.3Å; A264-K266 PolarHBondContact O-N 3.3Å; A264-A267 PolarHBondContact O-N 3.24Å; A264-M268 WeakPolarHBondContact O-CG 3.37Å; A264-M268 PolarHBondContact O-N 3.3Å; A264-M268 VanDerWaalsContact O-N 3.15Å
265	V	93.5	Very high	92.2	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.006	33%	0.325	C	S	.	.	H	α-helix	trans	-62	-41.3	175.7	173.4	0	0	0	0	110.7	F237 E261 E262 M268 C269 L289 A290	F237-V265 HydrophobicContact CB-CG2 4.46Å; E261-V265 WeakPolarHBondContact O-CG2 3.07Å; E261-V265 PolarHBondContact O-N 3.22Å; E262-V265 PolarHBondContact O-N 3.43Å; V265-M268 PolarHBondContact O-N 2.95Å; V265-C269 PolarHBondContact O-N 3.11Å; V265-C269 PolarHBondContact O-SG 3.03Å; V265-C269 VanDerWaalsContact O-SG 3.41Å; V265-L289 HydrophobicContact CG1-CB 4.1Å; V265-A290 HydrophobicContact CG1-CB 3.71Å
266	K	94.4	Very high	92.3	Very high	92 Å²	92	65 Å²	65	40%	0.4	34%	0.336	S	S	.	.	H	α-helix	trans	-62.3	-43.3	176.4	-174.4	178	177.9	-178.9	0	112.1	E262 K263 A264 M268 C269 D270 F293	E262-K266 WeakPolarHBondContact O-CB 3.29Å; E262-K266 PolarHBondContact O-N 3.43Å; K263-K266 PolarHBondContact O-N 3.44Å; A264-K266 VanDerWaalsContact C-N 3.3Å; A264-K266 PolarHBondContact O-N 3.3Å; K266-M268 VanDerWaalsContact C-N 3.34Å; K266-M268 PolarHBondContact O-N 2.93Å; K266-C269 CarbonylContact O-C 3.52Å; K266-C269 PolarHBondContact O-N 3.13Å; K266-C269 VanDerWaalsContact O-N 3.17Å; K266-D270 WeakPolarHBondContact O-CB 3.48Å; K266-D270 VanDerWaalsContact O-CG 3.26Å; K266-D270 PolarHBondContact O-N 3.12Å; K266-F293 HydrophobicContact CB-CD2 4.39Å; K266-F293 HydrophobicContact CB-CE2 3.91Å; K266-F293 HydrophobicContact CB-CZ 4.08Å; K266-F293 HydrophobicContact CD-CE1 4.21Å; K266-F293 HydrophobicContact CD-CZ 4.18Å; K266-F293 HydrophobicContact CG-CE1 4.29Å; K266-F293 HydrophobicContact CG-CE2 4.35Å; K266-F293 HydrophobicContact CG-CZ 4.18Å
267	A	93.7	Very high	92.6	Very high	53 Å²	53	62.2 Å²	62.2	44%	0.438	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-40.7	177.2	0	0	0	0	0	112.5	K263 A264 D270 S271	K263-A267 WeakPolarHBondContact O-CB 3.39Å; K263-A267 PolarHBondContact O-N 3.21Å; A264-A267 PolarHBondContact O-N 3.24Å; A267-D270 PolarHBondContact O-N 2.95Å; A267-S271 PolarHBondContact O-N 3.12Å; A267-S271 VanDerWaalsContact O-N 3.12Å; A267-S271 PolarHBondContact O-OG 3.39Å
268	M	93.8	Very high	93	Very high	37 Å²	37	61.4 Å²	61.4	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-62.1	-45	173.2	-65.5	174.8	-174	0	0	111.4	A264 V265 K266 I272 P325	A264-M268 WeakPolarHBondContact O-CG 3.37Å; A264-M268 PolarHBondContact O-N 3.3Å; A264-M268 VanDerWaalsContact O-N 3.15Å; V265-M268 PolarHBondContact O-N 2.95Å; K266-M268 VanDerWaalsContact C-N 3.34Å; K266-M268 PolarHBondContact O-N 2.93Å; M268-I272 WeakPolarHBondContact O-CG1 3.13Å; M268-I272 PolarHBondContact O-N 3.4Å; M268-P325 HydrophobicContact CB-CB 4.39Å; M268-P325 HydrophobicContact CB-CG 4.3Å
269	C	94.6	Very high	93.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66	-40	177.1	-70.5	0	0	0	0	112.6	V265 K266 S271 I272 I273 F293 L294	V265-C269 PolarHBondContact O-N 3.11Å; V265-C269 PolarHBondContact O-SG 3.03Å; V265-C269 VanDerWaalsContact O-SG 3.41Å; K266-C269 CarbonylContact O-C 3.52Å; K266-C269 PolarHBondContact O-N 3.13Å; K266-C269 VanDerWaalsContact O-N 3.17Å; C269-S271 VanDerWaalsContact C-N 3.33Å; C269-S271 PolarHBondContact O-N 3.48Å; C269-I272 WeakPolarHBondContact O-CB 3.3Å; C269-I272 PolarHBondContact O-N 2.82Å; C269-I273 HydrophobicContact CB-CD1 4.33Å; C269-I273 WeakPolarHBondContact O-CB 3.48Å; C269-I273 WeakPolarHBondContact O-CD1 3.48Å; C269-I273 WeakPolarHBondContact O-CG1 3.23Å; C269-I273 PolarHBondContact O-N 3.26Å; C269-F293 HydrophobicContact CB-CB 4.09Å; C269-L294 HydrophobicContact CB-CD2 4.47Å
270	D	94.7	Very high	93.5	Very high	67 Å²	67	52.5 Å²	52.5	36%	0.358	27%	0.268	S	S	.	.	H	α-helix	trans	-62.4	-42.4	179.8	-75.1	-21.8	0	0	0	110.5	K266 A267 I272 I273 E274	K266-D270 WeakPolarHBondContact O-CB 3.48Å; K266-D270 VanDerWaalsContact O-CG 3.26Å; K266-D270 PolarHBondContact O-N 3.12Å; A267-D270 PolarHBondContact O-N 2.95Å; D270-I272 VanDerWaalsContact C-N 3.28Å; D270-I272 PolarHBondContact O-N 2.93Å; D270-I273 PolarHBondContact O-N 3.47Å; D270-E274 WeakPolarHBondContact O-CG 3.32Å; D270-E274 PolarHBondContact O-N 2.89Å
271	S	93.5	Very high	93.8	Very high	34 Å²	34	49.3 Å²	49.3	24%	0.238	25%	0.249	C	C	.	.	H	α-helix	trans	-57.3	-40.4	174.3	-53	0	0	0	0	112.1	A267 C269 P325	A267-S271 PolarHBondContact O-N 3.12Å; A267-S271 VanDerWaalsContact O-N 3.12Å; A267-S271 PolarHBondContact O-OG 3.39Å; C269-S271 VanDerWaalsContact C-N 3.33Å; C269-S271 PolarHBondContact O-N 3.48Å; S271-P325 WeakPolarHBondContact CB-O 3.48Å
272	I	94.5	Very high	94.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-69.1	-43.4	174.8	-66.2	169.5	0	0	0	110.8	I229 L231 L235 M268 C269 D270 E274 L275 P277 V280 L294 P325 L328	I229-I272 HydrophobicContact CD1-CG2 4.32Å; L231-I272 HydrophobicContact CD1-CD1 3.77Å; L235-I272 HydrophobicContact CD1-CD1 3.95Å; L235-I272 HydrophobicContact CD2-CD1 3.67Å; L235-I272 HydrophobicContact CG-CD1 4.47Å; M268-I272 WeakPolarHBondContact O-CG1 3.13Å; M268-I272 PolarHBondContact O-N 3.4Å; C269-I272 WeakPolarHBondContact O-CB 3.3Å; C269-I272 PolarHBondContact O-N 2.82Å; D270-I272 VanDerWaalsContact C-N 3.28Å; D270-I272 PolarHBondContact O-N 2.93Å; I272-E274 VanDerWaalsContact C-N 3.35Å; I272-E274 PolarHBondContact O-N 3.45Å; I272-L275 PolarHBondContact O-N 3.04Å; I272-P277 HydrophobicContact CG2-CG 3.67Å; I272-P277 WeakPolarHBondContact O-CD 3.33Å; I272-P277 WeakPolarHBondContact O-CG 3.3Å; I272-V280 HydrophobicContact CG2-CG2 3.75Å; I272-L294 HydrophobicContact CG2-CD2 4.27Å; I272-P325 HydrophobicContact CD1-CB 4.25Å; I272-P325 HydrophobicContact CD1-CG 4.46Å; I272-P325 HydrophobicContact CG1-CB 4.11Å; I272-L328 HydrophobicContact CG1-CD1 3.81Å
273	I	94.6	Very high	94.2	Very high	31 Å²	31	42.7 Å²	42.7	16%	0.159	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-35.6	-176.4	-70.3	160.7	0	0	0	111.6	C269 D270 L275 K276 L294 K297 I299	C269-I273 HydrophobicContact CB-CD1 4.33Å; C269-I273 WeakPolarHBondContact O-CB 3.48Å; C269-I273 WeakPolarHBondContact O-CD1 3.48Å; C269-I273 WeakPolarHBondContact O-CG1 3.23Å; C269-I273 PolarHBondContact O-N 3.26Å; D270-I273 PolarHBondContact O-N 3.47Å; I273-L275 PolarHBondContact O-N 3.43Å; I273-K276 WeakPolarHBondContact O-CA 3.34Å; I273-K276 PolarHBondContact O-N 2.73Å; I273-L294 HydrophobicContact CD1-CD2 4.49Å; I273-L294 HydrophobicContact CG1-CD2 4.2Å; I273-K297 HydrophobicContact CD1-CG 3.83Å; I273-K297 HydrophobicContact CG1-CB 4.45Å; I273-K297 HydrophobicContact CG1-CG 4.01Å; I273-K297 HydrophobicContact CG2-CD 4.26Å; I273-K297 HydrophobicContact CG2-CG 3.99Å; I273-I299 HydrophobicContact CG1-CD1 3.83Å
274	E	93.7	Very high	94.3	Very high	156 Å²	156	42 Å²	42	73%	0.729	22%	0.215	S	C	*	.	H	α-helix	trans	-54.6	-39.9	177.1	-79.1	-177.8	-175.7	0	0	112.1	D270 I272 K276	D270-E274 WeakPolarHBondContact O-CG 3.32Å; D270-E274 PolarHBondContact O-N 2.89Å; I272-E274 VanDerWaalsContact C-N 3.35Å; I272-E274 PolarHBondContact O-N 3.45Å; E274-K276 PolarHBondContact O-N 3.25Å
275	L	92.6	Very high	94.3	Very high	20 Å²	20	40.8 Å²	40.8	11%	0.105	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-7.2	177.5	-65.7	174.7	0	0	0	113.7	R227 I229 I272 I273 L328 E330 V333	R227-L275 PolarHBondContact NH1-O 3.11Å; R227-L275 PolarHBondContact NH2-O 3.02Å; R227-L275 VanDerWaalsContact NH2-O 3.09Å; I229-L275 HydrophobicContact CD1-CB 4.32Å; I229-L275 HydrophobicContact CD1-CD1 4.11Å; I272-L275 PolarHBondContact O-N 3.04Å; I273-L275 PolarHBondContact O-N 3.43Å; L275-L328 HydrophobicContact CD1-CB 3.49Å; L275-L328 VanDerWaalsContact CD1-CB 3.49Å; L275-L328 HydrophobicContact CD1-CD1 4.34Å; L275-L328 HydrophobicContact CD1-CG 4.44Å; L275-E330 HydrophobicContact CD2-CG 3.85Å; L275-V333 HydrophobicContact CB-CG2 4.26Å; L275-V333 HydrophobicContact CD1-CG2 4.2Å
276	K	92.7	Very high	94.4	Very high	158 Å²	158	40.9 Å²	40.9	69%	0.687	21%	0.206	S	C	*	.			trans	51.3	52.5	-179.1	-56.8	174	-174	171.2	0	114.5	R227 I273 E274	R227-K276 PolarHBondContact NH1-O 2.97Å; I273-K276 WeakPolarHBondContact O-CA 3.34Å; I273-K276 PolarHBondContact O-N 2.73Å; E274-K276 PolarHBondContact O-N 3.25Å
277	P	94.1	Very high	94.3	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.032	20%	0.195	C	C	.	.			trans	-72.3	162.1	173.1	34.2	-37.5	0	0	0	110.8	I229 I272 V280 I299	I229-P277 HydrophobicContact CD1-CB 3.69Å; I229-P277 HydrophobicContact CD1-CG 3.74Å; I229-P277 HydrophobicContact CG1-CB 3.92Å; I229-P277 HydrophobicContact CG1-CG 4.47Å; I272-P277 HydrophobicContact CG2-CG 3.67Å; I272-P277 WeakPolarHBondContact O-CD 3.33Å; I272-P277 WeakPolarHBondContact O-CG 3.3Å; P277-V280 HydrophobicContact CB-CG2 4.48Å; P277-V280 HydrophobicContact CG-CG2 4.21Å; P277-I299 HydrophobicContact CG-CD1 4.09Å; P277-I299 HydrophobicContact CG-CG2 4.35Å; P277-I299 WeakPolarHBondContact O-CG1 3.29Å
278	N	93.8	Very high	94.3	Very high	62 Å²	62	41 Å²	41	33%	0.332	21%	0.206	S	C	.	.	S	Bend	trans	-105.8	-22	170	-59.1	102.4	0	0	0	111.9	I223 R227 S300	I223-N278 HydrophobicContact CD1-CB 4.16Å; I223-N278 HydrophobicContact CG2-CB 4.05Å; R227-N278 PolarHBondContact N-OD1 3.18Å; R227-N278 PolarHBondContact O-N 2.78Å; N278-S300 PolarHBondContact O-N 2.96Å
279	L	95.3	Very high	94.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	130.5	-173.5	-175.8	62.4	0	0	0	110.4	P226 R227 V228 I229 F281 S300 I302 F340	P226-L279 HydrophobicContact CB-CB 4.41Å; P226-L279 HydrophobicContact CB-CD2 4.47Å; R227-L279 PolarHBondContact O-N 3.29Å; R227-L279 VanDerWaalsContact O-N 3.08Å; V228-L279 WeakPolarHBondContact CA-O 3.22Å; V228-L279 HydrophobicContact CG2-CB 4.41Å; V228-L279 HydrophobicContact CG2-CD2 4.19Å; I229-L279 PolarHBondContact N-O 3.14Å; L279-F281 HydrophobicContact CD1-CE2 4.44Å; L279-F281 HydrophobicContact CD1-CZ 4.35Å; L279-F281 HydrophobicContact CD2-CD2 4.32Å; L279-F281 HydrophobicContact CD2-CE2 3.33Å; L279-F281 HydrophobicContact CD2-CZ 3.52Å; L279-F281 HydrophobicContact CG-CD2 4.18Å; L279-F281 HydrophobicContact CG-CE2 3.63Å; L279-F281 HydrophobicContact CG-CZ 3.98Å; L279-S300 CarbonylContact C-O 3.58Å; L279-S300 WeakPolarHBondContact CA-O 3.14Å; L279-I302 HydrophobicContact CD1-CD1 4.47Å; L279-F340 HydrophobicContact CD1-CD2 4.08Å; L279-F340 HydrophobicContact CD1-CE1 4.18Å; L279-F340 HydrophobicContact CD1-CE2 3.62Å; L279-F340 HydrophobicContact CD1-CG 4.49Å; L279-F340 HydrophobicContact CD1-CZ 3.69Å; L279-F340 HydrophobicContact CD2-CB 4.06Å; L279-F340 HydrophobicContact CD2-CD1 4.42Å; L279-F340 HydrophobicContact CD2-CD2 3.32Å; L279-F340 HydrophobicContact CD2-CE2 3.71Å; L279-F340 HydrophobicContact CD2-CG 3.7Å; L279-F340 HydrophobicContact CD2-CZ 4.45Å; L279-F340 HydrophobicContact CG-CD2 4.37Å; L279-F340 HydrophobicContact CG-CE2 4.35Å
280	V	95.8	Very high	94.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.1	177.6	-178.8	0	0	0	0	109.2	I229 L231 I272 P277 I299 S300 V301 I302	I229-V280 HydrophobicContact CB-CG2 4.44Å; L231-V280 HydrophobicContact CD1-CG1 4.06Å; I272-V280 HydrophobicContact CG2-CG2 3.75Å; P277-V280 HydrophobicContact CB-CG2 4.48Å; P277-V280 HydrophobicContact CG-CG2 4.21Å; V280-I299 HydrophobicContact CG2-CG2 3.67Å; V280-S300 PolarHBondContact N-O 3.41Å; V280-V301 HydrophobicContact CB-CG2 4.5Å; V280-V301 WeakPolarHBondContact O-CA 3.28Å; V280-I302 PolarHBondContact O-N 3.49Å
281	F	96.4	Very high	94.2	Very high	2 Å²	2	40 Å²	40	1%	0.009	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.8	174.8	-72.3	-76.3	0	0	0	108.9	L210 V228 I229 L230 L231 L279 I302 I305 L313 V353	L210-F281 HydrophobicContact CD1-CD1 4.23Å; L210-F281 HydrophobicContact CD1-CE1 3.73Å; V228-F281 HydrophobicContact CG1-CD2 3.47Å; V228-F281 VanDerWaalsContact CG1-CD2 3.47Å; V228-F281 HydrophobicContact CG1-CE2 3.61Å; I229-F281 PolarHBondContact O-N 2.99Å; L230-F281 HydrophobicContact CD2-CB 3.64Å; L230-F281 HydrophobicContact CD2-CD2 3.63Å; L230-F281 HydrophobicContact CD2-CG 4Å; L231-F281 PolarHBondContact N-O 3.3Å; L279-F281 HydrophobicContact CD1-CE2 4.44Å; L279-F281 HydrophobicContact CD1-CZ 4.35Å; L279-F281 HydrophobicContact CD2-CD2 4.32Å; L279-F281 HydrophobicContact CD2-CE2 3.33Å; L279-F281 HydrophobicContact CD2-CZ 3.52Å; L279-F281 HydrophobicContact CG-CD2 4.18Å; L279-F281 HydrophobicContact CG-CE2 3.63Å; L279-F281 HydrophobicContact CG-CZ 3.98Å; F281-I302 WeakPolarHBondContact CA-O 3.48Å; F281-I302 HydrophobicContact CD1-CB 3.68Å; F281-I302 HydrophobicContact CD1-CD1 4.14Å; F281-I302 HydrophobicContact CD1-CG1 4.43Å; F281-I302 HydrophobicContact CD1-CG2 3.97Å; F281-I302 HydrophobicContact CE1-CB 3.93Å; F281-I302 HydrophobicContact CE1-CD1 3.45Å; F281-I302 VanDerWaalsContact CE1-CD1 3.45Å; F281-I302 HydrophobicContact CE1-CG1 4.21Å; F281-I302 HydrophobicContact CE1-CG2 4.19Å; F281-I302 HydrophobicContact CZ-CD1 4.16Å; F281-I305 HydrophobicContact CB-CD1 3.35Å; F281-I305 HydrophobicContact CD1-CD1 3.34Å; F281-I305 HydrophobicContact CD1-CG1 4.45Å; F281-I305 HydrophobicContact CE1-CD1 4.46Å; F281-I305 HydrophobicContact CG-CD1 3.77Å; F281-L313 HydrophobicContact CB-CD1 4.38Å; F281-L313 HydrophobicContact CD1-CD1 3.93Å; F281-L313 HydrophobicContact CD2-CD1 4.03Å; F281-L313 HydrophobicContact CE1-CD1 4.12Å; F281-L313 HydrophobicContact CE2-CD1 4.24Å; F281-L313 HydrophobicContact CE2-CD2 4.26Å; F281-L313 HydrophobicContact CG-CD1 3.86Å; F281-L313 HydrophobicContact CZ-CD1 4.29Å; F281-L313 HydrophobicContact CZ-CD2 4.24Å; F281-V353 HydrophobicContact CE1-CG2 4.5Å; F281-V353 HydrophobicContact CE2-CG2 4.16Å; F281-V353 HydrophobicContact CZ-CG2 3.54Å
282	C	96.1	Very high	94.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.5	175.7	-59.2	0	0	0	0	110.4	L231 K284 V286 I302 R303 R304 I305	L231-C282 CarbonylContact O-C 3.21Å; L231-C282 WeakPolarHBondContact O-CA 3.39Å; C282-K284 VanDerWaalsContact C-N 3.3Å; C282-V286 HydrophobicContact CB-CG2 3.99Å; C282-I302 PolarHBondContact N-O 3Å; C282-R303 CarbonylContact O-C 3.2Å; C282-R304 PolarHBondContact O-N 2.91Å; C282-I305 PolarHBondContact O-N 3.42Å
283	E	95.4	Very high	94.1	Very high	22 Å²	22	44.8 Å²	44.8	10%	0.103	22%	0.218	C	C	.	.	S	Bend	trans	-69.5	-29.7	173.1	-67.2	-170.3	-154.5	0	0	112.1	L231 R304 I305 R307 S310	L231-E283 PolarHBondContact O-N 3.45Å; E283-R304 VanDerWaalsContact O-CA 3.27Å; E283-R304 WeakPolarHBondContact O-CA 3.34Å; E283-I305 WeakPolarHBondContact CA-O 3.14Å; E283-I305 PolarHBondContact O-N 3.36Å; E283-R307 WeakPolarHBondContact OE1-CD 3.29Å; E283-R307 IonicContact OE1-CZ 3.22Å; E283-R307 IonicContact OE1-NE 2.87Å; E283-R307 IonicContact OE1-NH1 3.75Å; E283-R307 PolarHBondContact OE1-NH1 3.35Å; E283-R307 WeakPolarHBondContact OE2-CD 3.49Å; E283-R307 IonicContact OE2-NH1 3.93Å; E283-S310 VanDerWaalsContact OE1-CB 3.26Å; E283-S310 WeakPolarHBondContact OE1-CB 3.49Å; E283-S310 PolarHBondContact OE1-OG 2.98Å
284	K	94.3	Very high	94.1	Very high	111 Å²	111	43.3 Å²	43.3	48%	0.483	21%	0.211	S	C	.	.	S	Bend	trans	-101.5	-160.5	178	-49.2	-62.4	177.5	-175	0	112.4	D232 C282 R303 R304	D232-K284 VanDerWaalsContact O-CG 3.32Å; D232-K284 WeakPolarHBondContact O-CG 3.39Å; C282-K284 VanDerWaalsContact C-N 3.3Å; K284-R303 WeakPolarHBondContact O-CB 3.46Å; K284-R304 PolarHBondContact O-N 3.43Å
285	G	93	Very high	94.1	Very high	5 Å²	5	37.1 Å²	37.1	5%	0.052	18%	0.183	C	C	.	.			trans	-72.4	165.9	177.9	0	0	0	0	0	113	G234 L235	G234-G285 CarbonylContact C-O 3.39Å; G234-G285 WeakPolarHBondContact CA-O 3.35Å; L235-G285 PolarHBondContact N-O 3.15Å
286	V	94.6	Very high	94.1	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.024	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-134.8	122.3	172.1	175.6	0	0	0	0	105.5	L215 L235 C282 A290 Q291 V301 R303	L215-V286 HydrophobicContact CD1-CB 3.8Å; L215-V286 HydrophobicContact CD1-CG1 3.91Å; L215-V286 HydrophobicContact CD1-CG2 4.28Å; L235-V286 HydrophobicContact CB-CB 4.49Å; L235-V286 HydrophobicContact CB-CG1 4.12Å; L235-V286 HydrophobicContact CB-CG2 4.32Å; L235-V286 HydrophobicContact CD1-CG1 4.35Å; L235-V286 HydrophobicContact CD1-CG2 4.42Å; L235-V286 HydrophobicContact CG-CG2 4.47Å; C282-V286 HydrophobicContact CB-CG2 3.99Å; V286-A290 HydrophobicContact CG1-CB 3.92Å; V286-Q291 HydrophobicContact CG1-CG 3.83Å; V286-Q291 PolarHBondContact O-NE2 3.33Å; V286-V301 HydrophobicContact CB-CG1 4.45Å; V286-V301 HydrophobicContact CG1-CG1 4.15Å; V286-V301 HydrophobicContact CG2-CG1 3.79Å; V286-R303 HydrophobicContact CB-CB 4.26Å; V286-R303 HydrophobicContact CG2-CB 3.74Å; V286-R303 PolarHBondContact O-NH1 3.43Å
287	S	93.8	Very high	94.2	Very high	23 Å²	23	40.1 Å²	40.1	16%	0.161	20%	0.198	C	C	.	.			trans	-65.2	155.8	177.7	63.4	0	0	0	0	111.6	L235 L289 A290 Q291	L235-S287 WeakPolarHBondContact O-CB 3.33Å; L235-S287 PolarHBondContact O-N 2.81Å; L235-S287 PolarHBondContact O-OG 3.4Å; S287-L289 VanDerWaalsContact C-N 3.28Å; S287-L289 PolarHBondContact O-N 2.92Å; S287-A290 PolarHBondContact O-N 3.33Å; S287-A290 VanDerWaalsContact OG-CB 3.3Å; S287-A290 WeakPolarHBondContact OG-CB 3.36Å; S287-A290 PolarHBondContact OG-N 3.29Å; S287-Q291 WeakPolarHBondContact O-CG 3.46Å; S287-Q291 PolarHBondContact O-N 3.46Å; S287-Q291 PolarHBondContact O-NE2 2.93Å
288	D	92.6	Very high	94.1	Very high	124 Å²	124	44.8 Å²	44.8	66%	0.663	22%	0.223	S	C	*	.	H	α-helix	trans	-68.7	-29.5	179.1	-61.8	-28	0	0	0	111.9	Q291 H292	D288-Q291 WeakPolarHBondContact O-CB 3.23Å; D288-Q291 PolarHBondContact O-N 3.26Å; D288-Q291 PolarHBondContact OD1-NE2 3.28Å; D288-H292 PolarHBondContact O-N 3.36Å
289	L	93	Very high	94.1	Very high	68 Å²	68	42 Å²	42	36%	0.356	21%	0.209	S	C	.	.	H	α-helix	trans	-62	-48.2	170.6	-68.8	175	0	0	0	111.4	E262 V265 S287 Q291 H292 F293	E262-L289 HydrophobicContact CB-CD1 4.47Å; V265-L289 HydrophobicContact CG1-CB 4.1Å; S287-L289 VanDerWaalsContact C-N 3.28Å; S287-L289 PolarHBondContact O-N 2.92Å; L289-Q291 VanDerWaalsContact C-N 3.29Å; L289-Q291 PolarHBondContact O-N 2.92Å; L289-H292 WeakPolarHBondContact O-CB 3.35Å; L289-H292 PolarHBondContact O-N 3.09Å; L289-H292 VanDerWaalsContact O-N 3.14Å; L289-F293 HydrophobicContact CB-CE2 4.44Å; L289-F293 WeakPolarHBondContact O-CD2 3.3Å; L289-F293 PolarHBondContact O-N 2.94Å; L289-F293 VanDerWaalsContact O-N 3.15Å
290	A	94.2	Very high	94.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-40.8	176.3	0	0	0	0	0	111.7	L235 V265 V286 S287 H292 F293 L294	L235-A290 HydrophobicContact CB-CB 3.79Å; V265-A290 HydrophobicContact CG1-CB 3.71Å; V286-A290 HydrophobicContact CG1-CB 3.92Å; S287-A290 PolarHBondContact O-N 3.33Å; S287-A290 VanDerWaalsContact OG-CB 3.3Å; S287-A290 WeakPolarHBondContact OG-CB 3.36Å; S287-A290 PolarHBondContact OG-N 3.29Å; A290-H292 VanDerWaalsContact C-N 3.33Å; A290-H292 PolarHBondContact O-N 2.64Å; A290-F293 PolarHBondContact O-N 2.96Å; A290-L294 WeakPolarHBondContact O-CB 3.25Å; A290-L294 VanDerWaalsContact O-CG 3.26Å; A290-L294 WeakPolarHBondContact O-CG 3.49Å; A290-L294 PolarHBondContact O-N 3.45Å
291	Q	93.7	Very high	94.1	Very high	16 Å²	16	42 Å²	42	8%	0.075	21%	0.209	C	C	.	.	H	α-helix	trans	-58.7	-45.7	175.2	-68.3	168.4	50.6	0	0	111.2	L215 V286 S287 D288 L289 F293 L294 V295	L215-Q291 HydrophobicContact CB-CG 4.08Å; L215-Q291 HydrophobicContact CD1-CG 3.7Å; V286-Q291 HydrophobicContact CG1-CG 3.83Å; V286-Q291 PolarHBondContact O-NE2 3.33Å; S287-Q291 WeakPolarHBondContact O-CG 3.46Å; S287-Q291 PolarHBondContact O-N 3.46Å; S287-Q291 PolarHBondContact O-NE2 2.93Å; D288-Q291 WeakPolarHBondContact O-CB 3.23Å; D288-Q291 PolarHBondContact O-N 3.26Å; D288-Q291 PolarHBondContact OD1-NE2 3.28Å; L289-Q291 VanDerWaalsContact C-N 3.29Å; L289-Q291 PolarHBondContact O-N 2.92Å; Q291-F293 PolarHBondContact O-N 2.99Å; Q291-L294 PolarHBondContact O-N 3.29Å; Q291-V295 WeakPolarHBondContact O-CB 3.47Å; Q291-V295 WeakPolarHBondContact O-CG2 3.47Å; Q291-V295 PolarHBondContact O-N 2.99Å
292	H	93.3	Very high	94	Very high	112 Å²	112	42 Å²	42	52%	0.519	21%	0.208	S	C	.	.	H	α-helix	trans	-59.2	-47.7	179.4	-177.3	67.8	0	0	0	112.4	D288 L289 A290 L294 V295 M296	D288-H292 PolarHBondContact O-N 3.36Å; L289-H292 WeakPolarHBondContact O-CB 3.35Å; L289-H292 PolarHBondContact O-N 3.09Å; L289-H292 VanDerWaalsContact O-N 3.14Å; A290-H292 VanDerWaalsContact C-N 3.33Å; A290-H292 PolarHBondContact O-N 2.64Å; H292-L294 VanDerWaalsContact C-N 3.35Å; H292-L294 PolarHBondContact O-N 2.92Å; H292-V295 PolarHBondContact O-N 3.2Å; H292-M296 PolarHBondContact O-N 3.19Å
293	F	93.7	Very high	94	Very high	22 Å²	22	46.1 Å²	46.1	10%	0.096	22%	0.224	C	C	.	.	H	α-helix	trans	-62.1	-40.9	178.4	-66.5	-56.8	0	0	0	112.7	E262 K266 C269 L289 A290 Q291 M296	E262-F293 HydrophobicContact CG-CE2 4.39Å; E262-F293 HydrophobicContact CG-CZ 4.09Å; K266-F293 HydrophobicContact CB-CD2 4.39Å; K266-F293 HydrophobicContact CB-CE2 3.91Å; K266-F293 HydrophobicContact CB-CZ 4.08Å; K266-F293 HydrophobicContact CD-CE1 4.21Å; K266-F293 HydrophobicContact CD-CZ 4.18Å; K266-F293 HydrophobicContact CG-CE1 4.29Å; K266-F293 HydrophobicContact CG-CE2 4.35Å; K266-F293 HydrophobicContact CG-CZ 4.18Å; C269-F293 HydrophobicContact CB-CB 4.09Å; L289-F293 HydrophobicContact CB-CE2 4.44Å; L289-F293 WeakPolarHBondContact O-CD2 3.3Å; L289-F293 PolarHBondContact O-N 2.94Å; L289-F293 VanDerWaalsContact O-N 3.15Å; A290-F293 PolarHBondContact O-N 2.96Å; Q291-F293 PolarHBondContact O-N 2.99Å; F293-M296 HydrophobicContact CD1-CE 3.63Å; F293-M296 HydrophobicContact CE1-CE 4.26Å
294	L	94.6	Very high	93.9	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-74	-35	-179.4	-66.6	172.7	0	0	0	112.5	L235 C269 I272 I273 A290 Q291 H292 M296 K297 N298 I299 V301	L235-L294 HydrophobicContact CD1-CD1 3.76Å; C269-L294 HydrophobicContact CB-CD2 4.47Å; I272-L294 HydrophobicContact CG2-CD2 4.27Å; I273-L294 HydrophobicContact CD1-CD2 4.49Å; I273-L294 HydrophobicContact CG1-CD2 4.2Å; A290-L294 WeakPolarHBondContact O-CB 3.25Å; A290-L294 VanDerWaalsContact O-CG 3.26Å; A290-L294 WeakPolarHBondContact O-CG 3.49Å; A290-L294 PolarHBondContact O-N 3.45Å; Q291-L294 PolarHBondContact O-N 3.29Å; H292-L294 VanDerWaalsContact C-N 3.35Å; H292-L294 PolarHBondContact O-N 2.92Å; L294-M296 PolarHBondContact O-N 3.47Å; L294-K297 CarbonylContact O-C 3.57Å; L294-K297 PolarHBondContact O-N 3.31Å; L294-K297 VanDerWaalsContact O-N 3.16Å; L294-N298 PolarHBondContact O-N 3.33Å; L294-I299 HydrophobicContact CB-CB 4.25Å; L294-I299 HydrophobicContact CD2-CB 4.31Å; L294-I299 HydrophobicContact CD2-CD1 3.82Å; L294-I299 HydrophobicContact CD2-CG2 4.37Å; L294-I299 PolarHBondContact O-N 3.04Å; L294-V301 HydrophobicContact CB-CG2 4.03Å; L294-V301 HydrophobicContact CD1-CG2 3.46Å; L294-V301 VanDerWaalsContact CD1-CG2 3.46Å; L294-V301 HydrophobicContact CG-CG2 4.34Å
295	V	93.9	Very high	93.9	Very high	25 Å²	25	47.6 Å²	47.6	15%	0.152	23%	0.226	C	C	.	.	H	α-helix	trans	-61.9	-42.9	174.2	169.8	0	0	0	0	111.1	H216 M219 Q291 H292 K297 N298	H216-V295 HydrophobicContact CB-CG2 3.81Å; M219-V295 HydrophobicContact CE-CG2 3.44Å; M219-V295 VanDerWaalsContact CE-CG2 3.44Å; M219-V295 HydrophobicContact CG-CG2 3.78Å; M219-V295 HydrophobicContact SD-CG2 4.45Å; Q291-V295 WeakPolarHBondContact O-CB 3.47Å; Q291-V295 WeakPolarHBondContact O-CG2 3.47Å; Q291-V295 PolarHBondContact O-N 2.99Å; H292-V295 PolarHBondContact O-N 3.2Å; V295-K297 PolarHBondContact O-N 2.94Å; V295-K297 VanDerWaalsContact O-N 3.08Å; V295-N298 PolarHBondContact O-N 3.42Å
296	M	92.5	Very high	94	Very high	112 Å²	112	54.4 Å²	54.4	55%	0.552	25%	0.254	S	S	*	.	H	α-helix	trans	-58.7	-23.5	177.6	-74.9	-169.5	-75.2	0	0	113.3	H292 F293 L294	H292-M296 PolarHBondContact O-N 3.19Å; F293-M296 HydrophobicContact CD1-CE 3.63Å; F293-M296 HydrophobicContact CE1-CE 4.26Å; L294-M296 PolarHBondContact O-N 3.47Å
297	K	93.3	Very high	93.9	Very high	129 Å²	129	59.2 Å²	59.2	56%	0.561	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	8.9	177.3	-60.8	-60.3	-174.5	179.9	0	113.5	I273 L294 V295 I299	I273-K297 HydrophobicContact CD1-CG 3.83Å; I273-K297 HydrophobicContact CG1-CB 4.45Å; I273-K297 HydrophobicContact CG1-CG 4.01Å; I273-K297 HydrophobicContact CG2-CD 4.26Å; I273-K297 HydrophobicContact CG2-CG 3.99Å; L294-K297 CarbonylContact O-C 3.57Å; L294-K297 PolarHBondContact O-N 3.31Å; L294-K297 VanDerWaalsContact O-N 3.16Å; V295-K297 PolarHBondContact O-N 2.94Å; V295-K297 VanDerWaalsContact O-N 3.08Å; K297-I299 VanDerWaalsContact C-N 3.28Å; K297-I299 HydrophobicContact CB-CD1 3.9Å; K297-I299 HydrophobicContact CB-CG1 3.98Å; K297-I299 PolarHBondContact O-N 3.2Å
298	N	92.6	Very high	93.9	Very high	104 Å²	104	61.7 Å²	61.7	56%	0.556	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	37.4	-176.4	-67.1	-41.9	0	0	0	113.8	P220 L294 V295	P220-N298 HydrophobicContact CG-CB 4.41Å; L294-N298 PolarHBondContact O-N 3.33Å; V295-N298 PolarHBondContact O-N 3.42Å
299	I	94.7	Very high	93.9	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	26%	0.257	C	S	.	.			trans	-97.3	119.8	176.8	-54.9	174.2	0	0	0	108.4	I273 P277 V280 L294 K297	I273-I299 HydrophobicContact CG1-CD1 3.83Å; P277-I299 HydrophobicContact CG-CD1 4.09Å; P277-I299 HydrophobicContact CG-CG2 4.35Å; P277-I299 WeakPolarHBondContact O-CG1 3.29Å; V280-I299 HydrophobicContact CG2-CG2 3.67Å; L294-I299 HydrophobicContact CB-CB 4.25Å; L294-I299 HydrophobicContact CD2-CB 4.31Å; L294-I299 HydrophobicContact CD2-CD1 3.82Å; L294-I299 HydrophobicContact CD2-CG2 4.37Å; L294-I299 PolarHBondContact O-N 3.04Å; K297-I299 VanDerWaalsContact C-N 3.28Å; K297-I299 HydrophobicContact CB-CD1 3.9Å; K297-I299 HydrophobicContact CB-CG1 3.98Å; K297-I299 PolarHBondContact O-N 3.2Å
300	S	95.2	Very high	94	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	139	175.4	-67.4	0	0	0	0	110.4	P220 N278 L279 V280	P220-S300 WeakPolarHBondContact CD-OG 3.47Å; P220-S300 PolarHBondContact O-OG 2.94Å; N278-S300 PolarHBondContact O-N 2.96Å; L279-S300 CarbonylContact C-O 3.58Å; L279-S300 WeakPolarHBondContact CA-O 3.14Å; V280-S300 PolarHBondContact N-O 3.41Å
301	V	95.3	Very high	93.9	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.3	-176.7	-172.4	0	0	0	0	110.5	L215 M219 V280 V286 L294	L215-V301 HydrophobicContact CD1-CB 4.06Å; L215-V301 HydrophobicContact CD1-CG1 3.91Å; M219-V301 HydrophobicContact CE-CB 4.12Å; M219-V301 HydrophobicContact CE-CG2 3.92Å; M219-V301 HydrophobicContact SD-CB 4.41Å; M219-V301 PolarHBondContact SD-N 3.34Å; V280-V301 HydrophobicContact CB-CG2 4.5Å; V280-V301 WeakPolarHBondContact O-CA 3.28Å; V286-V301 HydrophobicContact CB-CG1 4.45Å; V286-V301 HydrophobicContact CG1-CG1 4.15Å; V286-V301 HydrophobicContact CG2-CG1 3.79Å; L294-V301 HydrophobicContact CB-CG2 4.03Å; L294-V301 HydrophobicContact CD1-CG2 3.46Å; L294-V301 VanDerWaalsContact CD1-CG2 3.46Å; L294-V301 HydrophobicContact CG-CG2 4.34Å
302	I	95.3	Very high	93.9	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127	173.3	-66.6	172.3	0	0	0	108.3	K212 L279 V280 F281 C282 I305 F340 T351	K212-I302 HydrophobicContact CB-CG2 3.78Å; K212-I302 HydrophobicContact CG-CG2 4.19Å; L279-I302 HydrophobicContact CD1-CD1 4.47Å; V280-I302 PolarHBondContact O-N 3.49Å; F281-I302 WeakPolarHBondContact CA-O 3.48Å; F281-I302 HydrophobicContact CD1-CB 3.68Å; F281-I302 HydrophobicContact CD1-CD1 4.14Å; F281-I302 HydrophobicContact CD1-CG1 4.43Å; F281-I302 HydrophobicContact CD1-CG2 3.97Å; F281-I302 HydrophobicContact CE1-CB 3.93Å; F281-I302 HydrophobicContact CE1-CD1 3.45Å; F281-I302 VanDerWaalsContact CE1-CD1 3.45Å; F281-I302 HydrophobicContact CE1-CG1 4.21Å; F281-I302 HydrophobicContact CE1-CG2 4.19Å; F281-I302 HydrophobicContact CZ-CD1 4.16Å; C282-I302 PolarHBondContact N-O 3Å; I302-I305 HydrophobicContact CB-CD1 4.49Å; I302-I305 HydrophobicContact CG2-CD1 3.98Å; I302-I305 HydrophobicContact CG2-CG1 3.95Å; I302-F340 HydrophobicContact CD1-CE2 3.69Å; I302-F340 HydrophobicContact CD1-CZ 4.05Å; I302-T351 HydrophobicContact CD1-CG2 3.55Å; I302-T351 WeakPolarHBondContact CD1-OG1 3.42Å
303	R	94.2	Very high	93.9	Very high	88 Å²	88	51 Å²	51	33%	0.332	23%	0.232	S	C	.	.			trans	-110.7	165.2	-176.1	77.3	-176.5	173.1	-178.8	-3.2	112.4	L215 C282 K284 V286	L215-R303 HydrophobicContact CD1-CB 4.37Å; L215-R303 HydrophobicContact CD1-CG 4.43Å; L215-R303 VanDerWaalsContact CD2-CD 3.45Å; L215-R303 HydrophobicContact CD2-CG 3.77Å; L215-R303 VanDerWaalsContact CD2-NE 3.3Å; C282-R303 CarbonylContact O-C 3.2Å; K284-R303 WeakPolarHBondContact O-CB 3.46Å; V286-R303 HydrophobicContact CB-CB 4.26Å; V286-R303 HydrophobicContact CG2-CB 3.74Å; V286-R303 PolarHBondContact O-NH1 3.43Å
304	R	94.2	Very high	93.9	Very high	154 Å²	154	50.9 Å²	50.9	58%	0.581	24%	0.235	S	C	*	.	S	Bend	trans	58.6	49.5	172.6	-62.7	178.6	-176.3	-82.9	-0.5	113	K212 C282 E283 K284	K212-R304 WeakPolarHBondContact CE-O 3.22Å; C282-R304 PolarHBondContact O-N 2.91Å; E283-R304 VanDerWaalsContact O-CA 3.27Å; E283-R304 WeakPolarHBondContact O-CA 3.34Å; K284-R304 PolarHBondContact O-N 3.43Å
305	I	95	Very high	93.8	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.051	25%	0.254	C	S	.	.			trans	-88.6	145.1	177.3	-56.3	155.1	0	0	0	109	L210 F281 C282 E283 I302 D309	L210-I305 HydrophobicContact CD2-CG2 4.39Å; F281-I305 HydrophobicContact CB-CD1 3.35Å; F281-I305 HydrophobicContact CD1-CD1 3.34Å; F281-I305 HydrophobicContact CD1-CG1 4.45Å; F281-I305 HydrophobicContact CE1-CD1 4.46Å; F281-I305 HydrophobicContact CG-CD1 3.77Å; C282-I305 PolarHBondContact O-N 3.42Å; E283-I305 WeakPolarHBondContact CA-O 3.14Å; E283-I305 PolarHBondContact O-N 3.36Å; I302-I305 HydrophobicContact CB-CD1 4.49Å; I302-I305 HydrophobicContact CG2-CD1 3.98Å; I302-I305 HydrophobicContact CG2-CG1 3.95Å; I305-D309 HydrophobicContact CG2-CB 3.68Å
306	K	94.2	Very high	93.7	Very high	147 Å²	147	54 Å²	54	64%	0.639	25%	0.247	S	C	*	.			trans	-73.1	145.7	175.8	-64.6	179.6	179.9	177.7	0	109.8	T308 D309 S310	K306-T308 VanDerWaalsContact C-N 3.27Å; K306-T308 PolarHBondContact O-N 3.05Å; K306-D309 WeakPolarHBondContact O-CA 3.48Å; K306-D309 WeakPolarHBondContact O-CB 3.05Å; K306-D309 PolarHBondContact O-N 3.15Å; K306-S310 PolarHBondContact O-N 3.19Å
307	R	92.9	Very high	93.7	Very high	106 Å²	106	48.7 Å²	48.7	40%	0.4	22%	0.22	S	C	.	.	H	α-helix	trans	-51.7	-44.6	176.1	-178.5	56.5	176.3	-145.5	-7.6	113.5	D232 E283 D309 S310 D311	D232-R307 VanDerWaalsContact CG-NH1 3.35Å; D232-R307 IonicContact OD2-CZ 3.51Å; D232-R307 IonicContact OD2-NH1 3.22Å; D232-R307 PolarHBondContact OD2-NH1 3.36Å; E283-R307 WeakPolarHBondContact OE1-CD 3.29Å; E283-R307 IonicContact OE1-CZ 3.22Å; E283-R307 IonicContact OE1-NE 2.87Å; E283-R307 IonicContact OE1-NH1 3.75Å; E283-R307 PolarHBondContact OE1-NH1 3.35Å; E283-R307 WeakPolarHBondContact OE2-CD 3.49Å; E283-R307 IonicContact OE2-NH1 3.93Å; R307-D309 PolarHBondContact O-N 2.95Å; R307-S310 WeakPolarHBondContact O-CA 3.41Å; R307-S310 VanDerWaalsContact O-CB 3.28Å; R307-S310 WeakPolarHBondContact O-CB 3.43Å; R307-S310 PolarHBondContact O-N 2.73Å; R307-S310 VanDerWaalsContact O-N 3.07Å; R307-D311 IonicContact NE-OD1 3.61Å; R307-D311 PolarHBondContact NE-OD1 3.48Å; R307-D311 PolarHBondContact O-N 3.48Å
308	T	92.6	Very high	93.7	Very high	74 Å²	74	44 Å²	44	45%	0.454	21%	0.209	S	C	.	.	H	α-helix	trans	-61.6	-28.2	178.9	54	0	0	0	0	113.2	K306 R312	K306-T308 VanDerWaalsContact C-N 3.27Å; K306-T308 PolarHBondContact O-N 3.05Å; T308-R312 WeakPolarHBondContact O-CG 3.42Å; T308-R312 PolarHBondContact O-N 3.39Å; T308-R312 PolarHBondContact O-NH1 2.8Å
309	D	93.9	Very high	93.7	Very high	8 Å²	8	39.3 Å²	39.3	4%	0.043	19%	0.185	C	C	.	.	H	α-helix	trans	-80.6	-35.9	175	-67	-29.6	0	0	0	111.9	R190 L210 I305 K306 R307 D311 R312 L313	R190-D309 IonicContact CZ-OD1 2.86Å; R190-D309 IonicContact CZ-OD2 2.8Å; R190-D309 IonicContact NH1-OD1 3.56Å; R190-D309 PolarHBondContact NH1-OD1 2.89Å; R190-D309 IonicContact NH1-OD2 3.9Å; R190-D309 PolarHBondContact NH1-OD2 3.22Å; L210-D309 HydrophobicContact CD2-CB 3.74Å; I305-D309 HydrophobicContact CG2-CB 3.68Å; K306-D309 WeakPolarHBondContact O-CA 3.48Å; K306-D309 WeakPolarHBondContact O-CB 3.05Å; K306-D309 PolarHBondContact O-N 3.15Å; R307-D309 PolarHBondContact O-N 2.95Å; D309-D311 VanDerWaalsContact C-N 3.34Å; D309-R312 PolarHBondContact O-N 3.29Å; D309-R312 IonicContact OD1-NH1 2.98Å; D309-R312 PolarHBondContact OD1-NH1 3.5Å; D309-L313 WeakPolarHBondContact O-CB 3.49Å; D309-L313 WeakPolarHBondContact O-CG 3.09Å; D309-L313 PolarHBondContact O-N 3.1Å
310	S	94.1	Very high	93.8	Very high	2 Å²	2	42 Å²	42	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-58	-46.3	171.2	-161.5	0	0	0	0	111	E283 K306 R307 R312 L313 A314 I321	E283-S310 VanDerWaalsContact OE1-CB 3.26Å; E283-S310 WeakPolarHBondContact OE1-CB 3.49Å; E283-S310 PolarHBondContact OE1-OG 2.98Å; K306-S310 PolarHBondContact O-N 3.19Å; R307-S310 WeakPolarHBondContact O-CA 3.41Å; R307-S310 VanDerWaalsContact O-CB 3.28Å; R307-S310 WeakPolarHBondContact O-CB 3.43Å; R307-S310 PolarHBondContact O-N 2.73Å; R307-S310 VanDerWaalsContact O-N 3.07Å; S310-R312 VanDerWaalsContact C-N 3.31Å; S310-R312 PolarHBondContact O-N 2.9Å; S310-L313 PolarHBondContact O-N 3.29Å; S310-A314 WeakPolarHBondContact O-CB 3.34Å; S310-A314 PolarHBondContact O-N 3.46Å; S310-I321 WeakPolarHBondContact OG-CD1 3.46Å
311	D	93.4	Very high	93.8	Very high	63 Å²	63	44 Å²	44	34%	0.337	21%	0.212	S	C	.	.	H	α-helix	trans	-61.1	-37.6	176.9	-65.6	-31.3	0	0	0	112.4	R307 D309 K315 I321	R307-D311 IonicContact NE-OD1 3.61Å; R307-D311 PolarHBondContact NE-OD1 3.48Å; R307-D311 PolarHBondContact O-N 3.48Å; D309-D311 VanDerWaalsContact C-N 3.34Å; D311-K315 PolarHBondContact O-N 2.88Å; D311-I321 WeakPolarHBondContact OD1-CD1 3.29Å
312	R	93.1	Very high	93.8	Very high	23 Å²	23	44.9 Å²	44.9	9%	0.087	22%	0.217	C	C	.	.	H	α-helix	trans	-69.7	-44.8	175.1	-70.3	172	-171.9	111.1	6.9	111.5	K186 R187 V208 T308 D309 S310 A314 K315 V316 A361	K186-R312 PolarHBondContact O-NH2 3.03Å; R187-R312 WeakPolarHBondContact O-CD 3.37Å; R187-R312 WeakPolarHBondContact O-CG 3.43Å; R187-R312 PolarHBondContact O-NE 2.86Å; R187-R312 PolarHBondContact O-NH2 3.28Å; V208-R312 HydrophobicContact CG2-CB 3.7Å; T308-R312 WeakPolarHBondContact O-CG 3.42Å; T308-R312 PolarHBondContact O-N 3.39Å; T308-R312 PolarHBondContact O-NH1 2.8Å; D309-R312 PolarHBondContact O-N 3.29Å; D309-R312 IonicContact OD1-NH1 2.98Å; D309-R312 PolarHBondContact OD1-NH1 3.5Å; S310-R312 VanDerWaalsContact C-N 3.31Å; S310-R312 PolarHBondContact O-N 2.9Å; R312-A314 VanDerWaalsContact C-N 3.26Å; R312-A314 PolarHBondContact O-N 3.45Å; R312-K315 PolarHBondContact O-N 3.08Å; R312-K315 VanDerWaalsContact O-N 3.12Å; R312-V316 WeakPolarHBondContact O-CG2 3.34Å; R312-V316 PolarHBondContact O-N 2.84Å; R312-A361 HydrophobicContact CB-CB 4.28Å; R312-A361 HydrophobicContact CG-CB 4.39Å
313	L	94.2	Very high	93.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-40.1	176.1	-75.7	171.3	0	0	0	110.9	V208 L210 L230 F281 D309 S310 K315 V316 T317 V353	V208-L313 HydrophobicContact CB-CD2 3.78Å; V208-L313 HydrophobicContact CB-CG 4.3Å; V208-L313 HydrophobicContact CG1-CD2 4.24Å; V208-L313 HydrophobicContact CG1-CG 4.34Å; V208-L313 HydrophobicContact CG2-CD2 3.9Å; V208-L313 HydrophobicContact CG2-CG 4.16Å; L210-L313 HydrophobicContact CD1-CD1 4.21Å; L230-L313 HydrophobicContact CD1-CB 4Å; L230-L313 HydrophobicContact CD2-CB 3.97Å; L230-L313 HydrophobicContact CD2-CD1 4.12Å; F281-L313 HydrophobicContact CB-CD1 4.38Å; F281-L313 HydrophobicContact CD1-CD1 3.93Å; F281-L313 HydrophobicContact CD2-CD1 4.03Å; F281-L313 HydrophobicContact CE1-CD1 4.12Å; F281-L313 HydrophobicContact CE2-CD1 4.24Å; F281-L313 HydrophobicContact CE2-CD2 4.26Å; F281-L313 HydrophobicContact CG-CD1 3.86Å; F281-L313 HydrophobicContact CZ-CD1 4.29Å; F281-L313 HydrophobicContact CZ-CD2 4.24Å; D309-L313 WeakPolarHBondContact O-CB 3.49Å; D309-L313 WeakPolarHBondContact O-CG 3.09Å; D309-L313 PolarHBondContact O-N 3.1Å; S310-L313 PolarHBondContact O-N 3.29Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.15Å; L313-V316 PolarHBondContact O-N 2.86Å; L313-T317 VanDerWaalsContact O-CB 3.3Å; L313-T317 WeakPolarHBondContact O-CB 3.32Å; L313-T317 VanDerWaalsContact O-CG2 3.28Å; L313-T317 WeakPolarHBondContact O-CG2 3.37Å; L313-T317 PolarHBondContact O-N 3.37Å; L313-T317 PolarHBondContact O-OG1 3.41Å; L313-V353 HydrophobicContact CD2-CB 3.98Å; L313-V353 HydrophobicContact CD2-CG1 4.15Å; L313-V353 HydrophobicContact CD2-CG2 3.81Å
314	A	93.8	Very high	93.6	Very high	19 Å²	19	50 Å²	50	16%	0.157	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-42.5	175.8	0	0	0	0	0	111.5	L230 S310 R312 G318 A319 I321	L230-A314 HydrophobicContact CD1-CB 3.72Å; S310-A314 WeakPolarHBondContact O-CB 3.34Å; S310-A314 PolarHBondContact O-N 3.46Å; R312-A314 VanDerWaalsContact C-N 3.26Å; R312-A314 PolarHBondContact O-N 3.45Å; A314-G318 CarbonylContact O-C 3.51Å; A314-G318 WeakPolarHBondContact O-CA 3.45Å; A314-G318 PolarHBondContact O-N 3.16Å; A314-A319 WeakPolarHBondContact CA-O 3.34Å; A314-A319 VanDerWaalsContact CB-O 3.26Å; A314-A319 WeakPolarHBondContact CB-O 3.46Å; A314-I321 HydrophobicContact CB-CD1 4.43Å; A314-I321 HydrophobicContact CB-CG1 4.24Å
315	K	91	Very high	93.4	Very high	91 Å²	91	42.9 Å²	42.9	40%	0.396	22%	0.22	S	C	.	.	H	α-helix	trans	-69	-39.5	176.3	-67.5	-62.1	-174.4	-177.4	0	113.6	Y188 D311 R312 L313 K360 A361	Y188-K315 HydrophobicContact CD1-CG 4.17Å; Y188-K315 HydrophobicContact CE1-CD 4.37Å; Y188-K315 HydrophobicContact CE1-CG 3.67Å; Y188-K315 VanDerWaalsContact OH-CE 3.31Å; Y188-K315 WeakPolarHBondContact OH-CE 3.5Å; D311-K315 PolarHBondContact O-N 2.88Å; R312-K315 PolarHBondContact O-N 3.08Å; R312-K315 VanDerWaalsContact O-N 3.12Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.15Å; K315-K360 HydrophobicContact CB-CB 4.36Å; K315-A361 HydrophobicContact CB-CB 4.39Å
316	V	92.7	Very high	93.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-74	-41.6	-178.4	173.6	0	0	0	0	111.5	V208 R312 L313 V353 N355 A361	V208-V316 HydrophobicContact CG2-CG2 3.95Å; R312-V316 WeakPolarHBondContact O-CG2 3.34Å; R312-V316 PolarHBondContact O-N 2.84Å; L313-V316 PolarHBondContact O-N 2.86Å; V316-V353 HydrophobicContact CG1-CG1 4.29Å; V316-N355 HydrophobicContact CG1-CB 3.68Å; V316-N355 PolarHBondContact O-ND2 3.47Å; V316-A361 HydrophobicContact CG2-CB 3.95Å
317	T	92.9	Very high	93.2	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-91.3	-23.7	-174.6	64	0	0	0	0	112.8	V228 L313 A319 G334 T335 K336 A337 V353	V228-T317 HydrophobicContact CB-CG2 4.04Å; V228-T317 HydrophobicContact CG1-CG2 4.04Å; V228-T317 HydrophobicContact CG2-CG2 3.88Å; L313-T317 VanDerWaalsContact O-CB 3.3Å; L313-T317 WeakPolarHBondContact O-CB 3.32Å; L313-T317 VanDerWaalsContact O-CG2 3.28Å; L313-T317 WeakPolarHBondContact O-CG2 3.37Å; L313-T317 PolarHBondContact O-N 3.37Å; L313-T317 PolarHBondContact O-OG1 3.41Å; T317-A319 VanDerWaalsContact C-N 3.26Å; T317-A319 WeakPolarHBondContact OG1-CB 3.47Å; T317-A319 PolarHBondContact OG1-N 3.29Å; T317-G334 CarbonylContact O-C 3.41Å; T317-G334 WeakPolarHBondContact O-CA 3.21Å; T317-T335 PolarHBondContact O-N 3.08Å; T317-T335 VanDerWaalsContact O-N 3.13Å; T317-K336 VanDerWaalsContact O-CB 3.31Å; T317-K336 WeakPolarHBondContact O-CB 3.4Å; T317-K336 PolarHBondContact O-N 3Å; T317-A337 HydrophobicContact CG2-CB 4.2Å; T317-V353 HydrophobicContact CG2-CG1 3.95Å
318	G	91.8	Very high	93.2	Very high	32 Å²	32	40 Å²	40	33%	0.33	23%	0.229	S	C	.	.			trans	78.6	5.2	-170.2	0	0	0	0	0	114.3	A314	A314-G318 CarbonylContact O-C 3.51Å; A314-G318 WeakPolarHBondContact O-CA 3.45Å; A314-G318 PolarHBondContact O-N 3.16Å
319	A	94.3	Very high	93.1	Very high	5 Å²	5	39.7 Å²	39.7	4%	0.041	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-70.8	150.2	175.3	0	0	0	0	0	111.3	L230 A314 T317 D332	L230-A319 HydrophobicContact CD1-CB 3.84Å; L230-A319 HydrophobicContact CG-CB 3.78Å; A314-A319 WeakPolarHBondContact CA-O 3.34Å; A314-A319 VanDerWaalsContact CB-O 3.26Å; A314-A319 WeakPolarHBondContact CB-O 3.46Å; T317-A319 VanDerWaalsContact C-N 3.26Å; T317-A319 WeakPolarHBondContact OG1-CB 3.47Å; T317-A319 PolarHBondContact OG1-N 3.29Å; A319-D332 VanDerWaalsContact CA-O 3.29Å; A319-D332 WeakPolarHBondContact CA-O 3.43Å; A319-D332 WeakPolarHBondContact CB-O 3.09Å
320	T	94.9	Very high	93	Very high	60 Å²	60	46.8 Å²	46.8	37%	0.368	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-92.4	150	166.5	58.3	0	0	0	0	108.7	D332	T320-D332 PolarHBondContact N-O 3.36Å; T320-D332 WeakPolarHBondContact OG1-CA 3.1Å; T320-D332 WeakPolarHBondContact OG1-CB 3.35Å; T320-D332 PolarHBondContact OG1-OD1 3.27Å
321	I	95.8	Very high	93	Very high	43 Å²	43	57.5 Å²	57.5	22%	0.221	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118.9	175.9	-55.9	168.1	0	0	0	107	L230 D232 S310 D311 A314	L230-I321 HydrophobicContact CB-CG1 4.17Å; L230-I321 HydrophobicContact CD1-CG1 4.09Å; D232-I321 HydrophobicContact CB-CG2 4.18Å; S310-I321 WeakPolarHBondContact OG-CD1 3.46Å; D311-I321 WeakPolarHBondContact OD1-CD1 3.29Å; A314-I321 HydrophobicContact CB-CD1 4.43Å; A314-I321 HydrophobicContact CB-CG1 4.24Å
322	V	95.7	Very high	93	Very high	17 Å²	17	55.7 Å²	55.7	10%	0.103	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.8	-179.6	-178.5	0	0	0	0	109.4	L230 L231 D232 D324 D327 L328 D332	L230-V322 PolarHBondContact O-N 3.35Å; L230-V322 VanDerWaalsContact O-N 3.1Å; L231-V322 VanDerWaalsContact CA-O 3.31Å; L231-V322 WeakPolarHBondContact CA-O 3.29Å; L231-V322 HydrophobicContact CD2-CB 4.42Å; D232-V322 PolarHBondContact N-O 3.24Å; V322-D324 VanDerWaalsContact CG1-O 3.31Å; V322-D324 WeakPolarHBondContact CG1-O 3.3Å; V322-D327 HydrophobicContact CG1-CB 4.18Å; V322-L328 HydrophobicContact CB-CD2 3.74Å; V322-L328 HydrophobicContact CG1-CD2 4.03Å; V322-L328 HydrophobicContact CG1-CG 4.35Å; V322-L328 HydrophobicContact CG2-CD2 3.85Å; V322-D332 HydrophobicContact CG2-CB 4.01Å
323	H	93.8	Very high	93	Very high	125 Å²	125	55 Å²	55	58%	0.579	29%	0.289	S	S	*	.	S	Bend	trans	-84.4	-62.9	178.6	-170.9	72.8	0	0	0	111.2	S233	S233-H323 WeakPolarHBondContact CB-O 3.33Å; S233-H323 PolarHBondContact OG-O 3.12Å
324	D	91	Very high	92.9	Very high	71 Å²	71	55.1 Å²	55.1	38%	0.38	29%	0.29	S	S	.	.			trans	-89.4	126.8	-178.8	-164.9	-27.1	0	0	0	110.9	V322 A326 D327	V322-D324 VanDerWaalsContact CG1-O 3.31Å; V322-D324 WeakPolarHBondContact CG1-O 3.3Å; D324-A326 PolarHBondContact O-N 2.75Å; D324-A326 VanDerWaalsContact O-N 3.15Å; D324-A326 WeakPolarHBondContact OD1-CB 3.47Å; D324-A326 PolarHBondContact OD1-N 3.3Å; D324-D327 PolarHBondContact O-N 2.93Å; D324-D327 VanDerWaalsContact O-N 3.11Å
325	P	91.2	Very high	92.9	Very high	4 Å²	4	58.5 Å²	58.5	3%	0.026	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-53.1	-27.3	171.3	-27.2	35.5	0	0	0	114.8	L231 L235 M268 S271 I272 D327 L328	L231-P325 HydrophobicContact CD1-CG 4.16Å; L231-P325 HydrophobicContact CD2-CG 4.42Å; L235-P325 HydrophobicContact CD2-CG 3.91Å; M268-P325 HydrophobicContact CB-CB 4.39Å; M268-P325 HydrophobicContact CB-CG 4.3Å; S271-P325 WeakPolarHBondContact CB-O 3.48Å; I272-P325 HydrophobicContact CD1-CB 4.25Å; I272-P325 HydrophobicContact CD1-CG 4.46Å; I272-P325 HydrophobicContact CG1-CB 4.11Å; P325-D327 VanDerWaalsContact C-N 3.31Å; P325-D327 PolarHBondContact O-N 3.3Å; P325-L328 HydrophobicContact CB-CD1 4.29Å; P325-L328 WeakPolarHBondContact O-CB 3.18Å; P325-L328 WeakPolarHBondContact O-CD1 3.08Å; P325-L328 WeakPolarHBondContact O-CG 3.47Å; P325-L328 PolarHBondContact O-N 2.95Å
326	A	90.4	Very high	92.9	Very high	66 Å²	66	60.2 Å²	60.2	55%	0.545	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-70.4	-25.5	179	0	0	0	0	0	113.5	D324 L328	D324-A326 PolarHBondContact O-N 2.75Å; D324-A326 VanDerWaalsContact O-N 3.15Å; D324-A326 WeakPolarHBondContact OD1-CB 3.47Å; D324-A326 PolarHBondContact OD1-N 3.3Å; A326-L328 VanDerWaalsContact C-N 3.29Å
327	D	93	Very high	92.9	Very high	115 Å²	115	60.2 Å²	60.2	62%	0.615	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-85.5	-1.7	179.5	-71.5	-25.1	0	0	0	112.8	V322 D324 P325 T329	V322-D327 HydrophobicContact CG1-CB 4.18Å; D324-D327 PolarHBondContact O-N 2.93Å; D324-D327 VanDerWaalsContact O-N 3.11Å; P325-D327 VanDerWaalsContact C-N 3.31Å; P325-D327 PolarHBondContact O-N 3.3Å; D327-T329 PolarHBondContact O-N 3.4Å
328	L	92.8	Very high	92.9	Very high	21 Å²	21	61.5 Å²	61.5	11%	0.11	33%	0.325	C	S	.	.			trans	-64.8	128.8	-177.7	-72.1	169.1	0	0	0	111.3	I229 L231 I272 L275 V322 P325 A326 D332	I229-L328 HydrophobicContact CD1-CD1 4.3Å; I229-L328 HydrophobicContact CG2-CD1 4.03Å; I229-L328 HydrophobicContact CG2-CD2 3.78Å; L231-L328 HydrophobicContact CD2-CD1 4.23Å; L231-L328 HydrophobicContact CD2-CD2 4.14Å; L231-L328 HydrophobicContact CD2-CG 4.4Å; I272-L328 HydrophobicContact CG1-CD1 3.81Å; L275-L328 HydrophobicContact CD1-CB 3.49Å; L275-L328 VanDerWaalsContact CD1-CB 3.49Å; L275-L328 HydrophobicContact CD1-CD1 4.34Å; L275-L328 HydrophobicContact CD1-CG 4.44Å; V322-L328 HydrophobicContact CB-CD2 3.74Å; V322-L328 HydrophobicContact CG1-CD2 4.03Å; V322-L328 HydrophobicContact CG1-CG 4.35Å; V322-L328 HydrophobicContact CG2-CD2 3.85Å; P325-L328 HydrophobicContact CB-CD1 4.29Å; P325-L328 WeakPolarHBondContact O-CB 3.18Å; P325-L328 WeakPolarHBondContact O-CD1 3.08Å; P325-L328 WeakPolarHBondContact O-CG 3.47Å; P325-L328 PolarHBondContact O-N 2.95Å; A326-L328 VanDerWaalsContact C-N 3.29Å; L328-D332 HydrophobicContact CD2-CB 4.47Å
329	T	92.1	Very high	93	Very high	68 Å²	68	61.7 Å²	61.7	42%	0.417	32%	0.317	S	S	.	.			trans	-116.6	166.6	173.6	71.2	0	0	0	0	111.5	D327 R331 D332	D327-T329 PolarHBondContact O-N 3.4Å; T329-R331 PolarHBondContact O-N 3.33Å; T329-R331 VanDerWaalsContact O-N 3.09Å; T329-D332 WeakPolarHBondContact CB-OD2 3.41Å; T329-D332 PolarHBondContact N-OD2 2.95Å; T329-D332 WeakPolarHBondContact O-CB 3.21Å; T329-D332 PolarHBondContact O-N 3.06Å; T329-D332 PolarHBondContact OG1-OD2 3.22Å
330	E	91.9	Very high	93	Very high	157 Å²	157	61.4 Å²	61.4	73%	0.734	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-59.7	-22.6	176.3	-69.7	-167.5	159.3	0	0	113.7	L275 D332	L275-E330 HydrophobicContact CD2-CG 3.85Å; E330-D332 VanDerWaalsContact C-N 3.26Å; E330-D332 PolarHBondContact O-N 2.92Å
331	R	93.1	Very high	93.1	Very high	227 Å²	227	60.3 Å²	60.3	86%	0.857	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-72.3	-22.6	178.6	-63.5	-179.2	-179.2	172	1.8	112.8	T329 V333	T329-R331 PolarHBondContact O-N 3.33Å; T329-R331 VanDerWaalsContact O-N 3.09Å; R331-V333 VanDerWaalsContact C-N 3.33Å
332	D	93.8	Very high	93	Very high	25 Å²	25	59.3 Å²	59.3	13%	0.134	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-84	-14.8	-175.4	-56.9	-45.8	0	0	0	112	A319 T320 V322 L328 T329 E330 G334	A319-D332 VanDerWaalsContact CA-O 3.29Å; A319-D332 WeakPolarHBondContact CA-O 3.43Å; A319-D332 WeakPolarHBondContact CB-O 3.09Å; T320-D332 PolarHBondContact N-O 3.36Å; T320-D332 WeakPolarHBondContact OG1-CA 3.1Å; T320-D332 WeakPolarHBondContact OG1-CB 3.35Å; T320-D332 PolarHBondContact OG1-OD1 3.27Å; V322-D332 HydrophobicContact CG2-CB 4.01Å; L328-D332 HydrophobicContact CD2-CB 4.47Å; T329-D332 WeakPolarHBondContact CB-OD2 3.41Å; T329-D332 PolarHBondContact N-OD2 2.95Å; T329-D332 WeakPolarHBondContact O-CB 3.21Å; T329-D332 PolarHBondContact O-N 3.06Å; T329-D332 PolarHBondContact OG1-OD2 3.22Å; E330-D332 VanDerWaalsContact C-N 3.26Å; E330-D332 PolarHBondContact O-N 2.92Å; D332-G334 PolarHBondContact O-N 3.14Å
333	V	93.3	Very high	92.9	Very high	10 Å²	10	62.4 Å²	62.4	6%	0.061	31%	0.313	C	S	.	.			trans	-77.5	116.8	-178.2	-173.9	0	0	0	0	111.2	R227 I229 L275 R331	R227-V333 HydrophobicContact CB-CG1 3.96Å; I229-V333 HydrophobicContact CD1-CG2 4.32Å; I229-V333 HydrophobicContact CG1-CG2 4.21Å; L275-V333 HydrophobicContact CB-CG2 4.26Å; L275-V333 HydrophobicContact CD1-CG2 4.2Å; R331-V333 VanDerWaalsContact C-N 3.33Å
334	G	92.3	Very high	92.8	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.01	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-72.7	128	174.5	0	0	0	0	0	112	R227 V228 T317 D332	R227-G334 WeakPolarHBondContact CA-O 3.42Å; V228-G334 PolarHBondContact N-O 3.22Å; V228-G334 PolarHBondContact O-N 3.44Å; T317-G334 CarbonylContact O-C 3.41Å; T317-G334 WeakPolarHBondContact O-CA 3.21Å; D332-G334 PolarHBondContact O-N 3.14Å
335	T	92.4	Very high	92.7	Very high	91 Å²	91	59.2 Å²	59.2	56%	0.558	30%	0.295	S	S	*	.			trans	-124.2	1.6	-179.1	50.1	0	0	0	0	113.2	R227 T317	R227-T335 HydrophobicContact CG-CG2 4.39Å; T317-T335 PolarHBondContact O-N 3.08Å; T317-T335 VanDerWaalsContact O-N 3.13Å
336	K	91.7	Very high	92.3	Very high	126 Å²	126	61.5 Å²	61.5	55%	0.548	32%	0.319	S	S	.	.			trans	-86	-14.6	-172.2	-58.6	-174.9	177.4	-176.5	0	114.5	T317 N355	T317-K336 VanDerWaalsContact O-CB 3.31Å; T317-K336 WeakPolarHBondContact O-CB 3.4Å; T317-K336 PolarHBondContact O-N 3Å; K336-N355 VanDerWaalsContact O-CG 3.24Å; K336-N355 PolarHBondContact O-ND2 3.2Å; K336-N355 PolarHBondContact O-OD1 3.36Å
337	A	92.1	Very high	92.1	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.008	33%	0.331	C	S	.	.			trans	-69	134.2	177.6	0	0	0	0	0	110.4	N225 P226 T317 V353 I354	N225-A337 WeakPolarHBondContact CA-O 3.33Å; P226-A337 HydrophobicContact CG-CB 3.84Å; T317-A337 HydrophobicContact CG2-CB 4.2Å; A337-V353 HydrophobicContact CB-CG1 4.02Å; A337-I354 CarbonylContact C-O 3.55Å; A337-I354 WeakPolarHBondContact CA-O 3.13Å
338	S	92.6	Very high	92	Very high	26 Å²	26	64.6 Å²	64.6	18%	0.182	32%	0.323	C	S	.	.			trans	-83.8	-40.2	178.7	53.8	0	0	0	0	111.8	N225 I354 D356	N225-S338 PolarHBondContact N-O 3.38Å; N225-S338 PolarHBondContact OD1-O 2.87Å; S338-I354 PolarHBondContact N-O 3.31Å; S338-I354 PolarHBondContact OG-O 3.17Å; S338-D356 VanDerWaalsContact CB-OD2 3.3Å; S338-D356 WeakPolarHBondContact CB-OD2 3.28Å; S338-D356 PolarHBondContact OG-N 2.72Å; S338-D356 PolarHBondContact OG-OD2 3.49Å
339	E	94.5	Very high	92	Very high	36 Å²	36	67.6 Å²	67.6	17%	0.168	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	141.1	-177.9	-165.1	165.9	-134.3	0	0	111.9	R222 Y341 I354	R222-E339 IonicContact CZ-OE1 3.72Å; R222-E339 IonicContact NE-OE1 2.75Å; R222-E339 PolarHBondContact NE-OE1 3.32Å; R222-E339 IonicContact NH2-OE1 2.74Å; R222-E339 PolarHBondContact NH2-OE1 2.91Å; R222-E339 IonicContact NH2-OE2 3.74Å; R222-E339 PolarHBondContact NH2-OE2 3.44Å; E339-Y341 HydrophobicContact CG-CD1 4.13Å; E339-I354 PolarHBondContact N-O 2.95Å; E339-I354 PolarHBondContact O-N 3.12Å
340	F	95.4	Very high	92.2	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.4	164.3	162.9	-95.6	0	0	0	108.2	R222 I223 P226 L279 I302 I342 T351 F352 V353	R222-F340 CarbonylContact C-O 3.51Å; R222-F340 VanDerWaalsContact CA-O 3.24Å; R222-F340 WeakPolarHBondContact CA-O 3.48Å; I223-F340 HydrophobicContact CB-CB 4.35Å; I223-F340 HydrophobicContact CB-CD1 4.14Å; I223-F340 HydrophobicContact CD1-CD1 3.8Å; I223-F340 HydrophobicContact CD1-CE1 4.16Å; I223-F340 HydrophobicContact CG1-CD1 3.93Å; I223-F340 PolarHBondContact N-O 2.97Å; I223-F340 PolarHBondContact O-N 3.16Å; P226-F340 HydrophobicContact CB-CB 4.26Å; P226-F340 HydrophobicContact CG-CB 3.89Å; L279-F340 HydrophobicContact CD1-CD2 4.08Å; L279-F340 HydrophobicContact CD1-CE1 4.18Å; L279-F340 HydrophobicContact CD1-CE2 3.62Å; L279-F340 HydrophobicContact CD1-CG 4.49Å; L279-F340 HydrophobicContact CD1-CZ 3.69Å; L279-F340 HydrophobicContact CD2-CB 4.06Å; L279-F340 HydrophobicContact CD2-CD1 4.42Å; L279-F340 HydrophobicContact CD2-CD2 3.32Å; L279-F340 HydrophobicContact CD2-CE2 3.71Å; L279-F340 HydrophobicContact CD2-CG 3.7Å; L279-F340 HydrophobicContact CD2-CZ 4.45Å; L279-F340 HydrophobicContact CG-CD2 4.37Å; L279-F340 HydrophobicContact CG-CE2 4.35Å; I302-F340 HydrophobicContact CD1-CE2 3.69Å; I302-F340 HydrophobicContact CD1-CZ 4.05Å; F340-I342 HydrophobicContact CZ-CD1 4.03Å; F340-I342 HydrophobicContact CZ-CG1 4.06Å; F340-T351 HydrophobicContact CD2-CG2 3.89Å; F340-T351 HydrophobicContact CE2-CG2 3.39Å; F340-T351 HydrophobicContact CZ-CG2 4.36Å; F340-F352 WeakPolarHBondContact CA-O 3.49Å; F340-V353 HydrophobicContact CD2-CG2 4.2Å
341	Y	95.7	Very high	92.4	Very high	37 Å²	37	57 Å²	57	15%	0.145	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.9	169.2	67.6	-90.1	0	0	0	112.3	R221 E339 E343 F352 I354	R221-Y341 CarbonylContact O-C 3.6Å; R221-Y341 VanDerWaalsContact O-CA 3.22Å; R221-Y341 WeakPolarHBondContact O-CA 3.38Å; E339-Y341 HydrophobicContact CG-CD1 4.13Å; Y341-E343 HydrophobicContact CD2-CB 4.11Å; Y341-E343 HydrophobicContact CE2-CB 3.94Å; Y341-F352 HydrophobicContact CD1-CB 4.02Å; Y341-F352 HydrophobicContact CD2-CB 4.2Å; Y341-F352 AromaticContact CD2-CD2 3.9Å; Y341-F352 HydrophobicContact CD2-CD2 3.9Å; Y341-F352 HydrophobicContact CD2-CG 4.29Å; Y341-F352 HydrophobicContact CE1-CB 3.63Å; Y341-F352 HydrophobicContact CE1-CG 4.18Å; Y341-F352 HydrophobicContact CE2-CB 3.82Å; Y341-F352 HydrophobicContact CE2-CD1 4.39Å; Y341-F352 AromaticContact CE2-CD2 3.36Å; Y341-F352 HydrophobicContact CE2-CD2 3.36Å; Y341-F352 HydrophobicContact CE2-CE2 4.06Å; Y341-F352 AromaticContact CE2-CG 3.59Å; Y341-F352 HydrophobicContact CE2-CG 3.59Å; Y341-F352 HydrophobicContact CG-CB 4.29Å; Y341-F352 AromaticContact CZ-CD2 3.82Å; Y341-F352 AromaticContact CZ-CG 3.51Å; Y341-F352 PolarHBondContact N-O 3.33Å; Y341-F352 VanDerWaalsContact N-O 3.08Å; Y341-F352 PolarHBondContact O-N 3.37Å; Y341-I354 HydrophobicContact CE1-CD1 3.63Å; Y341-I354 HydrophobicContact CE1-CG1 4.37Å
342	I	94.5	Very high	92.5	Very high	22 Å²	22	46.1 Å²	46.1	11%	0.113	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	128.7	172.8	-63.1	177.1	0	0	0	109	I214 R221 F340 Y349 F350	I214-I342 HydrophobicContact CB-CD1 4.06Å; I214-I342 HydrophobicContact CG1-CD1 3.93Å; I214-I342 HydrophobicContact CG2-CD1 3.52Å; R221-I342 PolarHBondContact O-N 3.3Å; F340-I342 HydrophobicContact CZ-CD1 4.03Å; F340-I342 HydrophobicContact CZ-CG1 4.06Å; I342-Y349 HydrophobicContact CG2-CD1 4Å; I342-Y349 HydrophobicContact CG2-CG 4.47Å; I342-F350 WeakPolarHBondContact CA-O 3.43Å
343	E	93	Very high	92.5	Very high	82 Å²	82	45 Å²	45	38%	0.383	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.3	178.4	-173.9	176.6	-176.5	0	0	109.4	Y341 I345 F350 F352	Y341-E343 HydrophobicContact CD2-CB 4.11Å; Y341-E343 HydrophobicContact CE2-CB 3.94Å; E343-I345 HydrophobicContact CG-CG1 4.31Å; E343-F350 PolarHBondContact N-O 2.97Å; E343-F350 PolarHBondContact O-N 3.09Å; E343-F352 HydrophobicContact CB-CD2 4.26Å; E343-F352 HydrophobicContact CB-CE2 3.83Å
344	K	91.5	Very high	92.6	Very high	109 Å²	109	45.7 Å²	45.7	47%	0.474	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	117.8	174	-168.6	-178.3	177.7	-168.9	0	108.4	G346 E348 Y349	K344-G346 WeakPolarHBondContact CE-O 3.39Å; K344-E348 CarbonylContact C-O 3.46Å; K344-E348 WeakPolarHBondContact CA-O 3.34Å; K344-E348 WeakPolarHBondContact CG-O 3.29Å; K344-Y349 HydrophobicContact CB-CD1 3.82Å; K344-Y349 HydrophobicContact CB-CE1 3.75Å; K344-Y349 HydrophobicContact CD-CE1 4.14Å; K344-Y349 HydrophobicContact CG-CD1 4.16Å; K344-Y349 HydrophobicContact CG-CE1 4.04Å
345	I	89.1	Confident	92.5	Very high	20 Å²	20	45.8 Å²	45.8	10%	0.103	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	113	176.4	-56.2	179.8	0	0	0	107.7	V194 E343 D347 E348 F350 F352 L365	V194-I345 HydrophobicContact CG1-CB 4.4Å; V194-I345 HydrophobicContact CG1-CG2 3.75Å; E343-I345 HydrophobicContact CG-CG1 4.31Å; I345-D347 PolarHBondContact O-N 3.28Å; I345-E348 PolarHBondContact N-O 3.44Å; I345-E348 PolarHBondContact O-N 3.06Å; I345-F350 HydrophobicContact CB-CD2 3.79Å; I345-F350 HydrophobicContact CB-CE2 3.98Å; I345-F350 HydrophobicContact CD1-CD2 4.25Å; I345-F350 HydrophobicContact CG1-CD2 4.12Å; I345-F352 HydrophobicContact CD1-CE2 4.32Å; I345-F352 HydrophobicContact CD1-CZ 3.72Å; I345-L365 HydrophobicContact CD1-CD2 4.33Å
346	G	83.2	Confident	92.1	Very high	52 Å²	52	46.1 Å²	46.1	54%	0.536	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	-123.5	-168.3	0	0	0	0	0	110.4	K344	K344-G346 WeakPolarHBondContact CE-O 3.39Å
347	D	86.2	Confident	91.5	Very high	149 Å²	149	49 Å²	49	80%	0.797	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-5.4	-179.8	-68.6	-40.6	0	0	0	114.1	I345	I345-D347 PolarHBondContact O-N 3.28Å
348	E	91.2	Very high	91	Very high	96 Å²	96	54.6 Å²	54.6	45%	0.449	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	150.8	-173.7	-64.2	-178.2	170.9	0	0	112	N211 K344 I345 F350	N211-E348 PolarHBondContact ND2-OE2 3.4Å; K344-E348 CarbonylContact C-O 3.46Å; K344-E348 WeakPolarHBondContact CA-O 3.34Å; K344-E348 WeakPolarHBondContact CG-O 3.29Å; I345-E348 PolarHBondContact N-O 3.44Å; I345-E348 PolarHBondContact O-N 3.06Å; E348-F350 HydrophobicContact CB-CD2 4.49Å; E348-F350 HydrophobicContact CB-CE2 3.78Å; E348-F350 HydrophobicContact CB-CZ 4.24Å
349	Y	93.4	Very high	90.2	Very high	84 Å²	84	53.6 Å²	53.6	33%	0.329	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.1	175.3	-71.2	-76.6	0	0	0	110.3	K212 D213 I342 K344	K212-Y349 PolarHBondContact N-O 3.32Å; D213-Y349 HydrophobicContact CB-CD2 4.37Å; D213-Y349 HydrophobicContact CB-CG 4.27Å; D213-Y349 WeakPolarHBondContact OD2-CD2 3.32Å; I342-Y349 HydrophobicContact CG2-CD1 4Å; I342-Y349 HydrophobicContact CG2-CG 4.47Å; K344-Y349 HydrophobicContact CB-CD1 3.82Å; K344-Y349 HydrophobicContact CB-CE1 3.75Å; K344-Y349 HydrophobicContact CD-CE1 4.14Å; K344-Y349 HydrophobicContact CG-CD1 4.16Å; K344-Y349 HydrophobicContact CG-CE1 4.04Å
350	F	95	Very high	89.8	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132	176.4	-67.8	-90.6	0	0	0	110	E192 V194 V209 L210 N211 I342 E343 I345 E348 F352	E192-F350 HydrophobicContact CG-CE1 4.21Å; V194-F350 HydrophobicContact CB-CZ 4.39Å; V194-F350 HydrophobicContact CG1-CE2 3.93Å; V194-F350 HydrophobicContact CG1-CZ 3.92Å; V194-F350 HydrophobicContact CG2-CE1 3.78Å; V194-F350 HydrophobicContact CG2-CE2 4.13Å; V194-F350 HydrophobicContact CG2-CZ 3.53Å; V209-F350 HydrophobicContact CG1-CB 4.12Å; V209-F350 HydrophobicContact CG1-CD1 3.98Å; V209-F350 HydrophobicContact CG1-CG 4.45Å; L210-F350 CarbonylContact O-C 3.41Å; L210-F350 WeakPolarHBondContact O-CA 3.4Å; N211-F350 HydrophobicContact CB-CD1 4.02Å; N211-F350 HydrophobicContact CB-CE1 3.7Å; N211-F350 HydrophobicContact CB-CZ 4.48Å; I342-F350 WeakPolarHBondContact CA-O 3.43Å; E343-F350 PolarHBondContact N-O 2.97Å; E343-F350 PolarHBondContact O-N 3.09Å; I345-F350 HydrophobicContact CB-CD2 3.79Å; I345-F350 HydrophobicContact CB-CE2 3.98Å; I345-F350 HydrophobicContact CD1-CD2 4.25Å; I345-F350 HydrophobicContact CG1-CD2 4.12Å; E348-F350 HydrophobicContact CB-CD2 4.49Å; E348-F350 HydrophobicContact CB-CE2 3.78Å; E348-F350 HydrophobicContact CB-CZ 4.24Å; F350-F352 HydrophobicContact CB-CD2 4.41Å; F350-F352 HydrophobicContact CB-CE2 3.53Å; F350-F352 HydrophobicContact CB-CZ 3.87Å; F350-F352 WeakPolarHBondContact O-CD2 3.43Å; F350-F352 WeakPolarHBondContact O-CE2 3.45Å
351	T	95.6	Very high	89.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.5	169.7	-69.8	0	0	0	0	109.6	V209 L210 K212 I302 F340 V353	V209-T351 CarbonylContact C-O 3.56Å; V209-T351 VanDerWaalsContact CA-O 3.31Å; V209-T351 WeakPolarHBondContact CA-O 2.83Å; L210-T351 PolarHBondContact N-O 2.88Å; L210-T351 PolarHBondContact O-N 3.16Å; K212-T351 PolarHBondContact O-OG1 3.11Å; I302-T351 HydrophobicContact CD1-CG2 3.55Å; I302-T351 WeakPolarHBondContact CD1-OG1 3.42Å; F340-T351 HydrophobicContact CD2-CG2 3.89Å; F340-T351 HydrophobicContact CE2-CG2 3.39Å; F340-T351 HydrophobicContact CZ-CG2 4.36Å; T351-V353 HydrophobicContact CG2-CG2 4.3Å
352	F	96	Very high	89.5	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.9	175	-63.4	-97	0	0	0	109.7	I205 V209 F340 Y341 E343 I345 F350	I205-F352 HydrophobicContact CD1-CD1 3.86Å; I205-F352 HydrophobicContact CD1-CE1 3.54Å; V209-F352 HydrophobicContact CB-CD1 4.42Å; V209-F352 HydrophobicContact CB-CE1 4.28Å; V209-F352 HydrophobicContact CG1-CD1 4.16Å; V209-F352 HydrophobicContact CG1-CE1 3.72Å; V209-F352 HydrophobicContact CG1-CE2 4.48Å; V209-F352 HydrophobicContact CG1-CZ 3.88Å; V209-F352 HydrophobicContact CG2-CD1 3.55Å; V209-F352 HydrophobicContact CG2-CE1 3.53Å; V209-F352 HydrophobicContact CG2-CZ 4.5Å; F340-F352 WeakPolarHBondContact CA-O 3.49Å; Y341-F352 HydrophobicContact CD1-CB 4.02Å; Y341-F352 HydrophobicContact CD2-CB 4.2Å; Y341-F352 AromaticContact CD2-CD2 3.9Å; Y341-F352 HydrophobicContact CD2-CD2 3.9Å; Y341-F352 HydrophobicContact CD2-CG 4.29Å; Y341-F352 HydrophobicContact CE1-CB 3.63Å; Y341-F352 HydrophobicContact CE1-CG 4.18Å; Y341-F352 HydrophobicContact CE2-CB 3.82Å; Y341-F352 HydrophobicContact CE2-CD1 4.39Å; Y341-F352 AromaticContact CE2-CD2 3.36Å; Y341-F352 HydrophobicContact CE2-CD2 3.36Å; Y341-F352 HydrophobicContact CE2-CE2 4.06Å; Y341-F352 AromaticContact CE2-CG 3.59Å; Y341-F352 HydrophobicContact CE2-CG 3.59Å; Y341-F352 HydrophobicContact CG-CB 4.29Å; Y341-F352 AromaticContact CZ-CD2 3.82Å; Y341-F352 AromaticContact CZ-CG 3.51Å; Y341-F352 PolarHBondContact N-O 3.33Å; Y341-F352 VanDerWaalsContact N-O 3.08Å; Y341-F352 PolarHBondContact O-N 3.37Å; E343-F352 HydrophobicContact CB-CD2 4.26Å; E343-F352 HydrophobicContact CB-CE2 3.83Å; I345-F352 HydrophobicContact CD1-CE2 4.32Å; I345-F352 HydrophobicContact CD1-CZ 3.72Å; F350-F352 HydrophobicContact CB-CD2 4.41Å; F350-F352 HydrophobicContact CB-CE2 3.53Å; F350-F352 HydrophobicContact CB-CZ 3.87Å; F350-F352 WeakPolarHBondContact O-CD2 3.43Å; F350-F352 WeakPolarHBondContact O-CE2 3.45Å
353	V	94.7	Very high	89.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	108.7	170	-177.7	0	0	0	0	107.7	G207 V208 F281 L313 V316 T317 A337 F340 T351	G207-V353 CarbonylContact C-O 3.51Å; G207-V353 WeakPolarHBondContact CA-O 3.44Å; V208-V353 PolarHBondContact N-O 3.39Å; V208-V353 PolarHBondContact O-N 2.63Å; F281-V353 HydrophobicContact CE1-CG2 4.5Å; F281-V353 HydrophobicContact CE2-CG2 4.16Å; F281-V353 HydrophobicContact CZ-CG2 3.54Å; L313-V353 HydrophobicContact CD2-CB 3.98Å; L313-V353 HydrophobicContact CD2-CG1 4.15Å; L313-V353 HydrophobicContact CD2-CG2 3.81Å; V316-V353 HydrophobicContact CG1-CG1 4.29Å; T317-V353 HydrophobicContact CG2-CG1 3.95Å; A337-V353 HydrophobicContact CB-CG1 4.02Å; F340-V353 HydrophobicContact CD2-CG2 4.2Å; T351-V353 HydrophobicContact CG2-CG2 4.3Å
354	I	94.1	Very high	89.6	Confident	25 Å²	25	50 Å²	50	13%	0.128	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	144.2	-173.6	-57.7	-174.8	0	0	0	110.4	I205 A337 S338 E339 Y341 D356	I205-I354 HydrophobicContact CG2-CG1 4.3Å; A337-I354 CarbonylContact C-O 3.55Å; A337-I354 WeakPolarHBondContact CA-O 3.13Å; S338-I354 PolarHBondContact N-O 3.31Å; S338-I354 PolarHBondContact OG-O 3.17Å; E339-I354 PolarHBondContact N-O 2.95Å; E339-I354 PolarHBondContact O-N 3.12Å; Y341-I354 HydrophobicContact CE1-CD1 3.63Å; Y341-I354 HydrophobicContact CE1-CG1 4.37Å; I354-D356 WeakPolarHBondContact CG2-OD1 3.45Å
355	N	91.6	Very high	89.7	Confident	4 Å²	4	45 Å²	45	2%	0.021	23%	0.231	C	C	.	.			trans	-133.8	107.4	165.6	177.1	-11.6	0	0	0	109.1	K206 V316 K336 K357 D358 A359	K206-N355 PolarHBondContact O-N 3.34Å; V316-N355 HydrophobicContact CG1-CB 3.68Å; V316-N355 PolarHBondContact O-ND2 3.47Å; K336-N355 VanDerWaalsContact O-CG 3.24Å; K336-N355 PolarHBondContact O-ND2 3.2Å; K336-N355 PolarHBondContact O-OD1 3.36Å; N355-K357 VanDerWaalsContact C-N 3.32Å; N355-K357 PolarHBondContact O-N 3.17Å; N355-K357 PolarHBondContact OD1-N 3.05Å; N355-D358 PolarHBondContact OD1-N 2.86Å; N355-A359 HydrophobicContact CB-CB 4.26Å; N355-A359 WeakPolarHBondContact O-CB 3.43Å
356	D	84.1	Confident	89.9	Confident	98 Å²	98	44 Å²	44	52%	0.524	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-18.9	-175.4	-61.5	-56.9	0	0	0	114.3	S338 I354	S338-D356 VanDerWaalsContact CB-OD2 3.3Å; S338-D356 WeakPolarHBondContact CB-OD2 3.28Å; S338-D356 PolarHBondContact OG-N 2.72Å; S338-D356 PolarHBondContact OG-OD2 3.49Å; I354-D356 WeakPolarHBondContact CG2-OD1 3.45Å
357	K	78.4	Confident	90.2	Very high	186 Å²	186	42.8 Å²	42.8	81%	0.809	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-60.5	-169.1	-63.6	-176.6	-179	178.4	0	112.3	N355	N355-K357 VanDerWaalsContact C-N 3.32Å; N355-K357 PolarHBondContact O-N 3.17Å; N355-K357 PolarHBondContact OD1-N 3.05Å
358	D	80.6	Confident	90.3	Very high	119 Å²	119	35.7 Å²	35.7	64%	0.636	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137.4	47.1	-168.2	-68.6	-39.2	0	0	0	111.4	N355 K360	N355-D358 PolarHBondContact OD1-N 2.86Å; D358-K360 PolarHBondContact O-N 2.97Å
359	A	77.5	Confident	90.1	Very high	5 Å²	5	35.2 Å²	35.2	4%	0.041	17%	0.172	C	C	.	.			trans	-66.4	100	175.6	0	0	0	0	0	110.6	K206 N355 A361	K206-A359 HydrophobicContact CB-CB 3.96Å; N355-A359 HydrophobicContact CB-CB 4.26Å; N355-A359 WeakPolarHBondContact O-CB 3.43Å; A359-A361 PolarHBondContact O-N 3.27Å
360	K	84.7	Confident	89.8	Confident	99 Å²	99	34.3 Å²	34.3	43%	0.43	17%	0.173	S	C	.	.	S	Bend	trans	-78	1.6	171.6	-63.3	-170.7	177.9	-169.9	0	113.6	I175 K315 D358	I175-K360 HydrophobicContact CD1-CD 4.36Å; K315-K360 HydrophobicContact CB-CB 4.36Å; D358-K360 PolarHBondContact O-N 2.97Å
361	A	91.5	Very high	89.4	Confident	1 Å²	1	41 Å²	41	1%	0.008	20%	0.202	C	C	.	.	S	Bend	trans	-144.6	146.5	173.4	0	0	0	0	0	109.2	Y188 G207 R312 K315 V316 A359	Y188-A361 HydrophobicContact CD1-CB 4.24Å; Y188-A361 CarbonylContact O-C 3.51Å; Y188-A361 VanDerWaalsContact O-CA 3.25Å; Y188-A361 WeakPolarHBondContact O-CA 3.48Å; Y188-A361 WeakPolarHBondContact O-CB 3.22Å; G207-A361 PolarHBondContact N-O 3.33Å; R312-A361 HydrophobicContact CB-CB 4.28Å; R312-A361 HydrophobicContact CG-CB 4.39Å; K315-A361 HydrophobicContact CB-CB 4.39Å; V316-A361 HydrophobicContact CG2-CB 3.95Å; A359-A361 PolarHBondContact O-N 3.27Å
362	C	93.7	Very high	88.7	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.007	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	161	-176.1	65.1	0	0	0	0	111.5	L172 Y188 R190 L204 I205 G207	L172-C362 HydrophobicContact CD1-CB 4.45Å; Y188-C362 PolarHBondContact O-N 3.43Å; R190-C362 PolarHBondContact N-O 2.93Å; L204-C362 HydrophobicContact CD1-CB 3.78Å; I205-C362 WeakPolarHBondContact O-CA 3.38Å; I205-C362 WeakPolarHBondContact O-CB 3.23Å; G207-C362 CarbonylContact O-C 3.51Å; G207-C362 VanDerWaalsContact O-C 3.23Å; G207-C362 WeakPolarHBondContact O-CA 3.2Å
363	T	94.7	Very high	88.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.2	172.9	-54.9	0	0	0	0	109.5	R190 E192 I205 G207 V208 V209	R190-T363 HydrophobicContact CB-CG2 4.09Å; R190-T363 HydrophobicContact CG-CG2 4.01Å; R190-T363 CarbonylContact O-C 3.55Å; R190-T363 VanDerWaalsContact O-CA 3.27Å; R190-T363 WeakPolarHBondContact O-CA 3.36Å; E192-T363 HydrophobicContact CB-CG2 3.92Å; I205-T363 WeakPolarHBondContact CB-O 3.28Å; I205-T363 PolarHBondContact N-O 3.25Å; I205-T363 PolarHBondContact O-N 3.09Å; G207-T363 PolarHBondContact O-N 3.47Å; G207-T363 PolarHBondContact O-OG1 3.11Å; V208-T363 WeakPolarHBondContact CA-OG1 3.44Å; V209-T363 HydrophobicContact CB-CG2 3.86Å; V209-T363 HydrophobicContact CG2-CG2 3.83Å; V209-T363 PolarHBondContact N-OG1 3.15Å
364	L	94.2	Very high	87.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	105.9	171.4	-67.6	168.3	0	0	0	107.5	M165 A169 V189 R190 V191 E192 L204 L381 L385	M165-L364 HydrophobicContact CB-CD2 3.93Å; M165-L364 HydrophobicContact CG-CD2 4.44Å; M165-L364 HydrophobicContact SD-CD2 4.41Å; A169-L364 HydrophobicContact CB-CD1 4.24Å; A169-L364 HydrophobicContact CB-CD2 4.29Å; V189-L364 HydrophobicContact CG1-CD1 3.44Å; V189-L364 VanDerWaalsContact CG1-CD1 3.44Å; V189-L364 HydrophobicContact CG1-CG 4.06Å; R190-L364 PolarHBondContact O-N 3.02Å; V191-L364 WeakPolarHBondContact CA-O 3.46Å; V191-L364 HydrophobicContact CG2-CB 4.35Å; V191-L364 HydrophobicContact CG2-CD1 4.43Å; E192-L364 PolarHBondContact N-O 2.89Å; L204-L364 HydrophobicContact CB-CD2 4.1Å; L204-L364 HydrophobicContact CD1-CD2 3.46Å; L204-L364 VanDerWaalsContact CD1-CD2 3.46Å; L204-L364 HydrophobicContact CD1-CG 4.14Å; L204-L364 HydrophobicContact CG-CD2 4.37Å; L364-L381 HydrophobicContact CB-CD2 4.02Å; L364-L381 HydrophobicContact CD1-CD1 4.1Å; L364-L381 HydrophobicContact CD1-CD2 3.6Å; L364-L381 HydrophobicContact CD1-CG 4.09Å; L364-L381 HydrophobicContact CG-CD2 4.33Å; L364-L385 HydrophobicContact CD1-CD1 3.88Å; L364-L385 HydrophobicContact CD1-CD2 4.26Å
365	L	93.8	Very high	87.3	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.5	176.1	-179.8	68.6	0	0	0	108.4	E192 V194 S202 K203 I205 I345	E192-L365 HydrophobicContact CB-CD1 4.19Å; E192-L365 HydrophobicContact CG-CD1 4.3Å; V194-L365 HydrophobicContact CB-CD1 4.35Å; V194-L365 HydrophobicContact CG2-CD1 3.53Å; S202-L365 CarbonylContact C-O 3.56Å; S202-L365 WeakPolarHBondContact CA-O 3.49Å; S202-L365 WeakPolarHBondContact CB-O 3.35Å; K203-L365 HydrophobicContact CG-CB 4.49Å; K203-L365 HydrophobicContact CG-CD2 4.45Å; K203-L365 PolarHBondContact N-O 3.32Å; K203-L365 PolarHBondContact O-N 3.04Å; I205-L365 HydrophobicContact CD1-CB 3.9Å; I205-L365 HydrophobicContact CD1-CD2 4.11Å; I345-L365 HydrophobicContact CD1-CD2 4.33Å
366	L	92.9	Very high	86.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.5	176.8	-63	-176.3	0	0	0	110.6	M165 V191 E192 K193 V194 L374 M377 D378 L381	M165-L366 HydrophobicContact CE-CD2 3.89Å; V191-L366 HydrophobicContact CG1-CD1 3.53Å; V191-L366 HydrophobicContact CG1-CG 3.88Å; E192-L366 PolarHBondContact O-N 2.93Å; K193-L366 HydrophobicContact CG-CD1 4.45Å; V194-L366 PolarHBondContact N-O 3.14Å; L366-L374 HydrophobicContact CB-CD2 3.85Å; L366-M377 HydrophobicContact CD1-CB 4.32Å; L366-M377 HydrophobicContact CD2-CE 4.46Å; L366-D378 HydrophobicContact CD1-CB 4.16Å; L366-L381 HydrophobicContact CD1-CD2 4.07Å; L366-L381 HydrophobicContact CD2-CD2 4.02Å; L366-L381 HydrophobicContact CG-CD2 4.31Å
367	R	90.7	Very high	86.7	Confident	26 Å²	26	51.1 Å²	51.1	10%	0.098	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	141.4	177.7	-63.8	-74.2	-75.1	165.1	-5.9	109	P195 G196 Q198 E201 S202	P195-R367 PolarHBondContact O-NH1 3.28Å; G196-R367 VanDerWaalsContact O-CZ 3.24Å; G196-R367 PolarHBondContact O-NE 3.21Å; G196-R367 PolarHBondContact O-NH1 2.95Å; Q198-R367 VanDerWaalsContact O-CB 3.3Å; Q198-R367 WeakPolarHBondContact O-CB 3.3Å; E201-R367 HydrophobicContact CB-CB 4.06Å; E201-R367 HydrophobicContact CB-CG 3.92Å; E201-R367 IonicContact OE2-CZ 3.18Å; E201-R367 IonicContact OE2-NE 2.68Å; E201-R367 PolarHBondContact OE2-NE 3.49Å; E201-R367 IonicContact OE2-NH2 3.98Å; E201-R367 PolarHBondContact OE2-NH2 3.35Å; S202-R367 PolarHBondContact OG-N 2.9Å; S202-R367 PolarHBondContact OG-O 3.24Å
368	G	88.5	Confident	87.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.4	154.3	-172.8	0	0	0	0	0	112.3	G196 N370	G196-G368 CarbonylContact C-O 3.59Å; G196-G368 WeakPolarHBondContact CA-O 3.32Å; G196-G368 PolarHBondContact N-O 2.99Å; G196-G368 PolarHBondContact O-N 3.27Å; G368-N370 VanDerWaalsContact C-N 3.34Å; G368-N370 PolarHBondContact O-N 2.86Å
369	P	87.2	Confident	87.2	Confident	86 Å²	86	41.9 Å²	41.9	56%	0.558	21%	0.205	S	C	*	.	S	Bend	trans	-67.6	-32.1	-168.1	26.4	-35.5	0	0	0	113.5	I373	P369-I373 HydrophobicContact CG-CD1 3.78Å
370	N	85.3	Confident	87.5	Confident	64 Å²	64	42 Å²	42	34%	0.342	21%	0.205	S	C	.	.	S	Bend	trans	-139.1	165.7	179.2	65.6	10.4	0	0	0	110.9	G368 D372 I373 L374	G368-N370 VanDerWaalsContact C-N 3.34Å; G368-N370 PolarHBondContact O-N 2.86Å; N370-D372 VanDerWaalsContact C-N 3.33Å; N370-I373 WeakPolarHBondContact OD1-CB 3.36Å; N370-I373 VanDerWaalsContact OD1-CD1 3.26Å; N370-I373 WeakPolarHBondContact OD1-CD1 3.32Å; N370-I373 WeakPolarHBondContact OD1-CG1 3.24Å; N370-I373 PolarHBondContact OD1-N 2.9Å; N370-L374 WeakPolarHBondContact O-CG 3.38Å; N370-L374 PolarHBondContact O-N 3.43Å
371	K	87	Confident	87.6	Confident	143 Å²	143	37.3 Å²	37.3	62%	0.622	18%	0.184	S	C	*	.	H	α-helix	trans	-68	-33.8	-178.9	-70	-177.9	177.9	178.2	0	112.3	P195 L374 M375	P195-K371 HydrophobicContact CB-CG 4.38Å; K371-L374 WeakPolarHBondContact O-CB 3.21Å; K371-L374 PolarHBondContact O-N 3.22Å; K371-M375 WeakPolarHBondContact O-CG 3.32Å; K371-M375 PolarHBondContact O-N 3.41Å
372	D	81.8	Confident	87.5	Confident	118 Å²	118	40 Å²	40	63%	0.631	20%	0.196	S	C	*	.	H	α-helix	trans	-66.3	-45.6	-176.8	-53.8	-39.9	0	0	0	111.5	N370 L374 M375 E376	N370-D372 VanDerWaalsContact C-N 3.33Å; D372-L374 VanDerWaalsContact C-N 3.3Å; D372-L374 PolarHBondContact O-N 2.84Å; D372-M375 PolarHBondContact O-N 3.48Å; D372-M375 VanDerWaalsContact O-N 3.16Å; D372-E376 PolarHBondContact O-N 2.66Å
373	I	83.4	Confident	87.1	Confident	37 Å²	37	41.2 Å²	41.2	19%	0.19	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-39.9	173.8	-69.4	166.9	0	0	0	110.4	W158 P369 N370 M375 E376 M377	W158-I373 HydrophobicContact CH2-CB 4.35Å; W158-I373 HydrophobicContact CH2-CD1 4.35Å; W158-I373 HydrophobicContact CH2-CG1 4.19Å; W158-I373 HydrophobicContact CH2-CG2 3.29Å; W158-I373 HydrophobicContact CZ2-CG2 3.97Å; W158-I373 HydrophobicContact CZ3-CG2 3.68Å; P369-I373 HydrophobicContact CG-CD1 3.78Å; N370-I373 WeakPolarHBondContact OD1-CB 3.36Å; N370-I373 VanDerWaalsContact OD1-CD1 3.26Å; N370-I373 WeakPolarHBondContact OD1-CD1 3.32Å; N370-I373 WeakPolarHBondContact OD1-CG1 3.24Å; N370-I373 PolarHBondContact OD1-N 2.9Å; I373-M375 VanDerWaalsContact C-N 3.3Å; I373-M375 PolarHBondContact O-N 3.1Å; I373-E376 PolarHBondContact O-N 3.06Å; I373-M377 HydrophobicContact CG2-CG 4.16Å; I373-M377 HydrophobicContact CG2-SD 4.06Å; I373-M377 WeakPolarHBondContact O-CB 3.1Å; I373-M377 VanDerWaalsContact O-CG 3.31Å; I373-M377 WeakPolarHBondContact O-CG 3.31Å; I373-M377 PolarHBondContact O-N 3.47Å
374	L	87.4	Confident	86.8	Confident	4 Å²	4	41.2 Å²	41.2	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-35.3	176.5	-75.7	173.5	0	0	0	112.8	K193 P195 L366 N370 K371 D372 D378	K193-L374 HydrophobicContact CB-CB 4.49Å; K193-L374 HydrophobicContact CB-CD1 4.41Å; K193-L374 HydrophobicContact CD-CB 4.45Å; K193-L374 HydrophobicContact CG-CB 4.49Å; P195-L374 HydrophobicContact CB-CD1 4.39Å; L366-L374 HydrophobicContact CB-CD2 3.85Å; N370-L374 WeakPolarHBondContact O-CG 3.38Å; N370-L374 PolarHBondContact O-N 3.43Å; K371-L374 WeakPolarHBondContact O-CB 3.21Å; K371-L374 PolarHBondContact O-N 3.22Å; D372-L374 VanDerWaalsContact C-N 3.3Å; D372-L374 PolarHBondContact O-N 2.84Å; L374-D378 VanDerWaalsContact O-CB 3.31Å; L374-D378 WeakPolarHBondContact O-CB 3.17Å; L374-D378 PolarHBondContact O-N 3.32Å
375	M	84.4	Confident	86.7	Confident	95 Å²	95	41.2 Å²	41.2	47%	0.468	20%	0.203	S	C	.	.	H	α-helix	trans	-68.8	-39.9	174.9	-68.1	-168.1	-169.1	0	0	111.6	K371 D372 I373 D378 R379	K371-M375 WeakPolarHBondContact O-CG 3.32Å; K371-M375 PolarHBondContact O-N 3.41Å; D372-M375 PolarHBondContact O-N 3.48Å; D372-M375 VanDerWaalsContact O-N 3.16Å; I373-M375 VanDerWaalsContact C-N 3.3Å; I373-M375 PolarHBondContact O-N 3.1Å; M375-D378 PolarHBondContact O-N 3.2Å; M375-R379 WeakPolarHBondContact O-CG 3.48Å; M375-R379 PolarHBondContact O-N 2.95Å; M375-R379 VanDerWaalsContact O-N 3.14Å
376	E	79.4	Confident	86.6	Confident	82 Å²	82	42.5 Å²	42.5	38%	0.383	21%	0.209	S	C	.	.	H	α-helix	trans	-65.6	-42.6	174.8	-175.6	172.7	-160.2	0	0	111.7	D372 I373 R379 N380	D372-E376 PolarHBondContact O-N 2.66Å; I373-E376 PolarHBondContact O-N 3.06Å; E376-R379 PolarHBondContact O-N 3.32Å; E376-N380 WeakPolarHBondContact O-CB 3.5Å; E376-N380 PolarHBondContact O-N 3.34Å; E376-N380 VanDerWaalsContact O-N 3.1Å; E376-N380 PolarHBondContact O-ND2 2.9Å
377	M	83.6	Confident	86.4	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-41.4	174.9	-74.8	-176.3	74.4	0	0	112.6	W158 I199 L366 I373 N380 L381	W158-M377 HydrophobicContact CE3-CG 3.93Å; W158-M377 HydrophobicContact CE3-SD 4.46Å; W158-M377 HydrophobicContact CZ3-CG 4.15Å; I199-M377 HydrophobicContact CD1-SD 4.45Å; I199-M377 HydrophobicContact CG1-SD 4.42Å; I199-M377 HydrophobicContact CG2-CE 3.66Å; I199-M377 HydrophobicContact CG2-SD 4.28Å; L366-M377 HydrophobicContact CD1-CB 4.32Å; L366-M377 HydrophobicContact CD2-CE 4.46Å; I373-M377 HydrophobicContact CG2-CG 4.16Å; I373-M377 HydrophobicContact CG2-SD 4.06Å; I373-M377 WeakPolarHBondContact O-CB 3.1Å; I373-M377 VanDerWaalsContact O-CG 3.31Å; I373-M377 WeakPolarHBondContact O-CG 3.31Å; I373-M377 PolarHBondContact O-N 3.47Å; M377-N380 PolarHBondContact O-N 2.94Å; M377-L381 WeakPolarHBondContact O-CB 3.39Å; M377-L381 PolarHBondContact O-N 3.48Å
378	D	87.4	Confident	86.5	Confident	27 Å²	27	41.2 Å²	41.2	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-47.4	177.1	-178	24.7	0	0	0	111.1	V191 K193 L366 L374 M375 N380 L381 Q382	V191-D378 WeakPolarHBondContact CG1-OD1 3.25Å; K193-D378 HydrophobicContact CD-CB 3.94Å; K193-D378 IonicContact NZ-OD2 3.69Å; K193-D378 PolarHBondContact NZ-OD2 3.03Å; L366-D378 HydrophobicContact CD1-CB 4.16Å; L374-D378 VanDerWaalsContact O-CB 3.31Å; L374-D378 WeakPolarHBondContact O-CB 3.17Å; L374-D378 PolarHBondContact O-N 3.32Å; M375-D378 PolarHBondContact O-N 3.2Å; D378-N380 PolarHBondContact O-N 3.13Å; D378-L381 PolarHBondContact O-N 3.45Å; D378-Q382 WeakPolarHBondContact O-CG 3.41Å; D378-Q382 PolarHBondContact O-N 2.9Å
379	R	82.2	Confident	86.6	Confident	85 Å²	85	44 Å²	44	32%	0.321	21%	0.214	S	C	.	.	H	α-helix	trans	-56.2	-52.9	175.9	-70.8	175.6	-169.9	-178.4	2.6	111.7	M375 E376 L381 Q382 D383	M375-R379 WeakPolarHBondContact O-CG 3.48Å; M375-R379 PolarHBondContact O-N 2.95Å; M375-R379 VanDerWaalsContact O-N 3.14Å; E376-R379 PolarHBondContact O-N 3.32Å; R379-L381 VanDerWaalsContact C-N 3.29Å; R379-L381 PolarHBondContact O-N 2.82Å; R379-Q382 WeakPolarHBondContact O-CA 3.39Å; R379-Q382 WeakPolarHBondContact O-CB 3.32Å; R379-Q382 PolarHBondContact O-N 2.99Å; R379-D383 PolarHBondContact O-N 3.29Å
380	N	82.8	Confident	86.8	Confident	7 Å²	7	40 Å²	40	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-36.3	179.4	-81.9	-47.2	0	0	0	113.7	N153 I154 E376 M377 D378 D383 A384	N153-N380 WeakPolarHBondContact CB-OD1 3.35Å; I154-N380 HydrophobicContact CD1-CB 3.48Å; I154-N380 VanDerWaalsContact CD1-CB 3.48Å; I154-N380 HydrophobicContact CG1-CB 3.85Å; E376-N380 WeakPolarHBondContact O-CB 3.5Å; E376-N380 PolarHBondContact O-N 3.34Å; E376-N380 VanDerWaalsContact O-N 3.1Å; E376-N380 PolarHBondContact O-ND2 2.9Å; M377-N380 PolarHBondContact O-N 2.94Å; D378-N380 PolarHBondContact O-N 3.13Å; N380-D383 PolarHBondContact O-N 3.13Å; N380-A384 PolarHBondContact O-N 3.38Å
381	L	88.6	Confident	87.1	Confident	0 Å²	0	37 Å²	37	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-68.6	-38.2	173.9	176	66.8	0	0	0	111.4	V162 A166 V191 L364 L366 M377 D378 R379 D383 A384 L385	V162-L381 HydrophobicContact CG1-CB 4.18Å; V162-L381 HydrophobicContact CG1-CD1 3.89Å; A166-L381 HydrophobicContact CB-CD1 4.27Å; V191-L381 HydrophobicContact CG1-CD2 4.27Å; V191-L381 HydrophobicContact CG2-CD2 4.03Å; L364-L381 HydrophobicContact CB-CD2 4.02Å; L364-L381 HydrophobicContact CD1-CD1 4.1Å; L364-L381 HydrophobicContact CD1-CD2 3.6Å; L364-L381 HydrophobicContact CD1-CG 4.09Å; L364-L381 HydrophobicContact CG-CD2 4.33Å; L366-L381 HydrophobicContact CD1-CD2 4.07Å; L366-L381 HydrophobicContact CD2-CD2 4.02Å; L366-L381 HydrophobicContact CG-CD2 4.31Å; M377-L381 WeakPolarHBondContact O-CB 3.39Å; M377-L381 PolarHBondContact O-N 3.48Å; D378-L381 PolarHBondContact O-N 3.45Å; R379-L381 VanDerWaalsContact C-N 3.29Å; R379-L381 PolarHBondContact O-N 2.82Å; L381-D383 VanDerWaalsContact C-N 3.35Å; L381-A384 WeakPolarHBondContact O-CB 3.25Å; L381-A384 PolarHBondContact O-N 3.29Å; L381-L385 HydrophobicContact CD1-CG 4.43Å; L381-L385 HydrophobicContact CG-CD1 4.14Å; L381-L385 VanDerWaalsContact O-CG 3.23Å; L381-L385 WeakPolarHBondContact O-CG 3.34Å; L381-L385 PolarHBondContact O-N 3.49Å
382	Q	88.1	Confident	87.2	Confident	57 Å²	57	31 Å²	31	27%	0.266	15%	0.146	S	C	.	.	H	α-helix	trans	-59.9	-47.2	172.7	-66.1	-61.6	-30.6	0	0	110.4	D378 R379 A384 L385 H386	D378-Q382 WeakPolarHBondContact O-CG 3.41Å; D378-Q382 PolarHBondContact O-N 2.9Å; R379-Q382 WeakPolarHBondContact O-CA 3.39Å; R379-Q382 WeakPolarHBondContact O-CB 3.32Å; R379-Q382 PolarHBondContact O-N 2.99Å; Q382-A384 VanDerWaalsContact C-N 3.29Å; Q382-A384 PolarHBondContact O-N 3.47Å; Q382-L385 PolarHBondContact O-N 2.72Å; Q382-L385 VanDerWaalsContact O-N 3.15Å; Q382-H386 PolarHBondContact O-N 2.87Å; Q382-H386 PolarHBondContact O-ND1 2.74Å
383	D	85.2	Confident	87.5	Confident	28 Å²	28	29.3 Å²	29.3	15%	0.15	14%	0.137	C	C	.	.	H	α-helix	trans	-58.2	-44.8	177.9	-59.8	-14.6	0	0	0	110.7	R379 N380 L381 L385 H386 V387	R379-D383 PolarHBondContact O-N 3.29Å; N380-D383 PolarHBondContact O-N 3.13Å; L381-D383 VanDerWaalsContact C-N 3.35Å; D383-L385 PolarHBondContact O-N 3.18Å; D383-H386 PolarHBondContact O-N 2.84Å; D383-V387 VanDerWaalsContact O-CG2 3.29Å; D383-V387 WeakPolarHBondContact O-CG2 3.4Å; D383-V387 PolarHBondContact O-N 3Å
384	A	89.2	Confident	87.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-54.6	-50.4	174.2	0	0	0	0	0	112.7	V146 I150 V162 A166 N380 L381 Q382 H386 V387 V388	V146-A384 HydrophobicContact CG1-CB 4.3Å; I150-A384 HydrophobicContact CD1-CB 3.24Å; I150-A384 HydrophobicContact CG1-CB 4.27Å; V162-A384 HydrophobicContact CG1-CB 3.99Å; A166-A384 HydrophobicContact CB-CB 3.62Å; N380-A384 PolarHBondContact O-N 3.38Å; L381-A384 WeakPolarHBondContact O-CB 3.25Å; L381-A384 PolarHBondContact O-N 3.29Å; Q382-A384 VanDerWaalsContact C-N 3.29Å; Q382-A384 PolarHBondContact O-N 3.47Å; A384-H386 VanDerWaalsContact C-N 3.33Å; A384-H386 PolarHBondContact O-N 2.92Å; A384-V387 PolarHBondContact O-N 2.94Å; A384-V388 VanDerWaalsContact O-CG2 3.29Å; A384-V388 WeakPolarHBondContact O-CG2 3.39Å; A384-V388 PolarHBondContact O-N 3.24Å
385	L	92.1	Very high	87.9	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-41.6	-178.4	-71.6	166.1	0	0	0	111.3	A166 A169 I170 I185 V189 L364 L381 Q382 D383 R389	A166-L385 HydrophobicContact CB-CD2 3.99Å; A166-L385 HydrophobicContact CB-CG 4.24Å; A169-L385 HydrophobicContact CB-CD2 3.85Å; I170-L385 HydrophobicContact CD1-CB 4.43Å; I170-L385 HydrophobicContact CD1-CD2 3.97Å; I170-L385 HydrophobicContact CG1-CD2 3.97Å; I185-L385 HydrophobicContact CD1-CB 4.02Å; I185-L385 WeakPolarHBondContact CD1-O 3.46Å; I185-L385 HydrophobicContact CG2-CB 4.12Å; I185-L385 HydrophobicContact CG2-CD1 3.99Å; V189-L385 HydrophobicContact CG1-CD1 3.99Å; V189-L385 HydrophobicContact CG1-CD2 4.49Å; L364-L385 HydrophobicContact CD1-CD1 3.88Å; L364-L385 HydrophobicContact CD1-CD2 4.26Å; L381-L385 HydrophobicContact CD1-CG 4.43Å; L381-L385 HydrophobicContact CG-CD1 4.14Å; L381-L385 VanDerWaalsContact O-CG 3.23Å; L381-L385 WeakPolarHBondContact O-CG 3.34Å; L381-L385 PolarHBondContact O-N 3.49Å; Q382-L385 PolarHBondContact O-N 2.72Å; Q382-L385 VanDerWaalsContact O-N 3.15Å; D383-L385 PolarHBondContact O-N 3.18Å; L385-R389 WeakPolarHBondContact O-CB 3.39Å; L385-R389 PolarHBondContact O-N 3.45Å
386	H	90.7	Very high	88.2	Confident	30 Å²	30	30 Å²	30	14%	0.139	14%	0.143	C	C	.	.	H	α-helix	trans	-68.6	-41.6	178.3	-69.1	90.6	0	0	0	112	T77 Q382 D383 A384 R389 N390	T77-H386 WeakPolarHBondContact O-CB 3.34Å; Q382-H386 PolarHBondContact O-N 2.87Å; Q382-H386 PolarHBondContact O-ND1 2.74Å; D383-H386 PolarHBondContact O-N 2.84Å; A384-H386 VanDerWaalsContact C-N 3.33Å; A384-H386 PolarHBondContact O-N 2.92Å; H386-R389 WeakPolarHBondContact O-CB 3.27Å; H386-R389 PolarHBondContact O-N 3.29Å; H386-N390 WeakPolarHBondContact O-CB 3.44Å; H386-N390 PolarHBondContact O-N 2.97Å; H386-N390 PolarHBondContact O-ND2 3.06Å; H386-N390 VanDerWaalsContact O-ND2 3.14Å
387	V	89.9	Confident	88.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60	-48.5	175.2	170.1	0	0	0	0	110.7	D79 V145 V146 C149 D383 A384 R389 N390 V391 P488	D79-V387 HydrophobicContact CB-CG2 4.18Å; V145-V387 HydrophobicContact CG1-CG1 4.25Å; V146-V387 HydrophobicContact CG2-CG1 4.3Å; C149-V387 HydrophobicContact CB-CG1 4.23Å; C149-V387 HydrophobicContact CB-CG2 3.71Å; D383-V387 VanDerWaalsContact O-CG2 3.29Å; D383-V387 WeakPolarHBondContact O-CG2 3.4Å; D383-V387 PolarHBondContact O-N 3Å; A384-V387 PolarHBondContact O-N 2.94Å; V387-R389 PolarHBondContact O-N 2.74Å; V387-N390 PolarHBondContact O-N 3.47Å; V387-V391 WeakPolarHBondContact O-CG2 3.47Å; V387-V391 PolarHBondContact O-N 3.03Å; V387-P488 HydrophobicContact CG1-CG 3.91Å
388	V	91.4	Very high	89.2	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.9	-44.7	176.8	178	0	0	0	0	110.7	L142 V146 A166 V167 I170 A384 N390 V391 F392	L142-V388 HydrophobicContact CD2-CG1 4.38Å; V146-V388 HydrophobicContact CG1-CG2 4.49Å; V146-V388 HydrophobicContact CG2-CG2 3.35Å; A166-V388 HydrophobicContact CB-CG2 4.41Å; V167-V388 HydrophobicContact CG2-CG2 4Å; I170-V388 HydrophobicContact CB-CB 4.45Å; I170-V388 HydrophobicContact CB-CG1 3.66Å; I170-V388 HydrophobicContact CG1-CB 3.98Å; I170-V388 HydrophobicContact CG1-CG1 3.74Å; I170-V388 HydrophobicContact CG2-CG1 3.8Å; A384-V388 VanDerWaalsContact O-CG2 3.29Å; A384-V388 WeakPolarHBondContact O-CG2 3.39Å; A384-V388 PolarHBondContact O-N 3.24Å; V388-N390 VanDerWaalsContact C-N 3.32Å; V388-N390 PolarHBondContact O-N 3.14Å; V388-V391 PolarHBondContact O-N 2.82Å; V388-F392 HydrophobicContact CG1-CD2 3.74Å; V388-F392 HydrophobicContact CG1-CE2 3.72Å; V388-F392 VanDerWaalsContact O-CD2 3.29Å; V388-F392 WeakPolarHBondContact O-CD2 3.41Å; V388-F392 PolarHBondContact O-N 3.06Å
389	R	91.9	Very high	89.4	Confident	57 Å²	57	25 Å²	25	22%	0.215	12%	0.119	C	C	.	.	H	α-helix	trans	-55.1	-46.6	174.1	166.6	-179.7	176.6	-113.6	0.7	111.6	E76 I170 I183 I185 L385 H386 V387 V391 F392 L393	E76-R389 PolarHBondContact O-NH1 2.86Å; E76-R389 VanDerWaalsContact O-NH1 3.11Å; I170-R389 HydrophobicContact CD1-CB 4.45Å; I183-R389 HydrophobicContact CB-CG 4.15Å; I183-R389 HydrophobicContact CD1-CG 4.38Å; I183-R389 HydrophobicContact CG2-CB 4.2Å; I183-R389 HydrophobicContact CG2-CG 4.04Å; I183-R389 PolarHBondContact O-NE 2.98Å; I185-R389 HydrophobicContact CD1-CB 3.84Å; I185-R389 HydrophobicContact CD1-CG 4.31Å; L385-R389 WeakPolarHBondContact O-CB 3.39Å; L385-R389 PolarHBondContact O-N 3.45Å; H386-R389 WeakPolarHBondContact O-CB 3.27Å; H386-R389 PolarHBondContact O-N 3.29Å; V387-R389 PolarHBondContact O-N 2.74Å; R389-V391 PolarHBondContact O-N 3.44Å; R389-F392 PolarHBondContact O-N 2.82Å; R389-L393 HydrophobicContact CG-CD1 3.92Å; R389-L393 HydrophobicContact CG-CG 4.44Å; R389-L393 WeakPolarHBondContact O-CG 3.37Å; R389-L393 PolarHBondContact O-N 3.44Å
390	N	91.2	Very high	89.8	Confident	4 Å²	4	21 Å²	21	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-63	-41.6	-178.2	-67.4	-26.3	0	0	0	111.8	T77 H386 V387 V388 L393 N394 P488 V491	T77-N390 PolarHBondContact O-ND2 3.23Å; H386-N390 WeakPolarHBondContact O-CB 3.44Å; H386-N390 PolarHBondContact O-N 2.97Å; H386-N390 PolarHBondContact O-ND2 3.06Å; H386-N390 VanDerWaalsContact O-ND2 3.14Å; V387-N390 PolarHBondContact O-N 3.47Å; V388-N390 VanDerWaalsContact C-N 3.32Å; V388-N390 PolarHBondContact O-N 3.14Å; N390-L393 PolarHBondContact O-N 3.4Å; N390-N394 PolarHBondContact O-N 3.05Å; N390-P488 HydrophobicContact CB-CB 4.32Å; N390-V491 WeakPolarHBondContact ND2-CG2 3.33Å
391	V	90.7	Very high	90.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.7	-37	176.3	177.8	0	0	0	0	111.6	L142 V145 V387 V388 R389 N394 P395 P488	L142-V391 HydrophobicContact CD1-CB 4.12Å; L142-V391 HydrophobicContact CD1-CG1 3.76Å; V145-V391 HydrophobicContact CG1-CG2 3.81Å; V387-V391 WeakPolarHBondContact O-CG2 3.47Å; V387-V391 PolarHBondContact O-N 3.03Å; V388-V391 PolarHBondContact O-N 2.82Å; R389-V391 PolarHBondContact O-N 3.44Å; V391-N394 CarbonylContact O-C 3.4Å; V391-P395 WeakPolarHBondContact O-CA 3.45Å; V391-P488 HydrophobicContact CG2-CB 4.18Å; V391-P488 HydrophobicContact CG2-CG 4.03Å
392	F	89.2	Confident	90.2	Very high	17 Å²	17	21.4 Å²	21.4	8%	0.075	11%	0.11	C	C	.	.	H	α-helix	trans	-67.7	-36.6	176.2	-94.1	-112.5	0	0	0	113.1	I136 L142 I170 K171 T174 I183 V388 R389	I136-F392 HydrophobicContact CG2-CD1 3.89Å; I136-F392 HydrophobicContact CG2-CD2 3.73Å; I136-F392 HydrophobicContact CG2-CE1 3.64Å; I136-F392 HydrophobicContact CG2-CE2 3.5Å; I136-F392 VanDerWaalsContact CG2-CE2 3.5Å; I136-F392 HydrophobicContact CG2-CG 3.93Å; I136-F392 HydrophobicContact CG2-CZ 3.44Å; I136-F392 VanDerWaalsContact CG2-CZ 3.44Å; L142-F392 HydrophobicContact CD1-CE2 4.45Å; L142-F392 HydrophobicContact CD2-CE2 3.75Å; I170-F392 HydrophobicContact CG2-CD1 4.38Å; I170-F392 HydrophobicContact CG2-CD2 4.23Å; I170-F392 HydrophobicContact CG2-CE2 4.46Å; I170-F392 HydrophobicContact CG2-CG 4.18Å; K171-F392 HydrophobicContact CG-CE1 4.37Å; K171-F392 HydrophobicContact CG-CZ 3.81Å; T174-F392 HydrophobicContact CG2-CD1 4.48Å; I183-F392 HydrophobicContact CD1-CB 3.59Å; I183-F392 HydrophobicContact CD1-CD1 4.46Å; I183-F392 HydrophobicContact CD1-CG 4.29Å; V388-F392 HydrophobicContact CG1-CD2 3.74Å; V388-F392 HydrophobicContact CG1-CE2 3.72Å; V388-F392 VanDerWaalsContact O-CD2 3.29Å; V388-F392 WeakPolarHBondContact O-CD2 3.41Å; V388-F392 PolarHBondContact O-N 3.06Å; R389-F392 PolarHBondContact O-N 2.82Å
393	L	88.4	Confident	90.4	Very high	82 Å²	82	18.7 Å²	18.7	43%	0.429	10%	0.097	S	C	.	.	H	α-helix	trans	-73.9	-40.4	177.1	-69.1	174.6	0	0	0	111.8	K181 R389 N390	K181-L393 HydrophobicContact CB-CD2 4.4Å; K181-L393 VanDerWaalsContact O-CD2 3.22Å; K181-L393 WeakPolarHBondContact O-CD2 3.43Å; R389-L393 HydrophobicContact CG-CD1 3.92Å; R389-L393 HydrophobicContact CG-CG 4.44Å; R389-L393 WeakPolarHBondContact O-CG 3.37Å; R389-L393 PolarHBondContact O-N 3.44Å; N390-L393 PolarHBondContact O-N 3.4Å
394	N	88.9	Confident	90.7	Very high	47 Å²	47	17.3 Å²	17.3	25%	0.251	9%	0.09	S	C	.	.			trans	-138.1	103	177.8	-173.7	3.1	0	0	0	109.9	N390 V391 K396 T490	N390-N394 PolarHBondContact O-N 3.05Å; V391-N394 CarbonylContact O-C 3.4Å; N394-K396 PolarHBondContact O-N 3.35Å; N394-T490 WeakPolarHBondContact CB-OG1 3.47Å
395	P	89.7	Confident	90.8	Very high	45 Å²	45	17.3 Å²	17.3	29%	0.292	9%	0.09	S	C	.	.			trans	-78.1	42.5	-175.3	32.4	-35.7	0	0	0	112.9	C133 I134 I136 V391	C133-P395 CarbonylContact C-O 3.58Å; C133-P395 VanDerWaalsContact CA-O 3.24Å; C133-P395 WeakPolarHBondContact CA-O 3.31Å; I134-P395 PolarHBondContact N-O 2.98Å; I136-P395 HydrophobicContact CD1-CB 3.8Å; I136-P395 HydrophobicContact CD1-CG 4.19Å; I136-P395 HydrophobicContact CG1-CB 3.74Å; V391-P395 WeakPolarHBondContact O-CA 3.45Å
396	K	91.8	Very high	90.8	Very high	59 Å²	59	17.5 Å²	17.5	26%	0.257	9%	0.091	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.5	175.6	-71.4	-176.3	174.7	-174.8	0	109.9	N127 K132 N394 L489	N127-K396 PolarHBondContact O-NZ 2.91Å; K132-K396 CarbonylContact O-C 3.55Å; K132-K396 WeakPolarHBondContact O-CA 3.38Å; N394-K396 PolarHBondContact O-N 3.35Å; K396-L489 HydrophobicContact CB-CB 3.88Å; K396-L489 HydrophobicContact CB-CD2 3.53Å; K396-L489 HydrophobicContact CB-CG 4.35Å; K396-L489 HydrophobicContact CD-CD2 3.58Å; K396-L489 HydrophobicContact CG-CD2 4.21Å; K396-L489 WeakPolarHBondContact O-CB 3.48Å; K396-L489 PolarHBondContact O-N 3.12Å
397	V	92	Very high	90.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	159.8	174.9	-62.3	0	0	0	0	111.6	G131 K132 I134 V145 W486 D487	G131-V397 WeakPolarHBondContact CA-O 3.38Å; K132-V397 HydrophobicContact CB-CG2 4.14Å; K132-V397 PolarHBondContact N-O 3.46Å; K132-V397 PolarHBondContact O-N 2.82Å; I134-V397 HydrophobicContact CD1-CB 4.01Å; I134-V397 HydrophobicContact CD1-CG1 3.31Å; I134-V397 HydrophobicContact CD1-CG2 3.52Å; I134-V397 HydrophobicContact CG1-CG1 4.07Å; I134-V397 HydrophobicContact CG1-CG2 3.78Å; V145-V397 HydrophobicContact CG1-CG1 4.32Å; V145-V397 HydrophobicContact CG2-CG1 3.97Å; V397-W486 HydrophobicContact CB-CB 4.06Å; V397-W486 HydrophobicContact CB-CE3 4.47Å; V397-W486 HydrophobicContact CG1-CB 4.39Å; V397-W486 HydrophobicContact CG2-CB 4.06Å; V397-W486 HydrophobicContact CG2-CD2 3.96Å; V397-W486 HydrophobicContact CG2-CE3 3.63Å; V397-W486 HydrophobicContact CG2-CG 4.17Å; V397-W486 HydrophobicContact CG2-CZ3 4.29Å; V397-D487 CarbonylContact C-O 3.49Å; V397-D487 VanDerWaalsContact CA-O 3.28Å; V397-D487 WeakPolarHBondContact CA-O 3.22Å; V397-D487 WeakPolarHBondContact CB-O 3.44Å
398	L	92.3	Very high	90.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	152.7	172.2	-67	179.6	0	0	0	109.9	M130 G400 A404 W486 D487 L489 R492	M130-L398 HydrophobicContact CB-CD2 3.4Å; M130-L398 VanDerWaalsContact CB-CD2 3.4Å; L398-G400 PolarHBondContact O-N 3.24Å; L398-A404 HydrophobicContact CB-CB 4.16Å; L398-A404 HydrophobicContact CD1-CB 4.33Å; L398-W486 WeakPolarHBondContact O-CA 3.21Å; L398-D487 PolarHBondContact N-O 3.41Å; L398-D487 PolarHBondContact O-N 3.33Å; L398-L489 HydrophobicContact CD1-CD1 3.6Å; L398-L489 HydrophobicContact CD2-CD1 3.94Å; L398-L489 HydrophobicContact CG-CB 4.5Å; L398-L489 HydrophobicContact CG-CD1 3.69Å; L398-R492 HydrophobicContact CD1-CB 3.88Å; L398-R492 HydrophobicContact CD1-CG 4.27Å
399	P	92	Very high	90.9	Very high	7 Å²	7	16.4 Å²	16.4	5%	0.045	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129.3	173.8	28.8	-34.7	0	0	0	109.9	A403 A404 T467 M480 W486	P399-A403 HydrophobicContact CB-CB 3.89Å; P399-A403 HydrophobicContact CG-CB 4.02Å; P399-A404 WeakPolarHBondContact O-CB 3.32Å; P399-A404 PolarHBondContact O-N 2.96Å; P399-T467 HydrophobicContact CB-CG2 4.3Å; P399-T467 HydrophobicContact CG-CG2 4.32Å; P399-M480 HydrophobicContact CB-CB 3.86Å; P399-M480 HydrophobicContact CB-CG 4.28Å; P399-W486 HydrophobicContact CB-CZ3 4.44Å
400	G	90.6	Very high	90.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-156.8	-178.1	0	0	0	0	0	113.7	L398 G402 A403 M480 M485 D487	L398-G400 PolarHBondContact O-N 3.24Å; G400-G402 PolarHBondContact O-N 2.93Å; G400-G402 VanDerWaalsContact O-N 3.1Å; G400-A403 VanDerWaalsContact O-CB 3.28Å; G400-A403 WeakPolarHBondContact O-CB 3.43Å; G400-A403 PolarHBondContact O-N 3.16Å; G400-M480 VanDerWaalsContact O-CG 3.29Å; G400-M480 WeakPolarHBondContact O-CG 3.48Å; G400-M485 PolarHBondContact N-O 3.2Å; G400-D487 VanDerWaalsContact CA-OD2 3.29Å; G400-D487 WeakPolarHBondContact CA-OD2 3.31Å
401	G	88	Confident	90.8	Very high	16 Å²	16	17.2 Å²	17.2	17%	0.165	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.4	23.6	171.2	0	0	0	0	0	115.4	A403 I470	G401-A403 VanDerWaalsContact C-N 3.3Å; G401-A403 PolarHBondContact O-N 3.24Å; G401-I470 PolarHBondContact O-N 3.39Å
402	G	90.3	Very high	90.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	1.9	-176.3	0	0	0	0	0	114.8	G400 E405 M406	G400-G402 PolarHBondContact O-N 2.93Å; G400-G402 VanDerWaalsContact O-N 3.1Å; G402-E405 WeakPolarHBondContact CA-OE2 3.26Å; G402-M406 WeakPolarHBondContact O-CG 3.04Å; G402-M406 PolarHBondContact O-N 3.17Å
403	A	92.7	Very high	90.9	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65	-46.1	179.9	0	0	0	0	0	111.3	P399 G400 G401 E405 M406 A407 L468 M480	P399-A403 HydrophobicContact CB-CB 3.89Å; P399-A403 HydrophobicContact CG-CB 4.02Å; G400-A403 VanDerWaalsContact O-CB 3.28Å; G400-A403 WeakPolarHBondContact O-CB 3.43Å; G400-A403 PolarHBondContact O-N 3.16Å; G401-A403 VanDerWaalsContact C-N 3.3Å; G401-A403 PolarHBondContact O-N 3.24Å; A403-E405 VanDerWaalsContact C-N 3.32Å; A403-E405 PolarHBondContact O-N 3.12Å; A403-M406 PolarHBondContact O-N 3.16Å; A403-A407 WeakPolarHBondContact O-CB 3.2Å; A403-A407 PolarHBondContact O-N 3.13Å; A403-L468 WeakPolarHBondContact CB-O 3.22Å; A403-M480 HydrophobicContact CB-CG 3.96Å
404	A	92.2	Very high	91	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-43.2	179	0	0	0	0	0	112	M130 L398 P399 A407 L408	M130-A404 HydrophobicContact CE-CB 3.99Å; L398-A404 HydrophobicContact CB-CB 4.16Å; L398-A404 HydrophobicContact CD1-CB 4.33Å; P399-A404 WeakPolarHBondContact O-CB 3.32Å; P399-A404 PolarHBondContact O-N 2.96Å; A404-A407 PolarHBondContact O-N 2.88Å; A404-L408 WeakPolarHBondContact O-CB 3.31Å; A404-L408 VanDerWaalsContact O-CG 3.26Å; A404-L408 WeakPolarHBondContact O-CG 3.19Å; A404-L408 PolarHBondContact O-N 3.35Å
405	E	91.5	Very high	91.1	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-41	177.8	-68.1	75.2	-166.3	0	0	112.3	G402 A403 L408 A409 F434 I437 R492 Y496	G402-E405 WeakPolarHBondContact CA-OE2 3.26Å; A403-E405 VanDerWaalsContact C-N 3.32Å; A403-E405 PolarHBondContact O-N 3.12Å; E405-L408 PolarHBondContact O-N 3.12Å; E405-A409 WeakPolarHBondContact O-CB 3.49Å; E405-A409 PolarHBondContact O-N 3.38Å; E405-F434 HydrophobicContact CB-CB 4.36Å; E405-F434 HydrophobicContact CB-CD1 4.36Å; E405-F434 WeakPolarHBondContact CB-O 3.3Å; E405-F434 HydrophobicContact CG-CD1 4.26Å; E405-I437 HydrophobicContact CG-CB 4.08Å; E405-I437 HydrophobicContact CG-CG1 4.19Å; E405-I437 HydrophobicContact CG-CG2 4.28Å; E405-R492 WeakPolarHBondContact OE1-CD 3.4Å; E405-R492 IonicContact OE1-CZ 3.01Å; E405-R492 IonicContact OE1-NE 3.39Å; E405-R492 IonicContact OE1-NH1 2.71Å; E405-R492 PolarHBondContact OE1-NH1 2.86Å; E405-Y496 VanDerWaalsContact CD-OH 3.27Å; E405-Y496 HydrophobicContact CG-CE1 4.25Å; E405-Y496 PolarHBondContact OE1-OH 3.45Å
406	M	91.8	Very high	91.2	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.015	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-41.6	175.4	-74.1	-55.9	-54.9	0	0	112.8	G402 A403 A409 Q410 E435 P438 L456 R457 H460	G402-M406 WeakPolarHBondContact O-CG 3.04Å; G402-M406 PolarHBondContact O-N 3.17Å; A403-M406 PolarHBondContact O-N 3.16Å; M406-A409 WeakPolarHBondContact O-CB 3.26Å; M406-A409 PolarHBondContact O-N 2.86Å; M406-Q410 PolarHBondContact O-N 3.38Å; M406-E435 HydrophobicContact CE-CG 4.26Å; M406-E435 HydrophobicContact SD-CB 4.16Å; M406-E435 HydrophobicContact SD-CG 3.84Å; M406-P438 HydrophobicContact CG-CB 4.35Å; M406-P438 HydrophobicContact CG-CG 3.8Å; M406-P438 HydrophobicContact SD-CB 4.42Å; M406-P438 HydrophobicContact SD-CG 3.59Å; M406-P438 VanDerWaalsContact SD-CG 3.59Å; M406-L456 HydrophobicContact CE-CG 4.38Å; M406-L456 HydrophobicContact CG-CD2 3.63Å; M406-L456 HydrophobicContact CG-CG 4.09Å; M406-L456 HydrophobicContact SD-CD2 4.18Å; M406-R457 HydrophobicContact CE-CB 4.42Å; M406-R457 HydrophobicContact CE-CG 3.64Å; M406-H460 WeakPolarHBondContact CB-NE2 3.04Å
407	A	92	Very high	91.1	Very high	4 Å²	4	22.7 Å²	22.7	3%	0.033	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-43.5	176.4	0	0	0	0	0	111	M130 A403 A404 Q410 V411 E466	M130-A407 HydrophobicContact CE-CB 3.57Å; M130-A407 HydrophobicContact SD-CB 4.4Å; A403-A407 WeakPolarHBondContact O-CB 3.2Å; A403-A407 PolarHBondContact O-N 3.13Å; A404-A407 PolarHBondContact O-N 2.88Å; A407-Q410 PolarHBondContact O-N 3.41Å; A407-V411 VanDerWaalsContact O-CG2 3.3Å; A407-V411 WeakPolarHBondContact O-CG2 3.49Å; A407-V411 PolarHBondContact O-N 3.24Å; A407-E466 HydrophobicContact CB-CB 4.14Å; A407-E466 HydrophobicContact CB-CG 4.32Å
408	L	91.2	Very high	91	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.7	-43.1	174.4	-71.6	169.9	0	0	0	112.2	V122 H125 M130 A404 E405 Q410 V411 I412 F434 Y496	V122-L408 HydrophobicContact CG1-CD1 4.14Å; V122-L408 HydrophobicContact CG1-CD2 4.27Å; H125-L408 HydrophobicContact CB-CD2 4.37Å; M130-L408 HydrophobicContact SD-CD2 3.85Å; M130-L408 HydrophobicContact SD-CG 3.97Å; A404-L408 WeakPolarHBondContact O-CB 3.31Å; A404-L408 VanDerWaalsContact O-CG 3.26Å; A404-L408 WeakPolarHBondContact O-CG 3.19Å; A404-L408 PolarHBondContact O-N 3.35Å; E405-L408 PolarHBondContact O-N 3.12Å; L408-Q410 VanDerWaalsContact C-N 3.29Å; L408-Q410 PolarHBondContact O-N 3.33Å; L408-V411 PolarHBondContact O-N 3.22Å; L408-I412 WeakPolarHBondContact O-CB 3.14Å; L408-I412 WeakPolarHBondContact O-CD1 3.3Å; L408-I412 WeakPolarHBondContact O-CG1 2.89Å; L408-I412 PolarHBondContact O-N 2.82Å; L408-F434 HydrophobicContact CD1-CE1 4.3Å; L408-Y496 HydrophobicContact CD1-CD2 4.05Å; L408-Y496 HydrophobicContact CD1-CE2 3.37Å
409	A	90.9	Very high	90.8	Very high	2 Å²	2	28.3 Å²	28.3	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-54.5	-47.2	175.2	0	0	0	0	0	111.2	E405 M406 K413 A431 F434 E435	E405-A409 WeakPolarHBondContact O-CB 3.49Å; E405-A409 PolarHBondContact O-N 3.38Å; M406-A409 WeakPolarHBondContact O-CB 3.26Å; M406-A409 PolarHBondContact O-N 2.86Å; A409-K413 WeakPolarHBondContact O-CB 3.28Å; A409-K413 PolarHBondContact O-N 3Å; A409-A431 WeakPolarHBondContact CB-O 3.35Å; A409-A431 WeakPolarHBondContact O-CB 3.04Å; A409-F434 HydrophobicContact CB-CB 4.02Å; A409-E435 HydrophobicContact CB-CG 4.02Å
410	Q	91.4	Very high	90.4	Very high	36 Å²	36	37.4 Å²	37.4	17%	0.168	19%	0.191	C	C	.	.	H	α-helix	trans	-62.2	-48.2	178.1	-179.4	62	16.7	0	0	112.1	M406 A407 L408 I412 K413 E414	M406-Q410 PolarHBondContact O-N 3.38Å; A407-Q410 PolarHBondContact O-N 3.41Å; L408-Q410 VanDerWaalsContact C-N 3.29Å; L408-Q410 PolarHBondContact O-N 3.33Å; Q410-I412 PolarHBondContact O-N 3.24Å; Q410-K413 WeakPolarHBondContact O-CB 3.33Å; Q410-K413 PolarHBondContact O-N 2.85Å; Q410-E414 PolarHBondContact NE2-OE1 3.48Å; Q410-E414 WeakPolarHBondContact O-CG 3.43Å; Q410-E414 PolarHBondContact O-N 2.93Å
411	V	90.2	Very high	90.1	Very high	43 Å²	43	39.7 Å²	39.7	26%	0.261	22%	0.215	S	C	.	.	H	α-helix	trans	-62.2	-44.2	-178.9	170.6	0	0	0	0	111.7	A407 L408 K413 E414 K415	A407-V411 VanDerWaalsContact O-CG2 3.3Å; A407-V411 WeakPolarHBondContact O-CG2 3.49Å; A407-V411 PolarHBondContact O-N 3.24Å; L408-V411 PolarHBondContact O-N 3.22Å; V411-K413 VanDerWaalsContact C-N 3.32Å; V411-K413 PolarHBondContact O-N 2.74Å; V411-E414 PolarHBondContact O-N 3.38Å; V411-K415 WeakPolarHBondContact O-CB 3.3Å; V411-K415 PolarHBondContact O-N 2.81Å
412	I	90.8	Very high	89.5	Confident	6 Å²	6	43.9 Å²	43.9	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-38.7	178.3	-63.7	167.7	0	0	0	110.2	V122 L408 Q410 K415 A416 Y427 V430 A431 F434	V122-I412 HydrophobicContact CG2-CD1 3.32Å; V122-I412 HydrophobicContact CG2-CG1 3.98Å; L408-I412 WeakPolarHBondContact O-CB 3.14Å; L408-I412 WeakPolarHBondContact O-CD1 3.3Å; L408-I412 WeakPolarHBondContact O-CG1 2.89Å; L408-I412 PolarHBondContact O-N 2.82Å; Q410-I412 PolarHBondContact O-N 3.24Å; I412-K415 CarbonylContact O-C 3.24Å; I412-K415 PolarHBondContact O-N 3.48Å; I412-A416 WeakPolarHBondContact O-CB 3.37Å; I412-A416 PolarHBondContact O-N 3.22Å; I412-Y427 HydrophobicContact CG2-CD1 3.9Å; I412-Y427 VanDerWaalsContact CG2-O 3.24Å; I412-Y427 WeakPolarHBondContact CG2-O 3.47Å; I412-V430 HydrophobicContact CD1-CG1 3.92Å; I412-V430 HydrophobicContact CG2-CG1 4.41Å; I412-A431 HydrophobicContact CB-CB 4.07Å; I412-A431 HydrophobicContact CG2-CB 3.98Å; I412-F434 HydrophobicContact CD1-CD2 3.63Å; I412-F434 HydrophobicContact CD1-CE2 3.3Å; I412-F434 HydrophobicContact CD1-CZ 4.33Å
413	K	90.7	Very high	89.2	Confident	74 Å²	74	48 Å²	48	32%	0.322	25%	0.25	S	C	.	.	H	α-helix	trans	-65.5	-40.7	177.8	-169.9	171.4	-171.5	159.7	0	112.5	A409 Q410 V411 A416 N417 A431	A409-K413 WeakPolarHBondContact O-CB 3.28Å; A409-K413 PolarHBondContact O-N 3Å; Q410-K413 WeakPolarHBondContact O-CB 3.33Å; Q410-K413 PolarHBondContact O-N 2.85Å; V411-K413 VanDerWaalsContact C-N 3.32Å; V411-K413 PolarHBondContact O-N 2.74Å; K413-A416 WeakPolarHBondContact O-CB 3.41Å; K413-A416 PolarHBondContact O-N 2.95Å; K413-N417 PolarHBondContact O-N 3.31Å; K413-N417 PolarHBondContact O-ND2 3.3Å; K413-A431 HydrophobicContact CB-CB 4.04Å
414	E	90.9	Very high	88.9	Confident	107 Å²	107	50 Å²	50	50%	0.5	26%	0.259	S	S	.	.	H	α-helix	trans	-62.9	-45.1	171.8	-73.7	176.1	-171.2	0	0	111.3	Q410 V411 A416 N417	Q410-E414 PolarHBondContact NE2-OE1 3.48Å; Q410-E414 WeakPolarHBondContact O-CG 3.43Å; Q410-E414 PolarHBondContact O-N 2.93Å; V411-E414 PolarHBondContact O-N 3.38Å; E414-A416 VanDerWaalsContact C-N 3.3Å; E414-A416 PolarHBondContact O-N 2.85Å; E414-N417 WeakPolarHBondContact O-CB 3.39Å; E414-N417 PolarHBondContact O-N 2.89Å; E414-N417 VanDerWaalsContact O-N 3.08Å
415	K	90.9	Very high	88.4	Confident	78 Å²	78	54.2 Å²	54.2	34%	0.339	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-37.3	175.9	-171.1	161.5	-178.3	164.3	0	112.1	D121 V411 I412 N417 S418 I419 Y427	D121-K415 HydrophobicContact CB-CD 4.4Å; D121-K415 IonicContact OD1-NZ 2.62Å; D121-K415 PolarHBondContact OD1-NZ 2.91Å; D121-K415 WeakPolarHBondContact OD2-CE 3.14Å; D121-K415 IonicContact OD2-NZ 2.86Å; D121-K415 PolarHBondContact OD2-NZ 2.96Å; V411-K415 WeakPolarHBondContact O-CB 3.3Å; V411-K415 PolarHBondContact O-N 2.81Å; I412-K415 CarbonylContact O-C 3.24Å; I412-K415 PolarHBondContact O-N 3.48Å; K415-N417 PolarHBondContact O-N 2.8Å; K415-S418 WeakPolarHBondContact O-CB 3.5Å; K415-S418 PolarHBondContact O-N 2.85Å; K415-S418 PolarHBondContact O-OG 2.92Å; K415-I419 HydrophobicContact CG-CD1 4.22Å; K415-I419 WeakPolarHBondContact O-CG1 3.36Å; K415-I419 PolarHBondContact O-N 2.91Å; K415-Y427 HydrophobicContact CD-CE1 4.25Å; K415-Y427 HydrophobicContact CG-CE1 4.28Å
416	A	90.2	Very high	88	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-29.9	175.1	0	0	0	0	0	112.5	I412 K413 E414 S418 Q424 R428	I412-A416 WeakPolarHBondContact O-CB 3.37Å; I412-A416 PolarHBondContact O-N 3.22Å; K413-A416 WeakPolarHBondContact O-CB 3.41Å; K413-A416 PolarHBondContact O-N 2.95Å; E414-A416 VanDerWaalsContact C-N 3.3Å; E414-A416 PolarHBondContact O-N 2.85Å; A416-S418 VanDerWaalsContact C-N 3.32Å; A416-Q424 VanDerWaalsContact O-CG 3.26Å; A416-Q424 WeakPolarHBondContact O-CG 3.44Å; A416-Q424 PolarHBondContact O-NE2 3.34Å; A416-R428 HydrophobicContact CB-CG 3.74Å
417	N	90.3	Very high	87.9	Confident	100 Å²	100	54.5 Å²	54.5	54%	0.535	28%	0.279	S	S	.	.	H	α-helix	trans	-73.8	-23.9	175.7	-64.8	-30.3	0	0	0	112.9	K413 E414 K415 R428	K413-N417 PolarHBondContact O-N 3.31Å; K413-N417 PolarHBondContact O-ND2 3.3Å; E414-N417 WeakPolarHBondContact O-CB 3.39Å; E414-N417 PolarHBondContact O-N 2.89Å; E414-N417 VanDerWaalsContact O-N 3.08Å; K415-N417 PolarHBondContact O-N 2.8Å; N417-R428 PolarHBondContact OD1-NH2 3.48Å
418	S	90	Very high	87.7	Confident	89 Å²	89	58.8 Å²	58.8	62%	0.622	29%	0.294	S	S	*	.	H	α-helix	trans	-82.7	-23.7	175.6	73.6	0	0	0	0	113.6	K415 A416	K415-S418 WeakPolarHBondContact O-CB 3.5Å; K415-S418 PolarHBondContact O-N 2.85Å; K415-S418 PolarHBondContact O-OG 2.92Å; A416-S418 VanDerWaalsContact C-N 3.32Å
419	I	89.1	Confident	87.3	Confident	29 Å²	29	59 Å²	59	15%	0.149	30%	0.295	C	S	.	.			trans	-81.7	131.6	179.5	-63.4	168	0	0	0	109.4	K415 Q423 Y427	K415-I419 HydrophobicContact CG-CD1 4.22Å; K415-I419 WeakPolarHBondContact O-CG1 3.36Å; K415-I419 PolarHBondContact O-N 2.91Å; I419-Q423 HydrophobicContact CG2-CB 3.9Å; I419-Y427 HydrophobicContact CD1-CD1 3.6Å; I419-Y427 HydrophobicContact CD1-CD2 3.76Å; I419-Y427 HydrophobicContact CD1-CE1 3.52Å; I419-Y427 HydrophobicContact CD1-CE2 3.66Å; I419-Y427 HydrophobicContact CD1-CG 3.72Å
420	K	83.4	Confident	87.1	Confident	197 Å²	197	59 Å²	59	86%	0.857	30%	0.295	S	S	*	.			trans	-99.5	143.6	173.5	-65.2	-175.7	-179.8	-179.7	0	110.6
421	G	82.8	Confident	86.9	Confident	48 Å²	48	57.3 Å²	57.3	50%	0.495	29%	0.288	S	S	.	.	S	Bend	trans	96.4	-170	174.2	0	0	0	0	0	113.8	Q423 Q424	G421-Q423 PolarHBondContact O-N 2.73Å; G421-Q423 VanDerWaalsContact O-N 3.11Å; G421-Q424 VanDerWaalsContact O-CB 3.26Å; G421-Q424 WeakPolarHBondContact O-CB 3.34Å; G421-Q424 PolarHBondContact O-N 2.72Å
422	E	76.4	Confident	86.7	Confident	105 Å²	105	58.6 Å²	58.6	49%	0.491	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-29	-172.9	-72.3	178.2	-170.3	0	0	114.2	M106 Q424 F425	M106-E422 HydrophobicContact CE-CB 3.55Å; M106-E422 HydrophobicContact CE-CG 3.74Å; M106-E422 HydrophobicContact SD-CB 4.33Å; E422-Q424 PolarHBondContact O-N 3.06Å; E422-F425 PolarHBondContact O-N 3.21Å
423	Q	83.1	Confident	86.5	Confident	86 Å²	86	58.4 Å²	58.4	40%	0.402	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-29	178	-62.5	-173.3	-24.1	0	0	113.1	A114 I419 G421 F425 V426 Y427	A114-Q423 HydrophobicContact CB-CB 4.17Å; A114-Q423 HydrophobicContact CB-CG 4.09Å; I419-Q423 HydrophobicContact CG2-CB 3.9Å; G421-Q423 PolarHBondContact O-N 2.73Å; G421-Q423 VanDerWaalsContact O-N 3.11Å; Q423-F425 PolarHBondContact O-N 3.41Å; Q423-V426 PolarHBondContact O-N 2.95Å; Q423-Y427 WeakPolarHBondContact O-CD2 3.36Å; Q423-Y427 PolarHBondContact O-N 2.95Å
424	Q	87	Confident	86.4	Confident	41 Å²	41	55.3 Å²	55.3	19%	0.192	28%	0.279	C	S	.	.	H	α-helix	trans	-55.2	-41.2	177.7	169.5	168.6	50.2	0	0	111.7	A416 G421 E422 Y427 R428	A416-Q424 VanDerWaalsContact O-CG 3.26Å; A416-Q424 WeakPolarHBondContact O-CG 3.44Å; A416-Q424 PolarHBondContact O-NE2 3.34Å; G421-Q424 VanDerWaalsContact O-CB 3.26Å; G421-Q424 WeakPolarHBondContact O-CB 3.34Å; G421-Q424 PolarHBondContact O-N 2.72Å; E422-Q424 PolarHBondContact O-N 3.06Å; Q424-Y427 PolarHBondContact O-N 3.05Å; Q424-R428 WeakPolarHBondContact O-CG 3.44Å; Q424-R428 PolarHBondContact O-N 3.17Å; Q424-R428 VanDerWaalsContact O-N 3.08Å
425	F	82.2	Confident	86.3	Confident	90 Å²	90	50.5 Å²	50.5	40%	0.395	26%	0.256	S	S	.	.	H	α-helix	trans	-68.5	-38.8	-177.6	-64	-73	0	0	0	112	F101 E422 Q423 R428 A429	F101-F425 HydrophobicContact CD1-CB 4.43Å; F101-F425 HydrophobicContact CD2-CB 4.31Å; F101-F425 HydrophobicContact CE1-CB 3.72Å; F101-F425 HydrophobicContact CE1-CD1 4.06Å; F101-F425 AromaticContact CE1-CG 3.88Å; F101-F425 HydrophobicContact CE1-CG 3.88Å; F101-F425 HydrophobicContact CE2-CB 3.64Å; F101-F425 HydrophobicContact CZ-CB 3.37Å; F101-F425 HydrophobicContact CZ-CD1 4.11Å; F101-F425 AromaticContact CZ-CG 3.95Å; F101-F425 HydrophobicContact CZ-CG 3.95Å; E422-F425 PolarHBondContact O-N 3.21Å; Q423-F425 PolarHBondContact O-N 3.41Å; F425-R428 PolarHBondContact O-N 2.58Å; F425-A429 PolarHBondContact O-N 2.82Å
426	V	83.7	Confident	86.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-66.8	-41.2	176.5	-174.3	0	0	0	0	110.8	I111 A114 L115 Q423 R428 A429 V430	I111-V426 HydrophobicContact CG1-CG2 4.35Å; I111-V426 HydrophobicContact CG2-CG1 4.2Å; I111-V426 HydrophobicContact CG2-CG2 4.36Å; A114-V426 HydrophobicContact CB-CB 3.7Å; A114-V426 HydrophobicContact CB-CG1 3.74Å; A114-V426 HydrophobicContact CB-CG2 4.01Å; L115-V426 HydrophobicContact CD2-CG1 3.8Å; L115-V426 HydrophobicContact CG-CG1 3.94Å; Q423-V426 PolarHBondContact O-N 2.95Å; V426-R428 VanDerWaalsContact C-N 3.33Å; V426-R428 PolarHBondContact O-N 3.38Å; V426-A429 WeakPolarHBondContact O-CB 3.42Å; V426-A429 PolarHBondContact O-N 2.64Å; V426-V430 VanDerWaalsContact O-CG2 3.32Å; V426-V430 WeakPolarHBondContact O-CG2 3.46Å; V426-V430 PolarHBondContact O-N 3.18Å
427	Y	88.4	Confident	86.1	Confident	8 Å²	8	47.7 Å²	47.7	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-40.3	174.7	-92	-112	0	0	0	112.3	A117 A118 D121 I412 K415 I419 Q423 Q424 V430 A431	A117-Y427 HydrophobicContact CB-CE2 4.28Å; A117-Y427 VanDerWaalsContact CB-OH 3.26Å; A117-Y427 WeakPolarHBondContact CB-OH 3.48Å; A117-Y427 PolarHBondContact O-OH 2.69Å; A118-Y427 HydrophobicContact CB-CD1 4.37Å; A118-Y427 HydrophobicContact CB-CD2 4.35Å; A118-Y427 HydrophobicContact CB-CE1 4.06Å; A118-Y427 HydrophobicContact CB-CE2 4.04Å; A118-Y427 PolarHBondContact N-OH 3.09Å; D121-Y427 WeakPolarHBondContact OD2-CE1 2.9Å; D121-Y427 PolarHBondContact OD2-OH 3.46Å; I412-Y427 HydrophobicContact CG2-CD1 3.9Å; I412-Y427 VanDerWaalsContact CG2-O 3.24Å; I412-Y427 WeakPolarHBondContact CG2-O 3.47Å; K415-Y427 HydrophobicContact CD-CE1 4.25Å; K415-Y427 HydrophobicContact CG-CE1 4.28Å; I419-Y427 HydrophobicContact CD1-CD1 3.6Å; I419-Y427 HydrophobicContact CD1-CD2 3.76Å; I419-Y427 HydrophobicContact CD1-CE1 3.52Å; I419-Y427 HydrophobicContact CD1-CE2 3.66Å; I419-Y427 HydrophobicContact CD1-CG 3.72Å; Q423-Y427 WeakPolarHBondContact O-CD2 3.36Å; Q423-Y427 PolarHBondContact O-N 2.95Å; Q424-Y427 PolarHBondContact O-N 3.05Å; Y427-V430 PolarHBondContact O-N 3.35Å; Y427-A431 PolarHBondContact O-N 2.79Å
428	R	87.4	Confident	86.2	Confident	93 Å²	93	42.9 Å²	42.9	35%	0.351	22%	0.219	S	C	.	.	H	α-helix	trans	-64.6	-42	174.9	-73.2	-179.3	177.9	170	-0	112	A416 N417 Q424 F425 V426 V430 A431 D432	A416-R428 HydrophobicContact CB-CG 3.74Å; N417-R428 PolarHBondContact OD1-NH2 3.48Å; Q424-R428 WeakPolarHBondContact O-CG 3.44Å; Q424-R428 PolarHBondContact O-N 3.17Å; Q424-R428 VanDerWaalsContact O-N 3.08Å; F425-R428 PolarHBondContact O-N 2.58Å; V426-R428 VanDerWaalsContact C-N 3.33Å; V426-R428 PolarHBondContact O-N 3.38Å; R428-V430 VanDerWaalsContact C-N 3.33Å; R428-V430 PolarHBondContact O-N 3.2Å; R428-A431 WeakPolarHBondContact O-CB 3.19Å; R428-A431 PolarHBondContact O-N 3.24Å; R428-D432 PolarHBondContact O-N 3.06Å
429	A	83.7	Confident	86.2	Confident	5 Å²	5	42.2 Å²	42.2	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-58.3	-45.1	174.6	0	0	0	0	0	111.8	A97 F425 V426 A431 D432 A433	A97-A429 HydrophobicContact CB-CB 3.47Å; A97-A429 VanDerWaalsContact CB-CB 3.47Å; F425-A429 PolarHBondContact O-N 2.82Å; V426-A429 WeakPolarHBondContact O-CB 3.42Å; V426-A429 PolarHBondContact O-N 2.64Å; A429-A431 VanDerWaalsContact C-N 3.34Å; A429-A431 PolarHBondContact O-N 2.96Å; A429-D432 PolarHBondContact O-N 3.07Å; A429-A433 WeakPolarHBondContact O-CB 3.29Å; A429-A433 PolarHBondContact O-N 3.05Å
430	V	86.1	Confident	86.3	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-44.7	174.8	173	0	0	0	0	111.2	I94 L115 A118 I412 V426 Y427 R428 A433 F434	I94-V430 HydrophobicContact CD1-CB 4.31Å; I94-V430 HydrophobicContact CD1-CG2 3.7Å; I94-V430 HydrophobicContact CG1-CG2 4.05Å; L115-V430 HydrophobicContact CD2-CG2 3.48Å; L115-V430 VanDerWaalsContact CD2-CG2 3.48Å; A118-V430 HydrophobicContact CB-CG1 4.39Å; A118-V430 HydrophobicContact CB-CG2 4.23Å; I412-V430 HydrophobicContact CD1-CG1 3.92Å; I412-V430 HydrophobicContact CG2-CG1 4.41Å; V426-V430 VanDerWaalsContact O-CG2 3.32Å; V426-V430 WeakPolarHBondContact O-CG2 3.46Å; V426-V430 PolarHBondContact O-N 3.18Å; Y427-V430 PolarHBondContact O-N 3.35Å; R428-V430 VanDerWaalsContact C-N 3.33Å; R428-V430 PolarHBondContact O-N 3.2Å; V430-A433 PolarHBondContact O-N 3.21Å; V430-F434 HydrophobicContact CG1-CD2 4.04Å; V430-F434 HydrophobicContact CG1-CE2 3.57Å; V430-F434 WeakPolarHBondContact O-CD2 3.42Å; V430-F434 PolarHBondContact O-N 2.92Å
431	A	88.3	Confident	86.6	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.008	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-45.4	178.4	0	0	0	0	0	112.7	A409 I412 K413 Y427 R428 A429 A433 F434	A409-A431 WeakPolarHBondContact CB-O 3.35Å; A409-A431 WeakPolarHBondContact O-CB 3.04Å; I412-A431 HydrophobicContact CB-CB 4.07Å; I412-A431 HydrophobicContact CG2-CB 3.98Å; K413-A431 HydrophobicContact CB-CB 4.04Å; Y427-A431 PolarHBondContact O-N 2.79Å; R428-A431 WeakPolarHBondContact O-CB 3.19Å; R428-A431 PolarHBondContact O-N 3.24Å; A429-A431 VanDerWaalsContact C-N 3.34Å; A429-A431 PolarHBondContact O-N 2.96Å; A431-A433 VanDerWaalsContact C-N 3.26Å; A431-A433 PolarHBondContact O-N 3.21Å; A431-F434 PolarHBondContact O-N 2.86Å
432	D	86.3	Confident	87.1	Confident	71 Å²	71	29.9 Å²	29.9	38%	0.38	14%	0.135	S	C	.	.	H	α-helix	trans	-64.7	-34.3	179.1	-70.3	-30.3	0	0	0	111.4	R428 A429 E435	R428-D432 PolarHBondContact O-N 3.06Å; A429-D432 PolarHBondContact O-N 3.07Å; D432-E435 WeakPolarHBondContact O-CB 3.33Å; D432-E435 PolarHBondContact O-N 3.39Å
433	A	85.5	Confident	87.7	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.008	13%	0.13	C	C	.	.	H	α-helix	trans	-68.8	-39.5	-178.5	0	0	0	0	0	112.5	D90 E93 I94 A429 V430 A431 E435 I436	D90-A433 HydrophobicContact CB-CB 3.43Å; D90-A433 VanDerWaalsContact CB-CB 3.43Å; D90-A433 VanDerWaalsContact CG-CB 3.48Å; D90-A433 VanDerWaalsContact CG-O 3.26Å; E93-A433 HydrophobicContact CB-CB 4.47Å; I94-A433 HydrophobicContact CD1-CB 4.44Å; I94-A433 HydrophobicContact CG1-CB 3.93Å; A429-A433 WeakPolarHBondContact O-CB 3.29Å; A429-A433 PolarHBondContact O-N 3.05Å; V430-A433 PolarHBondContact O-N 3.21Å; A431-A433 VanDerWaalsContact C-N 3.26Å; A431-A433 PolarHBondContact O-N 3.21Å; A433-E435 PolarHBondContact O-N 2.74Å; A433-I436 WeakPolarHBondContact O-CB 3.39Å; A433-I436 VanDerWaalsContact O-CG2 3.29Å; A433-I436 WeakPolarHBondContact O-CG2 3.37Å; A433-I436 PolarHBondContact O-N 2.68Å
434	F	88.4	Confident	88	Confident	9 Å²	9	26 Å²	26	4%	0.039	12%	0.118	C	C	.	.	H	α-helix	trans	-52.9	-28.1	173.1	-83	-69.1	0	0	0	113.5	L87 V122 E405 L408 A409 I412 V430 A431 I436 Y496	L87-F434 HydrophobicContact CD2-CD1 4.38Å; V122-F434 HydrophobicContact CG1-CZ 4.06Å; V122-F434 HydrophobicContact CG2-CE2 3.97Å; V122-F434 HydrophobicContact CG2-CZ 3.99Å; E405-F434 HydrophobicContact CB-CB 4.36Å; E405-F434 HydrophobicContact CB-CD1 4.36Å; E405-F434 WeakPolarHBondContact CB-O 3.3Å; E405-F434 HydrophobicContact CG-CD1 4.26Å; L408-F434 HydrophobicContact CD1-CE1 4.3Å; A409-F434 HydrophobicContact CB-CB 4.02Å; I412-F434 HydrophobicContact CD1-CD2 3.63Å; I412-F434 HydrophobicContact CD1-CE2 3.3Å; I412-F434 HydrophobicContact CD1-CZ 4.33Å; V430-F434 HydrophobicContact CG1-CD2 4.04Å; V430-F434 HydrophobicContact CG1-CE2 3.57Å; V430-F434 WeakPolarHBondContact O-CD2 3.42Å; V430-F434 PolarHBondContact O-N 2.92Å; A431-F434 PolarHBondContact O-N 2.86Å; F434-I436 PolarHBondContact O-N 2.83Å; F434-Y496 HydrophobicContact CD1-CD1 4.47Å; F434-Y496 HydrophobicContact CD1-CE1 4.25Å; F434-Y496 AromaticContact CE1-CD1 3.56Å; F434-Y496 HydrophobicContact CE1-CD1 3.56Å; F434-Y496 HydrophobicContact CE1-CD2 4.37Å; F434-Y496 AromaticContact CE1-CE1 3.69Å; F434-Y496 HydrophobicContact CE1-CE1 3.69Å; F434-Y496 HydrophobicContact CE1-CE2 4.49Å; F434-Y496 AromaticContact CE1-CG 3.93Å; F434-Y496 HydrophobicContact CE1-CG 3.93Å; F434-Y496 HydrophobicContact CZ-CD1 4.36Å; F434-Y496 HydrophobicContact CZ-CG 4.35Å
435	E	89.2	Confident	88.1	Confident	7 Å²	7	24.5 Å²	24.5	3%	0.033	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-8.3	178.3	-53.6	-168.6	-175.7	0	0	114.7	M406 A409 D432 A433 I437 P438 R439 R457	M406-E435 HydrophobicContact CE-CG 4.26Å; M406-E435 HydrophobicContact SD-CB 4.16Å; M406-E435 HydrophobicContact SD-CG 3.84Å; A409-E435 HydrophobicContact CB-CG 4.02Å; D432-E435 WeakPolarHBondContact O-CB 3.33Å; D432-E435 PolarHBondContact O-N 3.39Å; A433-E435 PolarHBondContact O-N 2.74Å; E435-I437 PolarHBondContact O-N 2.88Å; E435-P438 WeakPolarHBondContact O-CD 3.26Å; E435-P438 VanDerWaalsContact O-CG 3.28Å; E435-P438 WeakPolarHBondContact O-CG 3.28Å; E435-R439 VanDerWaalsContact O-CB 3.25Å; E435-R439 WeakPolarHBondContact O-CB 3.39Å; E435-R439 PolarHBondContact O-N 2.93Å; E435-R457 VanDerWaalsContact CD-NH2 3.28Å; E435-R457 IonicContact OE1-CZ 3.14Å; E435-R457 IonicContact OE1-NE 3.06Å; E435-R457 PolarHBondContact OE1-NE 2.75Å; E435-R457 IonicContact OE1-NH2 2.73Å; E435-R457 PolarHBondContact OE1-NH2 2.86Å; E435-R457 IonicContact OE2-CZ 2.89Å; E435-R457 IonicContact OE2-NE 2.72Å; E435-R457 PolarHBondContact OE2-NE 3.07Å; E435-R457 IonicContact OE2-NH2 3.3Å; E435-R457 PolarHBondContact OE2-NH2 3.4Å
436	I	87.4	Confident	88.4	Confident	14 Å²	14	23.6 Å²	23.6	7%	0.072	13%	0.128	C	C	.	.	H	α-helix	trans	-64.3	-32	179.4	-160.4	54.3	0	0	0	112.1	I86 L87 D90 A433 F434 R439 T440	I86-I436 HydrophobicContact CG2-CG1 4.25Å; I86-I436 HydrophobicContact CG2-CG2 3.76Å; L87-I436 HydrophobicContact CD2-CG2 4.39Å; D90-I436 WeakPolarHBondContact OD1-CG2 2.99Å; D90-I436 VanDerWaalsContact OD2-CG2 3.22Å; D90-I436 WeakPolarHBondContact OD2-CG2 3.4Å; A433-I436 WeakPolarHBondContact O-CB 3.39Å; A433-I436 VanDerWaalsContact O-CG2 3.29Å; A433-I436 WeakPolarHBondContact O-CG2 3.37Å; A433-I436 PolarHBondContact O-N 2.68Å; F434-I436 PolarHBondContact O-N 2.83Å; I436-R439 HydrophobicContact CD1-CB 4.45Å; I436-R439 WeakPolarHBondContact O-CB 3.48Å; I436-R439 PolarHBondContact O-N 2.92Å; I436-T440 VanDerWaalsContact O-CB 3.25Å; I436-T440 WeakPolarHBondContact O-CB 3.35Å; I436-T440 PolarHBondContact O-N 3.13Å; I436-T440 PolarHBondContact O-OG1 3.37Å
437	I	89.2	Confident	88.7	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-65.4	-57.6	-178.5	-66.8	-62.9	0	0	0	110.4	L27 I86 L87 E405 E435 R439 T440 L441	L27-I437 HydrophobicContact CD2-CD1 3.68Å; L27-I437 HydrophobicContact CD2-CG2 4.31Å; I86-I437 HydrophobicContact CB-CD1 4.3Å; I86-I437 HydrophobicContact CG2-CD1 3.95Å; L87-I437 HydrophobicContact CD1-CD1 4.33Å; L87-I437 HydrophobicContact CD1-CG1 4.24Å; L87-I437 HydrophobicContact CD2-CD1 4.14Å; L87-I437 HydrophobicContact CD2-CG1 3.56Å; L87-I437 HydrophobicContact CG-CD1 3.95Å; L87-I437 HydrophobicContact CG-CG1 3.91Å; E405-I437 HydrophobicContact CG-CB 4.08Å; E405-I437 HydrophobicContact CG-CG1 4.19Å; E405-I437 HydrophobicContact CG-CG2 4.28Å; E435-I437 PolarHBondContact O-N 2.88Å; I437-R439 PolarHBondContact O-N 2.88Å; I437-T440 PolarHBondContact O-N 3.08Å; I437-T440 VanDerWaalsContact O-N 3.17Å; I437-L441 WeakPolarHBondContact O-CG 3.5Å; I437-L441 PolarHBondContact O-N 2.98Å
438	P	91.7	Very high	88.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-35.1	173.3	19.3	-29	0	0	0	112.2	M406 E435 T440 L441 L442 L456 I470	M406-P438 HydrophobicContact CG-CB 4.35Å; M406-P438 HydrophobicContact CG-CG 3.8Å; M406-P438 HydrophobicContact SD-CB 4.42Å; M406-P438 HydrophobicContact SD-CG 3.59Å; M406-P438 VanDerWaalsContact SD-CG 3.59Å; E435-P438 WeakPolarHBondContact O-CD 3.26Å; E435-P438 VanDerWaalsContact O-CG 3.28Å; E435-P438 WeakPolarHBondContact O-CG 3.28Å; P438-T440 PolarHBondContact O-N 2.86Å; P438-L441 PolarHBondContact O-N 2.82Å; P438-L442 WeakPolarHBondContact O-CG 3.35Å; P438-L442 PolarHBondContact O-N 2.8Å; P438-L456 HydrophobicContact CB-CD2 4.41Å; P438-I470 HydrophobicContact CB-CD1 3.47Å; P438-I470 VanDerWaalsContact CB-CD1 3.47Å; P438-I470 HydrophobicContact CB-CG1 4.19Å; P438-I470 WeakPolarHBondContact O-CD1 3.35Å
439	R	91.6	Very high	88.9	Confident	74 Å²	74	26 Å²	26	28%	0.279	15%	0.152	S	C	.	.	H	α-helix	trans	-59.9	-44.8	174.3	-170.7	178.6	-64.7	-86	-1.9	113	E435 I436 I437 L442 Q443 I449 I453	E435-R439 VanDerWaalsContact O-CB 3.25Å; E435-R439 WeakPolarHBondContact O-CB 3.39Å; E435-R439 PolarHBondContact O-N 2.93Å; I436-R439 HydrophobicContact CD1-CB 4.45Å; I436-R439 WeakPolarHBondContact O-CB 3.48Å; I436-R439 PolarHBondContact O-N 2.92Å; I437-R439 PolarHBondContact O-N 2.88Å; R439-L442 PolarHBondContact O-N 2.84Å; R439-Q443 WeakPolarHBondContact O-CB 3.44Å; R439-Q443 PolarHBondContact O-N 3.1Å; R439-I449 HydrophobicContact CG-CG2 3.55Å; R439-I453 HydrophobicContact CB-CD1 3.52Å; R439-I453 HydrophobicContact CG-CD1 3.72Å
440	T	89.6	Confident	89.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-40.4	179.5	-61.2	0	0	0	0	110.7	R24 L27 I436 I437 P438 L442 Q443 N444	R24-T440 HydrophobicContact CG-CG2 3.5Å; R24-T440 WeakPolarHBondContact O-CG2 3.46Å; L27-T440 HydrophobicContact CB-CG2 4.04Å; L27-T440 HydrophobicContact CD2-CG2 3.95Å; I436-T440 VanDerWaalsContact O-CB 3.25Å; I436-T440 WeakPolarHBondContact O-CB 3.35Å; I436-T440 PolarHBondContact O-N 3.13Å; I436-T440 PolarHBondContact O-OG1 3.37Å; I437-T440 PolarHBondContact O-N 3.08Å; I437-T440 VanDerWaalsContact O-N 3.17Å; P438-T440 PolarHBondContact O-N 2.86Å; T440-L442 VanDerWaalsContact C-N 3.35Å; T440-L442 PolarHBondContact O-N 3.37Å; T440-Q443 WeakPolarHBondContact O-CB 3.33Å; T440-Q443 PolarHBondContact O-N 3Å; T440-N444 PolarHBondContact O-N 2.8Å
441	L	90.7	Very high	89.6	Confident	16 Å²	16	40 Å²	40	8%	0.084	21%	0.212	C	C	.	.	H	α-helix	trans	-60.1	-43.4	173.7	-67.5	176.1	0	0	0	111.9	L27 G28 I437 P438 N444 S445	L27-L441 HydrophobicContact CG-CD2 4.32Å; G28-L441 VanDerWaalsContact CA-CD2 3.49Å; I437-L441 WeakPolarHBondContact O-CG 3.5Å; I437-L441 PolarHBondContact O-N 2.98Å; P438-L441 PolarHBondContact O-N 2.82Å; L441-N444 PolarHBondContact O-N 2.86Å; L441-S445 WeakPolarHBondContact O-CB 3.31Å; L441-S445 PolarHBondContact O-N 3Å; L441-S445 PolarHBondContact O-OG 2.96Å
442	L	92.3	Very high	89.7	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-44	175.3	-73.3	166.8	0	0	0	112	P438 R439 T440 N444 S445 G446 A447 I449 V452 I453 I470 G475	P438-L442 WeakPolarHBondContact O-CG 3.35Å; P438-L442 PolarHBondContact O-N 2.8Å; R439-L442 PolarHBondContact O-N 2.84Å; T440-L442 VanDerWaalsContact C-N 3.35Å; T440-L442 PolarHBondContact O-N 3.37Å; L442-N444 VanDerWaalsContact C-N 3.33Å; L442-N444 PolarHBondContact O-N 3.09Å; L442-S445 WeakPolarHBondContact CA-OG 3.24Å; L442-S445 PolarHBondContact O-N 2.64Å; L442-S445 PolarHBondContact O-OG 2.99Å; L442-G446 PolarHBondContact O-N 2.92Å; L442-G446 VanDerWaalsContact O-N 3.09Å; L442-A447 HydrophobicContact CD2-CB 3.87Å; L442-A447 PolarHBondContact O-N 2.9Å; L442-I449 HydrophobicContact CB-CG1 4.09Å; L442-V452 HydrophobicContact CD1-CB 3.84Å; L442-V452 HydrophobicContact CD1-CG1 3.93Å; L442-V452 HydrophobicContact CD2-CB 3.93Å; L442-V452 HydrophobicContact CD2-CG1 3.72Å; L442-V452 HydrophobicContact CD2-CG2 4.26Å; L442-V452 HydrophobicContact CG-CG1 4.46Å; L442-I453 HydrophobicContact CD1-CD1 4.3Å; L442-I453 HydrophobicContact CD1-CG1 3.62Å; L442-I470 HydrophobicContact CD1-CD1 3.48Å; L442-I470 VanDerWaalsContact CD1-CD1 3.48Å; L442-I470 HydrophobicContact CD2-CD1 3.92Å; L442-I470 HydrophobicContact CD2-CG2 3.58Å; L442-I470 HydrophobicContact CG-CD1 3.45Å; L442-I470 VanDerWaalsContact CG-CD1 3.45Å; L442-I470 HydrophobicContact CG-CG2 3.97Å; L442-G475 WeakPolarHBondContact CD2-O 3.22Å
443	Q	90.8	Very high	90	Very high	81 Å²	81	37.3 Å²	37.3	38%	0.379	20%	0.197	S	C	.	.	H	α-helix	trans	-57.8	-47.1	177.8	-175.1	174.9	-0.4	0	0	111.1	R439 T440 S445 G446 I449	R439-Q443 WeakPolarHBondContact O-CB 3.44Å; R439-Q443 PolarHBondContact O-N 3.1Å; T440-Q443 WeakPolarHBondContact O-CB 3.33Å; T440-Q443 PolarHBondContact O-N 3Å; Q443-S445 VanDerWaalsContact C-N 3.32Å; Q443-S445 PolarHBondContact O-N 2.81Å; Q443-G446 PolarHBondContact O-N 2.84Å; Q443-I449 HydrophobicContact CB-CD1 3.77Å; Q443-I449 HydrophobicContact CG-CD1 4.15Å
444	N	89.2	Confident	90.3	Very high	27 Å²	27	41.2 Å²	41.2	14%	0.144	22%	0.221	C	C	.	.	H	α-helix	trans	-71.3	-26.7	179.4	-65.2	-16.5	0	0	0	112.5	R24 L27 T440 L441 L442 G446	R24-N444 PolarHBondContact O-ND2 3.21Å; L27-N444 PolarHBondContact O-ND2 2.86Å; T440-N444 PolarHBondContact O-N 2.8Å; L441-N444 PolarHBondContact O-N 2.86Å; L442-N444 VanDerWaalsContact C-N 3.33Å; L442-N444 PolarHBondContact O-N 3.09Å; N444-G446 VanDerWaalsContact C-N 3.33Å
445	S	88.7	Confident	90.5	Very high	10 Å²	10	42.4 Å²	42.4	7%	0.07	23%	0.233	C	C	.	.	H	α-helix	trans	-74.5	-19.8	173.1	73.6	0	0	0	0	114.4	R30 L441 L442 Q443 A447 G472 G475	R30-S445 PolarHBondContact NH1-O 3.43Å; R30-S445 VanDerWaalsContact NH1-O 3.15Å; L441-S445 WeakPolarHBondContact O-CB 3.31Å; L441-S445 PolarHBondContact O-N 3Å; L441-S445 PolarHBondContact O-OG 2.96Å; L442-S445 WeakPolarHBondContact CA-OG 3.24Å; L442-S445 PolarHBondContact O-N 2.64Å; L442-S445 PolarHBondContact O-OG 2.99Å; Q443-S445 VanDerWaalsContact C-N 3.32Å; Q443-S445 PolarHBondContact O-N 2.81Å; S445-A447 WeakPolarHBondContact OG-CB 3.43Å; S445-A447 PolarHBondContact OG-N 3.08Å; S445-G472 WeakPolarHBondContact CB-O 3.32Å; S445-G475 VanDerWaalsContact OG-CA 3.3Å; S445-G475 WeakPolarHBondContact OG-CA 2.93Å
446	G	88.8	Confident	90.6	Very high	71 Å²	71	42 Å²	42	73%	0.732	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	19.5	-174.7	0	0	0	0	0	114.8	L442 Q443 N444	L442-G446 PolarHBondContact O-N 2.92Å; L442-G446 VanDerWaalsContact O-N 3.09Å; Q443-G446 PolarHBondContact O-N 2.84Å; N444-G446 VanDerWaalsContact C-N 3.33Å
447	A	89.1	Confident	90.8	Very high	28 Å²	28	45.3 Å²	45.3	23%	0.231	24%	0.243	C	C	.	.			trans	-87.8	165.4	-178.3	0	0	0	0	0	112.9	L442 S445 I449	L442-A447 HydrophobicContact CD2-CB 3.87Å; L442-A447 PolarHBondContact O-N 2.9Å; S445-A447 WeakPolarHBondContact OG-CB 3.43Å; S445-A447 PolarHBondContact OG-N 3.08Å; A447-I449 PolarHBondContact O-N 2.9Å
448	D	90.2	Very high	90.9	Very high	84 Å²	84	47.9 Å²	47.9	45%	0.449	26%	0.264	S	S	.	.			trans	-71.4	98.4	172.5	-175.8	-19	0	0	0	110.5	I450 R451 V452	D448-I450 VanDerWaalsContact C-N 3.35Å; D448-I450 PolarHBondContact O-N 2.86Å; D448-I450 PolarHBondContact OD1-N 3.28Å; D448-R451 HydrophobicContact CB-CB 4.19Å; D448-R451 PolarHBondContact OD1-N 2.96Å; D448-V452 WeakPolarHBondContact O-CG2 3.44Å; D448-V452 PolarHBondContact O-N 3.21Å; D448-V452 VanDerWaalsContact O-N 3.13Å
449	I	90.3	Very high	90.9	Very high	42 Å²	42	51.7 Å²	51.7	22%	0.215	28%	0.281	C	S	.	.	H	α-helix	trans	-55.9	-47.4	-175.9	-59.9	172.8	0	0	0	111.7	R439 L442 Q443 A447 I453	R439-I449 HydrophobicContact CG-CG2 3.55Å; L442-I449 HydrophobicContact CB-CG1 4.09Å; Q443-I449 HydrophobicContact CB-CD1 3.77Å; Q443-I449 HydrophobicContact CG-CD1 4.15Å; A447-I449 PolarHBondContact O-N 2.9Å; I449-I453 HydrophobicContact CG2-CD1 3.83Å; I449-I453 HydrophobicContact CG2-CG1 4.48Å; I449-I453 WeakPolarHBondContact O-CB 3.34Å; I449-I453 WeakPolarHBondContact O-CG1 3.34Å; I449-I453 PolarHBondContact O-N 2.68Å
450	I	91	Very high	90.8	Very high	123 Å²	123	48.9 Å²	48.9	63%	0.631	27%	0.271	S	S	*	.	H	α-helix	trans	-69	-46.5	-170.7	-61.3	174.2	0	0	0	109.6	D448 T454	D448-I450 VanDerWaalsContact C-N 3.35Å; D448-I450 PolarHBondContact O-N 2.86Å; D448-I450 PolarHBondContact OD1-N 3.28Å; I450-T454 WeakPolarHBondContact O-CB 3.49Å; I450-T454 PolarHBondContact O-N 2.72Å; I450-T454 VanDerWaalsContact O-N 3.13Å; I450-T454 PolarHBondContact O-OG1 3.42Å
451	R	92.7	Very high	90.8	Very high	178 Å²	178	53 Å²	53	67%	0.672	30%	0.296	S	S	*	.	H	α-helix	trans	-63.3	-46.7	-179.1	-171	-178.3	73.1	175.7	2.5	111.6	D448 A455	D448-R451 HydrophobicContact CB-CB 4.19Å; D448-R451 PolarHBondContact OD1-N 2.96Å; R451-A455 WeakPolarHBondContact O-CB 3.47Å; R451-A455 PolarHBondContact O-N 2.86Å; R451-A455 VanDerWaalsContact O-N 3.15Å
452	V	91.8	Very high	90.6	Very high	12 Å²	12	58.2 Å²	58.2	7%	0.073	32%	0.32	C	S	.	.	H	α-helix	trans	-72.4	-43.5	-174.6	-179.2	0	0	0	0	111.5	L442 D448 T454 A455 L456 M477	L442-V452 HydrophobicContact CD1-CB 3.84Å; L442-V452 HydrophobicContact CD1-CG1 3.93Å; L442-V452 HydrophobicContact CD2-CB 3.93Å; L442-V452 HydrophobicContact CD2-CG1 3.72Å; L442-V452 HydrophobicContact CD2-CG2 4.26Å; L442-V452 HydrophobicContact CG-CG1 4.46Å; D448-V452 WeakPolarHBondContact O-CG2 3.44Å; D448-V452 PolarHBondContact O-N 3.21Å; D448-V452 VanDerWaalsContact O-N 3.13Å; V452-T454 VanDerWaalsContact C-N 3.34Å; V452-T454 PolarHBondContact O-N 2.94Å; V452-A455 PolarHBondContact O-N 3.41Å; V452-L456 VanDerWaalsContact O-CB 3.3Å; V452-L456 WeakPolarHBondContact O-CB 3.31Å; V452-L456 PolarHBondContact O-N 3.49Å; V452-M477 HydrophobicContact CG1-CG 3.87Å
453	I	91.7	Very high	89.9	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-62.1	-42.7	176.5	-71.2	-177.1	0	0	0	111.4	R439 L442 I449 A455 L456 R457	R439-I453 HydrophobicContact CB-CD1 3.52Å; R439-I453 HydrophobicContact CG-CD1 3.72Å; L442-I453 HydrophobicContact CD1-CD1 4.3Å; L442-I453 HydrophobicContact CD1-CG1 3.62Å; I449-I453 HydrophobicContact CG2-CD1 3.83Å; I449-I453 HydrophobicContact CG2-CG1 4.48Å; I449-I453 WeakPolarHBondContact O-CB 3.34Å; I449-I453 WeakPolarHBondContact O-CG1 3.34Å; I449-I453 PolarHBondContact O-N 2.68Å; I453-A455 VanDerWaalsContact C-N 3.31Å; I453-A455 PolarHBondContact O-N 3.46Å; I453-L456 PolarHBondContact O-N 3.11Å; I453-L456 VanDerWaalsContact O-N 3.16Å; I453-R457 HydrophobicContact CG2-CG 4.22Å; I453-R457 WeakPolarHBondContact O-CG 3.31Å; I453-R457 PolarHBondContact O-N 3.15Å
454	T	92.4	Very high	89.4	Confident	83 Å²	83	62.4 Å²	62.4	51%	0.509	37%	0.374	S	S	.	.	H	α-helix	trans	-61.6	-42.8	179.4	-55.8	0	0	0	0	111	I450 V452 A458	I450-T454 WeakPolarHBondContact O-CB 3.49Å; I450-T454 PolarHBondContact O-N 2.72Å; I450-T454 VanDerWaalsContact O-N 3.13Å; I450-T454 PolarHBondContact O-OG1 3.42Å; V452-T454 VanDerWaalsContact C-N 3.34Å; V452-T454 PolarHBondContact O-N 2.94Å; T454-A458 PolarHBondContact O-N 2.89Å
455	A	92.3	Very high	89.1	Confident	34 Å²	34	63.5 Å²	63.5	28%	0.281	38%	0.38	S	S	.	.	H	α-helix	trans	-66.5	-37.7	174.9	0	0	0	0	0	112.5	R451 V452 I453 A458 K459 M477	R451-A455 WeakPolarHBondContact O-CB 3.47Å; R451-A455 PolarHBondContact O-N 2.86Å; R451-A455 VanDerWaalsContact O-N 3.15Å; V452-A455 PolarHBondContact O-N 3.41Å; I453-A455 VanDerWaalsContact C-N 3.31Å; I453-A455 PolarHBondContact O-N 3.46Å; A455-A458 PolarHBondContact O-N 3.28Å; A455-K459 WeakPolarHBondContact O-CG 3.39Å; A455-K459 PolarHBondContact O-N 3.36Å; A455-K459 VanDerWaalsContact O-N 3.14Å; A455-M477 HydrophobicContact CB-CE 3.63Å; A455-M477 HydrophobicContact CB-SD 4.02Å
456	L	91.7	Very high	88.9	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-66.4	-44.3	178.9	-167.9	61.4	0	0	0	111.5	M406 P438 V452 I453 A458 K459 H460 L468 I470 M477	M406-L456 HydrophobicContact CE-CG 4.38Å; M406-L456 HydrophobicContact CG-CD2 3.63Å; M406-L456 HydrophobicContact CG-CG 4.09Å; M406-L456 HydrophobicContact SD-CD2 4.18Å; P438-L456 HydrophobicContact CB-CD2 4.41Å; V452-L456 VanDerWaalsContact O-CB 3.3Å; V452-L456 WeakPolarHBondContact O-CB 3.31Å; V452-L456 PolarHBondContact O-N 3.49Å; I453-L456 PolarHBondContact O-N 3.11Å; I453-L456 VanDerWaalsContact O-N 3.16Å; L456-A458 PolarHBondContact O-N 2.95Å; L456-K459 PolarHBondContact O-N 3.47Å; L456-H460 VanDerWaalsContact CD1-CE1 3.46Å; L456-H460 WeakPolarHBondContact CD1-CE1 3.47Å; L456-H460 PolarHBondContact O-N 2.89Å; L456-H460 PolarHBondContact O-ND1 3.06Å; L456-L468 HydrophobicContact CD1-CB 4.46Å; L456-L468 HydrophobicContact CD1-CD2 3.78Å; L456-L468 HydrophobicContact CD1-CG 3.87Å; L456-I470 HydrophobicContact CD2-CD1 3.77Å; L456-I470 HydrophobicContact CD2-CG1 3.73Å; L456-M477 HydrophobicContact CB-SD 4.23Å; L456-M477 HydrophobicContact CD1-CG 4.09Å; L456-M477 HydrophobicContact CD1-SD 4.1Å
457	R	90.7	Very high	88.9	Confident	83 Å²	83	65.2 Å²	65.2	31%	0.313	37%	0.371	S	S	.	.	H	α-helix	trans	-56.9	-47.7	173.5	-74.2	172.6	176.8	-174.4	-4.8	111.7	M406 E435 I453 K459 H460 T461	M406-R457 HydrophobicContact CE-CB 4.42Å; M406-R457 HydrophobicContact CE-CG 3.64Å; E435-R457 VanDerWaalsContact CD-NH2 3.28Å; E435-R457 IonicContact OE1-CZ 3.14Å; E435-R457 IonicContact OE1-NE 3.06Å; E435-R457 PolarHBondContact OE1-NE 2.75Å; E435-R457 IonicContact OE1-NH2 2.73Å; E435-R457 PolarHBondContact OE1-NH2 2.86Å; E435-R457 IonicContact OE2-CZ 2.89Å; E435-R457 IonicContact OE2-NE 2.72Å; E435-R457 PolarHBondContact OE2-NE 3.07Å; E435-R457 IonicContact OE2-NH2 3.3Å; E435-R457 PolarHBondContact OE2-NH2 3.4Å; I453-R457 HydrophobicContact CG2-CG 4.22Å; I453-R457 WeakPolarHBondContact O-CG 3.31Å; I453-R457 PolarHBondContact O-N 3.15Å; R457-K459 VanDerWaalsContact C-N 3.31Å; R457-K459 PolarHBondContact O-N 2.59Å; R457-H460 PolarHBondContact O-N 3.28Å; R457-T461 PolarHBondContact O-N 2.85Å; R457-T461 PolarHBondContact O-OG1 3.31Å; R457-T461 VanDerWaalsContact O-OG1 3.13Å
458	A	91.4	Very high	89	Confident	58 Å²	58	64.9 Å²	64.9	48%	0.479	36%	0.364	S	S	.	.	H	α-helix	trans	-59.5	-43.6	180	0	0	0	0	0	111.5	T454 A455 L456 T461	T454-A458 PolarHBondContact O-N 2.89Å; A455-A458 PolarHBondContact O-N 3.28Å; L456-A458 PolarHBondContact O-N 2.95Å; A458-T461 WeakPolarHBondContact O-CB 3.34Å; A458-T461 PolarHBondContact O-N 3.17Å
459	K	91.7	Very high	89.1	Confident	80 Å²	80	60.9 Å²	60.9	35%	0.348	34%	0.343	S	S	.	.	H	α-helix	trans	-68.6	-37.1	178.7	-71.5	-177.9	177.7	-175.3	0	113.6	A455 L456 R457 T461 E462 N465 L468 M477	A455-K459 WeakPolarHBondContact O-CG 3.39Å; A455-K459 PolarHBondContact O-N 3.36Å; A455-K459 VanDerWaalsContact O-N 3.14Å; L456-K459 PolarHBondContact O-N 3.47Å; R457-K459 VanDerWaalsContact C-N 3.31Å; R457-K459 PolarHBondContact O-N 2.59Å; K459-T461 PolarHBondContact O-N 3.36Å; K459-E462 WeakPolarHBondContact O-CB 3.46Å; K459-E462 PolarHBondContact O-N 3.46Å; K459-E462 VanDerWaalsContact O-N 3.11Å; K459-N465 VanDerWaalsContact O-CB 3.29Å; K459-N465 WeakPolarHBondContact O-CB 3.41Å; K459-N465 PolarHBondContact O-ND2 2.87Å; K459-L468 HydrophobicContact CB-CD2 3.7Å; K459-L468 HydrophobicContact CD-CD2 3.31Å; K459-L468 HydrophobicContact CG-CD2 4.17Å; K459-M477 HydrophobicContact CD-SD 4.04Å
460	H	90.2	Very high	89.2	Confident	15 Å²	15	59 Å²	59	7%	0.069	33%	0.333	C	S	.	.	H	α-helix	trans	-68.8	-17	177.3	-79.9	83.8	0	0	0	113.9	M406 L456 R457 E462 L468	M406-H460 WeakPolarHBondContact CB-NE2 3.04Å; L456-H460 VanDerWaalsContact CD1-CE1 3.46Å; L456-H460 WeakPolarHBondContact CD1-CE1 3.47Å; L456-H460 PolarHBondContact O-N 2.89Å; L456-H460 PolarHBondContact O-ND1 3.06Å; R457-H460 PolarHBondContact O-N 3.28Å; H460-E462 VanDerWaalsContact C-N 3.25Å; H460-L468 PolarHBondContact CE1-O 3.12Å; H460-L468 PolarHBondContact NE2-O 2.82Å; H460-L468 VanDerWaalsContact NE2-O 3.17Å
461	T	88.4	Confident	89.2	Confident	86 Å²	86	54.8 Å²	54.8	53%	0.528	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-23.7	172.5	-51.9	0	0	0	0	111.4	R457 A458 K459	R457-T461 PolarHBondContact O-N 2.85Å; R457-T461 PolarHBondContact O-OG1 3.31Å; R457-T461 VanDerWaalsContact O-OG1 3.13Å; A458-T461 WeakPolarHBondContact O-CB 3.34Å; A458-T461 PolarHBondContact O-N 3.17Å; K459-T461 PolarHBondContact O-N 3.36Å
462	E	87.5	Confident	88.8	Confident	125 Å²	125	46.6 Å²	46.6	58%	0.584	28%	0.284	S	S	*	.	S	Bend	trans	-82.9	133	175	-60.2	173.2	-177.9	0	0	110.4	K459 H460 G464 N465	K459-E462 WeakPolarHBondContact O-CB 3.46Å; K459-E462 PolarHBondContact O-N 3.46Å; K459-E462 VanDerWaalsContact O-N 3.11Å; H460-E462 VanDerWaalsContact C-N 3.25Å; E462-G464 PolarHBondContact O-N 2.94Å; E462-N465 PolarHBondContact OE2-ND2 3.4Å
463	A	77.9	Confident	88.6	Confident	107 Å²	107	50.6 Å²	50.6	88%	0.884	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	135.3	-178.7	0	0	0	0	0	111.9
464	G	79.4	Confident	88.4	Confident	62 Å²	62	54 Å²	54	64%	0.639	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	-3.1	177.1	0	0	0	0	0	115.5	E462	E462-G464 PolarHBondContact O-N 2.94Å
465	N	83.6	Confident	88.1	Confident	50 Å²	50	50.3 Å²	50.3	27%	0.267	30%	0.303	S	S	.	.			trans	-95.6	16.2	178.2	-70.3	-33.9	0	0	0	114	K459 E462 T467 L468	K459-N465 VanDerWaalsContact O-CB 3.29Å; K459-N465 WeakPolarHBondContact O-CB 3.41Å; K459-N465 PolarHBondContact O-ND2 2.87Å; E462-N465 PolarHBondContact OE2-ND2 3.4Å; N465-T467 PolarHBondContact O-N 2.87Å; N465-T467 VanDerWaalsContact O-N 3.14Å; N465-L468 VanDerWaalsContact O-CB 3.23Å; N465-L468 WeakPolarHBondContact O-CB 3.39Å; N465-L468 PolarHBondContact O-N 3.03Å
466	E	84.4	Confident	88.1	Confident	87 Å²	87	54.9 Å²	54.9	41%	0.407	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.5	-178.6	-62.5	175.4	-169.6	0	0	113.7	A407	A407-E466 HydrophobicContact CB-CB 4.14Å; A407-E466 HydrophobicContact CB-CG 4.32Å
467	T	88.9	Confident	88.1	Confident	31 Å²	31	57.8 Å²	57.8	19%	0.19	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1	179.5	62.7	0	0	0	0	112.5	P399 N465 G469 D479 M480 N481	P399-T467 HydrophobicContact CB-CG2 4.3Å; P399-T467 HydrophobicContact CG-CG2 4.32Å; N465-T467 PolarHBondContact O-N 2.87Å; N465-T467 VanDerWaalsContact O-N 3.14Å; T467-G469 PolarHBondContact O-N 2.89Å; T467-D479 WeakPolarHBondContact CB-OD1 3.36Å; T467-D479 PolarHBondContact OG1-OD1 3Å; T467-M480 WeakPolarHBondContact O-CB 3.37Å; T467-M480 VanDerWaalsContact O-CG 3.31Å; T467-M480 WeakPolarHBondContact O-CG 3.5Å; T467-M480 PolarHBondContact O-N 2.76Å; T467-N481 WeakPolarHBondContact CB-OD1 3.44Å; T467-N481 VanDerWaalsContact CG2-ND2 3.31Å; T467-N481 WeakPolarHBondContact CG2-ND2 3.27Å; T467-N481 VanDerWaalsContact CG2-OD1 3.29Å; T467-N481 WeakPolarHBondContact CG2-OD1 3.35Å; T467-N481 PolarHBondContact OG1-ND2 3.47Å
468	L	91.6	Very high	88.1	Confident	20 Å²	20	54.8 Å²	54.8	11%	0.105	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	112.9	178.6	-170.4	73	0	0	0	109.3	A403 L456 K459 H460 N465 M477	A403-L468 WeakPolarHBondContact CB-O 3.22Å; L456-L468 HydrophobicContact CD1-CB 4.46Å; L456-L468 HydrophobicContact CD1-CD2 3.78Å; L456-L468 HydrophobicContact CD1-CG 3.87Å; K459-L468 HydrophobicContact CB-CD2 3.7Å; K459-L468 HydrophobicContact CD-CD2 3.31Å; K459-L468 HydrophobicContact CG-CD2 4.17Å; H460-L468 PolarHBondContact CE1-O 3.12Å; H460-L468 PolarHBondContact NE2-O 2.82Å; H460-L468 VanDerWaalsContact NE2-O 3.17Å; N465-L468 VanDerWaalsContact O-CB 3.23Å; N465-L468 WeakPolarHBondContact O-CB 3.39Å; N465-L468 PolarHBondContact O-N 3.03Å; L468-M477 HydrophobicContact CD1-CB 4.4Å; L468-M477 HydrophobicContact CD2-SD 4.39Å
469	G	91.8	Very high	88.1	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	-157.2	177.4	0	0	0	0	0	111.6	T467 M477 A478	T467-G469 PolarHBondContact O-N 2.89Å; G469-M477 WeakPolarHBondContact O-CA 3.37Å; G469-A478 PolarHBondContact N-O 3.12Å; G469-A478 PolarHBondContact O-N 3.45Å
470	I	92.3	Very high	88	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.6	178.7	-53.1	-170.1	0	0	0	108.5	G401 P438 L442 L456 G472	G401-I470 PolarHBondContact O-N 3.39Å; P438-I470 HydrophobicContact CB-CD1 3.47Å; P438-I470 VanDerWaalsContact CB-CD1 3.47Å; P438-I470 HydrophobicContact CB-CG1 4.19Å; P438-I470 WeakPolarHBondContact O-CD1 3.35Å; L442-I470 HydrophobicContact CD1-CD1 3.48Å; L442-I470 VanDerWaalsContact CD1-CD1 3.48Å; L442-I470 HydrophobicContact CD2-CD1 3.92Å; L442-I470 HydrophobicContact CD2-CG2 3.58Å; L442-I470 HydrophobicContact CG-CD1 3.45Å; L442-I470 VanDerWaalsContact CG-CD1 3.45Å; L442-I470 HydrophobicContact CG-CG2 3.97Å; L456-I470 HydrophobicContact CD2-CD1 3.77Å; L456-I470 HydrophobicContact CD2-CG1 3.73Å; I470-G472 PolarHBondContact O-N 3.47Å
471	N	90.6	Very high	87.9	Confident	35 Å²	35	52.4 Å²	52.4	19%	0.187	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	105.6	168	-178.3	-17.3	0	0	0	108.6	I473 T474 G475 E476 A478 L483	N471-I473 PolarHBondContact O-N 2.76Å; N471-I473 WeakPolarHBondContact OD1-CB 3.15Å; N471-I473 PolarHBondContact OD1-N 3.17Å; N471-T474 WeakPolarHBondContact CB-OG1 3.46Å; N471-T474 PolarHBondContact ND2-OG1 3.41Å; N471-T474 PolarHBondContact O-N 3.44Å; N471-G475 WeakPolarHBondContact O-CA 3.44Å; N471-G475 PolarHBondContact O-N 3.32Å; N471-E476 PolarHBondContact N-O 3.43Å; N471-A478 HydrophobicContact CB-CB 4.2Å; N471-L483 HydrophobicContact CB-CD1 4.18Å
472	G	85.1	Confident	87.9	Confident	7 Å²	7	56.4 Å²	56.4	7%	0.072	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.9	-177.7	0	0	0	0	0	115.3	S445 I470	S445-G472 WeakPolarHBondContact CB-O 3.32Å; I470-G472 PolarHBondContact O-N 3.47Å
473	I	86.3	Confident	87.9	Confident	95 Å²	95	54 Å²	54	49%	0.487	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-47.9	176.2	-57.5	174	0	0	0	110.7	P29 R30 N471	P29-I473 HydrophobicContact CB-CG1 4.09Å; P29-I473 HydrophobicContact CG-CG1 3.99Å; R30-I473 PolarHBondContact NE-O 3.01Å; R30-I473 PolarHBondContact NH1-O 3.01Å; R30-I473 PolarHBondContact NH2-O 3.41Å; R30-I473 VanDerWaalsContact NH2-O 3.15Å; N471-I473 PolarHBondContact O-N 2.76Å; N471-I473 WeakPolarHBondContact OD1-CB 3.15Å; N471-I473 PolarHBondContact OD1-N 3.17Å
474	T	87.7	Confident	88.3	Confident	75 Å²	75	52 Å²	52	46%	0.46	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-23	-176.7	61.6	0	0	0	0	113.1	N471 E476	N471-T474 WeakPolarHBondContact CB-OG1 3.46Å; N471-T474 PolarHBondContact ND2-OG1 3.41Å; N471-T474 PolarHBondContact O-N 3.44Å; T474-E476 VanDerWaalsContact C-N 3.28Å; T474-E476 PolarHBondContact OG1-N 3.06Å
475	G	87.6	Confident	88.7	Confident	4 Å²	4	52.3 Å²	52.3	4%	0.041	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	17.1	-173.5	0	0	0	0	0	113.8	L442 S445 N471	L442-G475 WeakPolarHBondContact CD2-O 3.22Å; S445-G475 VanDerWaalsContact OG-CA 3.3Å; S445-G475 WeakPolarHBondContact OG-CA 2.93Å; N471-G475 WeakPolarHBondContact O-CA 3.44Å; N471-G475 PolarHBondContact O-N 3.32Å
476	E	90.6	Very high	89	Confident	131 Å²	131	50.5 Å²	50.5	61%	0.612	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.9	156.8	-178.9	-62	-176.2	157.6	0	0	111.9	N471 T474 A478	N471-E476 PolarHBondContact N-O 3.43Å; T474-E476 VanDerWaalsContact C-N 3.28Å; T474-E476 PolarHBondContact OG1-N 3.06Å; E476-A478 PolarHBondContact O-N 3.4Å
477	M	91.7	Very high	89.3	Confident	60 Å²	60	47 Å²	47	30%	0.296	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	127.5	172.6	-64.7	179.8	-81.5	0	0	109.9	V452 A455 L456 K459 L468 G469	V452-M477 HydrophobicContact CG1-CG 3.87Å; A455-M477 HydrophobicContact CB-CE 3.63Å; A455-M477 HydrophobicContact CB-SD 4.02Å; L456-M477 HydrophobicContact CB-SD 4.23Å; L456-M477 HydrophobicContact CD1-CG 4.09Å; L456-M477 HydrophobicContact CD1-SD 4.1Å; K459-M477 HydrophobicContact CD-SD 4.04Å; L468-M477 HydrophobicContact CD1-CB 4.4Å; L468-M477 HydrophobicContact CD2-SD 4.39Å; G469-M477 WeakPolarHBondContact O-CA 3.37Å
478	A	91.1	Very high	89.4	Confident	21 Å²	21	45.5 Å²	45.5	17%	0.174	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	149.7	177.9	0	0	0	0	0	110.6	G469 N471 E476 M480 L483	G469-A478 PolarHBondContact N-O 3.12Å; G469-A478 PolarHBondContact O-N 3.45Å; N471-A478 HydrophobicContact CB-CB 4.2Å; E476-A478 PolarHBondContact O-N 3.4Å; A478-M480 HydrophobicContact CB-CE 4.05Å; A478-M480 WeakPolarHBondContact O-CE 3.45Å; A478-M480 PolarHBondContact O-N 3.29Å; A478-L483 HydrophobicContact CB-CD1 3.49Å; A478-L483 VanDerWaalsContact CB-CD1 3.49Å; A478-L483 HydrophobicContact CB-CG 4.25Å
479	D	92.1	Very high	89.5	Confident	41 Å²	41	44.6 Å²	44.6	22%	0.219	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	117.3	173.7	-177.9	1.7	0	0	0	109	T467 N481 K482 L483	T467-D479 WeakPolarHBondContact CB-OD1 3.36Å; T467-D479 PolarHBondContact OG1-OD1 3Å; D479-N481 PolarHBondContact O-N 3.39Å; D479-N481 WeakPolarHBondContact OD1-CB 3.43Å; D479-N481 PolarHBondContact OD1-N 2.93Å; D479-N481 VanDerWaalsContact OD1-N 3.14Å; D479-K482 HydrophobicContact CB-CB 4.39Å; D479-K482 HydrophobicContact CB-CD 4.06Å; D479-K482 HydrophobicContact CB-CG 4.07Å; D479-K482 PolarHBondContact O-N 3.08Å; D479-K482 WeakPolarHBondContact OD2-CE 3.48Å; D479-L483 PolarHBondContact O-N 3.2Å
480	M	89.7	Confident	89.5	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-64.1	-26.1	-176.3	-63.6	-62.6	108.5	0	0	111.9	P399 G400 A403 T467 A478 K482 L483 N484 M485	P399-M480 HydrophobicContact CB-CB 3.86Å; P399-M480 HydrophobicContact CB-CG 4.28Å; G400-M480 VanDerWaalsContact O-CG 3.29Å; G400-M480 WeakPolarHBondContact O-CG 3.48Å; A403-M480 HydrophobicContact CB-CG 3.96Å; T467-M480 WeakPolarHBondContact O-CB 3.37Å; T467-M480 VanDerWaalsContact O-CG 3.31Å; T467-M480 WeakPolarHBondContact O-CG 3.5Å; T467-M480 PolarHBondContact O-N 2.76Å; A478-M480 HydrophobicContact CB-CE 4.05Å; A478-M480 WeakPolarHBondContact O-CE 3.45Å; A478-M480 PolarHBondContact O-N 3.29Å; M480-K482 VanDerWaalsContact C-N 3.31Å; M480-K482 PolarHBondContact O-N 3.16Å; M480-L483 HydrophobicContact CE-CD1 4.01Å; M480-L483 PolarHBondContact O-N 3.5Å; M480-N484 PolarHBondContact O-N 2.87Å; M480-M485 PolarHBondContact O-N 3.47Å; M480-M485 HydrophobicContact SD-CB 3.87Å
481	N	87.4	Confident	89.5	Confident	60 Å²	60	46.9 Å²	46.9	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-64.9	-37.3	174.1	-65.1	-6.8	0	0	0	111.8	T467 D479 N484 W486	T467-N481 WeakPolarHBondContact CB-OD1 3.44Å; T467-N481 VanDerWaalsContact CG2-ND2 3.31Å; T467-N481 WeakPolarHBondContact CG2-ND2 3.27Å; T467-N481 VanDerWaalsContact CG2-OD1 3.29Å; T467-N481 WeakPolarHBondContact CG2-OD1 3.35Å; T467-N481 PolarHBondContact OG1-ND2 3.47Å; D479-N481 PolarHBondContact O-N 3.39Å; D479-N481 WeakPolarHBondContact OD1-CB 3.43Å; D479-N481 PolarHBondContact OD1-N 2.93Å; D479-N481 VanDerWaalsContact OD1-N 3.14Å; N481-N484 PolarHBondContact O-OD1 3.3Å; N481-W486 HydrophobicContact CB-CH2 4.35Å; N481-W486 HydrophobicContact CB-CZ2 4.25Å; N481-W486 WeakPolarHBondContact OD1-CH2 3.34Å; N481-W486 WeakPolarHBondContact OD1-CZ2 3.45Å; N481-W486 WeakPolarHBondContact OD1-CZ3 3.46Å
482	K	88.5	Confident	89.5	Confident	170 Å²	170	46.7 Å²	46.7	74%	0.739	24%	0.24	S	C	*	.	H	α-helix	trans	-77	-31.7	179.7	-63.7	-178.5	-172.7	175.2	0	111.9	D479 M480 N484	D479-K482 HydrophobicContact CB-CB 4.39Å; D479-K482 HydrophobicContact CB-CD 4.06Å; D479-K482 HydrophobicContact CB-CG 4.07Å; D479-K482 PolarHBondContact O-N 3.08Å; D479-K482 WeakPolarHBondContact OD2-CE 3.48Å; M480-K482 VanDerWaalsContact C-N 3.31Å; M480-K482 PolarHBondContact O-N 3.16Å; K482-N484 VanDerWaalsContact C-N 3.3Å
483	L	87.1	Confident	89.9	Confident	75 Å²	75	47.3 Å²	47.3	39%	0.393	24%	0.243	S	C	.	.	H	α-helix	trans	-83.1	-5.6	175.5	-66.5	-178.6	0	0	0	113.3	N471 A478 D479 M480 M485	N471-L483 HydrophobicContact CB-CD1 4.18Å; A478-L483 HydrophobicContact CB-CD1 3.49Å; A478-L483 VanDerWaalsContact CB-CD1 3.49Å; A478-L483 HydrophobicContact CB-CG 4.25Å; D479-L483 PolarHBondContact O-N 3.2Å; M480-L483 HydrophobicContact CE-CD1 4.01Å; M480-L483 PolarHBondContact O-N 3.5Å; L483-M485 HydrophobicContact CB-CB 4.48Å; L483-M485 HydrophobicContact CB-CG 3.85Å; L483-M485 PolarHBondContact O-N 2.93Å
484	N	86.1	Confident	90.2	Very high	65 Å²	65	45.4 Å²	45.4	35%	0.348	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	38	-172.6	-69	-38.1	0	0	0	113.2	H144 S148 M480 N481 K482 W486	H144-N484 HydrophobicContact CB-CB 4.29Å; S148-N484 PolarHBondContact OG-O 3.42Å; M480-N484 PolarHBondContact O-N 2.87Å; N481-N484 PolarHBondContact O-OD1 3.3Å; K482-N484 VanDerWaalsContact C-N 3.3Å; N484-W486 VanDerWaalsContact O-CD1 3.32Å
485	M	88.1	Confident	90.4	Very high	67 Å²	67	41.9 Å²	41.9	33%	0.33	21%	0.21	S	C	.	.			trans	-96.8	105	179.9	-70.6	-63.2	-58	0	0	110	S148 G400 M480 L483	S148-M485 WeakPolarHBondContact OG-CA 3.4Å; G400-M485 PolarHBondContact N-O 3.2Å; M480-M485 PolarHBondContact O-N 3.47Å; M480-M485 HydrophobicContact SD-CB 3.87Å; L483-M485 HydrophobicContact CB-CB 4.48Å; L483-M485 HydrophobicContact CB-CG 3.85Å; L483-M485 PolarHBondContact O-N 2.93Å
486	W	90.3	Very high	90.5	Very high	13 Å²	13	41.9 Å²	41.9	5%	0.049	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.5	-171.5	-57.5	103.7	0	0	0	110.8	K132 V145 S148 V397 L398 P399 N481 N484	K132-W486 HydrophobicContact CB-CZ3 4.43Å; K132-W486 HydrophobicContact CD-CH2 3.4Å; K132-W486 VanDerWaalsContact CD-CH2 3.4Å; K132-W486 HydrophobicContact CD-CZ2 3.98Å; K132-W486 HydrophobicContact CD-CZ3 3.83Å; V145-W486 HydrophobicContact CG2-CB 4.18Å; S148-W486 WeakPolarHBondContact CB-O 3.41Å; S148-W486 PolarHBondContact OG-N 3.43Å; V397-W486 HydrophobicContact CB-CB 4.06Å; V397-W486 HydrophobicContact CB-CE3 4.47Å; V397-W486 HydrophobicContact CG1-CB 4.39Å; V397-W486 HydrophobicContact CG2-CB 4.06Å; V397-W486 HydrophobicContact CG2-CD2 3.96Å; V397-W486 HydrophobicContact CG2-CE3 3.63Å; V397-W486 HydrophobicContact CG2-CG 4.17Å; V397-W486 HydrophobicContact CG2-CZ3 4.29Å; L398-W486 WeakPolarHBondContact O-CA 3.21Å; P399-W486 HydrophobicContact CB-CZ3 4.44Å; N481-W486 HydrophobicContact CB-CH2 4.35Å; N481-W486 HydrophobicContact CB-CZ2 4.25Å; N481-W486 WeakPolarHBondContact OD1-CH2 3.34Å; N481-W486 WeakPolarHBondContact OD1-CZ2 3.45Å; N481-W486 WeakPolarHBondContact OD1-CZ3 3.46Å; N484-W486 VanDerWaalsContact O-CD1 3.32Å
487	D	90.4	Very high	90.6	Very high	13 Å²	13	39.6 Å²	39.6	7%	0.07	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	142.2	173.7	-65	-39.7	0	0	0	110.5	V397 L398 G400 L489 R492	V397-D487 CarbonylContact C-O 3.49Å; V397-D487 VanDerWaalsContact CA-O 3.28Å; V397-D487 WeakPolarHBondContact CA-O 3.22Å; V397-D487 WeakPolarHBondContact CB-O 3.44Å; L398-D487 PolarHBondContact N-O 3.41Å; L398-D487 PolarHBondContact O-N 3.33Å; G400-D487 VanDerWaalsContact CA-OD2 3.29Å; G400-D487 WeakPolarHBondContact CA-OD2 3.31Å; D487-L489 PolarHBondContact O-N 3.47Å; D487-R492 HydrophobicContact CB-CG 4.01Å; D487-R492 IonicContact OD1-NH2 3.05Å; D487-R492 IonicContact OD2-CZ 2.59Å; D487-R492 IonicContact OD2-NE 3.35Å; D487-R492 PolarHBondContact OD2-NE 3.21Å; D487-R492 IonicContact OD2-NH2 3.52Å; D487-R492 PolarHBondContact OD2-NH2 3.2Å
488	P	92.1	Very high	90.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	132.4	176.3	-16.8	27.6	0	0	0	111.4	V145 V387 N390 V391 T490 V491 R492	V145-P488 HydrophobicContact CG1-CG 4.07Å; V387-P488 HydrophobicContact CG1-CG 3.91Å; N390-P488 HydrophobicContact CB-CB 4.32Å; V391-P488 HydrophobicContact CG2-CB 4.18Å; V391-P488 HydrophobicContact CG2-CG 4.03Å; P488-T490 PolarHBondContact O-N 3.36Å; P488-V491 HydrophobicContact CB-CG2 4.02Å; P488-V491 HydrophobicContact CG-CG2 4.15Å; P488-V491 PolarHBondContact O-N 3.15Å; P488-V491 VanDerWaalsContact O-N 3.11Å; P488-R492 PolarHBondContact O-N 3.28Å
489	L	92.6	Very high	90.5	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-55.2	-42.5	179.7	175.7	68.3	0	0	0	111.5	C126 K396 L398 D487 V491 R492 V493	C126-L489 HydrophobicContact CB-CD1 3.93Å; K396-L489 HydrophobicContact CB-CB 3.88Å; K396-L489 HydrophobicContact CB-CD2 3.53Å; K396-L489 HydrophobicContact CB-CG 4.35Å; K396-L489 HydrophobicContact CD-CD2 3.58Å; K396-L489 HydrophobicContact CG-CD2 4.21Å; K396-L489 WeakPolarHBondContact O-CB 3.48Å; K396-L489 PolarHBondContact O-N 3.12Å; L398-L489 HydrophobicContact CD1-CD1 3.6Å; L398-L489 HydrophobicContact CD2-CD1 3.94Å; L398-L489 HydrophobicContact CG-CB 4.5Å; L398-L489 HydrophobicContact CG-CD1 3.69Å; D487-L489 PolarHBondContact O-N 3.47Å; L489-V491 VanDerWaalsContact C-N 3.28Å; L489-V491 PolarHBondContact O-N 3.43Å; L489-R492 PolarHBondContact O-N 2.98Å; L489-V493 HydrophobicContact CD1-CG2 3.66Å; L489-V493 HydrophobicContact CG-CG2 4.01Å; L489-V493 WeakPolarHBondContact O-CB 3.36Å; L489-V493 VanDerWaalsContact O-CG2 3.32Å; L489-V493 WeakPolarHBondContact O-CG2 3.26Å; L489-V493 PolarHBondContact O-N 2.81Å
490	T	92.1	Very high	90.3	Very high	45 Å²	45	35.1 Å²	35.1	28%	0.276	17%	0.172	S	C	.	.	H	α-helix	trans	-56.1	-41.9	-179.9	-53.3	0	0	0	0	112.1	N394 P488 Q494	N394-T490 WeakPolarHBondContact CB-OG1 3.47Å; P488-T490 PolarHBondContact O-N 3.36Å; T490-Q494 VanDerWaalsContact O-CB 3.25Å; T490-Q494 WeakPolarHBondContact O-CB 3.44Å; T490-Q494 PolarHBondContact O-N 3.06Å; T490-Q494 VanDerWaalsContact O-N 3.09Å
491	V	92.2	Very high	90.3	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.03	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-52	-179.7	-178	0	0	0	0	109.7	T77 D79 N390 P488 L489 V493 Q494 V495	T77-V491 HydrophobicContact CG2-CG2 4.43Å; D79-V491 HydrophobicContact CB-CG1 4.25Å; D79-V491 WeakPolarHBondContact O-CG1 3.15Å; N390-V491 WeakPolarHBondContact ND2-CG2 3.33Å; P488-V491 HydrophobicContact CB-CG2 4.02Å; P488-V491 HydrophobicContact CG-CG2 4.15Å; P488-V491 PolarHBondContact O-N 3.15Å; P488-V491 VanDerWaalsContact O-N 3.11Å; L489-V491 VanDerWaalsContact C-N 3.28Å; L489-V491 PolarHBondContact O-N 3.43Å; V491-V493 PolarHBondContact O-N 2.89Å; V491-Q494 PolarHBondContact O-N 3.36Å; V491-V495 HydrophobicContact CG1-CG2 4.14Å; V491-V495 WeakPolarHBondContact O-CB 3.41Å; V491-V495 WeakPolarHBondContact O-CG2 3.48Å; V491-V495 PolarHBondContact O-N 2.91Å
492	R	91.1	Very high	90.3	Very high	30 Å²	30	36.8 Å²	36.8	11%	0.113	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-44.8	-177.9	-69	-72.8	176.2	-165.8	-10.5	112.7	L398 E405 D487 P488 L489 Q494 V495 Y496	L398-R492 HydrophobicContact CD1-CB 3.88Å; L398-R492 HydrophobicContact CD1-CG 4.27Å; E405-R492 WeakPolarHBondContact OE1-CD 3.4Å; E405-R492 IonicContact OE1-CZ 3.01Å; E405-R492 IonicContact OE1-NE 3.39Å; E405-R492 IonicContact OE1-NH1 2.71Å; E405-R492 PolarHBondContact OE1-NH1 2.86Å; D487-R492 HydrophobicContact CB-CG 4.01Å; D487-R492 IonicContact OD1-NH2 3.05Å; D487-R492 IonicContact OD2-CZ 2.59Å; D487-R492 IonicContact OD2-NE 3.35Å; D487-R492 PolarHBondContact OD2-NE 3.21Å; D487-R492 IonicContact OD2-NH2 3.52Å; D487-R492 PolarHBondContact OD2-NH2 3.2Å; P488-R492 PolarHBondContact O-N 3.28Å; L489-R492 PolarHBondContact O-N 2.98Å; R492-Q494 VanDerWaalsContact C-N 3.34Å; R492-Q494 PolarHBondContact O-N 3.49Å; R492-V495 WeakPolarHBondContact O-CB 3.45Å; R492-V495 PolarHBondContact O-N 3.43Å; R492-Y496 HydrophobicContact CB-CE2 4.13Å; R492-Y496 WeakPolarHBondContact O-CD2 3.4Å; R492-Y496 PolarHBondContact O-N 3.14Å
493	V	92.3	Very high	90.1	Very high	21 Å²	21	28.7 Å²	28.7	13%	0.127	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-44.3	176.6	169.8	0	0	0	0	111.1	V123 C126 L489 V491 V495 Y496 K497	V123-V493 HydrophobicContact CG1-CG1 4.03Å; V123-V493 HydrophobicContact CG2-CG1 4.22Å; C126-V493 HydrophobicContact CB-CG2 3.84Å; L489-V493 HydrophobicContact CD1-CG2 3.66Å; L489-V493 HydrophobicContact CG-CG2 4.01Å; L489-V493 WeakPolarHBondContact O-CB 3.36Å; L489-V493 VanDerWaalsContact O-CG2 3.32Å; L489-V493 WeakPolarHBondContact O-CG2 3.26Å; L489-V493 PolarHBondContact O-N 2.81Å; V491-V493 PolarHBondContact O-N 2.89Å; V493-V495 VanDerWaalsContact C-N 3.32Å; V493-V495 PolarHBondContact O-N 3.47Å; V493-Y496 PolarHBondContact O-N 3.15Å; V493-K497 WeakPolarHBondContact O-CB 3.07Å; V493-K497 PolarHBondContact O-N 3.38Å
494	Q	92.7	Very high	90.2	Very high	55 Å²	55	25.6 Å²	25.6	26%	0.257	13%	0.127	S	C	.	.	H	α-helix	trans	-64.1	-41.2	177.1	-174.3	60.3	22.9	0	0	110.9	T77 T490 V491 R492 Y496 K497 T498	T77-Q494 HydrophobicContact CG2-CB 4.09Å; T77-Q494 HydrophobicContact CG2-CG 4.11Å; T490-Q494 VanDerWaalsContact O-CB 3.25Å; T490-Q494 WeakPolarHBondContact O-CB 3.44Å; T490-Q494 PolarHBondContact O-N 3.06Å; T490-Q494 VanDerWaalsContact O-N 3.09Å; V491-Q494 PolarHBondContact O-N 3.36Å; R492-Q494 VanDerWaalsContact C-N 3.34Å; R492-Q494 PolarHBondContact O-N 3.49Å; Q494-Y496 PolarHBondContact O-N 3.28Å; Q494-K497 PolarHBondContact O-N 3.01Å; Q494-T498 PolarHBondContact NE2-OG1 2.72Å; Q494-T498 VanDerWaalsContact NE2-OG1 3.11Å; Q494-T498 WeakPolarHBondContact O-CB 3.15Å; Q494-T498 PolarHBondContact O-N 2.86Å; Q494-T498 PolarHBondContact O-OG1 3.21Å
495	V	91.9	Very high	90.3	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-56.9	-49	177.2	167.8	0	0	0	0	111	V84 L87 V491 R492 V493 A499	V84-V495 HydrophobicContact CG2-CB 3.82Å; V84-V495 HydrophobicContact CG2-CG1 3.75Å; V84-V495 HydrophobicContact CG2-CG2 3.71Å; L87-V495 HydrophobicContact CD1-CG1 3.23Å; V491-V495 HydrophobicContact CG1-CG2 4.14Å; V491-V495 WeakPolarHBondContact O-CB 3.41Å; V491-V495 WeakPolarHBondContact O-CG2 3.48Å; V491-V495 PolarHBondContact O-N 2.91Å; R492-V495 WeakPolarHBondContact O-CB 3.45Å; R492-V495 PolarHBondContact O-N 3.43Å; V493-V495 VanDerWaalsContact C-N 3.32Å; V493-V495 PolarHBondContact O-N 3.47Å; V495-A499 WeakPolarHBondContact O-CB 3.42Å; V495-A499 PolarHBondContact O-N 2.9Å
496	Y	90.9	Very high	90.2	Very high	3 Å²	3	23.8 Å²	23.8	1%	0.012	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-40.1	179.8	-53.6	-29.6	0	0	0	112.4	L87 V122 E405 L408 F434 R492 V493 Q494 I500	L87-Y496 HydrophobicContact CD1-CD1 3.98Å; L87-Y496 HydrophobicContact CD1-CE1 3.95Å; V122-Y496 HydrophobicContact CG1-CD2 3.77Å; V122-Y496 HydrophobicContact CG1-CG 4.27Å; E405-Y496 VanDerWaalsContact CD-OH 3.27Å; E405-Y496 HydrophobicContact CG-CE1 4.25Å; E405-Y496 PolarHBondContact OE1-OH 3.45Å; L408-Y496 HydrophobicContact CD1-CD2 4.05Å; L408-Y496 HydrophobicContact CD1-CE2 3.37Å; F434-Y496 HydrophobicContact CD1-CD1 4.47Å; F434-Y496 HydrophobicContact CD1-CE1 4.25Å; F434-Y496 AromaticContact CE1-CD1 3.56Å; F434-Y496 HydrophobicContact CE1-CD1 3.56Å; F434-Y496 HydrophobicContact CE1-CD2 4.37Å; F434-Y496 AromaticContact CE1-CE1 3.69Å; F434-Y496 HydrophobicContact CE1-CE1 3.69Å; F434-Y496 HydrophobicContact CE1-CE2 4.49Å; F434-Y496 AromaticContact CE1-CG 3.93Å; F434-Y496 HydrophobicContact CE1-CG 3.93Å; F434-Y496 HydrophobicContact CZ-CD1 4.36Å; F434-Y496 HydrophobicContact CZ-CG 4.35Å; R492-Y496 HydrophobicContact CB-CE2 4.13Å; R492-Y496 WeakPolarHBondContact O-CD2 3.4Å; R492-Y496 PolarHBondContact O-N 3.14Å; V493-Y496 PolarHBondContact O-N 3.15Å; Q494-Y496 PolarHBondContact O-N 3.28Å; Y496-I500 WeakPolarHBondContact O-CG1 3.33Å; Y496-I500 PolarHBondContact O-N 3.44Å; Y496-I500 VanDerWaalsContact O-N 3.1Å
497	K	91.8	Very high	89.9	Confident	83 Å²	83	23.2 Å²	23.2	36%	0.361	12%	0.116	S	C	.	.	H	α-helix	trans	-61.5	-55.1	176.1	-177.4	-179.2	175.2	-172.7	0	111.4	L119 V493 Q494 A499 I500 E501	L119-K497 HydrophobicContact CD1-CB 4.19Å; L119-K497 HydrophobicContact CD2-CG 4.29Å; V493-K497 WeakPolarHBondContact O-CB 3.07Å; V493-K497 PolarHBondContact O-N 3.38Å; Q494-K497 PolarHBondContact O-N 3.01Å; K497-A499 VanDerWaalsContact C-N 3.31Å; K497-A499 PolarHBondContact O-N 3.47Å; K497-I500 PolarHBondContact O-N 2.91Å; K497-E501 WeakPolarHBondContact CE-OE1 3.47Å; K497-E501 HydrophobicContact CG-CG 4.4Å; K497-E501 WeakPolarHBondContact O-CB 3.12Å; K497-E501 WeakPolarHBondContact O-CG 3.3Å; K497-E501 PolarHBondContact O-N 2.93Å
498	T	91.6	Very high	89.8	Confident	16 Å²	16	29.6 Å²	29.6	10%	0.098	14%	0.139	C	C	.	.	H	α-helix	trans	-60.2	-42.9	-178.6	-53.1	0	0	0	0	111	I69 Q73 V84 Q494 T502	I69-T498 HydrophobicContact CG2-CG2 3.35Å; Q73-T498 PolarHBondContact OE1-OG1 3.12Å; Q73-T498 VanDerWaalsContact OE1-OG1 3.13Å; V84-T498 HydrophobicContact CG1-CG2 3.77Å; Q494-T498 PolarHBondContact NE2-OG1 2.72Å; Q494-T498 VanDerWaalsContact NE2-OG1 3.11Å; Q494-T498 WeakPolarHBondContact O-CB 3.15Å; Q494-T498 PolarHBondContact O-N 2.86Å; Q494-T498 PolarHBondContact O-OG1 3.21Å; T498-T502 VanDerWaalsContact O-CB 3.28Å; T498-T502 WeakPolarHBondContact O-CB 3.43Å; T498-T502 PolarHBondContact O-N 3.31Å; T498-T502 PolarHBondContact O-OG1 3.27Å
499	A	88.9	Confident	89.6	Confident	4 Å²	4	32 Å²	32	3%	0.033	15%	0.152	C	C	.	.	H	α-helix	trans	-60.4	-50	178.3	0	0	0	0	0	112.8	L87 V495 K497 T502 A503	L87-A499 HydrophobicContact CB-CB 3.8Å; V495-A499 WeakPolarHBondContact O-CB 3.42Å; V495-A499 PolarHBondContact O-N 2.9Å; K497-A499 VanDerWaalsContact C-N 3.31Å; K497-A499 PolarHBondContact O-N 3.47Å; A499-T502 WeakPolarHBondContact O-CB 3.12Å; A499-T502 PolarHBondContact O-N 3.46Å; A499-A503 PolarHBondContact O-N 2.91Å
500	I	88.2	Confident	89.4	Confident	8 Å²	8	36.5 Å²	36.5	4%	0.041	18%	0.176	C	C	.	.	H	α-helix	trans	-70.6	-37.9	-178.9	-64.4	172.7	0	0	0	111.5	L115 L119 Y496 K497 T502 A503 I504	L115-I500 HydrophobicContact CB-CG2 3.95Å; L119-I500 HydrophobicContact CB-CB 4.34Å; L119-I500 HydrophobicContact CB-CD1 3.84Å; L119-I500 HydrophobicContact CB-CG2 3.99Å; L119-I500 HydrophobicContact CD1-CB 4.43Å; L119-I500 HydrophobicContact CD1-CD1 3.93Å; L119-I500 HydrophobicContact CD2-CB 4.33Å; L119-I500 HydrophobicContact CD2-CG2 4.31Å; L119-I500 HydrophobicContact CG-CD1 4.43Å; Y496-I500 WeakPolarHBondContact O-CG1 3.33Å; Y496-I500 PolarHBondContact O-N 3.44Å; Y496-I500 VanDerWaalsContact O-N 3.1Å; K497-I500 PolarHBondContact O-N 2.91Å; I500-T502 VanDerWaalsContact C-N 3.31Å; I500-T502 PolarHBondContact O-N 3.46Å; I500-A503 VanDerWaalsContact O-CB 3.3Å; I500-A503 WeakPolarHBondContact O-CB 3.39Å; I500-A503 PolarHBondContact O-N 3.39Å; I500-I504 HydrophobicContact CG2-CD1 4Å; I500-I504 WeakPolarHBondContact O-CD1 3.35Å; I500-I504 WeakPolarHBondContact O-CG1 3.18Å; I500-I504 PolarHBondContact O-N 2.77Å
501	E	89.4	Confident	89.2	Confident	91 Å²	91	37.5 Å²	37.5	43%	0.425	18%	0.178	S	C	.	.	H	α-helix	trans	-63.7	-38.2	174.9	-74	177.6	171.7	0	0	111.9	L119 K497 I504 L505	L119-E501 HydrophobicContact CD2-CG 4.28Å; K497-E501 WeakPolarHBondContact CE-OE1 3.47Å; K497-E501 HydrophobicContact CG-CG 4.4Å; K497-E501 WeakPolarHBondContact O-CB 3.12Å; K497-E501 WeakPolarHBondContact O-CG 3.3Å; K497-E501 PolarHBondContact O-N 2.93Å; E501-I504 PolarHBondContact O-N 3.14Å; E501-L505 PolarHBondContact O-N 3.48Å
502	T	88	Confident	88.8	Confident	6 Å²	6	39.2 Å²	39.2	4%	0.037	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-43.8	173.2	-59.2	0	0	0	0	111.4	M66 I69 T498 A499 I500 I504 L505 L506	M66-T502 HydrophobicContact SD-CG2 3.53Å; M66-T502 VanDerWaalsContact SD-CG2 3.53Å; I69-T502 HydrophobicContact CD1-CG2 3.31Å; I69-T502 WeakPolarHBondContact CD1-OG1 3.46Å; T498-T502 VanDerWaalsContact O-CB 3.28Å; T498-T502 WeakPolarHBondContact O-CB 3.43Å; T498-T502 PolarHBondContact O-N 3.31Å; T498-T502 PolarHBondContact O-OG1 3.27Å; A499-T502 WeakPolarHBondContact O-CB 3.12Å; A499-T502 PolarHBondContact O-N 3.46Å; I500-T502 VanDerWaalsContact C-N 3.31Å; I500-T502 PolarHBondContact O-N 3.46Å; T502-I504 VanDerWaalsContact C-N 3.3Å; T502-I504 PolarHBondContact O-N 2.96Å; T502-L505 WeakPolarHBondContact O-CB 3.34Å; T502-L505 PolarHBondContact O-N 3.48Å; T502-L505 VanDerWaalsContact O-N 3.16Å; T502-L506 HydrophobicContact CG2-CD1 4.27Å; T502-L506 HydrophobicContact CG2-CG 4.46Å; T502-L506 WeakPolarHBondContact O-CG 3.37Å; T502-L506 PolarHBondContact O-N 2.94Å
503	A	85.2	Confident	88.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.8	-47.5	175	0	0	0	0	0	112.1	A91 L115 A499 I500 L505 L506 L507	A91-A503 HydrophobicContact CB-CB 3.12Å; L115-A503 HydrophobicContact CD1-CB 4.3Å; A499-A503 PolarHBondContact O-N 2.91Å; I500-A503 VanDerWaalsContact O-CB 3.3Å; I500-A503 WeakPolarHBondContact O-CB 3.39Å; I500-A503 PolarHBondContact O-N 3.39Å; A503-L505 VanDerWaalsContact C-N 3.32Å; A503-L505 PolarHBondContact O-N 3.37Å; A503-L506 PolarHBondContact O-N 2.93Å; A503-L507 WeakPolarHBondContact O-CB 3.42Å; A503-L507 WeakPolarHBondContact O-CG 3.46Å; A503-L507 PolarHBondContact O-N 3.27Å
504	I	88.2	Confident	87.9	Confident	11 Å²	11	47.6 Å²	47.6	6%	0.056	24%	0.24	C	C	.	.	H	α-helix	trans	-62.6	-41.3	178.7	-70	161.9	0	0	0	110.6	I112 L115 Q116 I500 E501 T502 R508	I112-I504 HydrophobicContact CB-CG2 4.44Å; I112-I504 HydrophobicContact CG1-CG2 4.19Å; I112-I504 HydrophobicContact CG2-CB 4.45Å; I112-I504 HydrophobicContact CG2-CG1 4.2Å; I112-I504 HydrophobicContact CG2-CG2 3.57Å; L115-I504 HydrophobicContact CB-CD1 4.1Å; L115-I504 HydrophobicContact CB-CG1 4.03Å; L115-I504 HydrophobicContact CD1-CG1 4.13Å; Q116-I504 HydrophobicContact CG-CD1 3.5Å; I500-I504 HydrophobicContact CG2-CD1 4Å; I500-I504 WeakPolarHBondContact O-CD1 3.35Å; I500-I504 WeakPolarHBondContact O-CG1 3.18Å; I500-I504 PolarHBondContact O-N 2.77Å; E501-I504 PolarHBondContact O-N 3.14Å; T502-I504 VanDerWaalsContact C-N 3.3Å; T502-I504 PolarHBondContact O-N 2.96Å; I504-R508 VanDerWaalsContact O-CG 3.25Å; I504-R508 WeakPolarHBondContact O-CG 3.44Å; I504-R508 PolarHBondContact O-N 3.43Å
505	L	88.9	Confident	86.9	Confident	89 Å²	89	48.8 Å²	48.8	47%	0.466	27%	0.266	S	S	.	.	H	α-helix	trans	-62.8	-51	178.5	-179.2	65.6	0	0	0	111.4	E501 T502 A503 L507 R508 I509	E501-L505 PolarHBondContact O-N 3.48Å; T502-L505 WeakPolarHBondContact O-CB 3.34Å; T502-L505 PolarHBondContact O-N 3.48Å; T502-L505 VanDerWaalsContact O-N 3.16Å; A503-L505 VanDerWaalsContact C-N 3.32Å; A503-L505 PolarHBondContact O-N 3.37Å; L505-L507 VanDerWaalsContact C-N 3.31Å; L505-L507 PolarHBondContact O-N 3.08Å; L505-R508 WeakPolarHBondContact O-CB 3.43Å; L505-R508 PolarHBondContact O-N 3.36Å; L505-R508 VanDerWaalsContact O-N 3.12Å; L505-I509 PolarHBondContact O-N 3.02Å
506	L	86.1	Confident	85.8	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-36.1	-179.3	-66.3	-178.9	0	0	0	112.5	N12 A16 A62 M66 T502 A503 R508 I509	N12-L506 PolarHBondContact ND2-O 3.22Å; A16-L506 HydrophobicContact CB-CD1 3.85Å; A62-L506 HydrophobicContact CB-CD2 3.64Å; M66-L506 HydrophobicContact SD-CD1 4.3Å; T502-L506 HydrophobicContact CG2-CD1 4.27Å; T502-L506 HydrophobicContact CG2-CG 4.46Å; T502-L506 WeakPolarHBondContact O-CG 3.37Å; T502-L506 PolarHBondContact O-N 2.94Å; A503-L506 PolarHBondContact O-N 2.93Å; L506-R508 VanDerWaalsContact C-N 3.3Å; L506-R508 PolarHBondContact O-N 3.28Å; L506-I509 HydrophobicContact CD2-CD1 4.4Å; L506-I509 PolarHBondContact O-N 3.49Å
507	L	84.1	Confident	83.8	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-31.7	173.9	-90.1	172.4	0	0	0	114.1	Q9 L95 L102 I111 I112 L115 A503 L505 I509	Q9-L507 PolarHBondContact NE2-O 3.22Å; L95-L507 HydrophobicContact CD2-CD1 3.76Å; L95-L507 HydrophobicContact CD2-CD2 3.1Å; L95-L507 HydrophobicContact CD2-CG 3.25Å; L95-L507 HydrophobicContact CG-CD2 4.5Å; L95-L507 HydrophobicContact CG-CG 4.31Å; L102-L507 HydrophobicContact CD1-CD2 4.33Å; I111-L507 HydrophobicContact CB-CD1 4.4Å; I111-L507 HydrophobicContact CG2-CD1 3.74Å; I112-L507 HydrophobicContact CD1-CB 4.26Å; I112-L507 HydrophobicContact CG1-CB 4.17Å; I112-L507 HydrophobicContact CG1-CD1 4.21Å; L115-L507 HydrophobicContact CD1-CD1 3.91Å; A503-L507 WeakPolarHBondContact O-CB 3.42Å; A503-L507 WeakPolarHBondContact O-CG 3.46Å; A503-L507 PolarHBondContact O-N 3.27Å; L505-L507 VanDerWaalsContact C-N 3.31Å; L505-L507 PolarHBondContact O-N 3.08Å; L507-I509 VanDerWaalsContact C-N 3.3Å
508	R	88.1	Confident	81.8	Confident	146 Å²	146	68.4 Å²	68.4	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-76.1	-18.4	-179.4	-77.2	175.7	179.3	-164.1	1.4	113.1	I112 I504 L505 L506 D510	I112-R508 HydrophobicContact CD1-CG 3.48Å; I112-R508 VanDerWaalsContact CD1-CG 3.48Å; I504-R508 VanDerWaalsContact O-CG 3.25Å; I504-R508 WeakPolarHBondContact O-CG 3.44Å; I504-R508 PolarHBondContact O-N 3.43Å; L505-R508 WeakPolarHBondContact O-CB 3.43Å; L505-R508 PolarHBondContact O-N 3.36Å; L505-R508 VanDerWaalsContact O-N 3.12Å; L506-R508 VanDerWaalsContact C-N 3.3Å; L506-R508 PolarHBondContact O-N 3.28Å; R508-D510 PolarHBondContact O-N 3.03Å
509	I	87.8	Confident	79.6	Confident	52 Å²	52	76.6 Å²	76.6	27%	0.267	40%	0.399	S	S	.	.			trans	-83.9	106	-179.9	-59.7	166.2	0	0	0	108.3	V8 Q9 N12 L505 L506 L507 I512	V8-I509 HydrophobicContact CG1-CG2 4.15Å; Q9-I509 WeakPolarHBondContact CG-O 3.3Å; N12-I509 PolarHBondContact ND2-O 3.38Å; L505-I509 PolarHBondContact O-N 3.02Å; L506-I509 HydrophobicContact CD2-CD1 4.4Å; L506-I509 PolarHBondContact O-N 3.49Å; L507-I509 VanDerWaalsContact C-N 3.3Å; I509-I512 HydrophobicContact CG2-CG1 4.29Å
510	D	87.8	Confident	77.6	Confident	94 Å²	94	80.6 Å²	80.6	50%	0.503	42%	0.423	S	S	.	.			trans	-104.9	-11.4	177.1	63.7	-23.6	0	0	0	113.4	T4 G5 R508	T4-D510 CarbonylContact C-O 3.55Å; G5-D510 PolarHBondContact N-O 3.39Å; R508-D510 PolarHBondContact O-N 3.03Å
511	E	87.2	Confident	76	Confident	67 Å²	67	86.6 Å²	86.6	31%	0.313	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	136.8	-179.9	-173.6	170.9	-165.1	0	0	111.3	Q2 T4 L513	Q2-E511 VanDerWaalsContact CD-OE1 3.28Å; Q2-E511 WeakPolarHBondContact CG-OE1 3.48Å; Q2-E511 PolarHBondContact NE2-OE1 3.49Å; T4-E511 HydrophobicContact CG2-CG 4.06Å; E511-L513 HydrophobicContact CG-CD2 4.04Å; E511-L513 HydrophobicContact CG-CG 4.16Å; E511-L513 WeakPolarHBondContact OE1-CD2 3.38Å
512	I	84.8	Confident	74.2	Confident	41 Å²	41	89.2 Å²	89.2	21%	0.21	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	113.6	172.4	-62	171	0	0	0	108.6	V8 P61 I509	V8-I512 HydrophobicContact CG1-CD1 3.89Å; V8-I512 HydrophobicContact CG1-CG1 3.75Å; P61-I512 HydrophobicContact CG-CD1 4.48Å; P61-I512 HydrophobicContact CG-CG2 4.18Å; I509-I512 HydrophobicContact CG2-CG1 4.29Å
513	L	83.9	Confident	72.4	Confident	127 Å²	127	95.7 Å²	95.7	67%	0.665	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	124.3	176.7	-63	175.4	0	0	0	110.1	Q2 E511	Q2-L513 HydrophobicContact CG-CD2 4.28Å; E511-L513 HydrophobicContact CG-CD2 4.04Å; E511-L513 HydrophobicContact CG-CG 4.16Å; E511-L513 WeakPolarHBondContact OE1-CD2 3.38Å
514	S	79.5	Confident	70.6	Confident	100 Å²	100	103 Å²	103	70%	0.699	54%	0.538	S	S	*	.			trans	-95.3	104.6	170.3	-171.9	0	0	0	0	109.7
515	G	73.6	Confident	68.5	Low	79 Å²	79	107.7 Å²	107.7	81%	0.814	57%	0.569	S	S	*	*			trans	-106.6	90.8	178.3	0	0	0	0	0	111.6
516	V	67.6	Low	66.4	Low	125 Å²	125	112.1 Å²	112.1	76%	0.758	59%	0.588	S	S	*	*			trans	-114.2	114.5	159.1	-175.2	0	0	0	0	106.2	K518	V516-K518 PolarHBondContact O-N 3.17Å
517	Q	48.2	Very low	64.3	Low	182 Å²	182	120.7 Å²	120.7	85%	0.85	63%	0.627	S	S	*	*			trans	-55.3	112.9	163.3	-86.7	173.5	-18	0	0	106.5	K519	Q517-K519 PolarHBondContact O-N 3.26Å
518	K	50.1	Low	62.4	Low	193 Å²	193	131.2 Å²	131.2	84%	0.839	68%	0.684	S	S	*	*			trans	-54.5	113.1	157.1	-86.4	-177.3	173	-178.5	0	104.8	V516 T520	V516-K518 PolarHBondContact O-N 3.17Å; K518-T520 VanDerWaalsContact C-N 3.25Å; K518-T520 PolarHBondContact O-N 3.42Å
519	K	47	Very low	61.1	Low	188 Å²	188	130.5 Å²	130.5	82%	0.817	69%	0.69	S	S	*	*			trans	-54.9	103.4	157.9	-75.9	-175.2	174.3	-175.2	0	105	Q517	Q517-K519 PolarHBondContact O-N 3.26Å
520	T	45.6	Very low	59.7	Low	87 Å²	87	134.6 Å²	134.6	53%	0.534	71%	0.713	S	S	.	*			trans	-59	135.7	164.3	32.2	0	0	0	0	106.3	K518 D522	K518-T520 VanDerWaalsContact C-N 3.25Å; K518-T520 PolarHBondContact O-N 3.42Å; T520-D522 PolarHBondContact O-N 3.04Å
521	D	54.8	Low	58.2	Low	135 Å²	135	136.8 Å²	136.8	72%	0.722	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-60.5	4.5	-179.3	-86.9	-51.1	0	0	0	114.1
522	D	52.4	Low	56.5	Low	145 Å²	145	140.9 Å²	140.9	78%	0.775	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-81.5	-6.5	179.7	-65.5	-31.5	0	0	0	114.5	T520	T520-D522 PolarHBondContact O-N 3.04Å
523	D	49.3	Very low	54.7	Low	142 Å²	142	147.2 Å²	147.2	76%	0.759	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-93.9	19.5	177.2	-85.8	-22	0	0	0	113.8
524	K	47	Very low	52.8	Low	154 Å²	154	148.5 Å²	148.5	67%	0.67	79%	0.79	S	S	*	*	S	Bend	trans	-80.2	124.1	166.6	-77	179.6	-177.2	165.5	0	108.7	E526	K524-E526 PolarHBondContact O-N 3.38Å; K524-E526 VanDerWaalsContact O-N 3.12Å
525	P	45.4	Very low	50.8	Low	110 Å²	110	152 Å²	152	71%	0.714	80%	0.797	S	S	*	*			trans	-62.6	120.7	169.7	26.9	-30.4	0	0	0	107.4	Q527	P525-Q527 PolarHBondContact O-N 3.3Å
526	E	43.2	Very low	49.1	Very low	182 Å²	182	157.6 Å²	157.6	85%	0.85	80%	0.795	S	S	*	*			trans	-56.9	102.8	165.3	-74.1	-173.9	158.1	0	0	107.5	K524 N528	K524-E526 PolarHBondContact O-N 3.38Å; K524-E526 VanDerWaalsContact O-N 3.12Å; E526-N528 PolarHBondContact O-N 3.21Å
527	Q	42.9	Very low	47.5	Very low	183 Å²	183	160.3 Å²	160.3	86%	0.855	80%	0.798	S	S	*	*			trans	-74.9	102.1	161.8	-75.7	-177.3	-13.1	0	0	107	P525	P525-Q527 PolarHBondContact O-N 3.3Å
528	N	44.8	Very low	47.5	Very low	223 Å²	223	158.4 Å²	158.4	100%	1.193	79%	0.794	S	S	*	*			trans	-96	0	151.8	-88	-29.4	0	0	0	109.5	E526	E526-N528 PolarHBondContact O-N 3.21Å

Retrieved 528 of 528 residues in 519.2 ms (Link to these results)

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