G4V7P0_SCHMA Loading...

SWIM-type domain-containing protein

AlphaFold DB , UniProt , Accession G4V7P0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 490 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	54.5	Low	68.6	Low	50 Å²	50	62.5 Å²	62.5	25%	0.246	39%	0.385	C	S	.	.				0	126.3	0	-134.2	-175.3	68.5	0	0	108.4	E5 L6 M20 L52 Q55 V56	M1-E5 WeakPolarHBondContact CA-OE2 3.09Å; M1-E5 HydrophobicContact CE-CB 4.09Å; M1-E5 HydrophobicContact CG-CB 3.83Å; M1-E5 VanDerWaalsContact CG-CD 3.49Å; M1-E5 HydrophobicContact CG-CG 4.27Å; M1-E5 WeakPolarHBondContact CG-OE2 3.19Å; M1-E5 HydrophobicContact SD-CB 4.25Å; M1-L6 HydrophobicContact CE-CD1 4.29Å; M1-L6 HydrophobicContact CE-CD2 3.39Å; M1-L6 HydrophobicContact CE-CG 3.41Å; M1-L6 VanDerWaalsContact CE-CG 3.41Å; M1-M20 WeakPolarHBondContact O-CE 3.5Å; M1-L52 HydrophobicContact CE-CD2 3.37Å; M1-L52 HydrophobicContact SD-CD2 3.29Å; M1-L52 WeakPolarHBondContact SD-CD2 3.47Å; M1-Q55 HydrophobicContact CB-CB 3.91Å; M1-Q55 HydrophobicContact CG-CB 4.32Å; M1-Q55 PolarHBondContact N-O 3.48Å; M1-Q55 HydrophobicContact SD-CB 4.49Å; M1-Q55 PolarHBondContact SD-OE1 3.36Å; M1-V56 HydrophobicContact CB-CG2 3.91Å
2	G	60.9	Low	69.9	Low	35 Å²	35	70.3 Å²	70.3	36%	0.361	41%	0.409	S	S	.	.			trans	-84.1	163.8	177.5	0	0	0	0	0	112.1	E4 E5	G2-E4 PolarHBondContact O-N 3.11Å; G2-E4 VanDerWaalsContact O-N 3.12Å; G2-E5 PolarHBondContact N-OE2 2.91Å; G2-E5 PolarHBondContact O-N 3.48Å; G2-E5 VanDerWaalsContact O-N 3.12Å
3	S	62	Low	70.8	Confident	40 Å²	40	70.5 Å²	70.5	28%	0.28	41%	0.408	S	S	.	.	H	α-helix	trans	-55.3	-28.2	170.5	54	0	0	0	0	112.2	E5 L6 I7	S3-E5 VanDerWaalsContact C-N 3.34Å; S3-E5 PolarHBondContact O-N 3.43Å; S3-L6 PolarHBondContact O-N 3Å; S3-I7 VanDerWaalsContact O-CG1 3.27Å; S3-I7 WeakPolarHBondContact O-CG1 3.3Å; S3-I7 PolarHBondContact O-N 3.05Å
4	E	64	Low	71.8	Confident	157 Å²	157	76.6 Å²	76.6	73%	0.734	43%	0.431	S	S	*	.	H	α-helix	trans	-58.9	-38	176.6	-63.3	179.5	175.6	0	0	113.5	G2 I7 A8	G2-E4 PolarHBondContact O-N 3.11Å; G2-E4 VanDerWaalsContact O-N 3.12Å; E4-I7 PolarHBondContact O-N 3.28Å; E4-A8 PolarHBondContact O-N 2.85Å; E4-A8 VanDerWaalsContact O-N 3.12Å
5	E	69	Low	72.7	Confident	109 Å²	109	72.9 Å²	72.9	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-74.7	-30	179	-72.3	166.5	127.6	0	0	111.7	M1 G2 S3 A8	M1-E5 WeakPolarHBondContact CA-OE2 3.09Å; M1-E5 HydrophobicContact CE-CB 4.09Å; M1-E5 HydrophobicContact CG-CB 3.83Å; M1-E5 VanDerWaalsContact CG-CD 3.49Å; M1-E5 HydrophobicContact CG-CG 4.27Å; M1-E5 WeakPolarHBondContact CG-OE2 3.19Å; M1-E5 HydrophobicContact SD-CB 4.25Å; G2-E5 PolarHBondContact N-OE2 2.91Å; G2-E5 PolarHBondContact O-N 3.48Å; G2-E5 VanDerWaalsContact O-N 3.12Å; S3-E5 VanDerWaalsContact C-N 3.34Å; S3-E5 PolarHBondContact O-N 3.43Å; E5-A8 WeakPolarHBondContact O-CB 3.31Å; E5-A8 PolarHBondContact O-N 3.37Å
6	L	70.5	Confident	73.4	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-74.1	-34.7	171.3	-71.9	178.1	0	0	0	112.3	M1 S3 A8 L9 L11 A16 L19 M20 L52	M1-L6 HydrophobicContact CE-CD1 4.29Å; M1-L6 HydrophobicContact CE-CD2 3.39Å; M1-L6 HydrophobicContact CE-CG 3.41Å; M1-L6 VanDerWaalsContact CE-CG 3.41Å; S3-L6 PolarHBondContact O-N 3Å; L6-A8 PolarHBondContact O-N 2.87Å; L6-L9 HydrophobicContact CD2-CD1 3.96Å; L6-L9 WeakPolarHBondContact O-CB 3.38Å; L6-L9 PolarHBondContact O-N 3.15Å; L6-L11 HydrophobicContact CB-CD1 4Å; L6-L11 HydrophobicContact CD2-CD1 4.34Å; L6-A16 HydrophobicContact CB-CB 3.88Å; L6-L19 HydrophobicContact CD1-CB 4.18Å; L6-L19 HydrophobicContact CD1-CD2 4.09Å; L6-L19 HydrophobicContact CD1-CG 4.14Å; L6-L19 HydrophobicContact CD2-CD2 3.78Å; L6-M20 HydrophobicContact CD1-CG 3.56Å; L6-M20 HydrophobicContact CD1-SD 3.54Å; L6-M20 VanDerWaalsContact CD1-SD 3.54Å; L6-M20 HydrophobicContact CG-SD 4.48Å; L6-L52 HydrophobicContact CD2-CD1 4.25Å; L6-L52 HydrophobicContact CD2-CD2 4.11Å
7	I	70.4	Confident	74	Confident	66 Å²	66	70.6 Å²	70.6	34%	0.338	39%	0.389	S	S	.	.	H	α-helix	trans	-61.6	-35.7	172.2	-68.1	164	0	0	0	109.9	S3 E4 L9 G10 D13 A16	S3-I7 VanDerWaalsContact O-CG1 3.27Å; S3-I7 WeakPolarHBondContact O-CG1 3.3Å; S3-I7 PolarHBondContact O-N 3.05Å; E4-I7 PolarHBondContact O-N 3.28Å; I7-L9 PolarHBondContact O-N 3.33Å; I7-G10 PolarHBondContact O-N 3.38Å; I7-D13 HydrophobicContact CD1-CB 4.34Å; I7-A16 HydrophobicContact CG1-CB 3.88Å
8	A	74.2	Confident	74.6	Confident	87 Å²	87	70.7 Å²	70.7	72%	0.719	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.5	174	0	0	0	0	0	114	E4 E5 L6 G10	E4-A8 PolarHBondContact O-N 2.85Å; E4-A8 VanDerWaalsContact O-N 3.12Å; E5-A8 WeakPolarHBondContact O-CB 3.31Å; E5-A8 PolarHBondContact O-N 3.37Å; L6-A8 PolarHBondContact O-N 2.87Å; A8-G10 PolarHBondContact O-N 2.71Å
9	L	72.4	Confident	75.1	Confident	78 Å²	78	67.1 Å²	67.1	41%	0.408	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	0.1	170.8	-63.8	172.8	0	0	0	113.2	L6 I7 L40	L6-L9 HydrophobicContact CD2-CD1 3.96Å; L6-L9 WeakPolarHBondContact O-CB 3.38Å; L6-L9 PolarHBondContact O-N 3.15Å; I7-L9 PolarHBondContact O-N 3.33Å; L9-L40 HydrophobicContact CB-CD2 3.98Å; L9-L40 WeakPolarHBondContact O-CD2 3.27Å
10	G	77.1	Confident	75.4	Confident	58 Å²	58	64.8 Å²	64.8	60%	0.598	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.9	13.1	179.4	0	0	0	0	0	114.5	I7 A8	I7-G10 PolarHBondContact O-N 3.38Å; A8-G10 PolarHBondContact O-N 2.71Å
11	L	80.1	Confident	75.6	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.037	36%	0.362	C	S	.	.			trans	-76.1	140.7	173.1	-71.9	158.4	0	0	0	110.6	L6 D15 A16 L19 K39 L40	L6-L11 HydrophobicContact CB-CD1 4Å; L6-L11 HydrophobicContact CD2-CD1 4.34Å; L11-D15 HydrophobicContact CB-CB 4.45Å; L11-D15 HydrophobicContact CD2-CB 3.84Å; L11-A16 HydrophobicContact CB-CB 4.03Å; L11-L19 HydrophobicContact CD1-CD2 3.56Å; L11-K39 HydrophobicContact CD2-CB 3.71Å; L11-L40 HydrophobicContact CD1-CD2 4.16Å; L11-L40 HydrophobicContact CD2-CD2 4Å; L11-L40 HydrophobicContact CD2-CG 4.06Å; L11-L40 HydrophobicContact CG-CD2 3.64Å; L11-L40 HydrophobicContact CG-CG 4.19Å
12	K	83.9	Confident	76.9	Confident	157 Å²	157	65.9 Å²	65.9	68%	0.683	36%	0.358	S	S	*	.			trans	-64	151.1	164.5	-64.4	-179.6	-179.4	-179.4	0	109	E14 D15 A16	K12-E14 PolarHBondContact O-N 3.03Å; K12-E14 VanDerWaalsContact O-N 3.15Å; K12-D15 HydrophobicContact CB-CB 4.49Å; K12-D15 CarbonylContact O-C 3.51Å; K12-D15 WeakPolarHBondContact O-CA 3.29Å; K12-D15 PolarHBondContact O-N 3.44Å; K12-A16 PolarHBondContact O-N 3.38Å
13	D	81.2	Confident	77.7	Confident	73 Å²	73	64.3 Å²	64.3	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-51.4	-41.7	-178.8	-178.3	57.9	0	0	0	112.9	I7 A16 K17	I7-D13 HydrophobicContact CD1-CB 4.34Å; D13-A16 PolarHBondContact O-N 2.76Å; D13-K17 WeakPolarHBondContact O-CG 3.48Å; D13-K17 PolarHBondContact O-N 3.39Å; D13-K17 IonicContact OD1-NZ 3.81Å; D13-K17 WeakPolarHBondContact OD2-CE 3.42Å; D13-K17 IonicContact OD2-NZ 3.32Å; D13-K17 PolarHBondContact OD2-NZ 3.21Å
14	E	84.6	Confident	78.1	Confident	155 Å²	155	67 Å²	67	72%	0.724	35%	0.349	S	S	*	.	H	α-helix	trans	-63.8	-43.1	175.1	-65.2	-179	172.7	0	0	113.1	K12 K17 L18	K12-E14 PolarHBondContact O-N 3.03Å; K12-E14 VanDerWaalsContact O-N 3.15Å; E14-K17 PolarHBondContact O-N 2.9Å; E14-L18 WeakPolarHBondContact O-CB 3.42Å; E14-L18 PolarHBondContact O-N 3.4Å
15	D	86.2	Confident	78.3	Confident	22 Å²	22	64.3 Å²	64.3	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-71.5	-33.9	179.5	-68.5	-48.9	0	0	0	111.2	L11 K12 L18 L19 F35 K39	L11-D15 HydrophobicContact CB-CB 4.45Å; L11-D15 HydrophobicContact CD2-CB 3.84Å; K12-D15 HydrophobicContact CB-CB 4.49Å; K12-D15 CarbonylContact O-C 3.51Å; K12-D15 WeakPolarHBondContact O-CA 3.29Å; K12-D15 PolarHBondContact O-N 3.44Å; D15-L18 PolarHBondContact O-N 3.12Å; D15-L19 WeakPolarHBondContact O-CB 3.27Å; D15-L19 PolarHBondContact O-N 2.94Å; D15-F35 HydrophobicContact CB-CZ 4.36Å; D15-K39 WeakPolarHBondContact OD1-CE 3.31Å; D15-K39 IonicContact OD1-NZ 3.39Å; D15-K39 PolarHBondContact OD1-NZ 2.79Å; D15-K39 IonicContact OD2-NZ 3.75Å
16	A	83.4	Confident	78	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-65	-45.4	173.6	0	0	0	0	0	111.1	L6 I7 L11 K12 D13 L18 L19 M20	L6-A16 HydrophobicContact CB-CB 3.88Å; I7-A16 HydrophobicContact CG1-CB 3.88Å; L11-A16 HydrophobicContact CB-CB 4.03Å; K12-A16 PolarHBondContact O-N 3.38Å; D13-A16 PolarHBondContact O-N 2.76Å; A16-L18 VanDerWaalsContact C-N 3.34Å; A16-L18 PolarHBondContact O-N 2.89Å; A16-L19 PolarHBondContact O-N 3.03Å; A16-M20 WeakPolarHBondContact O-CG 3.42Å; A16-M20 PolarHBondContact O-N 3.25Å
17	K	83.6	Confident	77.9	Confident	107 Å²	107	63.1 Å²	63.1	47%	0.465	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-42.8	173.5	-76.1	168.7	179.1	163.3	0	112	D13 E14 M20 Q21	D13-K17 WeakPolarHBondContact O-CG 3.48Å; D13-K17 PolarHBondContact O-N 3.39Å; D13-K17 IonicContact OD1-NZ 3.81Å; D13-K17 WeakPolarHBondContact OD2-CE 3.42Å; D13-K17 IonicContact OD2-NZ 3.32Å; D13-K17 PolarHBondContact OD2-NZ 3.21Å; E14-K17 PolarHBondContact O-N 2.9Å; K17-M20 WeakPolarHBondContact O-CB 3.4Å; K17-M20 PolarHBondContact O-N 2.64Å; K17-Q21 WeakPolarHBondContact O-CG 3.49Å; K17-Q21 PolarHBondContact O-N 3.19Å
18	L	84.8	Confident	77.8	Confident	72 Å²	72	68 Å²	68	38%	0.377	37%	0.371	S	S	.	.	H	α-helix	trans	-67.6	-39.6	177.9	-173.2	59.5	0	0	0	111.9	E14 D15 A16 Q21 L22 F35	E14-L18 WeakPolarHBondContact O-CB 3.42Å; E14-L18 PolarHBondContact O-N 3.4Å; D15-L18 PolarHBondContact O-N 3.12Å; A16-L18 VanDerWaalsContact C-N 3.34Å; A16-L18 PolarHBondContact O-N 2.89Å; L18-Q21 PolarHBondContact O-N 3.26Å; L18-L22 VanDerWaalsContact O-CG 3.29Å; L18-L22 WeakPolarHBondContact O-CG 3.4Å; L18-L22 PolarHBondContact O-N 2.85Å; L18-F35 HydrophobicContact CB-CE2 4.49Å; L18-F35 HydrophobicContact CB-CZ 3.97Å; L18-F35 HydrophobicContact CD2-CD2 4.36Å; L18-F35 HydrophobicContact CD2-CE2 3.35Å; L18-F35 HydrophobicContact CD2-CZ 3.65Å; L18-F35 HydrophobicContact CG-CE2 3.9Å; L18-F35 HydrophobicContact CG-CZ 3.86Å
19	L	84	Confident	77.8	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-62.9	-42	173.8	-177.4	55.9	0	0	0	111.6	L6 L11 D15 A16 Q21 L22 L23 I32 F35	L6-L19 HydrophobicContact CD1-CB 4.18Å; L6-L19 HydrophobicContact CD1-CD2 4.09Å; L6-L19 HydrophobicContact CD1-CG 4.14Å; L6-L19 HydrophobicContact CD2-CD2 3.78Å; L11-L19 HydrophobicContact CD1-CD2 3.56Å; D15-L19 WeakPolarHBondContact O-CB 3.27Å; D15-L19 PolarHBondContact O-N 2.94Å; A16-L19 PolarHBondContact O-N 3.03Å; L19-Q21 VanDerWaalsContact C-N 3.35Å; L19-Q21 PolarHBondContact O-N 3.44Å; L19-L22 PolarHBondContact O-N 3.39Å; L19-L23 HydrophobicContact CD1-CD1 4.4Å; L19-L23 HydrophobicContact CD1-CG 4.3Å; L19-L23 HydrophobicContact CG-CD1 4.09Å; L19-L23 HydrophobicContact CG-CG 4.46Å; L19-L23 VanDerWaalsContact O-CG 3.26Å; L19-L23 WeakPolarHBondContact O-CG 3.5Å; L19-L23 PolarHBondContact O-N 3.32Å; L19-I32 HydrophobicContact CD1-CG2 3.69Å; L19-F35 HydrophobicContact CB-CD1 4.32Å; L19-F35 HydrophobicContact CB-CE1 3.88Å; L19-F35 HydrophobicContact CD1-CD1 4.07Å; L19-F35 HydrophobicContact CD1-CE1 4.49Å
20	M	80.8	Confident	77.9	Confident	21 Å²	21	68.3 Å²	68.3	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-56.9	-48.5	172.8	-72.5	-64.6	-68.9	0	0	111.2	M1 L6 A16 K17 L22 L23 E24 V56	M1-M20 WeakPolarHBondContact O-CE 3.5Å; L6-M20 HydrophobicContact CD1-CG 3.56Å; L6-M20 HydrophobicContact CD1-SD 3.54Å; L6-M20 VanDerWaalsContact CD1-SD 3.54Å; L6-M20 HydrophobicContact CG-SD 4.48Å; A16-M20 WeakPolarHBondContact O-CG 3.42Å; A16-M20 PolarHBondContact O-N 3.25Å; K17-M20 WeakPolarHBondContact O-CB 3.4Å; K17-M20 PolarHBondContact O-N 2.64Å; M20-L22 VanDerWaalsContact C-N 3.32Å; M20-L22 PolarHBondContact O-N 2.8Å; M20-L23 WeakPolarHBondContact O-CB 3.37Å; M20-L23 PolarHBondContact O-N 2.7Å; M20-L23 VanDerWaalsContact O-N 3.13Å; M20-E24 WeakPolarHBondContact O-CB 3.44Å; M20-E24 VanDerWaalsContact O-CG 3.28Å; M20-E24 WeakPolarHBondContact O-CG 3.37Å; M20-E24 PolarHBondContact O-N 3.48Å; M20-V56 HydrophobicContact CE-CB 4.18Å; M20-V56 HydrophobicContact CE-CG1 3.49Å; M20-V56 VanDerWaalsContact CE-CG1 3.49Å; M20-V56 HydrophobicContact CE-CG2 3.67Å; M20-V56 HydrophobicContact SD-CB 4.41Å; M20-V56 HydrophobicContact SD-CG1 4.03Å; M20-V56 HydrophobicContact SD-CG2 3.46Å; M20-V56 WeakPolarHBondContact SD-CG2 3.22Å
21	Q	81.1	Confident	78	Confident	109 Å²	109	69 Å²	69	51%	0.509	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-40.7	176.8	-72.9	176.8	-12.7	0	0	112.4	K17 L18 L19 E24 C25	K17-Q21 WeakPolarHBondContact O-CG 3.49Å; K17-Q21 PolarHBondContact O-N 3.19Å; L18-Q21 PolarHBondContact O-N 3.26Å; L19-Q21 VanDerWaalsContact C-N 3.35Å; L19-Q21 PolarHBondContact O-N 3.44Å; Q21-E24 PolarHBondContact O-N 2.75Å; Q21-C25 WeakPolarHBondContact O-CB 3.37Å; Q21-C25 PolarHBondContact O-N 2.91Å; Q21-C25 PolarHBondContact O-SG 3.3Å
22	L	81.8	Confident	78	Confident	29 Å²	29	68.6 Å²	68.6	15%	0.152	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-39.5	175.9	-69.6	172.6	0	0	0	112.1	L18 L19 M20 C27 I32 F35	L18-L22 VanDerWaalsContact O-CG 3.29Å; L18-L22 WeakPolarHBondContact O-CG 3.4Å; L18-L22 PolarHBondContact O-N 2.85Å; L19-L22 PolarHBondContact O-N 3.39Å; M20-L22 VanDerWaalsContact C-N 3.32Å; M20-L22 PolarHBondContact O-N 2.8Å; L22-C27 HydrophobicContact CB-CB 4.45Å; L22-C27 HydrophobicContact CD2-CB 4.21Å; L22-C27 WeakPolarHBondContact O-CB 3.36Å; L22-C27 PolarHBondContact O-N 2.81Å; L22-I32 HydrophobicContact CB-CG1 4.39Å; L22-F35 HydrophobicContact CD1-CB 3.81Å; L22-F35 HydrophobicContact CD1-CD1 3.75Å; L22-F35 HydrophobicContact CD1-CD2 3.89Å; L22-F35 HydrophobicContact CD1-CE1 4.33Å; L22-F35 HydrophobicContact CD1-CE2 4.45Å; L22-F35 HydrophobicContact CD1-CG 3.5Å; L22-F35 VanDerWaalsContact CD1-CG 3.5Å
23	L	77.8	Confident	77.8	Confident	2 Å²	2	63 Å²	63	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-66.6	-46.1	176.2	-69.4	167.9	0	0	0	111.1	L19 M20 G26 I32 I49 L52 R53 V56	L19-L23 HydrophobicContact CD1-CD1 4.4Å; L19-L23 HydrophobicContact CD1-CG 4.3Å; L19-L23 HydrophobicContact CG-CD1 4.09Å; L19-L23 HydrophobicContact CG-CG 4.46Å; L19-L23 VanDerWaalsContact O-CG 3.26Å; L19-L23 WeakPolarHBondContact O-CG 3.5Å; L19-L23 PolarHBondContact O-N 3.32Å; M20-L23 WeakPolarHBondContact O-CB 3.37Å; M20-L23 PolarHBondContact O-N 2.7Å; M20-L23 VanDerWaalsContact O-N 3.13Å; L23-G26 PolarHBondContact O-N 3.41Å; L23-I32 HydrophobicContact CD2-CD1 4.24Å; L23-I32 HydrophobicContact CD2-CG2 4.25Å; L23-I49 HydrophobicContact CD2-CG2 4.07Å; L23-L52 HydrophobicContact CD1-CB 4.11Å; L23-L52 HydrophobicContact CD2-CB 4.46Å; L23-R53 HydrophobicContact CD2-CB 4.07Å; L23-R53 HydrophobicContact CD2-CG 4.47Å; L23-V56 HydrophobicContact CB-CB 4.37Å; L23-V56 HydrophobicContact CB-CG1 4.07Å; L23-V56 HydrophobicContact CD1-CG2 4Å
24	E	69.3	Low	78	Confident	96 Å²	96	62.5 Å²	62.5	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-66.8	-40.7	179.8	-72.7	171.5	-174.5	0	0	112.9	M20 Q21 G26 V56	M20-E24 WeakPolarHBondContact O-CB 3.44Å; M20-E24 VanDerWaalsContact O-CG 3.28Å; M20-E24 WeakPolarHBondContact O-CG 3.37Å; M20-E24 PolarHBondContact O-N 3.48Å; Q21-E24 PolarHBondContact O-N 2.75Å; E24-G26 PolarHBondContact O-N 2.95Å; E24-G26 VanDerWaalsContact O-N 3.14Å; E24-V56 HydrophobicContact CG-CG1 3.63Å
25	C	67.4	Low	78.1	Confident	102 Å²	102	56.5 Å²	56.5	69%	0.689	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	3.9	179.9	-73.6	0	0	0	0	113.8	Q21 C27	Q21-C25 WeakPolarHBondContact O-CB 3.37Å; Q21-C25 PolarHBondContact O-N 2.91Å; Q21-C25 PolarHBondContact O-SG 3.3Å; C25-C27 VanDerWaalsContact C-N 3.26Å; C25-C27 PolarHBondContact O-N 2.87Å
26	G	64.3	Low	78	Confident	46 Å²	46	55.5 Å²	55.5	47%	0.474	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.4	28	178.2	0	0	0	0	0	113.3	L23 E24 R53	L23-G26 PolarHBondContact O-N 3.41Å; E24-G26 PolarHBondContact O-N 2.95Å; E24-G26 VanDerWaalsContact O-N 3.14Å; G26-R53 PolarHBondContact O-NH2 3.48Å
27	C	68.3	Low	78	Confident	37 Å²	37	58.4 Å²	58.4	25%	0.25	31%	0.314	C	S	.	.			trans	-58.9	154.2	-178.4	-78	0	0	0	0	112.6	L22 C25 I32 R53	L22-C27 HydrophobicContact CB-CB 4.45Å; L22-C27 HydrophobicContact CD2-CB 4.21Å; L22-C27 WeakPolarHBondContact O-CB 3.36Å; L22-C27 PolarHBondContact O-N 2.81Å; C25-C27 VanDerWaalsContact C-N 3.26Å; C25-C27 PolarHBondContact O-N 2.87Å; C27-I32 HydrophobicContact CB-CD1 4.35Å; C27-I32 HydrophobicContact CB-CG1 4.09Å; C27-I32 VanDerWaalsContact O-CD1 3.31Å; C27-I32 WeakPolarHBondContact O-CD1 3.31Å; C27-R53 PolarHBondContact O-NH2 3.43Å
28	R	67.3	Low	78.2	Confident	169 Å²	169	57.1 Å²	57.1	64%	0.638	32%	0.318	S	S	*	.			trans	-60.8	139.8	-178.9	-63.5	-176.1	-174.1	175.8	2.3	110.5	K30 T31 I32	R28-K30 PolarHBondContact O-N 3.46Å; R28-T31 WeakPolarHBondContact O-CA 3.11Å; R28-T31 VanDerWaalsContact O-CB 3.29Å; R28-T31 WeakPolarHBondContact O-CB 3.33Å; R28-T31 PolarHBondContact O-N 2.99Å; R28-I32 PolarHBondContact O-N 2.83Å; R28-I32 VanDerWaalsContact O-N 3.08Å
29	M	74.4	Confident	78.2	Confident	8 Å²	8	58 Å²	58	4%	0.039	32%	0.319	C	S	.	.	H	α-helix	trans	-52.5	-41.3	179.8	-178.7	56.4	77.7	0	0	112.4	T31 I32 L33 I49 K50 D289	M29-T31 VanDerWaalsContact C-N 3.29Å; M29-T31 PolarHBondContact O-N 3.44Å; M29-I32 PolarHBondContact O-N 2.93Å; M29-L33 HydrophobicContact CG-CD1 3.8Å; M29-L33 HydrophobicContact CG-CG 4.26Å; M29-L33 VanDerWaalsContact O-CB 3.31Å; M29-L33 WeakPolarHBondContact O-CB 3.24Å; M29-L33 WeakPolarHBondContact O-CG 3.29Å; M29-L33 PolarHBondContact O-N 2.98Å; M29-L33 HydrophobicContact SD-CD1 4.15Å; M29-L33 HydrophobicContact SD-CG 4.02Å; M29-I49 HydrophobicContact CE-CB 3.87Å; M29-I49 HydrophobicContact CE-CG2 3.57Å; M29-I49 HydrophobicContact SD-CB 3.7Å; M29-I49 HydrophobicContact SD-CD1 3.85Å; M29-I49 HydrophobicContact SD-CG1 4.39Å; M29-I49 HydrophobicContact SD-CG2 3.5Å; M29-I49 WeakPolarHBondContact SD-CG2 3.37Å; M29-K50 HydrophobicContact CE-CG 3.93Å; M29-D289 WeakPolarHBondContact CB-OD2 3.38Å; M29-D289 WeakPolarHBondContact CE-OD2 3.04Å
30	K	74	Confident	78	Confident	163 Å²	163	58.8 Å²	58.8	71%	0.709	32%	0.323	S	S	*	.	H	α-helix	trans	-58.7	-38.5	175.1	-172.2	178.2	-179.6	-179.4	0	113	R28 A34	R28-K30 PolarHBondContact O-N 3.46Å; K30-A34 VanDerWaalsContact O-CB 3.22Å; K30-A34 WeakPolarHBondContact O-CB 3.4Å; K30-A34 PolarHBondContact O-N 3.15Å
31	T	79.1	Confident	77.6	Confident	72 Å²	72	66.7 Å²	66.7	44%	0.442	37%	0.365	S	S	.	.	H	α-helix	trans	-69.7	-43.4	177.9	-53.2	0	0	0	0	110.8	R28 M29 A34 F35	R28-T31 WeakPolarHBondContact O-CA 3.11Å; R28-T31 VanDerWaalsContact O-CB 3.29Å; R28-T31 WeakPolarHBondContact O-CB 3.33Å; R28-T31 PolarHBondContact O-N 2.99Å; M29-T31 VanDerWaalsContact C-N 3.29Å; M29-T31 PolarHBondContact O-N 3.44Å; T31-A34 PolarHBondContact O-N 2.69Å; T31-F35 WeakPolarHBondContact O-CB 3.39Å; T31-F35 PolarHBondContact O-N 3.41Å
32	I	80.5	Confident	77.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-66.5	-44.5	178.4	-55.7	168.3	0	0	0	110.2	L19 L22 L23 C27 R28 M29 A34 F35 A36 I49	L19-I32 HydrophobicContact CD1-CG2 3.69Å; L22-I32 HydrophobicContact CB-CG1 4.39Å; L23-I32 HydrophobicContact CD2-CD1 4.24Å; L23-I32 HydrophobicContact CD2-CG2 4.25Å; C27-I32 HydrophobicContact CB-CD1 4.35Å; C27-I32 HydrophobicContact CB-CG1 4.09Å; C27-I32 VanDerWaalsContact O-CD1 3.31Å; C27-I32 WeakPolarHBondContact O-CD1 3.31Å; R28-I32 PolarHBondContact O-N 2.83Å; R28-I32 VanDerWaalsContact O-N 3.08Å; M29-I32 PolarHBondContact O-N 2.93Å; I32-A34 PolarHBondContact O-N 3.23Å; I32-F35 PolarHBondContact O-N 3.12Å; I32-A36 VanDerWaalsContact O-CB 3.24Å; I32-A36 WeakPolarHBondContact O-CB 3.42Å; I32-A36 PolarHBondContact O-N 3.21Å; I32-I49 HydrophobicContact CB-CD1 4.36Å; I32-I49 HydrophobicContact CB-CG2 4.29Å; I32-I49 HydrophobicContact CD1-CG2 4.34Å; I32-I49 HydrophobicContact CG2-CD1 3.89Å; I32-I49 HydrophobicContact CG2-CG1 4.3Å; I32-I49 HydrophobicContact CG2-CG2 3.72Å
33	L	81	Confident	77.5	Confident	39 Å²	39	70.4 Å²	70.4	20%	0.204	38%	0.383	C	S	.	.	H	α-helix	trans	-59.2	-45.6	174.6	-78.8	167.6	0	0	0	111.9	M29 S37 L44 I49	M29-L33 HydrophobicContact CG-CD1 3.8Å; M29-L33 HydrophobicContact CG-CG 4.26Å; M29-L33 VanDerWaalsContact O-CB 3.31Å; M29-L33 WeakPolarHBondContact O-CB 3.24Å; M29-L33 WeakPolarHBondContact O-CG 3.29Å; M29-L33 PolarHBondContact O-N 2.98Å; M29-L33 HydrophobicContact SD-CD1 4.15Å; M29-L33 HydrophobicContact SD-CG 4.02Å; L33-S37 WeakPolarHBondContact O-CB 3.47Å; L33-S37 PolarHBondContact O-N 3.13Å; L33-S37 PolarHBondContact O-OG 3.12Å; L33-L44 WeakPolarHBondContact CD2-O 3.32Å; L33-I49 HydrophobicContact CB-CD1 4.27Å; L33-I49 HydrophobicContact CD2-CD1 3.33Å; L33-I49 HydrophobicContact CG-CD1 3.53Å
34	A	83.6	Confident	77.5	Confident	62 Å²	62	70.9 Å²	70.9	51%	0.512	39%	0.385	S	S	.	.	H	α-helix	trans	-63.8	-43	178.1	0	0	0	0	0	111.4	K30 T31 I32 S38	K30-A34 VanDerWaalsContact O-CB 3.22Å; K30-A34 WeakPolarHBondContact O-CB 3.4Å; K30-A34 PolarHBondContact O-N 3.15Å; T31-A34 PolarHBondContact O-N 2.69Å; I32-A34 PolarHBondContact O-N 3.23Å; A34-S38 WeakPolarHBondContact O-CB 2.88Å; A34-S38 PolarHBondContact O-N 2.98Å; A34-S38 VanDerWaalsContact O-N 3.11Å; A34-S38 PolarHBondContact O-OG 3Å
35	F	86.7	Confident	77.9	Confident	30 Å²	30	69.4 Å²	69.4	13%	0.132	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-55.1	175.3	-179.1	-93.3	0	0	0	111.2	D15 L18 L19 L22 T31 I32 S37 S38 K39	D15-F35 HydrophobicContact CB-CZ 4.36Å; L18-F35 HydrophobicContact CB-CE2 4.49Å; L18-F35 HydrophobicContact CB-CZ 3.97Å; L18-F35 HydrophobicContact CD2-CD2 4.36Å; L18-F35 HydrophobicContact CD2-CE2 3.35Å; L18-F35 HydrophobicContact CD2-CZ 3.65Å; L18-F35 HydrophobicContact CG-CE2 3.9Å; L18-F35 HydrophobicContact CG-CZ 3.86Å; L19-F35 HydrophobicContact CB-CD1 4.32Å; L19-F35 HydrophobicContact CB-CE1 3.88Å; L19-F35 HydrophobicContact CD1-CD1 4.07Å; L19-F35 HydrophobicContact CD1-CE1 4.49Å; L22-F35 HydrophobicContact CD1-CB 3.81Å; L22-F35 HydrophobicContact CD1-CD1 3.75Å; L22-F35 HydrophobicContact CD1-CD2 3.89Å; L22-F35 HydrophobicContact CD1-CE1 4.33Å; L22-F35 HydrophobicContact CD1-CE2 4.45Å; L22-F35 HydrophobicContact CD1-CG 3.5Å; L22-F35 VanDerWaalsContact CD1-CG 3.5Å; T31-F35 WeakPolarHBondContact O-CB 3.39Å; T31-F35 PolarHBondContact O-N 3.41Å; I32-F35 PolarHBondContact O-N 3.12Å; F35-S37 VanDerWaalsContact C-N 3.34Å; F35-S37 PolarHBondContact O-N 3.13Å; F35-S38 PolarHBondContact O-N 2.9Å; F35-S38 PolarHBondContact O-OG 3.18Å; F35-K39 HydrophobicContact CE1-CG 4.27Å; F35-K39 HydrophobicContact CE2-CG 4.3Å; F35-K39 HydrophobicContact CZ-CG 4.07Å; F35-K39 WeakPolarHBondContact O-CG 3.5Å; F35-K39 PolarHBondContact O-N 3.4Å
36	A	84.2	Confident	78.1	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-56.6	-46.4	179.7	0	0	0	0	0	111.7	I32 S38 K39 L40 L44	I32-A36 VanDerWaalsContact O-CB 3.24Å; I32-A36 WeakPolarHBondContact O-CB 3.42Å; I32-A36 PolarHBondContact O-N 3.21Å; A36-S38 PolarHBondContact O-N 3.36Å; A36-K39 PolarHBondContact O-N 3.38Å; A36-K39 VanDerWaalsContact O-N 3.15Å; A36-L40 HydrophobicContact CB-CD1 4.11Å; A36-L40 VanDerWaalsContact O-CB 3.3Å; A36-L40 WeakPolarHBondContact O-CB 3.49Å; A36-L40 PolarHBondContact O-N 2.84Å; A36-L44 HydrophobicContact CB-CB 4.43Å; A36-L44 HydrophobicContact CB-CD1 3.89Å; A36-L44 HydrophobicContact CB-CG 4.26Å
37	S	84.6	Confident	78.4	Confident	61 Å²	61	69 Å²	69	43%	0.427	37%	0.374	S	S	.	.	H	α-helix	trans	-65.6	-25	179	-56.8	0	0	0	0	113.3	L33 F35	L33-S37 WeakPolarHBondContact O-CB 3.47Å; L33-S37 PolarHBondContact O-N 3.13Å; L33-S37 PolarHBondContact O-OG 3.12Å; F35-S37 VanDerWaalsContact C-N 3.34Å; F35-S37 PolarHBondContact O-N 3.13Å
38	S	86.3	Confident	78.9	Confident	80 Å²	80	69.8 Å²	69.8	56%	0.559	37%	0.374	S	S	*	.	H	α-helix	trans	-81.5	-16.3	177.1	75	0	0	0	0	113.9	A34 F35 A36	A34-S38 WeakPolarHBondContact O-CB 2.88Å; A34-S38 PolarHBondContact O-N 2.98Å; A34-S38 VanDerWaalsContact O-N 3.11Å; A34-S38 PolarHBondContact O-OG 3Å; F35-S38 PolarHBondContact O-N 2.9Å; F35-S38 PolarHBondContact O-OG 3.18Å; A36-S38 PolarHBondContact O-N 3.36Å
39	K	84.9	Confident	79.3	Confident	91 Å²	91	61.7 Å²	61.7	40%	0.396	34%	0.344	S	S	.	.	H	α-helix	trans	-118.6	-28.3	-171.7	-60	-58.3	-176.4	134	0	114.1	L11 D15 F35 A36	L11-K39 HydrophobicContact CD2-CB 3.71Å; D15-K39 WeakPolarHBondContact OD1-CE 3.31Å; D15-K39 IonicContact OD1-NZ 3.39Å; D15-K39 PolarHBondContact OD1-NZ 2.79Å; D15-K39 IonicContact OD2-NZ 3.75Å; F35-K39 HydrophobicContact CE1-CG 4.27Å; F35-K39 HydrophobicContact CE2-CG 4.3Å; F35-K39 HydrophobicContact CZ-CG 4.07Å; F35-K39 WeakPolarHBondContact O-CG 3.5Å; F35-K39 PolarHBondContact O-N 3.4Å; A36-K39 PolarHBondContact O-N 3.38Å; A36-K39 VanDerWaalsContact O-N 3.15Å
40	L	80.6	Confident	79.1	Confident	18 Å²	18	64.4 Å²	64.4	9%	0.094	36%	0.355	C	S	.	.	S	Bend	trans	-94.8	143.3	180	-68.9	167.1	0	0	0	111.1	L9 L11 A36 R42 L44	L9-L40 HydrophobicContact CB-CD2 3.98Å; L9-L40 WeakPolarHBondContact O-CD2 3.27Å; L11-L40 HydrophobicContact CD1-CD2 4.16Å; L11-L40 HydrophobicContact CD2-CD2 4Å; L11-L40 HydrophobicContact CD2-CG 4.06Å; L11-L40 HydrophobicContact CG-CD2 3.64Å; L11-L40 HydrophobicContact CG-CG 4.19Å; A36-L40 HydrophobicContact CB-CD1 4.11Å; A36-L40 VanDerWaalsContact O-CB 3.3Å; A36-L40 WeakPolarHBondContact O-CB 3.49Å; A36-L40 PolarHBondContact O-N 2.84Å; L40-R42 VanDerWaalsContact CB-O 3.31Å; L40-R42 WeakPolarHBondContact CB-O 3.43Å; L40-R42 PolarHBondContact O-N 3.34Å; L40-L44 HydrophobicContact CD1-CD1 3.62Å; L40-L44 HydrophobicContact CD1-CD2 4.08Å; L40-L44 HydrophobicContact CD1-CG 3.55Å
41	L	72.9	Confident	79.1	Confident	187 Å²	187	61.1 Å²	61.1	98%	0.979	34%	0.344	S	S	*	.	S	Bend	trans	-63.8	-29	173.9	-75	162.9	0	0	0	112.5
42	R	80.7	Confident	79	Confident	133 Å²	133	58.4 Å²	58.4	50%	0.502	33%	0.327	S	S	.	.	S	Bend	trans	-115	128.4	173.5	-171.4	-175.9	69.8	105	-1.6	109.2	L40 L44 E48	L40-R42 VanDerWaalsContact CB-O 3.31Å; L40-R42 WeakPolarHBondContact CB-O 3.43Å; L40-R42 PolarHBondContact O-N 3.34Å; R42-L44 PolarHBondContact O-N 3.12Å; R42-E48 IonicContact CZ-OE1 3.28Å; R42-E48 VanDerWaalsContact CZ-OE1 3.28Å; R42-E48 IonicContact CZ-OE2 3.79Å; R42-E48 IonicContact NH1-OE1 3Å; R42-E48 PolarHBondContact NH1-OE1 3.08Å; R42-E48 IonicContact NH1-OE2 3.43Å; R42-E48 PolarHBondContact NH1-OE2 2.95Å; R42-E48 VanDerWaalsContact NH2-CD 3.27Å; R42-E48 IonicContact NH2-OE1 3.68Å; R42-E48 PolarHBondContact NH2-OE1 3.01Å; R42-E48 IonicContact NH2-OE2 2.69Å; R42-E48 PolarHBondContact NH2-OE2 3.25Å
43	P	78.5	Confident	78.6	Confident	82 Å²	82	60.7 Å²	60.7	53%	0.532	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-62.8	132.3	173	25.8	-32.4	0	0	0	109.8
44	L	79.1	Confident	77.9	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.063	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-72.1	142.1	170.3	-64.6	177.9	0	0	0	109.7	L33 A36 L40 R42 E48 I49 L52	L33-L44 WeakPolarHBondContact CD2-O 3.32Å; A36-L44 HydrophobicContact CB-CB 4.43Å; A36-L44 HydrophobicContact CB-CD1 3.89Å; A36-L44 HydrophobicContact CB-CG 4.26Å; L40-L44 HydrophobicContact CD1-CD1 3.62Å; L40-L44 HydrophobicContact CD1-CD2 4.08Å; L40-L44 HydrophobicContact CD1-CG 3.55Å; R42-L44 PolarHBondContact O-N 3.12Å; L44-E48 WeakPolarHBondContact CA-OE2 3.45Å; L44-E48 HydrophobicContact CD2-CB 4.34Å; L44-I49 HydrophobicContact CB-CD1 4.2Å; L44-I49 HydrophobicContact CB-CG1 3.95Å; L44-I49 HydrophobicContact CD1-CG1 4.04Å; L44-L52 HydrophobicContact CD1-CD1 3.76Å
45	T	77.3	Confident	77.3	Confident	65 Å²	65	65 Å²	65	40%	0.399	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-79.1	158.4	170.1	62.7	0	0	0	0	110.5	S47 E48 I49	T45-S47 PolarHBondContact O-N 3.37Å; T45-E48 PolarHBondContact N-OE2 3.17Å; T45-E48 PolarHBondContact O-N 2.96Å; T45-E48 VanDerWaalsContact O-N 3.13Å; T45-E48 VanDerWaalsContact OG1-CD 3.24Å; T45-E48 VanDerWaalsContact OG1-CG 3.27Å; T45-E48 WeakPolarHBondContact OG1-CG 3.47Å; T45-E48 PolarHBondContact OG1-N 3.31Å; T45-E48 PolarHBondContact OG1-OE2 3.14Å; T45-I49 PolarHBondContact O-N 3.14Å; T45-I49 VanDerWaalsContact O-N 3.13Å
46	S	71.9	Confident	76.4	Confident	59 Å²	59	64.6 Å²	64.6	41%	0.413	35%	0.347	S	S	.	.	H	α-helix	trans	-56.2	-34.4	174.1	-52.4	0	0	0	0	112.1	K50	S46-K50 WeakPolarHBondContact O-CG 3.32Å; S46-K50 PolarHBondContact O-N 3.07Å; S46-K50 VanDerWaalsContact O-N 3.12Å
47	S	70.7	Confident	75.4	Confident	81 Å²	81	69.2 Å²	69.2	57%	0.566	37%	0.367	S	S	*	.	H	α-helix	trans	-66.1	-42.5	177.4	-51.4	0	0	0	0	112.2	T45 K50 I51	T45-S47 PolarHBondContact O-N 3.37Å; S47-K50 WeakPolarHBondContact O-CB 3.43Å; S47-K50 PolarHBondContact O-N 3.13Å; S47-I51 WeakPolarHBondContact O-CG1 3.42Å; S47-I51 PolarHBondContact O-N 3.25Å; S47-I51 VanDerWaalsContact O-N 3.14Å
48	E	77.9	Confident	73.9	Confident	53 Å²	53	71.6 Å²	71.6	25%	0.248	38%	0.381	C	S	.	.	H	α-helix	trans	-65.8	-43	177.9	-72.4	160.8	151.5	0	0	111.4	R42 L44 T45 K50 I51 L52	R42-E48 IonicContact CZ-OE1 3.28Å; R42-E48 VanDerWaalsContact CZ-OE1 3.28Å; R42-E48 IonicContact CZ-OE2 3.79Å; R42-E48 IonicContact NH1-OE1 3Å; R42-E48 PolarHBondContact NH1-OE1 3.08Å; R42-E48 IonicContact NH1-OE2 3.43Å; R42-E48 PolarHBondContact NH1-OE2 2.95Å; R42-E48 VanDerWaalsContact NH2-CD 3.27Å; R42-E48 IonicContact NH2-OE1 3.68Å; R42-E48 PolarHBondContact NH2-OE1 3.01Å; R42-E48 IonicContact NH2-OE2 2.69Å; R42-E48 PolarHBondContact NH2-OE2 3.25Å; L44-E48 WeakPolarHBondContact CA-OE2 3.45Å; L44-E48 HydrophobicContact CD2-CB 4.34Å; T45-E48 PolarHBondContact N-OE2 3.17Å; T45-E48 PolarHBondContact O-N 2.96Å; T45-E48 VanDerWaalsContact O-N 3.13Å; T45-E48 VanDerWaalsContact OG1-CD 3.24Å; T45-E48 VanDerWaalsContact OG1-CG 3.27Å; T45-E48 WeakPolarHBondContact OG1-CG 3.47Å; T45-E48 PolarHBondContact OG1-N 3.31Å; T45-E48 PolarHBondContact OG1-OE2 3.14Å; E48-K50 VanDerWaalsContact C-N 3.28Å; E48-K50 PolarHBondContact O-N 2.88Å; E48-I51 WeakPolarHBondContact O-CB 3.29Å; E48-I51 PolarHBondContact O-N 3.09Å; E48-I51 VanDerWaalsContact O-N 3.17Å; E48-L52 VanDerWaalsContact O-CG 3.32Å; E48-L52 WeakPolarHBondContact O-CG 3.41Å; E48-L52 PolarHBondContact O-N 3.27Å
49	I	76.9	Confident	72.2	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.3	-35.9	176.5	-67.3	171.1	0	0	0	111.6	L23 M29 I32 L33 L44 T45 L52 R53	L23-I49 HydrophobicContact CD2-CG2 4.07Å; M29-I49 HydrophobicContact CE-CB 3.87Å; M29-I49 HydrophobicContact CE-CG2 3.57Å; M29-I49 HydrophobicContact SD-CB 3.7Å; M29-I49 HydrophobicContact SD-CD1 3.85Å; M29-I49 HydrophobicContact SD-CG1 4.39Å; M29-I49 HydrophobicContact SD-CG2 3.5Å; M29-I49 WeakPolarHBondContact SD-CG2 3.37Å; I32-I49 HydrophobicContact CB-CD1 4.36Å; I32-I49 HydrophobicContact CB-CG2 4.29Å; I32-I49 HydrophobicContact CD1-CG2 4.34Å; I32-I49 HydrophobicContact CG2-CD1 3.89Å; I32-I49 HydrophobicContact CG2-CG1 4.3Å; I32-I49 HydrophobicContact CG2-CG2 3.72Å; L33-I49 HydrophobicContact CB-CD1 4.27Å; L33-I49 HydrophobicContact CD2-CD1 3.33Å; L33-I49 HydrophobicContact CG-CD1 3.53Å; L44-I49 HydrophobicContact CB-CD1 4.2Å; L44-I49 HydrophobicContact CB-CG1 3.95Å; L44-I49 HydrophobicContact CD1-CG1 4.04Å; T45-I49 PolarHBondContact O-N 3.14Å; T45-I49 VanDerWaalsContact O-N 3.13Å; I49-L52 PolarHBondContact O-N 3.06Å; I49-R53 VanDerWaalsContact O-CB 3.29Å; I49-R53 WeakPolarHBondContact O-CB 3.31Å; I49-R53 PolarHBondContact O-N 3.15Å
50	K	68.8	Low	70.8	Confident	64 Å²	64	69 Å²	69	28%	0.278	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-44	173.8	-77.5	177.2	176.2	-171.9	0	112.3	M29 S46 S47 E48 R53 N54 D289	M29-K50 HydrophobicContact CE-CG 3.93Å; S46-K50 WeakPolarHBondContact O-CG 3.32Å; S46-K50 PolarHBondContact O-N 3.07Å; S46-K50 VanDerWaalsContact O-N 3.12Å; S47-K50 WeakPolarHBondContact O-CB 3.43Å; S47-K50 PolarHBondContact O-N 3.13Å; E48-K50 VanDerWaalsContact C-N 3.28Å; E48-K50 PolarHBondContact O-N 2.88Å; K50-R53 PolarHBondContact O-N 2.99Å; K50-N54 WeakPolarHBondContact O-CB 3.24Å; K50-N54 VanDerWaalsContact O-CG 3.29Å; K50-N54 PolarHBondContact O-N 3.35Å; K50-N54 PolarHBondContact O-OD1 3.29Å; K50-D289 WeakPolarHBondContact CE-O 3.41Å; K50-D289 PolarHBondContact NZ-O 3.03Å
51	I	75.4	Confident	69.9	Low	95 Å²	95	73.4 Å²	73.4	49%	0.487	40%	0.401	S	S	.	.	H	α-helix	trans	-59.9	-49.7	176.2	-66	166	0	0	0	109.6	S47 E48 R53 N54 Q55	S47-I51 WeakPolarHBondContact O-CG1 3.42Å; S47-I51 PolarHBondContact O-N 3.25Å; S47-I51 VanDerWaalsContact O-N 3.14Å; E48-I51 WeakPolarHBondContact O-CB 3.29Å; E48-I51 PolarHBondContact O-N 3.09Å; E48-I51 VanDerWaalsContact O-N 3.17Å; I51-R53 VanDerWaalsContact C-N 3.31Å; I51-R53 PolarHBondContact O-N 3.39Å; I51-N54 PolarHBondContact O-N 2.79Å; I51-Q55 HydrophobicContact CG2-CG 4.49Å; I51-Q55 VanDerWaalsContact O-CG 3.27Å; I51-Q55 WeakPolarHBondContact O-CG 3.26Å; I51-Q55 PolarHBondContact O-N 2.84Å
52	L	76.2	Confident	70.1	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-56.9	-45.9	176.9	-65	175.5	0	0	0	111.3	M1 L6 L23 L44 E48 I49 Q55 V56	M1-L52 HydrophobicContact CE-CD2 3.37Å; M1-L52 HydrophobicContact SD-CD2 3.29Å; M1-L52 WeakPolarHBondContact SD-CD2 3.47Å; L6-L52 HydrophobicContact CD2-CD1 4.25Å; L6-L52 HydrophobicContact CD2-CD2 4.11Å; L23-L52 HydrophobicContact CD1-CB 4.11Å; L23-L52 HydrophobicContact CD2-CB 4.46Å; L44-L52 HydrophobicContact CD1-CD1 3.76Å; E48-L52 VanDerWaalsContact O-CG 3.32Å; E48-L52 WeakPolarHBondContact O-CG 3.41Å; E48-L52 PolarHBondContact O-N 3.27Å; I49-L52 PolarHBondContact O-N 3.06Å; L52-Q55 PolarHBondContact O-N 3.46Å; L52-V56 WeakPolarHBondContact O-CB 3.46Å; L52-V56 VanDerWaalsContact O-CG2 3.22Å; L52-V56 WeakPolarHBondContact O-CG2 3.29Å; L52-V56 PolarHBondContact O-N 3.26Å
53	R	72.7	Confident	70.2	Confident	48 Å²	48	66 Å²	66	18%	0.181	37%	0.368	C	S	.	.	H	α-helix	trans	-61.5	-47	180	-166.1	-175.6	-145.2	168.7	9.4	111.9	L23 G26 C27 I49 K50 I51 Q55 V56 F57	L23-R53 HydrophobicContact CD2-CB 4.07Å; L23-R53 HydrophobicContact CD2-CG 4.47Å; G26-R53 PolarHBondContact O-NH2 3.48Å; C27-R53 PolarHBondContact O-NH2 3.43Å; I49-R53 VanDerWaalsContact O-CB 3.29Å; I49-R53 WeakPolarHBondContact O-CB 3.31Å; I49-R53 PolarHBondContact O-N 3.15Å; K50-R53 PolarHBondContact O-N 2.99Å; I51-R53 VanDerWaalsContact C-N 3.31Å; I51-R53 PolarHBondContact O-N 3.39Å; R53-Q55 PolarHBondContact O-N 3.26Å; R53-V56 PolarHBondContact O-N 3.11Å; R53-F57 PolarHBondContact O-N 3.31Å
54	N	66.4	Low	70.5	Confident	95 Å²	95	64.5 Å²	64.5	51%	0.508	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-32.1	178.4	-70.4	-2.1	0	0	0	111.9	K50 I51	K50-N54 WeakPolarHBondContact O-CB 3.24Å; K50-N54 VanDerWaalsContact O-CG 3.29Å; K50-N54 PolarHBondContact O-N 3.35Å; K50-N54 PolarHBondContact O-OD1 3.29Å; I51-N54 PolarHBondContact O-N 2.79Å
55	Q	71.1	Confident	71	Confident	98 Å²	98	67.8 Å²	67.8	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-79	-25.6	176.9	-69.4	172.8	-20.1	0	0	114	M1 I51 L52 R53	M1-Q55 HydrophobicContact CB-CB 3.91Å; M1-Q55 HydrophobicContact CG-CB 4.32Å; M1-Q55 PolarHBondContact N-O 3.48Å; M1-Q55 HydrophobicContact SD-CB 4.49Å; M1-Q55 PolarHBondContact SD-OE1 3.36Å; I51-Q55 HydrophobicContact CG2-CG 4.49Å; I51-Q55 VanDerWaalsContact O-CG 3.27Å; I51-Q55 WeakPolarHBondContact O-CG 3.26Å; I51-Q55 PolarHBondContact O-N 2.84Å; L52-Q55 PolarHBondContact O-N 3.46Å; R53-Q55 PolarHBondContact O-N 3.26Å
56	V	67.2	Low	71.7	Confident	20 Å²	20	64.9 Å²	64.9	12%	0.121	36%	0.359	C	S	.	.	H	α-helix	trans	-90.6	-41.3	-179.8	170.4	0	0	0	0	111.2	M1 M20 L23 E24 L52 R53 P58	M1-V56 HydrophobicContact CB-CG2 3.91Å; M20-V56 HydrophobicContact CE-CB 4.18Å; M20-V56 HydrophobicContact CE-CG1 3.49Å; M20-V56 VanDerWaalsContact CE-CG1 3.49Å; M20-V56 HydrophobicContact CE-CG2 3.67Å; M20-V56 HydrophobicContact SD-CB 4.41Å; M20-V56 HydrophobicContact SD-CG1 4.03Å; M20-V56 HydrophobicContact SD-CG2 3.46Å; M20-V56 WeakPolarHBondContact SD-CG2 3.22Å; L23-V56 HydrophobicContact CB-CB 4.37Å; L23-V56 HydrophobicContact CB-CG1 4.07Å; L23-V56 HydrophobicContact CD1-CG2 4Å; E24-V56 HydrophobicContact CG-CG1 3.63Å; L52-V56 WeakPolarHBondContact O-CB 3.46Å; L52-V56 VanDerWaalsContact O-CG2 3.22Å; L52-V56 WeakPolarHBondContact O-CG2 3.29Å; L52-V56 PolarHBondContact O-N 3.26Å; R53-V56 PolarHBondContact O-N 3.11Å; V56-P58 WeakPolarHBondContact O-CD 3.35Å
57	F	62.5	Low	72.7	Confident	98 Å²	98	62.6 Å²	62.6	43%	0.43	34%	0.342	S	S	.	.			trans	-124	79.6	-179.5	-156.5	-94.1	0	0	0	109.6	R53 G59 S60	R53-F57 PolarHBondContact O-N 3.31Å; F57-G59 VanDerWaalsContact CE1-C 3.49Å; F57-G59 PolarHBondContact O-N 3.45Å; F57-S60 PolarHBondContact O-N 2.87Å
58	P	54.6	Low	73.8	Confident	110 Å²	110	62.9 Å²	62.9	71%	0.714	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-4.9	172.4	25.3	-32.2	0	0	0	112.7	V56 S60	V56-P58 WeakPolarHBondContact O-CD 3.35Å; P58-S60 VanDerWaalsContact C-N 3.28Å; P58-S60 PolarHBondContact O-N 2.95Å
59	G	49.2	Very low	74.5	Confident	52 Å²	52	64.1 Å²	64.1	54%	0.536	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	12.3	176.2	0	0	0	0	0	115.6	F57 K61	F57-G59 VanDerWaalsContact CE1-C 3.49Å; F57-G59 PolarHBondContact O-N 3.45Å; G59-K61 PolarHBondContact O-N 3.33Å
60	S	55.7	Low	75.3	Confident	65 Å²	65	64.3 Å²	64.3	46%	0.455	34%	0.344	S	S	.	.	S	Bend	trans	-58.7	120.7	160.6	55.8	0	0	0	0	107.1	F57 P58 E62	F57-S60 PolarHBondContact O-N 2.87Å; P58-S60 VanDerWaalsContact C-N 3.28Å; P58-S60 PolarHBondContact O-N 2.95Å; S60-E62 PolarHBondContact O-N 2.92Å; S60-E62 VanDerWaalsContact O-N 3.11Å
61	K	62.9	Low	76.5	Confident	111 Å²	111	66 Å²	66	48%	0.483	35%	0.349	S	S	.	.			trans	-44.1	125.7	173.1	-78.7	-169.3	175.7	-166	0	107.9	G59 D65 V66	G59-K61 PolarHBondContact O-N 3.33Å; K61-D65 HydrophobicContact CB-CB 4.13Å; K61-D65 HydrophobicContact CG-CB 4.45Å; K61-V66 HydrophobicContact CB-CG2 3.71Å; K61-V66 HydrophobicContact CD-CG2 4.24Å
62	E	75.7	Confident	77.4	Confident	133 Å²	133	68.2 Å²	68.2	62%	0.621	36%	0.355	S	S	*	.			trans	-59	149.5	174.5	-68.3	-170.3	167.2	0	0	107.6	S60 S64 D65 V66	S60-E62 PolarHBondContact O-N 2.92Å; S60-E62 VanDerWaalsContact O-N 3.11Å; E62-S64 WeakPolarHBondContact CB-OG 3.5Å; E62-S64 PolarHBondContact O-N 3.48Å; E62-S64 VanDerWaalsContact O-N 3.1Å; E62-S64 PolarHBondContact OE2-OG 2.8Å; E62-D65 PolarHBondContact N-OD2 3.28Å; E62-D65 WeakPolarHBondContact O-CA 3.42Å; E62-D65 WeakPolarHBondContact O-CB 2.89Å; E62-D65 PolarHBondContact O-N 3Å; E62-V66 PolarHBondContact O-N 3.37Å
63	L	83.4	Confident	78.1	Confident	32 Å²	32	68.7 Å²	68.7	17%	0.168	36%	0.358	C	S	.	.	H	α-helix	trans	-56	-31.8	178.4	180	58.4	0	0	0	111.7	V66 L67 I85 L291 E292 L295	L63-V66 PolarHBondContact O-N 3.08Å; L63-L67 HydrophobicContact CD1-CD1 4.35Å; L63-L67 HydrophobicContact CD1-CG 4.18Å; L63-L67 HydrophobicContact CG-CD1 4.02Å; L63-L67 HydrophobicContact CG-CG 4.34Å; L63-L67 WeakPolarHBondContact O-CB 3.22Å; L63-L67 WeakPolarHBondContact O-CG 2.99Å; L63-L67 PolarHBondContact O-N 2.94Å; L63-I85 HydrophobicContact CD2-CD1 3.14Å; L63-I85 HydrophobicContact CG-CD1 4.27Å; L63-L291 HydrophobicContact CD1-CD2 4.41Å; L63-L291 HydrophobicContact CD1-CG 4.48Å; L63-L291 HydrophobicContact CD2-CD2 4.02Å; L63-E292 HydrophobicContact CB-CG 4.13Å; L63-E292 HydrophobicContact CD1-CG 3.99Å; L63-L295 HydrophobicContact CD1-CD1 3.62Å
64	S	85.8	Confident	79.2	Confident	49 Å²	49	66.5 Å²	66.5	34%	0.343	35%	0.349	S	S	.	.	H	α-helix	trans	-53	-53	167.6	43.2	0	0	0	0	112.1	E62 V66 L67 D68	E62-S64 WeakPolarHBondContact CB-OG 3.5Å; E62-S64 PolarHBondContact O-N 3.48Å; E62-S64 VanDerWaalsContact O-N 3.1Å; E62-S64 PolarHBondContact OE2-OG 2.8Å; S64-V66 VanDerWaalsContact C-N 3.3Å; S64-V66 PolarHBondContact O-N 3.33Å; S64-L67 PolarHBondContact O-N 2.91Å; S64-D68 WeakPolarHBondContact O-CB 3.32Å; S64-D68 VanDerWaalsContact O-CG 3.27Å; S64-D68 PolarHBondContact O-N 3.22Å
65	D	89.2	Confident	80.5	Confident	82 Å²	82	64.4 Å²	64.4	44%	0.439	34%	0.338	S	S	.	.	H	α-helix	trans	-60.8	-39.2	178.4	-60.6	-41.4	0	0	0	112.2	K61 E62 E69	K61-D65 HydrophobicContact CB-CB 4.13Å; K61-D65 HydrophobicContact CG-CB 4.45Å; E62-D65 PolarHBondContact N-OD2 3.28Å; E62-D65 WeakPolarHBondContact O-CA 3.42Å; E62-D65 WeakPolarHBondContact O-CB 2.89Å; E62-D65 PolarHBondContact O-N 3Å; D65-E69 WeakPolarHBondContact O-CB 3.29Å; D65-E69 PolarHBondContact O-N 3.23Å
66	V	90.9	Very high	81.7	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.018	32%	0.321	C	S	.	.	H	α-helix	trans	-65.8	-47.5	177.2	175.9	0	0	0	0	110.6	K61 E62 L63 S64 D68 E69 I70 E292 L295 I296	K61-V66 HydrophobicContact CB-CG2 3.71Å; K61-V66 HydrophobicContact CD-CG2 4.24Å; E62-V66 PolarHBondContact O-N 3.37Å; L63-V66 PolarHBondContact O-N 3.08Å; S64-V66 VanDerWaalsContact C-N 3.3Å; S64-V66 PolarHBondContact O-N 3.33Å; V66-D68 VanDerWaalsContact C-N 3.33Å; V66-D68 PolarHBondContact O-N 2.85Å; V66-E69 PolarHBondContact O-N 3.17Å; V66-I70 HydrophobicContact CG1-CD1 3.94Å; V66-I70 VanDerWaalsContact O-CG1 3.27Å; V66-I70 WeakPolarHBondContact O-CG1 3.42Å; V66-I70 PolarHBondContact O-N 3.48Å; V66-I70 VanDerWaalsContact O-N 3.1Å; V66-E292 HydrophobicContact CG2-CB 4.19Å; V66-E292 HydrophobicContact CG2-CG 4.4Å; V66-L295 HydrophobicContact CG1-CB 4.08Å; V66-I296 HydrophobicContact CG1-CD1 4.35Å; V66-I296 HydrophobicContact CG1-CG1 3.75Å; V66-I296 HydrophobicContact CG2-CD1 4.03Å; V66-I296 HydrophobicContact CG2-CG1 4.34Å
67	L	93.3	Very high	83.1	Confident	12 Å²	12	62.3 Å²	62.3	6%	0.063	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-40.1	178.6	-68.8	168.7	0	0	0	111.4	L63 S64 I70 R71 V76 V78 V88 L295	L63-L67 HydrophobicContact CD1-CD1 4.35Å; L63-L67 HydrophobicContact CD1-CG 4.18Å; L63-L67 HydrophobicContact CG-CD1 4.02Å; L63-L67 HydrophobicContact CG-CG 4.34Å; L63-L67 WeakPolarHBondContact O-CB 3.22Å; L63-L67 WeakPolarHBondContact O-CG 2.99Å; L63-L67 PolarHBondContact O-N 2.94Å; S64-L67 PolarHBondContact O-N 2.91Å; L67-I70 PolarHBondContact O-N 3.29Å; L67-R71 WeakPolarHBondContact O-CB 3.23Å; L67-R71 VanDerWaalsContact O-CG 3.25Å; L67-R71 WeakPolarHBondContact O-CG 3.37Å; L67-R71 PolarHBondContact O-N 3Å; L67-V76 HydrophobicContact CD2-CG1 3.82Å; L67-V78 HydrophobicContact CD1-CG2 3.94Å; L67-V78 HydrophobicContact CD2-CG2 3.97Å; L67-V88 HydrophobicContact CD2-CG1 4.07Å; L67-L295 HydrophobicContact CD2-CD1 4.16Å
68	D	93.2	Very high	84.5	Confident	87 Å²	87	59.9 Å²	59.9	47%	0.465	32%	0.32	S	S	.	.	H	α-helix	trans	-68.1	-36.1	178.9	-72.9	-11.8	0	0	0	112.2	S64 V66 R71	S64-D68 WeakPolarHBondContact O-CB 3.32Å; S64-D68 VanDerWaalsContact O-CG 3.27Å; S64-D68 PolarHBondContact O-N 3.22Å; V66-D68 VanDerWaalsContact C-N 3.33Å; V66-D68 PolarHBondContact O-N 2.85Å; D68-R71 PolarHBondContact O-N 3.44Å; D68-R71 IonicContact OD1-CZ 3.73Å; D68-R71 IonicContact OD1-NH1 2.71Å; D68-R71 PolarHBondContact OD1-NH1 3.2Å
69	E	92.5	Very high	86.2	Confident	79 Å²	79	57 Å²	57	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-46.3	170.5	-173.2	62.7	-148.4	0	0	111.4	D65 V66 R71 K72	D65-E69 WeakPolarHBondContact O-CB 3.29Å; D65-E69 PolarHBondContact O-N 3.23Å; V66-E69 PolarHBondContact O-N 3.17Å; E69-R71 VanDerWaalsContact C-N 3.35Å; E69-R71 PolarHBondContact O-N 3.36Å; E69-K72 WeakPolarHBondContact O-CB 3.5Å; E69-K72 WeakPolarHBondContact O-CG 3.46Å; E69-K72 PolarHBondContact O-N 2.81Å; E69-K72 IonicContact OE1-NZ 3.14Å; E69-K72 PolarHBondContact OE1-NZ 3.48Å; E69-K72 WeakPolarHBondContact OE2-CE 3.3Å; E69-K72 IonicContact OE2-NZ 2.61Å; E69-K72 PolarHBondContact OE2-NZ 3.38Å
70	I	94	Very high	87.8	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.015	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-38.1	-179.3	-64.1	168.4	0	0	0	110.8	V66 L67 K72 D73 S74 V76 L295 H299	V66-I70 HydrophobicContact CG1-CD1 3.94Å; V66-I70 VanDerWaalsContact O-CG1 3.27Å; V66-I70 WeakPolarHBondContact O-CG1 3.42Å; V66-I70 PolarHBondContact O-N 3.48Å; V66-I70 VanDerWaalsContact O-N 3.1Å; L67-I70 PolarHBondContact O-N 3.29Å; I70-K72 PolarHBondContact O-N 2.94Å; I70-K72 VanDerWaalsContact O-N 3.11Å; I70-D73 PolarHBondContact O-N 3.22Å; I70-S74 VanDerWaalsContact O-CB 3.22Å; I70-S74 WeakPolarHBondContact O-CB 3.18Å; I70-S74 PolarHBondContact O-N 3.41Å; I70-S74 VanDerWaalsContact O-N 3.12Å; I70-S74 PolarHBondContact O-OG 3.48Å; I70-V76 HydrophobicContact CB-CG2 4.23Å; I70-V76 HydrophobicContact CG2-CG2 3.53Å; I70-L295 HydrophobicContact CD1-CB 3.95Å; I70-H299 HydrophobicContact CD1-CB 4.13Å; I70-H299 HydrophobicContact CG1-CB 3.95Å
71	R	95	Very high	88.8	Confident	100 Å²	100	59.9 Å²	59.9	38%	0.377	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-17.7	178.9	-77.9	173.4	-175.8	128.2	2.3	114.1	L67 D68 E69 D73 S74 V76	L67-R71 WeakPolarHBondContact O-CB 3.23Å; L67-R71 VanDerWaalsContact O-CG 3.25Å; L67-R71 WeakPolarHBondContact O-CG 3.37Å; L67-R71 PolarHBondContact O-N 3Å; D68-R71 PolarHBondContact O-N 3.44Å; D68-R71 IonicContact OD1-CZ 3.73Å; D68-R71 IonicContact OD1-NH1 2.71Å; D68-R71 PolarHBondContact OD1-NH1 3.2Å; E69-R71 VanDerWaalsContact C-N 3.35Å; E69-R71 PolarHBondContact O-N 3.36Å; R71-D73 VanDerWaalsContact C-N 3.26Å; R71-D73 PolarHBondContact O-N 2.85Å; R71-S74 WeakPolarHBondContact CA-O 3.02Å; R71-V76 HydrophobicContact CG-CB 4.07Å; R71-V76 HydrophobicContact CG-CG2 3.9Å
72	K	93.2	Very high	89.2	Confident	141 Å²	141	61.9 Å²	61.9	61%	0.613	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.9	177.3	-68.4	176.1	-179.4	173.2	0	112.6	E69 I70	E69-K72 WeakPolarHBondContact O-CB 3.5Å; E69-K72 WeakPolarHBondContact O-CG 3.46Å; E69-K72 PolarHBondContact O-N 2.81Å; E69-K72 IonicContact OE1-NZ 3.14Å; E69-K72 PolarHBondContact OE1-NZ 3.48Å; E69-K72 WeakPolarHBondContact OE2-CE 3.3Å; E69-K72 IonicContact OE2-NZ 2.61Å; E69-K72 PolarHBondContact OE2-NZ 3.38Å; I70-K72 PolarHBondContact O-N 2.94Å; I70-K72 VanDerWaalsContact O-N 3.11Å
73	D	92.4	Very high	88.9	Confident	25 Å²	25	60.9 Å²	60.9	13%	0.134	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	9.1	-177.7	65.2	11.1	0	0	0	113.5	I70 R71 H92 Y93 H299 K303	I70-D73 PolarHBondContact O-N 3.22Å; R71-D73 VanDerWaalsContact C-N 3.26Å; R71-D73 PolarHBondContact O-N 2.85Å; D73-H92 VanDerWaalsContact CG-CE1 3.49Å; D73-H92 WeakPolarHBondContact O-CA 3.47Å; D73-H92 IonicContact OD1-CE1 3.18Å; D73-H92 PolarHBondContact OD1-CE1 3.49Å; D73-H92 IonicContact OD1-ND1 2.67Å; D73-H92 PolarHBondContact OD1-ND1 2.94Å; D73-H92 IonicContact OD2-CE1 3.63Å; D73-H92 IonicContact OD2-ND1 3.85Å; D73-Y93 VanDerWaalsContact C-CD2 3.41Å; D73-Y93 VanDerWaalsContact CA-CE2 3.48Å; D73-Y93 WeakPolarHBondContact O-CD2 3.24Å; D73-Y93 PolarHBondContact O-N 3.02Å; D73-H299 IonicContact OD1-CE1 3.55Å; D73-H299 PolarHBondContact OD1-CE1 3.38Å; D73-H299 IonicContact OD1-ND1 3.96Å; D73-H299 IonicContact OD2-CE1 3.26Å; D73-K303 IonicContact OD2-NZ 3.58Å; D73-K303 PolarHBondContact OD2-NZ 3Å
74	S	94.3	Very high	88.4	Confident	1 Å²	1	66 Å²	66	1%	0.007	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.4	-176.6	-52.4	0	0	0	0	113.5	I70 R71 S91 H92	I70-S74 VanDerWaalsContact O-CB 3.22Å; I70-S74 WeakPolarHBondContact O-CB 3.18Å; I70-S74 PolarHBondContact O-N 3.41Å; I70-S74 VanDerWaalsContact O-N 3.12Å; I70-S74 PolarHBondContact O-OG 3.48Å; R71-S74 WeakPolarHBondContact CA-O 3.02Å; S74-S91 CarbonylContact C-O 3.57Å; S74-S91 VanDerWaalsContact CA-O 3.29Å; S74-S91 WeakPolarHBondContact CA-O 3.35Å; S74-S91 WeakPolarHBondContact CB-O 3.01Å; S74-H92 PolarHBondContact OG-CD2 3.42Å; S74-H92 PolarHBondContact OG-CE1 2.94Å; S74-H92 VanDerWaalsContact OG-CG 3.24Å; S74-H92 PolarHBondContact OG-ND1 3.38Å; S74-H92 PolarHBondContact OG-NE2 2.99Å
75	I	95.5	Very high	88.3	Confident	51 Å²	51	65.8 Å²	65.8	26%	0.262	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.2	160.6	-57.4	-174.9	0	0	0	107.8	F77 L90 S91 Y93 I96 I159	I75-F77 HydrophobicContact CG2-CD2 4.04Å; I75-F77 HydrophobicContact CG2-CE2 3.54Å; I75-F77 HydrophobicContact CG2-CZ 4.31Å; I75-L90 VanDerWaalsContact O-CA 3.28Å; I75-L90 WeakPolarHBondContact O-CA 3.4Å; I75-S91 PolarHBondContact N-O 3.43Å; I75-S91 PolarHBondContact O-N 3.47Å; I75-Y93 HydrophobicContact CG1-CD1 4.42Å; I75-Y93 HydrophobicContact CG1-CE1 3.79Å; I75-I96 HydrophobicContact CD1-CD1 3.46Å; I75-I96 VanDerWaalsContact CD1-CD1 3.46Å; I75-I96 HydrophobicContact CG1-CD1 3.84Å; I75-I159 HydrophobicContact CB-CG1 4.42Å; I75-I159 HydrophobicContact CG2-CG1 4.01Å
76	V	95.9	Very high	88.1	Confident	17 Å²	17	62.9 Å²	62.9	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	125.2	-179.3	-173.2	0	0	0	0	110.2	L67 I70 R71 V78 V88 S89 L90	L67-V76 HydrophobicContact CD2-CG1 3.82Å; I70-V76 HydrophobicContact CB-CG2 4.23Å; I70-V76 HydrophobicContact CG2-CG2 3.53Å; R71-V76 HydrophobicContact CG-CB 4.07Å; R71-V76 HydrophobicContact CG-CG2 3.9Å; V76-V78 HydrophobicContact CG1-CG2 4.24Å; V76-V88 HydrophobicContact CG1-CG1 3.85Å; V76-S89 CarbonylContact C-O 3.56Å; V76-S89 VanDerWaalsContact CA-O 3.32Å; V76-S89 WeakPolarHBondContact CA-O 3.42Å; V76-L90 HydrophobicContact CG2-CB 4.14Å
77	F	95.2	Very high	88	Confident	57 Å²	57	62.8 Å²	62.8	25%	0.25	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137.8	170.4	-73.2	-84.7	0	0	0	110.2	I75 V88 S89 H155 E158 I159	I75-F77 HydrophobicContact CG2-CD2 4.04Å; I75-F77 HydrophobicContact CG2-CE2 3.54Å; I75-F77 HydrophobicContact CG2-CZ 4.31Å; F77-V88 CarbonylContact O-C 3.53Å; F77-V88 WeakPolarHBondContact O-CA 3.28Å; F77-S89 PolarHBondContact N-O 3.01Å; F77-S89 PolarHBondContact O-N 2.94Å; F77-H155 HydrophobicContact CB-CB 4.49Å; F77-H155 WeakPolarHBondContact CB-NE2 3.48Å; F77-H155 AromaticContact CD1-CD2 3.79Å; F77-H155 HydrophobicContact CD2-CB 4.29Å; F77-H155 HydrophobicContact CG-CB 4.43Å; F77-H155 AromaticContact CG-CD2 3.59Å; F77-H155 AromaticContact CG-CG 3.98Å; F77-H155 AromaticContact CG-NE2 3.98Å; F77-E158 HydrophobicContact CE1-CB 4.34Å; F77-E158 WeakPolarHBondContact CE1-OE2 3.28Å; F77-E158 HydrophobicContact CE2-CB 4.1Å; F77-E158 HydrophobicContact CZ-CB 3.65Å; F77-E158 WeakPolarHBondContact CZ-OE2 2.95Å; F77-I159 HydrophobicContact CD2-CD1 4.1Å; F77-I159 HydrophobicContact CD2-CG1 3.96Å; F77-I159 HydrophobicContact CE2-CD1 4.25Å; F77-I159 HydrophobicContact CE2-CG1 3.58Å
78	V	92.1	Very high	87.9	Confident	48 Å²	48	62.3 Å²	62.3	29%	0.291	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.5	179.9	-178.7	0	0	0	0	107.8	L67 V76 I85 V88	L67-V78 HydrophobicContact CD1-CG2 3.94Å; L67-V78 HydrophobicContact CD2-CG2 3.97Å; V76-V78 HydrophobicContact CG1-CG2 4.24Å; V78-I85 HydrophobicContact CG1-CD1 3.94Å; V78-I85 HydrophobicContact CG1-CG1 3.81Å; V78-I85 HydrophobicContact CG1-CG2 3.98Å; V78-V88 HydrophobicContact CG1-CG2 4.44Å; V78-V88 HydrophobicContact CG2-CG1 4.34Å; V78-V88 HydrophobicContact CG2-CG2 4.4Å
79	E	90.1	Very high	88	Confident	48 Å²	48	58.1 Å²	58.1	22%	0.224	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.6	175.6	-68.9	-82.4	-176.9	0	0	108.8	T86 Q87 I151 K154 H155	E79-T86 PolarHBondContact O-N 3.02Å; E79-T86 PolarHBondContact O-OG1 3.31Å; E79-T86 VanDerWaalsContact O-OG1 3.14Å; E79-Q87 HydrophobicContact CB-CB 4.18Å; E79-Q87 PolarHBondContact N-O 2.98Å; E79-Q87 PolarHBondContact O-N 2.92Å; E79-I151 HydrophobicContact CG-CG2 3.63Å; E79-K154 IonicContact OE1-NZ 2.91Å; E79-H155 WeakPolarHBondContact CG-CE1 3.3Å; E79-H155 WeakPolarHBondContact CG-NE2 3.27Å; E79-H155 IonicContact OE1-CE1 2.69Å; E79-H155 IonicContact OE1-NE2 3.98Å; E79-H155 PolarHBondContact OE1-NE2 2.99Å
80	Q	84	Confident	88.1	Confident	120 Å²	120	54.4 Å²	54.4	56%	0.561	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130	137.1	-171.2	-166.8	177.9	15.2	0	0	109.3	C83 E84 I85	Q80-C83 VanDerWaalsContact NE2-CA 3.29Å; Q80-C83 PolarHBondContact NE2-O 3.47Å; Q80-E84 CarbonylContact C-O 3.56Å; Q80-E84 VanDerWaalsContact CA-O 3.29Å; Q80-E84 WeakPolarHBondContact CA-O 3.48Å; Q80-E84 VanDerWaalsContact CG-O 3.31Å; Q80-E84 WeakPolarHBondContact CG-O 3.46Å; Q80-I85 HydrophobicContact CG-CG1 4.43Å
81	C	75.5	Confident	88.2	Confident	58 Å²	58	54.3 Å²	54.3	39%	0.392	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	129.9	173.9	-170.4	0	0	0	0	107.3	C83 E84 T86	C81-C83 VanDerWaalsContact C-N 3.26Å; C81-C83 PolarHBondContact O-N 3.24Å; C81-E84 PolarHBondContact N-O 3.23Å; C81-E84 PolarHBondContact O-N 2.67Å; C81-E84 VanDerWaalsContact O-O 3.11Å; C81-T86 HydrophobicContact CB-CG2 3.58Å
82	D	72.8	Confident	88.2	Confident	154 Å²	154	49.6 Å²	49.6	82%	0.824	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	44	179.3	-58.8	-27	0	0	0	114.3	E84	D82-E84 PolarHBondContact O-N 2.92Å
83	C	67.9	Low	88.2	Confident	112 Å²	112	45.7 Å²	45.7	76%	0.757	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.2	-1.4	-176.3	-58.3	0	0	0	0	115.8	Q80 C81	Q80-C83 VanDerWaalsContact NE2-CA 3.29Å; Q80-C83 PolarHBondContact NE2-O 3.47Å; C81-C83 VanDerWaalsContact C-N 3.26Å; C81-C83 PolarHBondContact O-N 3.24Å
84	E	74.3	Confident	88.1	Confident	140 Å²	140	46.9 Å²	46.9	65%	0.654	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	137.4	174.6	-63.6	-162.4	159.6	0	0	111.9	Q80 C81 D82 T86	Q80-E84 CarbonylContact C-O 3.56Å; Q80-E84 VanDerWaalsContact CA-O 3.29Å; Q80-E84 WeakPolarHBondContact CA-O 3.48Å; Q80-E84 VanDerWaalsContact CG-O 3.31Å; Q80-E84 WeakPolarHBondContact CG-O 3.46Å; C81-E84 PolarHBondContact N-O 3.23Å; C81-E84 PolarHBondContact O-N 2.67Å; C81-E84 VanDerWaalsContact O-O 3.11Å; D82-E84 PolarHBondContact O-N 2.92Å; E84-T86 PolarHBondContact O-N 3.36Å
85	I	83.6	Confident	88.1	Confident	44 Å²	44	46.8 Å²	46.8	23%	0.226	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	116.8	176.4	-71.6	163.8	0	0	0	108.8	L63 V78 Q80 V88 L291	L63-I85 HydrophobicContact CD2-CD1 3.14Å; L63-I85 HydrophobicContact CG-CD1 4.27Å; V78-I85 HydrophobicContact CG1-CD1 3.94Å; V78-I85 HydrophobicContact CG1-CG1 3.81Å; V78-I85 HydrophobicContact CG1-CG2 3.98Å; Q80-I85 HydrophobicContact CG-CG1 4.43Å; I85-V88 HydrophobicContact CG2-CG2 3.45Å; I85-V88 VanDerWaalsContact CG2-CG2 3.45Å; I85-L291 HydrophobicContact CB-CD2 4.18Å; I85-L291 HydrophobicContact CG2-CD2 3.88Å
86	T	83.6	Confident	88.1	Confident	20 Å²	20	45.1 Å²	45.1	12%	0.123	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-32	-177.7	57.8	0	0	0	0	111.6	E79 C81 E84 H141 S142	E79-T86 PolarHBondContact O-N 3.02Å; E79-T86 PolarHBondContact O-OG1 3.31Å; E79-T86 VanDerWaalsContact O-OG1 3.14Å; C81-T86 HydrophobicContact CB-CG2 3.58Å; E84-T86 PolarHBondContact O-N 3.36Å; T86-H141 WeakPolarHBondContact O-CA 3.29Å; T86-S142 PolarHBondContact O-N 3.28Å
87	Q	89.2	Confident	87.9	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.009	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	137.7	-178.6	-178.2	-179.2	-19.9	0	0	111.8	E79 S89 S139 L140 H141 H155	E79-Q87 HydrophobicContact CB-CB 4.18Å; E79-Q87 PolarHBondContact N-O 2.98Å; E79-Q87 PolarHBondContact O-N 2.92Å; Q87-S89 PolarHBondContact NE2-OG 3.24Å; Q87-S139 VanDerWaalsContact CG-OG 3.25Å; Q87-S139 WeakPolarHBondContact CG-OG 3.37Å; Q87-S139 PolarHBondContact NE2-OG 3.29Å; Q87-L140 CarbonylContact C-O 3.57Å; Q87-L140 VanDerWaalsContact CA-O 3.22Å; Q87-L140 WeakPolarHBondContact CA-O 3.45Å; Q87-H141 PolarHBondContact OE1-CE1 3.31Å; Q87-H155 PolarHBondContact NE2-ND1 3.49Å
88	V	92.6	Very high	87.8	Confident	1 Å²	1	44 Å²	44	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	120	168.2	-176.6	0	0	0	0	108.7	L67 V76 F77 V78 I85 S139 L140 L291 L295	L67-V88 HydrophobicContact CD2-CG1 4.07Å; V76-V88 HydrophobicContact CG1-CG1 3.85Å; F77-V88 CarbonylContact O-C 3.53Å; F77-V88 WeakPolarHBondContact O-CA 3.28Å; V78-V88 HydrophobicContact CG1-CG2 4.44Å; V78-V88 HydrophobicContact CG2-CG1 4.34Å; V78-V88 HydrophobicContact CG2-CG2 4.4Å; I85-V88 HydrophobicContact CG2-CG2 3.45Å; I85-V88 VanDerWaalsContact CG2-CG2 3.45Å; V88-S139 CarbonylContact O-C 3.54Å; V88-S139 VanDerWaalsContact O-CA 3.27Å; V88-S139 WeakPolarHBondContact O-CA 3.34Å; V88-S139 PolarHBondContact O-OG 3.17Å; V88-L140 PolarHBondContact N-O 3.44Å; V88-L140 PolarHBondContact O-N 3.37Å; V88-L291 HydrophobicContact CG2-CD2 4.35Å; V88-L295 HydrophobicContact CB-CD2 4.02Å; V88-L295 HydrophobicContact CG1-CD1 4.35Å; V88-L295 HydrophobicContact CG1-CD2 3.61Å; V88-L295 HydrophobicContact CG2-CD1 4.43Å
89	S	94.4	Very high	88	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.6	179.3	-47.8	0	0	0	0	110.5	V76 F77 Q87 F138 S139 H155	V76-S89 CarbonylContact C-O 3.56Å; V76-S89 VanDerWaalsContact CA-O 3.32Å; V76-S89 WeakPolarHBondContact CA-O 3.42Å; F77-S89 PolarHBondContact N-O 3.01Å; F77-S89 PolarHBondContact O-N 2.94Å; Q87-S89 PolarHBondContact NE2-OG 3.24Å; S89-F138 CarbonylContact C-O 3.52Å; S89-F138 VanDerWaalsContact CA-O 3.3Å; S89-F138 WeakPolarHBondContact CA-O 3.45Å; S89-S139 PolarHBondContact OG-OG 3.23Å; S89-H155 PolarHBondContact OG-ND1 3.4Å
90	L	95.2	Very high	88.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	147.2	-177.9	68.7	94.7	0	0	0	113	I75 V76 M137 F138 L295 L298	I75-L90 VanDerWaalsContact O-CA 3.28Å; I75-L90 WeakPolarHBondContact O-CA 3.4Å; V76-L90 HydrophobicContact CG2-CB 4.14Å; L90-M137 WeakPolarHBondContact O-CA 3.32Å; L90-F138 HydrophobicContact CD1-CD2 4.22Å; L90-F138 PolarHBondContact N-O 3Å; L90-F138 PolarHBondContact O-N 2.83Å; L90-L295 HydrophobicContact CD2-CD2 4.03Å; L90-L298 HydrophobicContact CD2-CD2 4.03Å; L90-L298 HydrophobicContact CD2-CG 4.47Å
91	S	95.6	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	125.4	172	177	0	0	0	0	109.4	S74 I75 I96 I136	S74-S91 CarbonylContact C-O 3.57Å; S74-S91 VanDerWaalsContact CA-O 3.29Å; S74-S91 WeakPolarHBondContact CA-O 3.35Å; S74-S91 WeakPolarHBondContact CB-O 3.01Å; I75-S91 PolarHBondContact N-O 3.43Å; I75-S91 PolarHBondContact O-N 3.47Å; S91-I96 WeakPolarHBondContact OG-CG1 3.28Å; S91-I136 WeakPolarHBondContact CB-O 3.44Å; S91-I136 PolarHBondContact OG-O 3.24Å
92	H	94.4	Very high	89.5	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.009	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	155.8	170.5	-78.8	-104.4	0	0	0	111.4	D73 S74 E94 Q95 I96 H299 A302	D73-H92 VanDerWaalsContact CG-CE1 3.49Å; D73-H92 WeakPolarHBondContact O-CA 3.47Å; D73-H92 IonicContact OD1-CE1 3.18Å; D73-H92 PolarHBondContact OD1-CE1 3.49Å; D73-H92 IonicContact OD1-ND1 2.67Å; D73-H92 PolarHBondContact OD1-ND1 2.94Å; D73-H92 IonicContact OD2-CE1 3.63Å; D73-H92 IonicContact OD2-ND1 3.85Å; S74-H92 PolarHBondContact OG-CD2 3.42Å; S74-H92 PolarHBondContact OG-CE1 2.94Å; S74-H92 VanDerWaalsContact OG-CG 3.24Å; S74-H92 PolarHBondContact OG-ND1 3.38Å; S74-H92 PolarHBondContact OG-NE2 2.99Å; H92-E94 VanDerWaalsContact C-N 3.29Å; H92-E94 PolarHBondContact O-N 2.89Å; H92-Q95 HydrophobicContact CB-CB 4.34Å; H92-Q95 HydrophobicContact CB-CG 4.03Å; H92-Q95 WeakPolarHBondContact O-CA 3.47Å; H92-Q95 VanDerWaalsContact O-CB 3.32Å; H92-Q95 WeakPolarHBondContact O-CB 3.48Å; H92-Q95 PolarHBondContact O-N 2.99Å; H92-I96 WeakPolarHBondContact O-CG1 2.92Å; H92-I96 PolarHBondContact O-N 3.02Å; H92-I96 VanDerWaalsContact O-N 3.07Å; H92-H299 AromaticContact CE1-CE1 3.31Å; H92-H299 PolarHBondContact CE1-CE1 3.4Å; H92-H299 AromaticContact CE1-ND1 3.21Å; H92-H299 PolarHBondContact CE1-ND1 2.97Å; H92-H299 AromaticContact NE2-CE1 3.69Å; H92-H299 AromaticContact NE2-ND1 3.06Å; H92-H299 PolarHBondContact NE2-ND1 2.9Å; H92-A302 VanDerWaalsContact CD2-CB 3.49Å; H92-A302 WeakPolarHBondContact CD2-CB 3.22Å
93	Y	93	Very high	90.5	Very high	58 Å²	58	31.9 Å²	31.9	23%	0.227	16%	0.159	C	C	.	.	H	α-helix	trans	-61.2	-38.4	177.6	-59.5	-50.2	0	0	0	112.4	D73 I75 Q95 I96 E97 R432	D73-Y93 VanDerWaalsContact C-CD2 3.41Å; D73-Y93 VanDerWaalsContact CA-CE2 3.48Å; D73-Y93 WeakPolarHBondContact O-CD2 3.24Å; D73-Y93 PolarHBondContact O-N 3.02Å; I75-Y93 HydrophobicContact CG1-CD1 4.42Å; I75-Y93 HydrophobicContact CG1-CE1 3.79Å; Y93-Q95 PolarHBondContact O-N 3.31Å; Y93-I96 HydrophobicContact CD1-CD1 4.23Å; Y93-I96 WeakPolarHBondContact O-CB 3.45Å; Y93-I96 PolarHBondContact O-N 3.05Å; Y93-I96 VanDerWaalsContact O-N 3.13Å; Y93-E97 PolarHBondContact O-N 2.91Å; Y93-R432 PolarHBondContact OH-NH1 3.47Å; Y93-R432 PolarHBondContact OH-NH2 3.29Å
94	E	92	Very high	91.8	Very high	50 Å²	50	27.3 Å²	27.3	23%	0.234	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-31.2	174.8	-62.5	86.6	166.6	0	0	112.2	H92 L98 C306 L426	H92-E94 VanDerWaalsContact C-N 3.29Å; H92-E94 PolarHBondContact O-N 2.89Å; E94-L98 VanDerWaalsContact O-CB 3.26Å; E94-L98 WeakPolarHBondContact O-CB 3.47Å; E94-L98 PolarHBondContact O-N 3Å; E94-C306 HydrophobicContact CB-CB 4.26Å; E94-L426 HydrophobicContact CB-CB 4.32Å
95	Q	93.9	Very high	92.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-71.8	-33.9	175	-70.1	179.2	-62.5	0	0	112	H92 Y93 L98 Y99 P135 I136	H92-Q95 HydrophobicContact CB-CB 4.34Å; H92-Q95 HydrophobicContact CB-CG 4.03Å; H92-Q95 WeakPolarHBondContact O-CA 3.47Å; H92-Q95 VanDerWaalsContact O-CB 3.32Å; H92-Q95 WeakPolarHBondContact O-CB 3.48Å; H92-Q95 PolarHBondContact O-N 2.99Å; Y93-Q95 PolarHBondContact O-N 3.31Å; Q95-L98 WeakPolarHBondContact O-CB 3.48Å; Q95-L98 PolarHBondContact O-N 3.05Å; Q95-Y99 PolarHBondContact O-N 3.44Å; Q95-P135 PolarHBondContact NE2-O 3.34Å; Q95-I136 HydrophobicContact CB-CB 4.44Å; Q95-I136 WeakPolarHBondContact CB-O 3.48Å
96	I	94.9	Very high	93.3	Very high	15 Å²	15	18.6 Å²	18.6	8%	0.077	9%	0.085	C	C	.	.	H	α-helix	trans	-65.4	-47.8	173.1	-60.3	172.3	0	0	0	110.4	I75 S91 H92 Y93 L98 Y99 K100 I159 F160	I75-I96 HydrophobicContact CD1-CD1 3.46Å; I75-I96 VanDerWaalsContact CD1-CD1 3.46Å; I75-I96 HydrophobicContact CG1-CD1 3.84Å; S91-I96 WeakPolarHBondContact OG-CG1 3.28Å; H92-I96 WeakPolarHBondContact O-CG1 2.92Å; H92-I96 PolarHBondContact O-N 3.02Å; H92-I96 VanDerWaalsContact O-N 3.07Å; Y93-I96 HydrophobicContact CD1-CD1 4.23Å; Y93-I96 WeakPolarHBondContact O-CB 3.45Å; Y93-I96 PolarHBondContact O-N 3.05Å; Y93-I96 VanDerWaalsContact O-N 3.13Å; I96-L98 PolarHBondContact O-N 3.47Å; I96-Y99 PolarHBondContact O-N 2.55Å; I96-K100 PolarHBondContact O-N 3.01Å; I96-K100 VanDerWaalsContact O-N 3.13Å; I96-I159 HydrophobicContact CD1-CG2 3.79Å; I96-I159 HydrophobicContact CG1-CG2 3.76Å; I96-F160 HydrophobicContact CB-CE1 4.39Å; I96-F160 HydrophobicContact CG1-CE1 4.14Å; I96-F160 HydrophobicContact CG2-CD1 4.31Å
97	E	92.5	Very high	93.6	Very high	45 Å²	45	17.6 Å²	17.6	21%	0.21	8%	0.079	C	C	.	.	H	α-helix	trans	-62.6	-35	174.5	-66.5	-51.7	130.3	0	0	111.8	Y93 Y99 K100 R101 L426	Y93-E97 PolarHBondContact O-N 2.91Å; E97-Y99 PolarHBondContact O-N 2.77Å; E97-K100 PolarHBondContact O-N 2.99Å; E97-K100 IonicContact OE1-NZ 2.79Å; E97-K100 PolarHBondContact OE1-NZ 2.88Å; E97-K100 IonicContact OE2-NZ 3.57Å; E97-R101 WeakPolarHBondContact O-CB 3.4Å; E97-R101 PolarHBondContact O-N 3.18Å; E97-L426 HydrophobicContact CB-CD2 4.38Å; E97-L426 WeakPolarHBondContact CG-O 3.46Å
98	L	92.5	Very high	93.6	Very high	5 Å²	5	17.6 Å²	17.6	3%	0.026	8%	0.079	C	C	.	.	H	α-helix	trans	-63.6	-41	176	-172.2	60.9	0	0	0	112.7	E94 Q95 I96 R101 F102 V126 R134 I136 L309 L426	E94-L98 VanDerWaalsContact O-CB 3.26Å; E94-L98 WeakPolarHBondContact O-CB 3.47Å; E94-L98 PolarHBondContact O-N 3Å; Q95-L98 WeakPolarHBondContact O-CB 3.48Å; Q95-L98 PolarHBondContact O-N 3.05Å; I96-L98 PolarHBondContact O-N 3.47Å; L98-R101 PolarHBondContact O-N 3.03Å; L98-F102 HydrophobicContact CD1-CD2 3.56Å; L98-F102 HydrophobicContact CD1-CE2 3.7Å; L98-F102 HydrophobicContact CG-CD2 4.43Å; L98-F102 PolarHBondContact O-N 2.84Å; L98-V126 HydrophobicContact CD2-CG2 4.27Å; L98-V126 HydrophobicContact CG-CG2 3.99Å; L98-R134 HydrophobicContact CD2-CB 3.48Å; L98-R134 VanDerWaalsContact CD2-CB 3.48Å; L98-R134 HydrophobicContact CD2-CG 4.04Å; L98-I136 HydrophobicContact CB-CG2 4.41Å; L98-I136 HydrophobicContact CD2-CG2 4.25Å; L98-I136 HydrophobicContact CG-CG2 4.37Å; L98-L309 HydrophobicContact CD1-CD2 3.5Å; L98-L309 VanDerWaalsContact CD1-CD2 3.5Å; L98-L309 HydrophobicContact CD2-CD2 3.82Å; L98-L309 HydrophobicContact CG-CD2 4.31Å; L98-L426 HydrophobicContact CB-CD1 4.39Å; L98-L426 HydrophobicContact CB-CD2 4.31Å; L98-L426 HydrophobicContact CD1-CD1 4.13Å; L98-L426 HydrophobicContact CD1-CD2 4.09Å
99	Y	95.2	Very high	93.3	Very high	4 Å²	4	17.6 Å²	17.6	2%	0.016	8%	0.079	C	C	.	.	H	α-helix	trans	-64.4	-45.6	174.5	170.8	-104	0	0	0	112.1	Q95 I96 E97 R101 F102 P103 L106 V126 I136 F156 F160 D162 V163 T166	Q95-Y99 PolarHBondContact O-N 3.44Å; I96-Y99 PolarHBondContact O-N 2.55Å; E97-Y99 PolarHBondContact O-N 2.77Å; Y99-R101 PolarHBondContact O-N 3.19Å; Y99-R101 VanDerWaalsContact O-N 3.16Å; Y99-F102 CarbonylContact O-C 3.42Å; Y99-F102 PolarHBondContact O-N 3.13Å; Y99-P103 HydrophobicContact CD2-CB 4.5Å; Y99-P103 HydrophobicContact CE2-CB 4.06Å; Y99-P103 WeakPolarHBondContact O-CA 3.43Å; Y99-P103 WeakPolarHBondContact O-CB 3.03Å; Y99-P103 WeakPolarHBondContact O-CD 3.43Å; Y99-P103 VanDerWaalsContact O-N 3.08Å; Y99-L106 HydrophobicContact CD2-CD2 3.85Å; Y99-L106 HydrophobicContact CE2-CD1 3.91Å; Y99-L106 HydrophobicContact CE2-CD2 3.8Å; Y99-L106 HydrophobicContact CE2-CG 4.05Å; Y99-V126 HydrophobicContact CD2-CG1 3.9Å; Y99-I136 HydrophobicContact CD2-CD1 3.7Å; Y99-I136 HydrophobicContact CG-CD1 4.02Å; Y99-F156 HydrophobicContact CD2-CZ 4.48Å; Y99-F156 HydrophobicContact CE2-CZ 4.01Å; Y99-F160 HydrophobicContact CD1-CB 3.72Å; Y99-F160 AromaticContact CD1-CD1 3.29Å; Y99-F160 HydrophobicContact CD1-CD1 3.29Å; Y99-F160 HydrophobicContact CD1-CE1 4.12Å; Y99-F160 AromaticContact CD1-CG 3.71Å; Y99-F160 HydrophobicContact CD1-CG 3.71Å; Y99-F160 HydrophobicContact CE1-CB 3.63Å; Y99-F160 HydrophobicContact CE1-CD1 4.11Å; Y99-F160 HydrophobicContact CE1-CG 4.06Å; Y99-F160 AromaticContact CG-CD1 3.57Å; Y99-F160 HydrophobicContact CG-CD1 3.57Å; Y99-F160 AromaticContact CG-CE1 3.92Å; Y99-F160 HydrophobicContact CG-CE1 3.92Å; Y99-F160 HydrophobicContact CG-CG 4.17Å; Y99-D162 WeakPolarHBondContact CE1-O 3.41Å; Y99-D162 PolarHBondContact OH-O 3.18Å; Y99-V163 WeakPolarHBondContact OH-CA 3.34Å; Y99-T166 PolarHBondContact OH-OG1 3.16Å
100	K	94.1	Very high	92.8	Very high	122 Å²	122	18.4 Å²	18.4	53%	0.53	8%	0.084	S	C	.	.	H	α-helix	trans	-56	-34.2	176	-68.9	175.5	-176.8	170.6	0	112.4	I96 E97	I96-K100 PolarHBondContact O-N 3.01Å; I96-K100 VanDerWaalsContact O-N 3.13Å; E97-K100 PolarHBondContact O-N 2.99Å; E97-K100 IonicContact OE1-NZ 2.79Å; E97-K100 PolarHBondContact OE1-NZ 2.88Å; E97-K100 IonicContact OE2-NZ 3.57Å
101	R	92.7	Very high	92.3	Very high	27 Å²	27	19.5 Å²	19.5	10%	0.102	9%	0.09	C	C	.	.	H	α-helix	trans	-78.1	-36.5	-178.6	-162.9	176.9	-165.8	165.8	2.2	113.7	E97 L98 Y99 P103 H421 N422 Q424	E97-R101 WeakPolarHBondContact O-CB 3.4Å; E97-R101 PolarHBondContact O-N 3.18Å; L98-R101 PolarHBondContact O-N 3.03Å; Y99-R101 PolarHBondContact O-N 3.19Å; Y99-R101 VanDerWaalsContact O-N 3.16Å; R101-P103 VanDerWaalsContact C-CD 3.45Å; R101-H421 WeakPolarHBondContact CG-NE2 3.26Å; R101-H421 PolarHBondContact NE-O 3.34Å; R101-H421 VanDerWaalsContact NH2-C 3.26Å; R101-H421 PolarHBondContact NH2-O 3.49Å; R101-H421 PolarHBondContact O-NE2 3.3Å; R101-N422 PolarHBondContact NH2-O 3.17Å; R101-Q424 VanDerWaalsContact CZ-O 3.27Å; R101-Q424 PolarHBondContact NH1-O 2.87Å; R101-Q424 VanDerWaalsContact NH2-CB 3.33Å; R101-Q424 PolarHBondContact NH2-O 3.46Å
102	F	94.3	Very high	91.7	Very high	6 Å²	6	23.6 Å²	23.6	3%	0.026	11%	0.107	C	C	.	.	S	Bend	trans	-130.9	60.6	-177.5	-54.1	-63.6	0	0	0	112.2	L98 Y99 E104 V126 D128 G129 R416 N422	L98-F102 HydrophobicContact CD1-CD2 3.56Å; L98-F102 HydrophobicContact CD1-CE2 3.7Å; L98-F102 HydrophobicContact CG-CD2 4.43Å; L98-F102 PolarHBondContact O-N 2.84Å; Y99-F102 CarbonylContact O-C 3.42Å; Y99-F102 PolarHBondContact O-N 3.13Å; F102-E104 VanDerWaalsContact C-N 3.3Å; F102-E104 WeakPolarHBondContact CA-OE2 3.49Å; F102-E104 PolarHBondContact O-N 3.36Å; F102-V126 HydrophobicContact CB-CB 4.39Å; F102-V126 HydrophobicContact CB-CG2 4.31Å; F102-V126 WeakPolarHBondContact O-CB 3.17Å; F102-V126 VanDerWaalsContact O-CG1 3.28Å; F102-V126 WeakPolarHBondContact O-CG1 3.49Å; F102-D128 HydrophobicContact CD2-CB 3.92Å; F102-D128 HydrophobicContact CE2-CB 3.84Å; F102-D128 HydrophobicContact CG-CB 4.49Å; F102-D128 HydrophobicContact CZ-CB 4.35Å; F102-G129 VanDerWaalsContact CE1-N 3.32Å; F102-R416 HydrophobicContact CD1-CB 3.98Å; F102-R416 HydrophobicContact CE1-CB 4.11Å; F102-N422 WeakPolarHBondContact CZ-OD1 3.28Å
103	P	95.5	Very high	91.2	Very high	16 Å²	16	28.9 Å²	28.9	10%	0.104	14%	0.135	C	C	.	.			trans	-78.3	-14.3	-171.7	32.3	-36.6	0	0	0	113.2	Y99 R101 V105 T166	Y99-P103 HydrophobicContact CD2-CB 4.5Å; Y99-P103 HydrophobicContact CE2-CB 4.06Å; Y99-P103 WeakPolarHBondContact O-CA 3.43Å; Y99-P103 WeakPolarHBondContact O-CB 3.03Å; Y99-P103 WeakPolarHBondContact O-CD 3.43Å; Y99-P103 VanDerWaalsContact O-N 3.08Å; R101-P103 VanDerWaalsContact C-CD 3.45Å; P103-V105 VanDerWaalsContact C-N 3.31Å; P103-V105 PolarHBondContact O-N 3.08Å; P103-T166 VanDerWaalsContact O-CA 3.31Å; P103-T166 WeakPolarHBondContact O-CA 3.35Å; P103-T166 PolarHBondContact O-OG1 3.09Å
104	E	95.5	Very high	90.8	Very high	15 Å²	15	26.1 Å²	26.1	7%	0.07	12%	0.124	C	C	.	.	S	Bend	trans	-66.7	-33.2	-158.8	-51.9	95.2	152.9	0	0	113.3	F102 L167 T168 L391 R416	F102-E104 VanDerWaalsContact C-N 3.3Å; F102-E104 WeakPolarHBondContact CA-OE2 3.49Å; F102-E104 PolarHBondContact O-N 3.36Å; E104-L167 HydrophobicContact CB-CD1 4.3Å; E104-L167 HydrophobicContact CB-CG 4.44Å; E104-L167 WeakPolarHBondContact O-CA 3.31Å; E104-L167 WeakPolarHBondContact O-CB 3.46Å; E104-L167 PolarHBondContact O-N 3.29Å; E104-T168 PolarHBondContact O-N 3.4Å; E104-L391 HydrophobicContact CB-CD1 4.17Å; E104-L391 HydrophobicContact CG-CD1 3.96Å; E104-R416 VanDerWaalsContact CD-NE 3.25Å; E104-R416 VanDerWaalsContact OE1-CD 3.29Å; E104-R416 WeakPolarHBondContact OE1-CD 3.48Å; E104-R416 IonicContact OE1-NE 2.73Å; E104-R416 PolarHBondContact OE1-NE 3.01Å; E104-R416 VanDerWaalsContact OE1-NE 3.1Å; E104-R416 IonicContact OE2-CZ 2.95Å; E104-R416 IonicContact OE2-NE 3.73Å; E104-R416 PolarHBondContact OE2-NE 2.79Å; E104-R416 IonicContact OE2-NH2 3.7Å; E104-R416 PolarHBondContact OE2-NH2 2.8Å
105	V	94	Very high	90.4	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	110.1	-176.8	178.5	0	0	0	0	110	P103 V126 T127 T168 V264 L266 V273	P103-V105 VanDerWaalsContact C-N 3.31Å; P103-V105 PolarHBondContact O-N 3.08Å; V105-V126 WeakPolarHBondContact O-CA 3.5Å; V105-T127 PolarHBondContact O-N 3.24Å; V105-T168 WeakPolarHBondContact CA-O 3.36Å; V105-V264 HydrophobicContact CG2-CG1 3.98Å; V105-L266 HydrophobicContact CB-CD1 3.83Å; V105-L266 HydrophobicContact CB-CG 4.5Å; V105-L266 HydrophobicContact CG2-CD1 3.5Å; V105-L266 HydrophobicContact CG2-CD2 4.45Å; V105-L266 HydrophobicContact CG2-CG 3.66Å; V105-V273 HydrophobicContact CG1-CG1 3.38Å
106	L	93.5	Very high	89.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	151	172.3	-75.2	177.8	0	0	0	111.4	Y99 F108 I124 A125 V126 I136 F156 T166 T168 V169 A170 F185	Y99-L106 HydrophobicContact CD2-CD2 3.85Å; Y99-L106 HydrophobicContact CE2-CD1 3.91Å; Y99-L106 HydrophobicContact CE2-CD2 3.8Å; Y99-L106 HydrophobicContact CE2-CG 4.05Å; L106-F108 HydrophobicContact CB-CE2 4.29Å; L106-F108 HydrophobicContact CD1-CE2 4.39Å; L106-I124 HydrophobicContact CD2-CG2 4.09Å; L106-A125 CarbonylContact C-O 3.56Å; L106-A125 WeakPolarHBondContact CA-O 3.42Å; L106-V126 HydrophobicContact CD2-CG1 3.71Å; L106-I136 HydrophobicContact CD2-CD1 3.67Å; L106-F156 HydrophobicContact CD1-CE1 4.26Å; L106-F156 HydrophobicContact CD1-CE2 4.2Å; L106-F156 HydrophobicContact CD1-CZ 3.57Å; L106-F156 HydrophobicContact CD2-CZ 4.42Å; L106-T166 HydrophobicContact CB-CG2 4.4Å; L106-T166 HydrophobicContact CD1-CG2 3.88Å; L106-T166 HydrophobicContact CG-CG2 4.08Å; L106-T168 PolarHBondContact N-O 3.43Å; L106-V169 HydrophobicContact CB-CG2 4.34Å; L106-A170 PolarHBondContact O-N 2.9Å; L106-F185 HydrophobicContact CD1-CD1 4.36Å; L106-F185 HydrophobicContact CD1-CE1 3.47Å; L106-F185 VanDerWaalsContact CD1-CE1 3.47Å; L106-F185 HydrophobicContact CD1-CZ 3.67Å
107	S	90.9	Very high	88.8	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	123.9	178.7	-45	0	0	0	0	109.5	I124 A125 A170 V273 C276	S107-I124 CarbonylContact O-C 3.54Å; S107-I124 WeakPolarHBondContact O-CA 3.4Å; S107-A125 PolarHBondContact N-O 3.43Å; S107-A125 PolarHBondContact O-N 3.26Å; S107-A170 CarbonylContact C-O 3.5Å; S107-A170 WeakPolarHBondContact CA-O 3.4Å; S107-V273 WeakPolarHBondContact CB-O 3.33Å; S107-V273 PolarHBondContact OG-O 3.05Å; S107-C276 WeakPolarHBondContact CB-SG 3.24Å; S107-C276 PolarHBondContact O-SG 3.32Å
108	F	89.3	Confident	88.2	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.009	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	128	179.7	-76.6	-115	0	0	0	108.7	L106 I124 L152 L153 V169 A170 V171 D172 F185	L106-F108 HydrophobicContact CB-CE2 4.29Å; L106-F108 HydrophobicContact CD1-CE2 4.39Å; F108-I124 HydrophobicContact CD1-CD1 4.01Å; F108-I124 HydrophobicContact CD1-CG1 3.8Å; F108-I124 HydrophobicContact CD2-CG2 4.21Å; F108-I124 HydrophobicContact CE1-CD1 3.39Å; F108-I124 HydrophobicContact CE1-CG1 3.7Å; F108-I124 HydrophobicContact CE2-CG2 3.88Å; F108-I124 HydrophobicContact CG-CG1 4.26Å; F108-I124 HydrophobicContact CZ-CD1 3.7Å; F108-I124 HydrophobicContact CZ-CG1 4.07Å; F108-I124 HydrophobicContact CZ-CG2 4.05Å; F108-L152 HydrophobicContact CD1-CD2 4.41Å; F108-L152 HydrophobicContact CE1-CD2 4.44Å; F108-L153 HydrophobicContact CE1-CD2 3.8Å; F108-L153 HydrophobicContact CZ-CD2 3.94Å; F108-V169 HydrophobicContact CD2-CG1 3.63Å; F108-V169 HydrophobicContact CE2-CG1 3.6Å; F108-A170 PolarHBondContact N-O 2.8Å; F108-V171 HydrophobicContact CB-CG1 4.08Å; F108-V171 HydrophobicContact CB-CG2 4.45Å; F108-D172 PolarHBondContact O-N 3.07Å; F108-F185 HydrophobicContact CE2-CE2 4.22Å; F108-F185 HydrophobicContact CE2-CZ 4.32Å; F108-F185 AromaticContact CZ-CE2 3.96Å; F108-F185 HydrophobicContact CZ-CE2 3.96Å; F108-F185 HydrophobicContact CZ-CZ 4.1Å
109	S	86	Confident	87.8	Confident	1 Å²	1	30 Å²	30	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	155.6	176.3	66.3	0	0	0	0	111.2	F122 Q123 C276	S109-F122 WeakPolarHBondContact O-CA 3.17Å; S109-Q123 PolarHBondContact N-O 3Å; S109-Q123 PolarHBondContact O-N 3.24Å; S109-Q123 PolarHBondContact OG-O 3.41Å; S109-C276 WeakPolarHBondContact OG-CB 3.27Å
110	V	84.9	Confident	87.5	Confident	17 Å²	17	30.5 Å²	30.5	10%	0.103	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.8	177.7	66.5	0	0	0	0	110.1	Y112 T120 I121 F122 C173	V110-Y112 HydrophobicContact CG1-CE2 3.66Å; V110-Y112 HydrophobicContact CG2-CE1 4.01Å; V110-Y112 HydrophobicContact CG2-CE2 4.11Å; V110-T120 HydrophobicContact CG2-CG2 3.37Å; V110-I121 CarbonylContact C-O 3.54Å; V110-I121 WeakPolarHBondContact CA-O 3.4Å; V110-F122 HydrophobicContact CB-CD1 3.99Å; V110-F122 HydrophobicContact CB-CE1 3.87Å; V110-F122 HydrophobicContact CB-CZ 4.29Å; V110-F122 HydrophobicContact CG2-CD1 4.12Å; V110-F122 HydrophobicContact CG2-CD2 4.19Å; V110-F122 HydrophobicContact CG2-CE1 3.85Å; V110-F122 HydrophobicContact CG2-CE2 3.93Å; V110-F122 HydrophobicContact CG2-CG 4.3Å; V110-F122 HydrophobicContact CG2-CZ 3.75Å; V110-C173 HydrophobicContact CB-CB 3.71Å; V110-C173 HydrophobicContact CG1-CB 3.37Å
111	T	84.3	Confident	87.2	Confident	23 Å²	23	24.9 Å²	24.9	14%	0.141	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.9	169.1	-52.4	0	0	0	0	109	V114 T120 I121 V277	T111-V114 HydrophobicContact CG2-CG1 3.4Å; T111-V114 VanDerWaalsContact CG2-CG1 3.4Å; T111-T120 WeakPolarHBondContact O-CA 3.47Å; T111-I121 PolarHBondContact N-O 2.83Å; T111-I121 PolarHBondContact O-N 3.22Å; T111-V277 WeakPolarHBondContact OG1-CG1 3.12Å; T111-V277 WeakPolarHBondContact OG1-CG2 3.08Å
112	Y	83.3	Confident	87	Confident	87 Å²	87	24.5 Å²	24.5	34%	0.341	13%	0.131	S	C	.	.	S	Bend	trans	-88.8	151.7	179.3	-59.1	-80.9	0	0	0	111	V110 V114 T120 P174	V110-Y112 HydrophobicContact CG1-CE2 3.66Å; V110-Y112 HydrophobicContact CG2-CE1 4.01Å; V110-Y112 HydrophobicContact CG2-CE2 4.11Å; Y112-V114 PolarHBondContact O-N 3.26Å; Y112-T120 HydrophobicContact CD1-CG2 3.79Å; Y112-T120 WeakPolarHBondContact CD1-OG1 3.2Å; Y112-T120 HydrophobicContact CE1-CG2 3.97Å; Y112-P174 WeakPolarHBondContact OH-CD 3.3Å; Y112-P174 WeakPolarHBondContact OH-CG 3.26Å
113	N	83.1	Confident	86.9	Confident	112 Å²	112	24.5 Å²	24.5	60%	0.599	13%	0.131	S	C	*	.			trans	52.7	51.4	174.7	-55.3	-30.5	0	0	0	112.1	S115 G118 L119	N113-S115 VanDerWaalsContact C-N 3.29Å; N113-G118 PolarHBondContact OD1-O 2.79Å; N113-L119 CarbonylContact C-O 3.57Å; N113-L119 WeakPolarHBondContact CA-O 3.4Å; N113-L119 PolarHBondContact N-O 3.41Å; N113-L119 VanDerWaalsContact N-O 3.11Å
114	V	84.2	Confident	86.7	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.006	13%	0.127	C	C	.	.			trans	-79.8	-10.5	-178.6	-67.9	0	0	0	0	114	T111 Y112 L119 I121 L285 K286	T111-V114 HydrophobicContact CG2-CG1 3.4Å; T111-V114 VanDerWaalsContact CG2-CG1 3.4Å; Y112-V114 PolarHBondContact O-N 3.26Å; V114-L119 HydrophobicContact CG2-CB 4.28Å; V114-L119 VanDerWaalsContact CG2-O 3.3Å; V114-L119 WeakPolarHBondContact CG2-O 3.44Å; V114-L119 PolarHBondContact N-O 3.26Å; V114-I121 HydrophobicContact CB-CG2 4.36Å; V114-I121 HydrophobicContact CG1-CG2 3.57Å; V114-I121 HydrophobicContact CG2-CB 4.14Å; V114-I121 HydrophobicContact CG2-CG2 4.07Å; V114-L285 HydrophobicContact CB-CB 4.19Å; V114-L285 HydrophobicContact CB-CD1 4.13Å; V114-L285 HydrophobicContact CG2-CB 4.38Å; V114-L285 HydrophobicContact CG2-CD1 3.8Å; V114-L285 CarbonylContact O-C 3.59Å; V114-L285 VanDerWaalsContact O-CB 3.23Å; V114-L285 WeakPolarHBondContact O-CB 3.48Å; V114-K286 WeakPolarHBondContact O-CA 3.49Å; V114-K286 PolarHBondContact O-N 2.88Å
115	S	83.4	Confident	86.6	Confident	11 Å²	11	23 Å²	23	8%	0.077	12%	0.123	C	C	.	.	S	Bend	trans	-137.5	171.4	-179.1	68.1	0	0	0	0	111.3	N113 V117 G118 L119 H288 C294	N113-S115 VanDerWaalsContact C-N 3.29Å; S115-V117 PolarHBondContact O-N 3.05Å; S115-V117 VanDerWaalsContact OG-CG2 3.29Å; S115-V117 WeakPolarHBondContact OG-CG2 3.4Å; S115-G118 PolarHBondContact O-N 2.89Å; S115-L119 WeakPolarHBondContact OG-CB 3.23Å; S115-L119 WeakPolarHBondContact OG-CG 3.17Å; S115-L119 PolarHBondContact OG-N 3.43Å; S115-H288 WeakPolarHBondContact CB-O 3.29Å; S115-C294 VanDerWaalsContact CB-SG 3.57Å
116	L	78	Confident	86.5	Confident	101 Å²	101	23 Å²	23	53%	0.529	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-20	179.9	-64.7	176.6	0	0	0	113.3	H288 D289	L116-H288 WeakPolarHBondContact CB-O 3.37Å; L116-H288 PolarHBondContact N-O 2.87Å; L116-D289 HydrophobicContact CB-CB 4.03Å; L116-D289 HydrophobicContact CD1-CB 4.12Å
117	V	76.6	Confident	86.4	Confident	55 Å²	55	23.3 Å²	23.3	33%	0.333	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	7.3	173.2	-74	0	0	0	0	113.4	S115 L119 D289	S115-V117 PolarHBondContact O-N 3.05Å; S115-V117 VanDerWaalsContact OG-CG2 3.29Å; S115-V117 WeakPolarHBondContact OG-CG2 3.4Å; V117-L119 HydrophobicContact CG2-CD1 4.13Å; V117-L119 HydrophobicContact CG2-CG 3.9Å; V117-L119 PolarHBondContact O-N 3.11Å; V117-D289 WeakPolarHBondContact CG1-O 3.44Å
118	G	80.7	Confident	86.3	Confident	13 Å²	13	23.3 Å²	23.3	13%	0.134	13%	0.125	C	C	.	.			trans	79.5	12.2	173.1	0	0	0	0	0	115.4	N113 S115 T143	N113-G118 PolarHBondContact OD1-O 2.79Å; S115-G118 PolarHBondContact O-N 2.89Å; G118-T143 VanDerWaalsContact C-CG2 3.46Å; G118-T143 WeakPolarHBondContact O-CG2 3.44Å
119	L	85.3	Confident	86.1	Confident	16 Å²	16	23.2 Å²	23.2	8%	0.084	13%	0.125	C	C	.	.			trans	-52.7	148.5	-178.9	-66	172.1	0	0	0	112	N113 V114 S115 V117 H141 L291 C294	N113-L119 CarbonylContact C-O 3.57Å; N113-L119 WeakPolarHBondContact CA-O 3.4Å; N113-L119 PolarHBondContact N-O 3.41Å; N113-L119 VanDerWaalsContact N-O 3.11Å; V114-L119 HydrophobicContact CG2-CB 4.28Å; V114-L119 VanDerWaalsContact CG2-O 3.3Å; V114-L119 WeakPolarHBondContact CG2-O 3.44Å; V114-L119 PolarHBondContact N-O 3.26Å; S115-L119 WeakPolarHBondContact OG-CB 3.23Å; S115-L119 WeakPolarHBondContact OG-CG 3.17Å; S115-L119 PolarHBondContact OG-N 3.43Å; V117-L119 HydrophobicContact CG2-CD1 4.13Å; V117-L119 HydrophobicContact CG2-CG 3.9Å; V117-L119 PolarHBondContact O-N 3.11Å; L119-H141 WeakPolarHBondContact CA-O 3.31Å; L119-H141 WeakPolarHBondContact CD2-O 3.08Å; L119-L291 HydrophobicContact CD1-CD1 4.11Å; L119-C294 HydrophobicContact CD1-CB 4.05Å
120	T	87.1	Confident	85.9	Confident	14 Å²	14	24.7 Å²	24.7	9%	0.086	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.2	171	-64.9	0	0	0	0	108.9	V110 T111 Y112 F122 L140 H141	V110-T120 HydrophobicContact CG2-CG2 3.37Å; T111-T120 WeakPolarHBondContact O-CA 3.47Å; Y112-T120 HydrophobicContact CD1-CG2 3.79Å; Y112-T120 WeakPolarHBondContact CD1-OG1 3.2Å; Y112-T120 HydrophobicContact CE1-CG2 3.97Å; T120-F122 HydrophobicContact CG2-CD2 4.33Å; T120-F122 HydrophobicContact CG2-CE2 4.02Å; T120-L140 CarbonylContact O-C 3.59Å; T120-L140 WeakPolarHBondContact O-CA 3.43Å; T120-H141 PolarHBondContact N-O 3.34Å; T120-H141 PolarHBondContact O-N 3.11Å
121	I	88.9	Confident	85.9	Confident	5 Å²	5	26 Å²	26	3%	0.026	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.4	173.4	-169.3	171.1	0	0	0	110.3	V110 T111 V114 F138 S139 L140 I281 L285 L298	V110-I121 CarbonylContact C-O 3.54Å; V110-I121 WeakPolarHBondContact CA-O 3.4Å; T111-I121 PolarHBondContact N-O 2.83Å; T111-I121 PolarHBondContact O-N 3.22Å; V114-I121 HydrophobicContact CB-CG2 4.36Å; V114-I121 HydrophobicContact CG1-CG2 3.57Å; V114-I121 HydrophobicContact CG2-CB 4.14Å; V114-I121 HydrophobicContact CG2-CG2 4.07Å; I121-F138 HydrophobicContact CD1-CB 4.45Å; I121-F138 HydrophobicContact CD1-CD1 4.02Å; I121-S139 CarbonylContact C-O 3.57Å; I121-S139 WeakPolarHBondContact CA-O 3.49Å; I121-L140 HydrophobicContact CB-CD2 3.89Å; I121-L140 HydrophobicContact CD1-CD2 4.12Å; I121-L140 HydrophobicContact CG1-CD2 3.99Å; I121-I281 HydrophobicContact CD1-CG2 3.78Å; I121-L285 HydrophobicContact CD1-CD1 3.99Å; I121-L298 HydrophobicContact CD1-CD1 3.65Å; I121-L298 HydrophobicContact CD1-CD2 4.13Å
122	F	89.3	Confident	85.9	Confident	18 Å²	18	28.3 Å²	28.3	8%	0.079	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	136	160.8	-72.6	-98.1	0	0	0	109.1	S109 V110 T120 F138 S139 H141 L152 C173	S109-F122 WeakPolarHBondContact O-CA 3.17Å; V110-F122 HydrophobicContact CB-CD1 3.99Å; V110-F122 HydrophobicContact CB-CE1 3.87Å; V110-F122 HydrophobicContact CB-CZ 4.29Å; V110-F122 HydrophobicContact CG2-CD1 4.12Å; V110-F122 HydrophobicContact CG2-CD2 4.19Å; V110-F122 HydrophobicContact CG2-CE1 3.85Å; V110-F122 HydrophobicContact CG2-CE2 3.93Å; V110-F122 HydrophobicContact CG2-CG 4.3Å; V110-F122 HydrophobicContact CG2-CZ 3.75Å; T120-F122 HydrophobicContact CG2-CD2 4.33Å; T120-F122 HydrophobicContact CG2-CE2 4.02Å; F122-F138 CarbonylContact O-C 3.59Å; F122-F138 WeakPolarHBondContact O-CA 3.43Å; F122-S139 PolarHBondContact N-O 3.28Å; F122-S139 PolarHBondContact O-N 2.73Å; F122-H141 AromaticContact CD2-CD2 3.44Å; F122-H141 VanDerWaalsContact CD2-CD2 3.44Å; F122-H141 WeakPolarHBondContact CD2-CD2 3.36Å; F122-H141 AromaticContact CD2-NE2 3.35Å; F122-H141 VanDerWaalsContact CD2-NE2 3.35Å; F122-H141 WeakPolarHBondContact CD2-NE2 3.28Å; F122-H141 AromaticContact CE2-CD2 3.93Å; F122-H141 AromaticContact CE2-NE2 3.84Å; F122-L152 HydrophobicContact CB-CD1 4.47Å; F122-L152 HydrophobicContact CB-CD2 3.75Å; F122-L152 HydrophobicContact CD1-CD2 3.71Å; F122-L152 HydrophobicContact CE1-CD2 4.46Å; F122-L152 HydrophobicContact CG-CD2 3.78Å; F122-C173 HydrophobicContact CE1-CB 3.94Å
123	Q	90.1	Very high	86.1	Confident	6 Å²	6	26.2 Å²	26.2	3%	0.028	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128	175.6	177.5	-172.4	-18.6	0	0	108.4	S109 P135 F138 C276	S109-Q123 PolarHBondContact N-O 3Å; S109-Q123 PolarHBondContact O-N 3.24Å; S109-Q123 PolarHBondContact OG-O 3.41Å; Q123-P135 HydrophobicContact CG-CB 4.17Å; Q123-F138 HydrophobicContact CB-CD1 4.09Å; Q123-F138 HydrophobicContact CB-CE1 4.25Å; Q123-F138 HydrophobicContact CG-CD1 3.9Å; Q123-F138 HydrophobicContact CG-CE1 3.63Å; Q123-C276 VanDerWaalsContact CD-O 3.24Å; Q123-C276 PolarHBondContact NE2-O 3.36Å; Q123-C276 PolarHBondContact OE1-O 3.12Å
124	I	92.5	Very high	86.4	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.005	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.1	172.3	-51.7	173.4	0	0	0	107.4	L106 S107 F108 I136 M137 L152 F156	L106-I124 HydrophobicContact CD2-CG2 4.09Å; S107-I124 CarbonylContact O-C 3.54Å; S107-I124 WeakPolarHBondContact O-CA 3.4Å; F108-I124 HydrophobicContact CD1-CD1 4.01Å; F108-I124 HydrophobicContact CD1-CG1 3.8Å; F108-I124 HydrophobicContact CD2-CG2 4.21Å; F108-I124 HydrophobicContact CE1-CD1 3.39Å; F108-I124 HydrophobicContact CE1-CG1 3.7Å; F108-I124 HydrophobicContact CE2-CG2 3.88Å; F108-I124 HydrophobicContact CG-CG1 4.26Å; F108-I124 HydrophobicContact CZ-CD1 3.7Å; F108-I124 HydrophobicContact CZ-CG1 4.07Å; F108-I124 HydrophobicContact CZ-CG2 4.05Å; I124-I136 HydrophobicContact CB-CG1 4.34Å; I124-I136 HydrophobicContact CG2-CD1 4.07Å; I124-I136 HydrophobicContact CG2-CG1 4.09Å; I124-I136 WeakPolarHBondContact O-CG1 3.44Å; I124-I136 PolarHBondContact O-N 2.8Å; I124-M137 HydrophobicContact CB-CB 4.23Å; I124-M137 HydrophobicContact CD1-CB 4.43Å; I124-M137 HydrophobicContact CD1-CG 4.49Å; I124-M137 HydrophobicContact CD1-SD 3.8Å; I124-M137 PolarHBondContact N-O 2.99Å; I124-M137 PolarHBondContact O-N 2.98Å; I124-L152 HydrophobicContact CD1-CD1 4.22Å; I124-L152 HydrophobicContact CD1-CG 4.34Å; I124-F156 HydrophobicContact CD1-CB 4.47Å; I124-F156 HydrophobicContact CD1-CD2 3.55Å; I124-F156 HydrophobicContact CD1-CE2 4.25Å; I124-F156 HydrophobicContact CD1-CG 4.36Å; I124-F156 HydrophobicContact CG2-CD2 4.29Å; I124-F156 HydrophobicContact CG2-CE2 3.91Å
125	A	92.7	Very high	86.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154	-176	0	0	0	0	0	111.9	L106 S107 T133 R134 C276	L106-A125 CarbonylContact C-O 3.56Å; L106-A125 WeakPolarHBondContact CA-O 3.42Å; S107-A125 PolarHBondContact N-O 3.43Å; S107-A125 PolarHBondContact O-N 3.26Å; A125-T133 HydrophobicContact CB-CG2 3.45Å; A125-T133 VanDerWaalsContact CB-CG2 3.45Å; A125-R134 CarbonylContact C-O 3.59Å; A125-R134 WeakPolarHBondContact CA-O 3.11Å; A125-R134 WeakPolarHBondContact CB-O 3.31Å; A125-C276 HydrophobicContact CB-CB 3.91Å
126	V	93.1	Very high	87.2	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	163.9	167.7	-64.3	0	0	0	0	110.4	L98 Y99 F102 V105 L106 T133 R134 I136	L98-V126 HydrophobicContact CD2-CG2 4.27Å; L98-V126 HydrophobicContact CG-CG2 3.99Å; Y99-V126 HydrophobicContact CD2-CG1 3.9Å; F102-V126 HydrophobicContact CB-CB 4.39Å; F102-V126 HydrophobicContact CB-CG2 4.31Å; F102-V126 WeakPolarHBondContact O-CB 3.17Å; F102-V126 VanDerWaalsContact O-CG1 3.28Å; F102-V126 WeakPolarHBondContact O-CG1 3.49Å; V105-V126 WeakPolarHBondContact O-CA 3.5Å; L106-V126 HydrophobicContact CD2-CG1 3.71Å; V126-T133 CarbonylContact O-C 3.6Å; V126-T133 WeakPolarHBondContact O-CA 3.44Å; V126-R134 HydrophobicContact CG2-CB 4.16Å; V126-R134 PolarHBondContact N-O 3.23Å; V126-R134 PolarHBondContact O-N 3.05Å; V126-I136 HydrophobicContact CB-CG2 4.39Å; V126-I136 HydrophobicContact CG1-CD1 3.95Å; V126-I136 HydrophobicContact CG1-CG1 4.47Å; V126-I136 HydrophobicContact CG1-CG2 3.93Å; V126-I136 HydrophobicContact CG2-CG2 3.77Å
127	T	90.5	Very high	88	Confident	6 Å²	6	16.3 Å²	16.3	4%	0.037	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	119.1	165.4	-60.4	0	0	0	0	109.1	V105 L131 R132 L266 R416	V105-T127 PolarHBondContact O-N 3.24Å; T127-L131 HydrophobicContact CG2-CD2 4.15Å; T127-R132 WeakPolarHBondContact CA-O 3.44Å; T127-L266 HydrophobicContact CG2-CD1 4.05Å; T127-R416 PolarHBondContact O-NH2 3.41Å
128	D	88.3	Confident	88.8	Confident	1 Å²	1	13.8 Å²	13.8	1%	0.005	7%	0.071	C	C	.	.			trans	-73.4	179.7	-179.2	70.9	13.4	0	0	0	113.5	F102 L130 L131 R132 R134 R416	F102-D128 HydrophobicContact CD2-CB 3.92Å; F102-D128 HydrophobicContact CE2-CB 3.84Å; F102-D128 HydrophobicContact CG-CB 4.49Å; F102-D128 HydrophobicContact CZ-CB 4.35Å; D128-L130 PolarHBondContact O-N 2.96Å; D128-L130 VanDerWaalsContact OD1-C 3.24Å; D128-L130 VanDerWaalsContact OD1-CA 3.29Å; D128-L130 WeakPolarHBondContact OD1-CA 2.99Å; D128-L130 WeakPolarHBondContact OD1-CB 3.1Å; D128-L130 PolarHBondContact OD1-N 3.32Å; D128-L131 PolarHBondContact O-N 3.26Å; D128-L131 VanDerWaalsContact O-N 3.13Å; D128-L131 PolarHBondContact OD1-N 3.02Å; D128-L131 VanDerWaalsContact OD1-N 3.1Å; D128-R132 PolarHBondContact N-O 2.92Å; D128-R132 PolarHBondContact OD1-N 3.07Å; D128-R134 HydrophobicContact CB-CG 4.05Å; D128-R134 IonicContact OD2-CZ 2.66Å; D128-R134 VanDerWaalsContact OD2-CZ 3.31Å; D128-R134 IonicContact OD2-NE 3.9Å; D128-R134 PolarHBondContact OD2-NE 3.29Å; D128-R134 IonicContact OD2-NH2 3.32Å; D128-R134 PolarHBondContact OD2-NH2 2.94Å; D128-R416 PolarHBondContact O-NH1 3.09Å
129	G	85.6	Confident	89.4	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-6.3	176	0	0	0	0	0	114.7	F102 N422	F102-G129 VanDerWaalsContact CE1-N 3.32Å; G129-N422 VanDerWaalsContact CA-OD1 3.32Å; G129-N422 WeakPolarHBondContact CA-OD1 3.44Å
130	L	81.8	Confident	89.6	Confident	31 Å²	31	12.5 Å²	12.5	16%	0.162	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	13.4	173.8	-58.1	179.4	0	0	0	112.3	D128 R132 L317	D128-L130 PolarHBondContact O-N 2.96Å; D128-L130 VanDerWaalsContact OD1-C 3.24Å; D128-L130 VanDerWaalsContact OD1-CA 3.29Å; D128-L130 WeakPolarHBondContact OD1-CA 2.99Å; D128-L130 WeakPolarHBondContact OD1-CB 3.1Å; D128-L130 PolarHBondContact OD1-N 3.32Å; L130-R132 VanDerWaalsContact C-N 3.29Å; L130-R132 PolarHBondContact O-N 2.79Å; L130-L317 HydrophobicContact CD2-CD2 4.11Å
131	L	85.2	Confident	89.7	Confident	44 Å²	44	12.2 Å²	12.2	23%	0.23	6%	0.059	C	C	.	.	S	Bend	trans	61.6	29	-177.8	-58	-174	0	0	0	115.3	T127 D128 L266 Y339 W417	T127-L131 HydrophobicContact CG2-CD2 4.15Å; D128-L131 PolarHBondContact O-N 3.26Å; D128-L131 VanDerWaalsContact O-N 3.13Å; D128-L131 PolarHBondContact OD1-N 3.02Å; D128-L131 VanDerWaalsContact OD1-N 3.1Å; L131-L266 HydrophobicContact CD2-CB 4.03Å; L131-L266 WeakPolarHBondContact CD2-O 3.48Å; L131-Y339 HydrophobicContact CD1-CD1 3.85Å; L131-Y339 HydrophobicContact CD1-CD2 3.52Å; L131-Y339 HydrophobicContact CD1-CE1 3.7Å; L131-Y339 HydrophobicContact CD1-CE2 3.34Å; L131-Y339 HydrophobicContact CD1-CG 3.78Å; L131-Y339 VanDerWaalsContact CD1-CZ 3.46Å; L131-Y339 HydrophobicContact CD2-CE1 4.39Å; L131-Y339 HydrophobicContact CG-CD1 4.13Å; L131-Y339 HydrophobicContact CG-CD2 4.4Å; L131-Y339 HydrophobicContact CG-CE1 4.29Å; L131-Y339 HydrophobicContact CG-CG 4.2Å; L131-W417 HydrophobicContact CD2-CH2 3.71Å; L131-W417 HydrophobicContact CD2-CZ3 4.12Å
132	R	84.6	Confident	89.3	Confident	72 Å²	72	13.5 Å²	13.5	27%	0.272	7%	0.069	S	C	.	.			trans	-102.2	138.2	175.9	-64.9	180	177.6	-146	25.7	111	T127 D128 L130 R134 E312	T127-R132 WeakPolarHBondContact CA-O 3.44Å; D128-R132 PolarHBondContact N-O 2.92Å; D128-R132 PolarHBondContact OD1-N 3.07Å; L130-R132 VanDerWaalsContact C-N 3.29Å; L130-R132 PolarHBondContact O-N 2.79Å; R132-R134 VanDerWaalsContact CD-NH2 3.34Å; R132-R134 PolarHBondContact O-N 2.9Å; R132-E312 IonicContact CZ-OE1 3.31Å; R132-E312 IonicContact CZ-OE2 2.68Å; R132-E312 VanDerWaalsContact CZ-OE2 3.32Å; R132-E312 IonicContact NE-OE2 3.53Å; R132-E312 VanDerWaalsContact NH1-CD 3.3Å; R132-E312 IonicContact NH1-OE1 3.87Å; R132-E312 PolarHBondContact NH1-OE1 3.37Å; R132-E312 IonicContact NH1-OE2 2.82Å; R132-E312 PolarHBondContact NH1-OE2 2.95Å; R132-E312 VanDerWaalsContact NH1-OE2 3.14Å; R132-E312 IonicContact NH2-OE1 2.96Å; R132-E312 PolarHBondContact NH2-OE1 3.04Å; R132-E312 IonicContact NH2-OE2 2.75Å
133	T	87	Confident	88.1	Confident	43 Å²	43	16.8 Å²	16.8	26%	0.264	9%	0.09	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	117.7	173.4	-49.4	0	0	0	0	110.2	A125 V126 C276 H278	A125-T133 HydrophobicContact CB-CG2 3.45Å; A125-T133 VanDerWaalsContact CB-CG2 3.45Å; V126-T133 CarbonylContact O-C 3.6Å; V126-T133 WeakPolarHBondContact O-CA 3.44Å; T133-C276 HydrophobicContact CG2-CB 4.11Å; T133-H278 PolarHBondContact O-NE2 2.89Å
134	R	88.7	Confident	86.1	Confident	13 Å²	13	24.4 Å²	24.4	5%	0.049	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.1	-179.1	-57.8	-63.3	-176.8	172.9	1	110.3	L98 A125 V126 D128 R132 I136 E312	L98-R134 HydrophobicContact CD2-CB 3.48Å; L98-R134 VanDerWaalsContact CD2-CB 3.48Å; L98-R134 HydrophobicContact CD2-CG 4.04Å; A125-R134 CarbonylContact C-O 3.59Å; A125-R134 WeakPolarHBondContact CA-O 3.11Å; A125-R134 WeakPolarHBondContact CB-O 3.31Å; V126-R134 HydrophobicContact CG2-CB 4.16Å; V126-R134 PolarHBondContact N-O 3.23Å; V126-R134 PolarHBondContact O-N 3.05Å; D128-R134 HydrophobicContact CB-CG 4.05Å; D128-R134 IonicContact OD2-CZ 2.66Å; D128-R134 VanDerWaalsContact OD2-CZ 3.31Å; D128-R134 IonicContact OD2-NE 3.9Å; D128-R134 PolarHBondContact OD2-NE 3.29Å; D128-R134 IonicContact OD2-NH2 3.32Å; D128-R134 PolarHBondContact OD2-NH2 2.94Å; R132-R134 VanDerWaalsContact CD-NH2 3.34Å; R132-R134 PolarHBondContact O-N 2.9Å; R134-I136 PolarHBondContact O-N 3.12Å; R134-E312 IonicContact CZ-OE2 3.74Å; R134-E312 IonicContact NH1-OE2 2.75Å; R134-E312 PolarHBondContact NH1-OE2 3.01Å; R134-E312 IonicContact NH2-OE2 2.76Å; R134-E312 PolarHBondContact NH2-OE2 3.36Å
135	P	92	Very high	84.1	Confident	4 Å²	4	28 Å²	28	3%	0.026	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	132.6	174.9	25.2	-31.1	0	0	0	110.4	Q95 Q123 F138	Q95-P135 PolarHBondContact NE2-O 3.34Å; Q123-P135 HydrophobicContact CG-CB 4.17Å; P135-F138 HydrophobicContact CB-CE1 3.67Å; P135-F138 HydrophobicContact CB-CE2 4.03Å; P135-F138 HydrophobicContact CB-CZ 3.28Å; P135-F138 HydrophobicContact CG-CE1 4.42Å; P135-F138 HydrophobicContact CG-CE2 4.46Å; P135-F138 HydrophobicContact CG-CZ 3.7Å
136	I	94.2	Very high	82.1	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-22.2	174.7	58.5	162.3	0	0	0	112.5	S91 Q95 L98 Y99 L106 I124 V126 R134 F156 F160	S91-I136 WeakPolarHBondContact CB-O 3.44Å; S91-I136 PolarHBondContact OG-O 3.24Å; Q95-I136 HydrophobicContact CB-CB 4.44Å; Q95-I136 WeakPolarHBondContact CB-O 3.48Å; L98-I136 HydrophobicContact CB-CG2 4.41Å; L98-I136 HydrophobicContact CD2-CG2 4.25Å; L98-I136 HydrophobicContact CG-CG2 4.37Å; Y99-I136 HydrophobicContact CD2-CD1 3.7Å; Y99-I136 HydrophobicContact CG-CD1 4.02Å; L106-I136 HydrophobicContact CD2-CD1 3.67Å; I124-I136 HydrophobicContact CB-CG1 4.34Å; I124-I136 HydrophobicContact CG2-CD1 4.07Å; I124-I136 HydrophobicContact CG2-CG1 4.09Å; I124-I136 WeakPolarHBondContact O-CG1 3.44Å; I124-I136 PolarHBondContact O-N 2.8Å; V126-I136 HydrophobicContact CB-CG2 4.39Å; V126-I136 HydrophobicContact CG1-CD1 3.95Å; V126-I136 HydrophobicContact CG1-CG1 4.47Å; V126-I136 HydrophobicContact CG1-CG2 3.93Å; V126-I136 HydrophobicContact CG2-CG2 3.77Å; R134-I136 PolarHBondContact O-N 3.12Å; I136-F156 HydrophobicContact CD1-CE2 3.96Å; I136-F160 HydrophobicContact CB-CE1 4.39Å; I136-F160 HydrophobicContact CB-CZ 4.09Å; I136-F160 HydrophobicContact CD1-CE1 4.04Å; I136-F160 HydrophobicContact CD1-CE2 4.18Å; I136-F160 HydrophobicContact CD1-CZ 3.73Å; I136-F160 HydrophobicContact CG1-CZ 4.1Å
137	M	94.4	Very high	80.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143.7	179.9	-179.6	-176.6	171.9	0	0	109.5	L90 I124 L152 H155 F156 I159 F160	L90-M137 WeakPolarHBondContact O-CA 3.32Å; I124-M137 HydrophobicContact CB-CB 4.23Å; I124-M137 HydrophobicContact CD1-CB 4.43Å; I124-M137 HydrophobicContact CD1-CG 4.49Å; I124-M137 HydrophobicContact CD1-SD 3.8Å; I124-M137 PolarHBondContact N-O 2.99Å; I124-M137 PolarHBondContact O-N 2.98Å; M137-L152 HydrophobicContact CE-CD1 3.77Å; M137-H155 HydrophobicContact CE-CB 3.73Å; M137-F156 HydrophobicContact SD-CB 4.12Å; M137-F156 HydrophobicContact SD-CD2 3.96Å; M137-I159 HydrophobicContact CE-CD1 3.89Å; M137-I159 HydrophobicContact CG-CD1 4.36Å; M137-I159 HydrophobicContact SD-CD1 3.93Å; M137-F160 HydrophobicContact CB-CE2 4.13Å; M137-F160 HydrophobicContact CB-CZ 4.21Å; M137-F160 HydrophobicContact SD-CE2 4.05Å
138	F	93.2	Very high	79.2	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.009	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149.8	172	-57.9	-73.7	0	0	0	110.2	S89 L90 I121 F122 Q123 P135 I281 L298 A302	S89-F138 CarbonylContact C-O 3.52Å; S89-F138 VanDerWaalsContact CA-O 3.3Å; S89-F138 WeakPolarHBondContact CA-O 3.45Å; L90-F138 HydrophobicContact CD1-CD2 4.22Å; L90-F138 PolarHBondContact N-O 3Å; L90-F138 PolarHBondContact O-N 2.83Å; I121-F138 HydrophobicContact CD1-CB 4.45Å; I121-F138 HydrophobicContact CD1-CD1 4.02Å; F122-F138 CarbonylContact O-C 3.59Å; F122-F138 WeakPolarHBondContact O-CA 3.43Å; Q123-F138 HydrophobicContact CB-CD1 4.09Å; Q123-F138 HydrophobicContact CB-CE1 4.25Å; Q123-F138 HydrophobicContact CG-CD1 3.9Å; Q123-F138 HydrophobicContact CG-CE1 3.63Å; P135-F138 HydrophobicContact CB-CE1 3.67Å; P135-F138 HydrophobicContact CB-CE2 4.03Å; P135-F138 HydrophobicContact CB-CZ 3.28Å; P135-F138 HydrophobicContact CG-CE1 4.42Å; P135-F138 HydrophobicContact CG-CE2 4.46Å; P135-F138 HydrophobicContact CG-CZ 3.7Å; F138-I281 HydrophobicContact CD1-CD1 4.32Å; F138-I281 HydrophobicContact CE1-CD1 3.28Å; F138-I281 HydrophobicContact CZ-CD1 3.62Å; F138-L298 HydrophobicContact CB-CD1 4.02Å; F138-L298 HydrophobicContact CB-CD2 3.69Å; F138-L298 HydrophobicContact CB-CG 4.12Å; F138-L298 HydrophobicContact CD1-CD1 3.84Å; F138-L298 HydrophobicContact CD2-CD1 3.87Å; F138-L298 HydrophobicContact CD2-CG 4.2Å; F138-L298 HydrophobicContact CE1-CD1 4.21Å; F138-L298 HydrophobicContact CE2-CD1 4.22Å; F138-L298 HydrophobicContact CG-CD1 3.63Å; F138-L298 HydrophobicContact CG-CD2 4.24Å; F138-L298 HydrophobicContact CG-CG 4.14Å; F138-L298 HydrophobicContact CZ-CD1 4.35Å; F138-A302 HydrophobicContact CD2-CB 4.28Å; F138-A302 HydrophobicContact CE2-CB 3.71Å
139	S	92.1	Very high	78.8	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	121.4	170.7	-161.2	0	0	0	0	110.6	Q87 V88 S89 I121 F122 H141	Q87-S139 VanDerWaalsContact CG-OG 3.25Å; Q87-S139 WeakPolarHBondContact CG-OG 3.37Å; Q87-S139 PolarHBondContact NE2-OG 3.29Å; V88-S139 CarbonylContact O-C 3.54Å; V88-S139 VanDerWaalsContact O-CA 3.27Å; V88-S139 WeakPolarHBondContact O-CA 3.34Å; V88-S139 PolarHBondContact O-OG 3.17Å; S89-S139 PolarHBondContact OG-OG 3.23Å; I121-S139 CarbonylContact C-O 3.57Å; I121-S139 WeakPolarHBondContact CA-O 3.49Å; F122-S139 PolarHBondContact N-O 3.28Å; F122-S139 PolarHBondContact O-N 2.73Å; S139-H141 PolarHBondContact O-CD2 2.92Å; S139-H141 PolarHBondContact OG-NE2 3.14Å
140	L	91.1	Very high	78.8	Confident	3 Å²	3	42.9 Å²	42.9	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.1	173.6	-69.6	175.5	0	0	0	109.1	Q87 V88 T120 I121 L285 L291 C294 L295 L298	Q87-L140 CarbonylContact C-O 3.57Å; Q87-L140 VanDerWaalsContact CA-O 3.22Å; Q87-L140 WeakPolarHBondContact CA-O 3.45Å; V88-L140 PolarHBondContact N-O 3.44Å; V88-L140 PolarHBondContact O-N 3.37Å; T120-L140 CarbonylContact O-C 3.59Å; T120-L140 WeakPolarHBondContact O-CA 3.43Å; I121-L140 HydrophobicContact CB-CD2 3.89Å; I121-L140 HydrophobicContact CD1-CD2 4.12Å; I121-L140 HydrophobicContact CG1-CD2 3.99Å; L140-L285 HydrophobicContact CD2-CD1 4.32Å; L140-L291 HydrophobicContact CD1-CD1 4.19Å; L140-C294 HydrophobicContact CD1-CB 4.01Å; L140-L295 HydrophobicContact CD1-CD2 3.82Å; L140-L295 HydrophobicContact CD1-CG 4.14Å; L140-L298 HydrophobicContact CD1-CD2 3.96Å; L140-L298 HydrophobicContact CD2-CD2 4.34Å; L140-L298 HydrophobicContact CG-CD2 3.87Å
141	H	88.2	Confident	79.1	Confident	8 Å²	8	42.9 Å²	42.9	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.4	-179.3	-66	-120	0	0	0	110.3	T86 Q87 L119 T120 F122 S139	T86-H141 WeakPolarHBondContact O-CA 3.29Å; Q87-H141 PolarHBondContact OE1-CE1 3.31Å; L119-H141 WeakPolarHBondContact CA-O 3.31Å; L119-H141 WeakPolarHBondContact CD2-O 3.08Å; T120-H141 PolarHBondContact N-O 3.34Å; T120-H141 PolarHBondContact O-N 3.11Å; F122-H141 AromaticContact CD2-CD2 3.44Å; F122-H141 VanDerWaalsContact CD2-CD2 3.44Å; F122-H141 WeakPolarHBondContact CD2-CD2 3.36Å; F122-H141 AromaticContact CD2-NE2 3.35Å; F122-H141 VanDerWaalsContact CD2-NE2 3.35Å; F122-H141 WeakPolarHBondContact CD2-NE2 3.28Å; F122-H141 AromaticContact CE2-CD2 3.93Å; F122-H141 AromaticContact CE2-NE2 3.84Å; S139-H141 PolarHBondContact O-CD2 2.92Å; S139-H141 PolarHBondContact OG-NE2 3.14Å
142	S	81.1	Confident	79.3	Confident	32 Å²	32	40.8 Å²	40.8	22%	0.224	22%	0.217	C	C	.	.			trans	-70.8	156.7	168.3	65.1	0	0	0	0	111.3	T86 E144	T86-S142 PolarHBondContact O-N 3.28Å; S142-E144 PolarHBondContact O-N 2.89Å
143	T	62.8	Low	79.7	Confident	86 Å²	86	37.6 Å²	37.6	53%	0.528	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.2	-167.6	37.9	0	0	0	0	116	G118	G118-T143 VanDerWaalsContact C-CG2 3.46Å; G118-T143 WeakPolarHBondContact O-CG2 3.44Å
144	E	49.8	Very low	79.9	Confident	166 Å²	166	40.1 Å²	40.1	78%	0.776	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.6	0.1	-165.3	-60.3	-157	155.4	0	0	115.4	S142	S142-E144 PolarHBondContact O-N 2.89Å
145	Q	50.5	Low	80.2	Confident	76 Å²	76	39.5 Å²	39.5	36%	0.355	21%	0.211	S	C	.	.			trans	-128.3	91.9	179.4	-61.7	-167.6	7.5	0	0	112	E147 N148	Q145-E147 PolarHBondContact O-N 2.89Å; Q145-N148 PolarHBondContact OE1-ND2 2.86Å
146	T	49.7	Very low	80.3	Confident	127 Å²	127	39.3 Å²	39.3	78%	0.779	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	110.8	151.4	19.7	0	0	0	0	108.1
147	E	55.9	Low	80.3	Confident	73 Å²	73	44.2 Å²	44.2	34%	0.341	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	44.6	155.5	-51.6	169.9	173	0	0	118.4	Q145 L149 S176	Q145-E147 PolarHBondContact O-N 2.89Å; E147-L149 PolarHBondContact O-N 2.71Å; E147-S176 VanDerWaalsContact CD-OG 3.27Å; E147-S176 WeakPolarHBondContact OE2-CB 3.35Å; E147-S176 PolarHBondContact OE2-OG 3.41Å
148	N	66.5	Low	80.3	Confident	52 Å²	52	48 Å²	48	28%	0.278	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	45.1	154	-107.9	-30.3	0	0	0	112.2	Q145 C150 I151 L152	Q145-N148 PolarHBondContact OE1-ND2 2.86Å; N148-C150 PolarHBondContact O-N 3.21Å; N148-I151 HydrophobicContact CB-CB 4.16Å; N148-I151 HydrophobicContact CB-CD1 3.89Å; N148-I151 HydrophobicContact CB-CG1 4.01Å; N148-I151 VanDerWaalsContact ND2-CD1 3.28Å; N148-I151 WeakPolarHBondContact ND2-CD1 3.19Å; N148-I151 PolarHBondContact O-N 3.29Å; N148-L152 PolarHBondContact O-N 3.08Å; N148-L152 VanDerWaalsContact O-N 3.07Å
149	L	80.8	Confident	80.4	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-56.2	-31.9	170.1	-179.1	60.8	0	0	0	110.2	E147 I151 L152 L153 V175 V181	E147-L149 PolarHBondContact O-N 2.71Å; L149-I151 PolarHBondContact O-N 2.58Å; L149-L152 HydrophobicContact CD1-CD2 4.04Å; L149-L152 PolarHBondContact O-N 3.2Å; L149-L153 HydrophobicContact CD1-CD1 4.1Å; L149-L153 HydrophobicContact CD1-CG 4.01Å; L149-L153 HydrophobicContact CD2-CD1 4.32Å; L149-L153 HydrophobicContact CG-CD1 3.71Å; L149-L153 HydrophobicContact CG-CG 4.12Å; L149-L153 VanDerWaalsContact O-CB 3.3Å; L149-L153 WeakPolarHBondContact O-CB 3.48Å; L149-L153 WeakPolarHBondContact O-CG 3.08Å; L149-L153 PolarHBondContact O-N 3.4Å; L149-V175 HydrophobicContact CD2-CB 4.5Å; L149-V175 HydrophobicContact CD2-CG1 3.72Å; L149-V175 HydrophobicContact CD2-CG2 4.35Å; L149-V181 HydrophobicContact CD2-CG2 3.88Å
150	C	84.8	Confident	80.6	Confident	61 Å²	61	48.9 Å²	48.9	41%	0.412	25%	0.25	S	C	.	.	H	α-helix	trans	-55.4	-47.9	171.4	-63.6	0	0	0	0	112.4	N148 L153 K154	N148-C150 PolarHBondContact O-N 3.21Å; C150-L153 PolarHBondContact O-N 3.37Å; C150-K154 WeakPolarHBondContact O-CB 3.29Å; C150-K154 PolarHBondContact O-N 3.14Å
151	I	88.5	Confident	80.6	Confident	30 Å²	30	57 Å²	57	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-67.6	-44.9	179.1	-63.6	-176.6	0	0	0	110.3	E79 N148 L149 L153 K154 H155	E79-I151 HydrophobicContact CG-CG2 3.63Å; N148-I151 HydrophobicContact CB-CB 4.16Å; N148-I151 HydrophobicContact CB-CD1 3.89Å; N148-I151 HydrophobicContact CB-CG1 4.01Å; N148-I151 VanDerWaalsContact ND2-CD1 3.28Å; N148-I151 WeakPolarHBondContact ND2-CD1 3.19Å; N148-I151 PolarHBondContact O-N 3.29Å; L149-I151 PolarHBondContact O-N 2.58Å; I151-L153 VanDerWaalsContact C-N 3.31Å; I151-L153 PolarHBondContact O-N 3.44Å; I151-K154 WeakPolarHBondContact O-CB 3.46Å; I151-K154 PolarHBondContact O-N 3.41Å; I151-H155 VanDerWaalsContact CG2-CE1 3.42Å; I151-H155 WeakPolarHBondContact CG2-CE1 3.29Å; I151-H155 PolarHBondContact O-N 3.33Å
152	L	90.3	Very high	80.8	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-56	-46.2	175	177.9	64.7	0	0	0	111.9	F108 F122 I124 M137 N148 L149 H155 F156	F108-L152 HydrophobicContact CD1-CD2 4.41Å; F108-L152 HydrophobicContact CE1-CD2 4.44Å; F122-L152 HydrophobicContact CB-CD1 4.47Å; F122-L152 HydrophobicContact CB-CD2 3.75Å; F122-L152 HydrophobicContact CD1-CD2 3.71Å; F122-L152 HydrophobicContact CE1-CD2 4.46Å; F122-L152 HydrophobicContact CG-CD2 3.78Å; I124-L152 HydrophobicContact CD1-CD1 4.22Å; I124-L152 HydrophobicContact CD1-CG 4.34Å; M137-L152 HydrophobicContact CE-CD1 3.77Å; N148-L152 PolarHBondContact O-N 3.08Å; N148-L152 VanDerWaalsContact O-N 3.07Å; L149-L152 HydrophobicContact CD1-CD2 4.04Å; L149-L152 PolarHBondContact O-N 3.2Å; L152-H155 PolarHBondContact O-N 3.07Å; L152-F156 WeakPolarHBondContact O-CB 3.5Å; L152-F156 PolarHBondContact O-N 3.14Å
153	L	91.6	Very high	81.5	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-69.3	-34.6	179.2	-69.7	170.2	0	0	0	112.2	F108 L149 C150 I151 F156 R157 L180 V181 S184 F185	F108-L153 HydrophobicContact CE1-CD2 3.8Å; F108-L153 HydrophobicContact CZ-CD2 3.94Å; L149-L153 HydrophobicContact CD1-CD1 4.1Å; L149-L153 HydrophobicContact CD1-CG 4.01Å; L149-L153 HydrophobicContact CD2-CD1 4.32Å; L149-L153 HydrophobicContact CG-CD1 3.71Å; L149-L153 HydrophobicContact CG-CG 4.12Å; L149-L153 VanDerWaalsContact O-CB 3.3Å; L149-L153 WeakPolarHBondContact O-CB 3.48Å; L149-L153 WeakPolarHBondContact O-CG 3.08Å; L149-L153 PolarHBondContact O-N 3.4Å; C150-L153 PolarHBondContact O-N 3.37Å; I151-L153 VanDerWaalsContact C-N 3.31Å; I151-L153 PolarHBondContact O-N 3.44Å; L153-F156 PolarHBondContact O-N 2.78Å; L153-R157 WeakPolarHBondContact O-CG 3.41Å; L153-R157 PolarHBondContact O-N 3.04Å; L153-L180 HydrophobicContact CD1-CB 4.4Å; L153-V181 HydrophobicContact CD1-CG2 4.34Å; L153-S184 WeakPolarHBondContact CB-OG 3.28Å; L153-S184 WeakPolarHBondContact CD1-OG 3.32Å; L153-F185 HydrophobicContact CD2-CE2 3.91Å
154	K	92	Very high	82.9	Confident	97 Å²	97	59.8 Å²	59.8	42%	0.422	30%	0.3	S	S	.	.	H	α-helix	trans	-60.8	-54	170.8	176.8	-167.9	164.9	-156.9	0	110.6	E79 C150 I151 F156 R157 E158	E79-K154 IonicContact OE1-NZ 2.91Å; C150-K154 WeakPolarHBondContact O-CB 3.29Å; C150-K154 PolarHBondContact O-N 3.14Å; I151-K154 WeakPolarHBondContact O-CB 3.46Å; I151-K154 PolarHBondContact O-N 3.41Å; K154-F156 VanDerWaalsContact C-N 3.27Å; K154-F156 PolarHBondContact O-N 3.17Å; K154-R157 PolarHBondContact O-N 3.25Å; K154-R157 VanDerWaalsContact O-N 3.12Å; K154-E158 WeakPolarHBondContact CE-OE1 3.47Å; K154-E158 WeakPolarHBondContact O-CG 3.3Å; K154-E158 PolarHBondContact O-N 3.07Å
155	H	94.6	Very high	85.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-41.6	176.3	-66.9	160.9	0	0	0	111.8	F77 E79 Q87 S89 M137 I151 L152 R157 E158 I159	F77-H155 HydrophobicContact CB-CB 4.49Å; F77-H155 WeakPolarHBondContact CB-NE2 3.48Å; F77-H155 AromaticContact CD1-CD2 3.79Å; F77-H155 HydrophobicContact CD2-CB 4.29Å; F77-H155 HydrophobicContact CG-CB 4.43Å; F77-H155 AromaticContact CG-CD2 3.59Å; F77-H155 AromaticContact CG-CG 3.98Å; F77-H155 AromaticContact CG-NE2 3.98Å; E79-H155 WeakPolarHBondContact CG-CE1 3.3Å; E79-H155 WeakPolarHBondContact CG-NE2 3.27Å; E79-H155 IonicContact OE1-CE1 2.69Å; E79-H155 IonicContact OE1-NE2 3.98Å; E79-H155 PolarHBondContact OE1-NE2 2.99Å; Q87-H155 PolarHBondContact NE2-ND1 3.49Å; S89-H155 PolarHBondContact OG-ND1 3.4Å; M137-H155 HydrophobicContact CE-CB 3.73Å; I151-H155 VanDerWaalsContact CG2-CE1 3.42Å; I151-H155 WeakPolarHBondContact CG2-CE1 3.29Å; I151-H155 PolarHBondContact O-N 3.33Å; L152-H155 PolarHBondContact O-N 3.07Å; H155-R157 PolarHBondContact O-N 3.25Å; H155-E158 IonicContact CD2-OE2 2.96Å; H155-E158 PolarHBondContact O-N 3.03Å; H155-I159 VanDerWaalsContact O-CG1 3.24Å; H155-I159 WeakPolarHBondContact O-CG1 3.45Å; H155-I159 PolarHBondContact O-N 2.84Å
156	F	94.9	Very high	87.2	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-56.7	-50.1	175.6	-178.6	-84.4	0	0	0	111.2	Y99 L106 I124 I136 M137 L152 L153 K154 E158 I159 F160 V163 F185	Y99-F156 HydrophobicContact CD2-CZ 4.48Å; Y99-F156 HydrophobicContact CE2-CZ 4.01Å; L106-F156 HydrophobicContact CD1-CE1 4.26Å; L106-F156 HydrophobicContact CD1-CE2 4.2Å; L106-F156 HydrophobicContact CD1-CZ 3.57Å; L106-F156 HydrophobicContact CD2-CZ 4.42Å; I124-F156 HydrophobicContact CD1-CB 4.47Å; I124-F156 HydrophobicContact CD1-CD2 3.55Å; I124-F156 HydrophobicContact CD1-CE2 4.25Å; I124-F156 HydrophobicContact CD1-CG 4.36Å; I124-F156 HydrophobicContact CG2-CD2 4.29Å; I124-F156 HydrophobicContact CG2-CE2 3.91Å; I136-F156 HydrophobicContact CD1-CE2 3.96Å; M137-F156 HydrophobicContact SD-CB 4.12Å; M137-F156 HydrophobicContact SD-CD2 3.96Å; L152-F156 WeakPolarHBondContact O-CB 3.5Å; L152-F156 PolarHBondContact O-N 3.14Å; L153-F156 PolarHBondContact O-N 2.78Å; K154-F156 VanDerWaalsContact C-N 3.27Å; K154-F156 PolarHBondContact O-N 3.17Å; F156-E158 VanDerWaalsContact C-N 3.3Å; F156-E158 PolarHBondContact O-N 3.25Å; F156-I159 PolarHBondContact O-N 3.45Å; F156-F160 HydrophobicContact CD1-CD2 4.11Å; F156-F160 AromaticContact CD2-CD2 3.44Å; F156-F160 HydrophobicContact CD2-CD2 3.44Å; F156-F160 VanDerWaalsContact CD2-CD2 3.44Å; F156-F160 AromaticContact CD2-CE2 3.49Å; F156-F160 HydrophobicContact CD2-CE2 3.49Å; F156-F160 VanDerWaalsContact CD2-CE2 3.49Å; F156-F160 HydrophobicContact CE1-CB 4.31Å; F156-F160 AromaticContact CE1-CD2 3.98Å; F156-F160 HydrophobicContact CE1-CD2 3.98Å; F156-F160 HydrophobicContact CE1-CG 4.46Å; F156-F160 AromaticContact CE2-CD2 3.32Å; F156-F160 HydrophobicContact CE2-CD2 3.32Å; F156-F160 AromaticContact CE2-CE2 3.43Å; F156-F160 HydrophobicContact CE2-CE2 3.43Å; F156-F160 VanDerWaalsContact CE2-CE2 3.43Å; F156-F160 HydrophobicContact CE2-CG 4.22Å; F156-F160 HydrophobicContact CE2-CZ 4.36Å; F156-F160 AromaticContact CG-CD2 3.84Å; F156-F160 HydrophobicContact CG-CD2 3.84Å; F156-F160 HydrophobicContact CG-CE2 4.28Å; F156-F160 HydrophobicContact CZ-CB 4.38Å; F156-F160 AromaticContact CZ-CD2 3.6Å; F156-F160 HydrophobicContact CZ-CD2 3.6Å; F156-F160 HydrophobicContact CZ-CE2 4.16Å; F156-F160 HydrophobicContact CZ-CG 4.12Å; F156-F160 VanDerWaalsContact O-CD2 3.27Å; F156-F160 WeakPolarHBondContact O-CD2 3.47Å; F156-F160 PolarHBondContact O-N 2.89Å; F156-V163 HydrophobicContact CD1-CG1 4.41Å; F156-V163 HydrophobicContact CE1-CG1 3.75Å; F156-F185 HydrophobicContact CD1-CE1 4.2Å; F156-F185 AromaticContact CD1-CZ 3.7Å; F156-F185 HydrophobicContact CD1-CZ 3.7Å; F156-F185 AromaticContact CE1-CE1 3.52Å; F156-F185 HydrophobicContact CE1-CE1 3.52Å; F156-F185 AromaticContact CE1-CZ 3.39Å; F156-F185 HydrophobicContact CE1-CZ 3.39Å; F156-F185 HydrophobicContact CG-CZ 4.48Å; F156-F185 HydrophobicContact CZ-CE1 4.08Å; F156-F185 AromaticContact CZ-CZ 3.93Å; F156-F185 HydrophobicContact CZ-CZ 3.93Å
157	R	93.6	Very high	89.4	Confident	102 Å²	102	47.8 Å²	47.8	39%	0.385	24%	0.244	S	C	.	.	H	α-helix	trans	-61.8	-37.7	177.7	-77.2	177.4	157.6	-169.2	-13.7	112.6	L153 K154 H155 K161 E183 S184	L153-R157 WeakPolarHBondContact O-CG 3.41Å; L153-R157 PolarHBondContact O-N 3.04Å; K154-R157 PolarHBondContact O-N 3.25Å; K154-R157 VanDerWaalsContact O-N 3.12Å; H155-R157 PolarHBondContact O-N 3.25Å; R157-K161 WeakPolarHBondContact O-CA 3.44Å; R157-K161 PolarHBondContact O-N 3.4Å; R157-E183 PolarHBondContact NH2-O 2.69Å; R157-S184 VanDerWaalsContact CZ-CA 3.44Å; R157-S184 PolarHBondContact NE-O 2.91Å; R157-S184 PolarHBondContact NH2-O 2.85Å
158	E	94.9	Very high	91.3	Very high	80 Å²	80	44.3 Å²	44.3	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-68.4	-37.7	177.6	-71	172.4	173	0	0	112.3	F77 K154 H155 F156	F77-E158 HydrophobicContact CE1-CB 4.34Å; F77-E158 WeakPolarHBondContact CE1-OE2 3.28Å; F77-E158 HydrophobicContact CE2-CB 4.1Å; F77-E158 HydrophobicContact CZ-CB 3.65Å; F77-E158 WeakPolarHBondContact CZ-OE2 2.95Å; K154-E158 WeakPolarHBondContact CE-OE1 3.47Å; K154-E158 WeakPolarHBondContact O-CG 3.3Å; K154-E158 PolarHBondContact O-N 3.07Å; H155-E158 IonicContact CD2-OE2 2.96Å; H155-E158 PolarHBondContact O-N 3.03Å; F156-E158 VanDerWaalsContact C-N 3.3Å; F156-E158 PolarHBondContact O-N 3.25Å
159	I	95.4	Very high	92.5	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.041	21%	0.214	C	C	.	.	H	α-helix	trans	-71.1	-53.2	178	-67.6	170	0	0	0	111.3	I75 F77 I96 M137 H155 F156	I75-I159 HydrophobicContact CB-CG1 4.42Å; I75-I159 HydrophobicContact CG2-CG1 4.01Å; F77-I159 HydrophobicContact CD2-CD1 4.1Å; F77-I159 HydrophobicContact CD2-CG1 3.96Å; F77-I159 HydrophobicContact CE2-CD1 4.25Å; F77-I159 HydrophobicContact CE2-CG1 3.58Å; I96-I159 HydrophobicContact CD1-CG2 3.79Å; I96-I159 HydrophobicContact CG1-CG2 3.76Å; M137-I159 HydrophobicContact CE-CD1 3.89Å; M137-I159 HydrophobicContact CG-CD1 4.36Å; M137-I159 HydrophobicContact SD-CD1 3.93Å; H155-I159 VanDerWaalsContact O-CG1 3.24Å; H155-I159 WeakPolarHBondContact O-CG1 3.45Å; H155-I159 PolarHBondContact O-N 2.84Å; F156-I159 PolarHBondContact O-N 3.45Å
160	F	95	Very high	93	Very high	12 Å²	12	41.5 Å²	41.5	5%	0.053	21%	0.212	C	C	.	.	H	α-helix	trans	-96.6	-19.4	-167.6	-61.3	-76.4	0	0	0	113.8	I96 Y99 I136 M137 F156 D162	I96-F160 HydrophobicContact CB-CE1 4.39Å; I96-F160 HydrophobicContact CG1-CE1 4.14Å; I96-F160 HydrophobicContact CG2-CD1 4.31Å; Y99-F160 HydrophobicContact CD1-CB 3.72Å; Y99-F160 AromaticContact CD1-CD1 3.29Å; Y99-F160 HydrophobicContact CD1-CD1 3.29Å; Y99-F160 HydrophobicContact CD1-CE1 4.12Å; Y99-F160 AromaticContact CD1-CG 3.71Å; Y99-F160 HydrophobicContact CD1-CG 3.71Å; Y99-F160 HydrophobicContact CE1-CB 3.63Å; Y99-F160 HydrophobicContact CE1-CD1 4.11Å; Y99-F160 HydrophobicContact CE1-CG 4.06Å; Y99-F160 AromaticContact CG-CD1 3.57Å; Y99-F160 HydrophobicContact CG-CD1 3.57Å; Y99-F160 AromaticContact CG-CE1 3.92Å; Y99-F160 HydrophobicContact CG-CE1 3.92Å; Y99-F160 HydrophobicContact CG-CG 4.17Å; I136-F160 HydrophobicContact CB-CE1 4.39Å; I136-F160 HydrophobicContact CB-CZ 4.09Å; I136-F160 HydrophobicContact CD1-CE1 4.04Å; I136-F160 HydrophobicContact CD1-CE2 4.18Å; I136-F160 HydrophobicContact CD1-CZ 3.73Å; I136-F160 HydrophobicContact CG1-CZ 4.1Å; M137-F160 HydrophobicContact CB-CE2 4.13Å; M137-F160 HydrophobicContact CB-CZ 4.21Å; M137-F160 HydrophobicContact SD-CE2 4.05Å; F156-F160 HydrophobicContact CD1-CD2 4.11Å; F156-F160 AromaticContact CD2-CD2 3.44Å; F156-F160 HydrophobicContact CD2-CD2 3.44Å; F156-F160 VanDerWaalsContact CD2-CD2 3.44Å; F156-F160 AromaticContact CD2-CE2 3.49Å; F156-F160 HydrophobicContact CD2-CE2 3.49Å; F156-F160 VanDerWaalsContact CD2-CE2 3.49Å; F156-F160 HydrophobicContact CE1-CB 4.31Å; F156-F160 AromaticContact CE1-CD2 3.98Å; F156-F160 HydrophobicContact CE1-CD2 3.98Å; F156-F160 HydrophobicContact CE1-CG 4.46Å; F156-F160 AromaticContact CE2-CD2 3.32Å; F156-F160 HydrophobicContact CE2-CD2 3.32Å; F156-F160 AromaticContact CE2-CE2 3.43Å; F156-F160 HydrophobicContact CE2-CE2 3.43Å; F156-F160 VanDerWaalsContact CE2-CE2 3.43Å; F156-F160 HydrophobicContact CE2-CG 4.22Å; F156-F160 HydrophobicContact CE2-CZ 4.36Å; F156-F160 AromaticContact CG-CD2 3.84Å; F156-F160 HydrophobicContact CG-CD2 3.84Å; F156-F160 HydrophobicContact CG-CE2 4.28Å; F156-F160 HydrophobicContact CZ-CB 4.38Å; F156-F160 AromaticContact CZ-CD2 3.6Å; F156-F160 HydrophobicContact CZ-CD2 3.6Å; F156-F160 HydrophobicContact CZ-CE2 4.16Å; F156-F160 HydrophobicContact CZ-CG 4.12Å; F156-F160 VanDerWaalsContact O-CD2 3.27Å; F156-F160 WeakPolarHBondContact O-CD2 3.47Å; F156-F160 PolarHBondContact O-N 2.89Å; F160-D162 VanDerWaalsContact C-N 3.25Å; F160-D162 PolarHBondContact O-N 3.5Å
161	K	91.5	Very high	93.2	Very high	175 Å²	175	38.6 Å²	38.6	76%	0.761	19%	0.193	S	C	*	.			trans	61.3	-69.1	176.9	-56.6	-179.3	-179.9	-178.2	0	114.7	R157	R157-K161 WeakPolarHBondContact O-CA 3.44Å; R157-K161 PolarHBondContact O-N 3.4Å
162	D	92.8	Very high	92.9	Very high	100 Å²	100	39 Å²	39	54%	0.535	20%	0.195	S	C	.	.			trans	-90.4	126.3	-179.3	-175.4	12.9	0	0	0	111.2	Y99 F160 S164	Y99-D162 WeakPolarHBondContact CE1-O 3.41Å; Y99-D162 PolarHBondContact OH-O 3.18Å; F160-D162 VanDerWaalsContact C-N 3.25Å; F160-D162 PolarHBondContact O-N 3.5Å; D162-S164 WeakPolarHBondContact OD1-CB 3.37Å; D162-S164 PolarHBondContact OD1-N 3.24Å; D162-S164 PolarHBondContact OD1-OG 2.92Å; D162-S164 PolarHBondContact OD2-OG 3.18Å
163	V	94.7	Very high	92	Very high	17 Å²	17	39 Å²	39	10%	0.103	20%	0.195	C	C	.	.			trans	-123.4	5.3	178.6	-55.6	0	0	0	0	113.1	Y99 F156 S165 T166 F185	Y99-V163 WeakPolarHBondContact OH-CA 3.34Å; F156-V163 HydrophobicContact CD1-CG1 4.41Å; F156-V163 HydrophobicContact CE1-CG1 3.75Å; V163-S165 PolarHBondContact O-N 3.38Å; V163-T166 WeakPolarHBondContact O-CB 3.32Å; V163-T166 PolarHBondContact O-N 3.22Å; V163-T166 PolarHBondContact O-OG1 2.99Å; V163-F185 HydrophobicContact CB-CD1 3.82Å; V163-F185 HydrophobicContact CB-CE1 3.92Å; V163-F185 HydrophobicContact CG1-CD1 4.24Å; V163-F185 HydrophobicContact CG1-CE1 3.84Å; V163-F185 HydrophobicContact CG2-CD1 4.19Å
164	S	94.2	Very high	90.7	Very high	67 Å²	67	40 Å²	40	47%	0.469	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.3	-174.8	60.9	0	0	0	0	113.5	D162 T166 T187	D162-S164 WeakPolarHBondContact OD1-CB 3.37Å; D162-S164 PolarHBondContact OD1-N 3.24Å; D162-S164 PolarHBondContact OD1-OG 2.92Å; D162-S164 PolarHBondContact OD2-OG 3.18Å; S164-T166 VanDerWaalsContact C-N 3.35Å; S164-T187 PolarHBondContact O-OG1 2.92Å
165	S	94.6	Very high	89.3	Confident	62 Å²	62	35.8 Å²	35.8	43%	0.434	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-4.5	-179.6	-63.7	0	0	0	0	114	V163 L167	V163-S165 PolarHBondContact O-N 3.38Å; S165-L167 PolarHBondContact O-N 3.22Å
166	T	96.1	Very high	87.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.206	C	C	.	.			trans	-74.2	119.9	173	-59.6	0	0	0	0	109.5	Y99 P103 L106 V163 S164 V169 F185 A188	Y99-T166 PolarHBondContact OH-OG1 3.16Å; P103-T166 VanDerWaalsContact O-CA 3.31Å; P103-T166 WeakPolarHBondContact O-CA 3.35Å; P103-T166 PolarHBondContact O-OG1 3.09Å; L106-T166 HydrophobicContact CB-CG2 4.4Å; L106-T166 HydrophobicContact CD1-CG2 3.88Å; L106-T166 HydrophobicContact CG-CG2 4.08Å; V163-T166 WeakPolarHBondContact O-CB 3.32Å; V163-T166 PolarHBondContact O-N 3.22Å; V163-T166 PolarHBondContact O-OG1 2.99Å; S164-T166 VanDerWaalsContact C-N 3.35Å; T166-V169 HydrophobicContact CG2-CG2 3.62Å; T166-F185 HydrophobicContact CG2-CD1 4.02Å; T166-F185 HydrophobicContact CG2-CE1 4.39Å; T166-A188 HydrophobicContact CG2-CB 3.99Å; T166-A188 WeakPolarHBondContact O-CB 3.3Å
167	L	95.3	Very high	86.7	Confident	55 Å²	55	45.6 Å²	45.6	29%	0.288	23%	0.231	S	C	.	.			trans	-101.3	-29.8	-178	-57.1	179.3	0	0	0	111.9	E104 S165 A188 R189 V264 L391	E104-L167 HydrophobicContact CB-CD1 4.3Å; E104-L167 HydrophobicContact CB-CG 4.44Å; E104-L167 WeakPolarHBondContact O-CA 3.31Å; E104-L167 WeakPolarHBondContact O-CB 3.46Å; E104-L167 PolarHBondContact O-N 3.29Å; S165-L167 PolarHBondContact O-N 3.22Å; L167-A188 WeakPolarHBondContact O-CA 3.34Å; L167-R189 PolarHBondContact O-N 2.84Å; L167-V264 HydrophobicContact CB-CB 4.17Å; L167-V264 HydrophobicContact CB-CG2 4.03Å; L167-V264 HydrophobicContact CD1-CB 4.5Å; L167-V264 HydrophobicContact CD1-CG1 4.44Å; L167-V264 HydrophobicContact CD1-CG2 3.86Å; L167-L391 HydrophobicContact CD1-CD1 4.1Å; L167-L391 HydrophobicContact CD1-CD2 4.38Å
168	T	94.6	Very high	86.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	132.6	179.9	-64.2	0	0	0	0	111.1	E104 V105 L106 R189 V191 V263 V264 V273	E104-T168 PolarHBondContact O-N 3.4Å; V105-T168 WeakPolarHBondContact CA-O 3.36Å; L106-T168 PolarHBondContact N-O 3.43Å; T168-R189 CarbonylContact C-O 3.46Å; T168-R189 WeakPolarHBondContact CA-O 3.42Å; T168-V191 HydrophobicContact CG2-CG2 3.83Å; T168-V263 HydrophobicContact CG2-CG1 3.69Å; T168-V263 WeakPolarHBondContact OG1-CG1 3.39Å; T168-V264 WeakPolarHBondContact CB-O 3.45Å; T168-V264 PolarHBondContact OG1-O 2.81Å; T168-V264 VanDerWaalsContact OG1-O 3.08Å; T168-V273 HydrophobicContact CG2-CG1 4.45Å
169	V	93.1	Very high	85.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	106.2	172.6	-177.7	0	0	0	0	108.5	L106 F108 T166 V171 V181 F185 A188 R189 I190 V191	L106-V169 HydrophobicContact CB-CG2 4.34Å; F108-V169 HydrophobicContact CD2-CG1 3.63Å; F108-V169 HydrophobicContact CE2-CG1 3.6Å; T166-V169 HydrophobicContact CG2-CG2 3.62Å; V169-V171 HydrophobicContact CG1-CG2 4.02Å; V169-V181 HydrophobicContact CB-CG1 4.39Å; V169-V181 HydrophobicContact CG1-CG1 3.75Å; V169-F185 HydrophobicContact CG2-CB 3.99Å; V169-F185 HydrophobicContact CG2-CD1 4.01Å; V169-F185 HydrophobicContact CG2-CD2 3.81Å; V169-F185 HydrophobicContact CG2-CE1 4.44Å; V169-F185 HydrophobicContact CG2-CE2 4.26Å; V169-F185 HydrophobicContact CG2-CG 3.67Å; V169-A188 HydrophobicContact CG2-CB 3.83Å; V169-R189 PolarHBondContact N-O 3.46Å; V169-I190 HydrophobicContact CB-CD1 3.79Å; V169-I190 HydrophobicContact CG1-CD1 4.48Å; V169-I190 HydrophobicContact CG2-CD1 4.25Å; V169-I190 WeakPolarHBondContact O-CA 3.48Å; V169-V191 PolarHBondContact O-N 2.86Å
170	A	90.5	Very high	85	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.6	175.8	0	0	0	0	0	111.1	L106 S107 F108 V191 V273 V274	L106-A170 PolarHBondContact O-N 2.9Å; S107-A170 CarbonylContact C-O 3.5Å; S107-A170 WeakPolarHBondContact CA-O 3.4Å; F108-A170 PolarHBondContact N-O 2.8Å; A170-V191 CarbonylContact C-O 3.54Å; A170-V191 VanDerWaalsContact CA-O 3.27Å; A170-V191 WeakPolarHBondContact CA-O 3.38Å; A170-V273 HydrophobicContact CB-CB 4.06Å; A170-V273 HydrophobicContact CB-CG1 3.52Å; A170-V274 HydrophobicContact CB-CB 4.09Å; A170-V274 HydrophobicContact CB-CG1 3.98Å; A170-V274 HydrophobicContact CB-CG2 3.9Å
171	V	88.8	Confident	84.8	Confident	1 Å²	1	42 Å²	42	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	117.1	-173.7	-165.7	0	0	0	0	112.7	F108 V169 C173 V175 V181 I190 V191 L192 S193 V274	F108-V171 HydrophobicContact CB-CG1 4.08Å; F108-V171 HydrophobicContact CB-CG2 4.45Å; V169-V171 HydrophobicContact CG1-CG2 4.02Å; V171-C173 HydrophobicContact CG1-CB 4.49Å; V171-C173 WeakPolarHBondContact CG1-SG 3.31Å; V171-V175 HydrophobicContact CB-CG2 4.08Å; V171-V175 HydrophobicContact CG1-CG2 3.21Å; V171-V181 HydrophobicContact CG2-CG1 4.38Å; V171-I190 HydrophobicContact CG2-CG2 4.31Å; V171-V191 PolarHBondContact N-O 3.35Å; V171-L192 HydrophobicContact CB-CD2 4.27Å; V171-S193 PolarHBondContact O-N 3.07Å; V171-V274 WeakPolarHBondContact O-CG1 3.46Å
172	D	82.3	Confident	84.7	Confident	38 Å²	38	36.5 Å²	36.5	20%	0.203	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	26.1	175.1	-153.6	22.6	0	0	0	112.8	F108 S193 S195 V274	F108-D172 PolarHBondContact O-N 3.07Å; D172-S193 WeakPolarHBondContact OD1-CB 3.48Å; D172-S193 PolarHBondContact OD1-OG 3.01Å; D172-S195 PolarHBondContact OD1-OG 3.01Å; D172-V274 HydrophobicContact CB-CG1 3.82Å; D172-V274 WeakPolarHBondContact CB-O 3.35Å
173	C	72.6	Confident	84.6	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-121.3	161.8	177.2	67.6	0	0	0	0	111.4	V110 F122 V171 V175 Y196	V110-C173 HydrophobicContact CB-CB 3.71Å; V110-C173 HydrophobicContact CG1-CB 3.37Å; F122-C173 HydrophobicContact CE1-CB 3.94Å; V171-C173 HydrophobicContact CG1-CB 4.49Å; V171-C173 WeakPolarHBondContact CG1-SG 3.31Å; C173-V175 VanDerWaalsContact C-N 3.3Å; C173-V175 PolarHBondContact O-N 2.83Å; C173-Y196 WeakPolarHBondContact O-CE2 3.43Å
174	P	64.2	Low	84.4	Confident	26 Å²	26	37 Å²	37	17%	0.169	20%	0.197	C	C	.	.			trans	-55.6	97	165.1	-24.5	37.5	0	0	0	110.7	Y112 Y196	Y112-P174 WeakPolarHBondContact OH-CD 3.3Å; Y112-P174 WeakPolarHBondContact OH-CG 3.26Å; P174-Y196 WeakPolarHBondContact CA-OH 3.44Å; P174-Y196 HydrophobicContact CB-CE2 4.07Å; P174-Y196 HydrophobicContact CG-CE2 4.09Å
175	V	61.7	Low	84.4	Confident	8 Å²	8	33.9 Å²	33.9	5%	0.048	18%	0.175	C	C	.	.			trans	-97.3	100.5	161.9	-158.8	0	0	0	0	105.1	L149 V171 C173 R177 P178 V181 Y196	L149-V175 HydrophobicContact CD2-CB 4.5Å; L149-V175 HydrophobicContact CD2-CG1 3.72Å; L149-V175 HydrophobicContact CD2-CG2 4.35Å; V171-V175 HydrophobicContact CB-CG2 4.08Å; V171-V175 HydrophobicContact CG1-CG2 3.21Å; C173-V175 VanDerWaalsContact C-N 3.3Å; C173-V175 PolarHBondContact O-N 2.83Å; V175-R177 VanDerWaalsContact CG1-O 3.28Å; V175-R177 WeakPolarHBondContact CG1-O 3.3Å; V175-R177 PolarHBondContact O-N 3.04Å; V175-P178 HydrophobicContact CG1-CG 4.44Å; V175-V181 HydrophobicContact CG1-CG2 3.94Å; V175-Y196 PolarHBondContact N-OH 3.33Å; V175-Y196 PolarHBondContact O-OH 3.41Å; V175-Y196 VanDerWaalsContact O-OH 3.12Å
176	S	60.2	Low	84.3	Confident	66 Å²	66	35.1 Å²	35.1	46%	0.462	18%	0.181	S	C	.	.	S	Bend	trans	-63.3	-26.9	167.7	51	0	0	0	0	111.3	E147	E147-S176 VanDerWaalsContact CD-OG 3.27Å; E147-S176 WeakPolarHBondContact OE2-CB 3.35Å; E147-S176 PolarHBondContact OE2-OG 3.41Å
177	R	75.7	Confident	84.1	Confident	140 Å²	140	39.5 Å²	39.5	53%	0.528	21%	0.208	S	C	.	.			trans	-138.3	82.5	-174	-60.3	-179.9	67.2	119.4	2.4	112	V175 E179 L180	V175-R177 VanDerWaalsContact CG1-O 3.28Å; V175-R177 WeakPolarHBondContact CG1-O 3.3Å; V175-R177 PolarHBondContact O-N 3.04Å; R177-E179 WeakPolarHBondContact CA-OE2 3.27Å; R177-E179 WeakPolarHBondContact CB-OE2 3.22Å; R177-E179 PolarHBondContact O-N 3.11Å; R177-L180 HydrophobicContact CB-CD1 3.83Å; R177-L180 HydrophobicContact CB-CG 3.83Å; R177-L180 WeakPolarHBondContact O-CB 3.37Å; R177-L180 PolarHBondContact O-N 3Å
178	P	79.9	Confident	84.1	Confident	9 Å²	9	37 Å²	37	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-49.4	-26	174.7	-27	35.7	0	0	0	113.4	V175 L180 V181 Q182 L192 I251 M254	V175-P178 HydrophobicContact CG1-CG 4.44Å; P178-L180 VanDerWaalsContact C-N 3.27Å; P178-L180 PolarHBondContact O-N 2.87Å; P178-V181 PolarHBondContact O-N 3.1Å; P178-V181 VanDerWaalsContact O-N 3.15Å; P178-Q182 PolarHBondContact O-N 3.05Å; P178-L192 HydrophobicContact CG-CD1 4.5Å; P178-I251 HydrophobicContact CG-CD1 4.49Å; P178-M254 HydrophobicContact CB-CE 4.34Å; P178-M254 HydrophobicContact CB-SD 3.8Å
179	E	83	Confident	84	Confident	88 Å²	88	41.5 Å²	41.5	41%	0.411	21%	0.212	S	C	.	.	H	α-helix	trans	-57.6	-36.3	175.4	-52.7	75.4	-156.9	0	0	112.1	R177 V181 Q182 E183	R177-E179 WeakPolarHBondContact CA-OE2 3.27Å; R177-E179 WeakPolarHBondContact CB-OE2 3.22Å; R177-E179 PolarHBondContact O-N 3.11Å; E179-V181 VanDerWaalsContact C-N 3.32Å; E179-V181 PolarHBondContact O-N 3.23Å; E179-Q182 CarbonylContact O-C 3.03Å; E179-Q182 PolarHBondContact O-N 3.45Å; E179-E183 WeakPolarHBondContact O-CB 3.44Å; E179-E183 VanDerWaalsContact O-CG 3.28Å; E179-E183 WeakPolarHBondContact O-CG 3.25Å; E179-E183 PolarHBondContact O-N 3.35Å
180	L	85.4	Confident	83.9	Confident	30 Å²	30	41.6 Å²	41.6	16%	0.157	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-37.5	177.8	-66.3	174.6	0	0	0	112.4	L153 R177 P178 S184	L153-L180 HydrophobicContact CD1-CB 4.4Å; R177-L180 HydrophobicContact CB-CD1 3.83Å; R177-L180 HydrophobicContact CB-CG 3.83Å; R177-L180 WeakPolarHBondContact O-CB 3.37Å; R177-L180 PolarHBondContact O-N 3Å; P178-L180 VanDerWaalsContact C-N 3.27Å; P178-L180 PolarHBondContact O-N 2.87Å; L180-S184 WeakPolarHBondContact O-CB 3.1Å; L180-S184 PolarHBondContact O-N 3.31Å; L180-S184 VanDerWaalsContact O-N 3.14Å; L180-S184 PolarHBondContact O-OG 2.97Å
181	V	89	Confident	84	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-71.1	-41.4	175.3	-171.4	0	0	0	0	109.3	L149 L153 V169 V171 V175 P178 E179 E183 S184 F185 I190	L149-V181 HydrophobicContact CD2-CG2 3.88Å; L153-V181 HydrophobicContact CD1-CG2 4.34Å; V169-V181 HydrophobicContact CB-CG1 4.39Å; V169-V181 HydrophobicContact CG1-CG1 3.75Å; V171-V181 HydrophobicContact CG2-CG1 4.38Å; V175-V181 HydrophobicContact CG1-CG2 3.94Å; P178-V181 PolarHBondContact O-N 3.1Å; P178-V181 VanDerWaalsContact O-N 3.15Å; E179-V181 VanDerWaalsContact C-N 3.32Å; E179-V181 PolarHBondContact O-N 3.23Å; V181-E183 PolarHBondContact O-N 2.98Å; V181-S184 CarbonylContact O-C 3.36Å; V181-S184 WeakPolarHBondContact O-CA 3.43Å; V181-S184 WeakPolarHBondContact O-CB 3.39Å; V181-S184 PolarHBondContact O-N 3.49Å; V181-F185 HydrophobicContact CG1-CD2 4.02Å; V181-F185 HydrophobicContact CG1-CE2 4.43Å; V181-F185 WeakPolarHBondContact O-CD2 3.16Å; V181-F185 PolarHBondContact O-N 3.2Å; V181-I190 HydrophobicContact CB-CD1 4.26Å; V181-I190 HydrophobicContact CG1-CD1 3.67Å
182	Q	90.5	Very high	84	Confident	59 Å²	59	41.8 Å²	41.8	28%	0.276	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-41	176.7	-170.1	69.1	75.1	0	0	112.3	P178 E179 S184 F185 P186 A188 I190	P178-Q182 PolarHBondContact O-N 3.05Å; E179-Q182 CarbonylContact O-C 3.03Å; E179-Q182 PolarHBondContact O-N 3.45Å; Q182-S184 PolarHBondContact O-N 2.78Å; Q182-F185 PolarHBondContact NE2-O 3.18Å; Q182-F185 CarbonylContact O-C 3.59Å; Q182-F185 PolarHBondContact O-N 2.95Å; Q182-P186 PolarHBondContact NE2-O 3.1Å; Q182-P186 WeakPolarHBondContact O-CA 3.36Å; Q182-A188 PolarHBondContact NE2-O 3.49Å; Q182-I190 HydrophobicContact CB-CG1 4.31Å
183	E	90.7	Very high	84.2	Confident	118 Å²	118	40 Å²	40	55%	0.551	21%	0.205	S	C	*	.	H	α-helix	trans	-59.5	-35.4	172	-76.1	168.9	-159.1	0	0	111	R157 E179 V181	R157-E183 PolarHBondContact NH2-O 2.69Å; E179-E183 WeakPolarHBondContact O-CB 3.44Å; E179-E183 VanDerWaalsContact O-CG 3.28Å; E179-E183 WeakPolarHBondContact O-CG 3.25Å; E179-E183 PolarHBondContact O-N 3.35Å; V181-E183 PolarHBondContact O-N 2.98Å
184	S	91.2	Very high	84.9	Confident	10 Å²	10	41 Å²	41	7%	0.07	21%	0.212	C	C	.	.	H	α-helix	trans	-73.2	-33.6	178.2	-65.6	0	0	0	0	113.4	L153 R157 L180 V181 Q182	L153-S184 WeakPolarHBondContact CB-OG 3.28Å; L153-S184 WeakPolarHBondContact CD1-OG 3.32Å; R157-S184 VanDerWaalsContact CZ-CA 3.44Å; R157-S184 PolarHBondContact NE-O 2.91Å; R157-S184 PolarHBondContact NH2-O 2.85Å; L180-S184 WeakPolarHBondContact O-CB 3.1Å; L180-S184 PolarHBondContact O-N 3.31Å; L180-S184 VanDerWaalsContact O-N 3.14Å; L180-S184 PolarHBondContact O-OG 2.97Å; V181-S184 CarbonylContact O-C 3.36Å; V181-S184 WeakPolarHBondContact O-CA 3.43Å; V181-S184 WeakPolarHBondContact O-CB 3.39Å; V181-S184 PolarHBondContact O-N 3.49Å; Q182-S184 PolarHBondContact O-N 2.78Å
185	F	94	Very high	85.8	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.224	C	C	.	.			trans	-131	74.7	-178.5	-58.6	-87.3	0	0	0	111.2	L106 F108 L153 F156 V163 T166 V169 V181 Q182 T187 A188	L106-F185 HydrophobicContact CD1-CD1 4.36Å; L106-F185 HydrophobicContact CD1-CE1 3.47Å; L106-F185 VanDerWaalsContact CD1-CE1 3.47Å; L106-F185 HydrophobicContact CD1-CZ 3.67Å; F108-F185 HydrophobicContact CE2-CE2 4.22Å; F108-F185 HydrophobicContact CE2-CZ 4.32Å; F108-F185 AromaticContact CZ-CE2 3.96Å; F108-F185 HydrophobicContact CZ-CE2 3.96Å; F108-F185 HydrophobicContact CZ-CZ 4.1Å; L153-F185 HydrophobicContact CD2-CE2 3.91Å; F156-F185 HydrophobicContact CD1-CE1 4.2Å; F156-F185 AromaticContact CD1-CZ 3.7Å; F156-F185 HydrophobicContact CD1-CZ 3.7Å; F156-F185 AromaticContact CE1-CE1 3.52Å; F156-F185 HydrophobicContact CE1-CE1 3.52Å; F156-F185 AromaticContact CE1-CZ 3.39Å; F156-F185 HydrophobicContact CE1-CZ 3.39Å; F156-F185 HydrophobicContact CG-CZ 4.48Å; F156-F185 HydrophobicContact CZ-CE1 4.08Å; F156-F185 AromaticContact CZ-CZ 3.93Å; F156-F185 HydrophobicContact CZ-CZ 3.93Å; V163-F185 HydrophobicContact CB-CD1 3.82Å; V163-F185 HydrophobicContact CB-CE1 3.92Å; V163-F185 HydrophobicContact CG1-CD1 4.24Å; V163-F185 HydrophobicContact CG1-CE1 3.84Å; V163-F185 HydrophobicContact CG2-CD1 4.19Å; T166-F185 HydrophobicContact CG2-CD1 4.02Å; T166-F185 HydrophobicContact CG2-CE1 4.39Å; V169-F185 HydrophobicContact CG2-CB 3.99Å; V169-F185 HydrophobicContact CG2-CD1 4.01Å; V169-F185 HydrophobicContact CG2-CD2 3.81Å; V169-F185 HydrophobicContact CG2-CE1 4.44Å; V169-F185 HydrophobicContact CG2-CE2 4.26Å; V169-F185 HydrophobicContact CG2-CG 3.67Å; V181-F185 HydrophobicContact CG1-CD2 4.02Å; V181-F185 HydrophobicContact CG1-CE2 4.43Å; V181-F185 WeakPolarHBondContact O-CD2 3.16Å; V181-F185 PolarHBondContact O-N 3.2Å; Q182-F185 PolarHBondContact NE2-O 3.18Å; Q182-F185 CarbonylContact O-C 3.59Å; Q182-F185 PolarHBondContact O-N 2.95Å; F185-T187 PolarHBondContact O-N 3.17Å; F185-T187 VanDerWaalsContact O-N 3.15Å; F185-A188 HydrophobicContact CB-CB 3.72Å; F185-A188 PolarHBondContact O-N 3.16Å; F185-A188 VanDerWaalsContact O-N 3.11Å
186	P	92.5	Very high	86.9	Confident	88 Å²	88	43.4 Å²	43.4	57%	0.571	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.5	-170.2	-25.9	35.7	0	0	0	114.6	Q182	Q182-P186 PolarHBondContact NE2-O 3.1Å; Q182-P186 WeakPolarHBondContact O-CA 3.36Å
187	T	91.2	Very high	88.2	Confident	92 Å²	92	40.3 Å²	40.3	56%	0.564	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-12.8	-178.4	52.7	0	0	0	0	113.4	S164 F185	S164-T187 PolarHBondContact O-OG1 2.92Å; F185-T187 PolarHBondContact O-N 3.17Å; F185-T187 VanDerWaalsContact O-N 3.15Å
188	A	94.5	Very high	88.9	Confident	3 Å²	3	38 Å²	38	3%	0.025	20%	0.195	C	C	.	.	S	Bend	trans	-89.6	146.7	-174	0	0	0	0	0	112.1	T166 L167 V169 Q182 F185	T166-A188 HydrophobicContact CG2-CB 3.99Å; T166-A188 WeakPolarHBondContact O-CB 3.3Å; L167-A188 WeakPolarHBondContact O-CA 3.34Å; V169-A188 HydrophobicContact CG2-CB 3.83Å; Q182-A188 PolarHBondContact NE2-O 3.49Å; F185-A188 HydrophobicContact CB-CB 3.72Å; F185-A188 PolarHBondContact O-N 3.16Å; F185-A188 VanDerWaalsContact O-N 3.11Å
189	R	93.4	Very high	89.3	Confident	94 Å²	94	42.6 Å²	42.6	36%	0.355	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	124.9	166.9	-64.4	-64.9	-60.1	178.8	0.1	109.7	L167 T168 V169 E253 V263	L167-R189 PolarHBondContact O-N 2.84Å; T168-R189 CarbonylContact C-O 3.46Å; T168-R189 WeakPolarHBondContact CA-O 3.42Å; V169-R189 PolarHBondContact N-O 3.46Å; R189-E253 PolarHBondContact NH2-O 3.1Å; R189-V263 HydrophobicContact CB-CG1 4.36Å; R189-V263 HydrophobicContact CB-CG2 4.03Å; R189-V263 HydrophobicContact CG-CG2 4.19Å
190	I	92	Very high	89.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	129.4	175.7	-50.1	-52.9	0	0	0	109.8	V169 V171 V181 Q182 L192 M254	V169-I190 HydrophobicContact CB-CD1 3.79Å; V169-I190 HydrophobicContact CG1-CD1 4.48Å; V169-I190 HydrophobicContact CG2-CD1 4.25Å; V169-I190 WeakPolarHBondContact O-CA 3.48Å; V171-I190 HydrophobicContact CG2-CG2 4.31Å; V181-I190 HydrophobicContact CB-CD1 4.26Å; V181-I190 HydrophobicContact CG1-CD1 3.67Å; Q182-I190 HydrophobicContact CB-CG1 4.31Å; I190-L192 HydrophobicContact CG2-CD2 4.37Å; I190-M254 HydrophobicContact CB-CE 4.41Å; I190-M254 HydrophobicContact CB-SD 4.32Å; I190-M254 HydrophobicContact CG2-SD 4.47Å; I190-M254 WeakPolarHBondContact O-CA 3.44Å; I190-M254 WeakPolarHBondContact O-CB 3.33Å
191	V	91.8	Very high	89.9	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	120.4	178.4	-179.1	0	0	0	0	110.1	T168 V169 A170 V171 M254 L260 V263 V270 V274	T168-V191 HydrophobicContact CG2-CG2 3.83Å; V169-V191 PolarHBondContact O-N 2.86Å; A170-V191 CarbonylContact C-O 3.54Å; A170-V191 VanDerWaalsContact CA-O 3.27Å; A170-V191 WeakPolarHBondContact CA-O 3.38Å; V171-V191 PolarHBondContact N-O 3.35Å; V191-M254 CarbonylContact C-O 3.57Å; V191-M254 VanDerWaalsContact CA-O 3.31Å; V191-M254 WeakPolarHBondContact CA-O 3.46Å; V191-L260 HydrophobicContact CG1-CD1 4.46Å; V191-L260 HydrophobicContact CG2-CD2 4.15Å; V191-V263 HydrophobicContact CG2-CG1 3.74Å; V191-V270 HydrophobicContact CG1-CG1 3.57Å; V191-V274 HydrophobicContact CG1-CG2 4.26Å
192	L	89.6	Confident	90.1	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	139.3	177.1	-55.5	179.4	0	0	0	111	V171 P178 I190 S194 I197 I251 M254 W255	V171-L192 HydrophobicContact CB-CD2 4.27Å; P178-L192 HydrophobicContact CG-CD1 4.5Å; I190-L192 HydrophobicContact CG2-CD2 4.37Å; L192-S194 PolarHBondContact O-N 3.23Å; L192-I197 HydrophobicContact CB-CG2 3.89Å; L192-I197 HydrophobicContact CD1-CG2 4.32Å; L192-I251 HydrophobicContact CD1-CD1 4.19Å; L192-M254 HydrophobicContact CD1-CB 4.4Å; L192-M254 HydrophobicContact CG-CB 4.19Å; L192-M254 PolarHBondContact N-O 2.86Å; L192-W255 HydrophobicContact CB-CB 4.11Å
193	S	86	Confident	90.2	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.014	24%	0.237	C	C	.	.			trans	-63.6	131.4	177.2	-169.7	0	0	0	0	112.9	V171 D172 S195 Y196 I197 V274	V171-S193 PolarHBondContact O-N 3.07Å; D172-S193 WeakPolarHBondContact OD1-CB 3.48Å; D172-S193 PolarHBondContact OD1-OG 3.01Å; S193-S195 PolarHBondContact O-N 3.06Å; S193-S195 PolarHBondContact OG-N 2.87Å; S193-S195 PolarHBondContact OG-OG 3.02Å; S193-Y196 WeakPolarHBondContact O-CB 3.43Å; S193-Y196 PolarHBondContact O-N 3.15Å; S193-I197 PolarHBondContact O-N 3.14Å; S193-V274 VanDerWaalsContact CB-CG1 3.42Å
194	S	86.7	Confident	90.3	Very high	21 Å²	21	49.8 Å²	49.8	15%	0.147	24%	0.239	C	C	.	.	H	α-helix	trans	-58.2	-30.4	171.3	60	0	0	0	0	113.3	L192 I197 R198 N271	L192-S194 PolarHBondContact O-N 3.23Å; S194-I197 WeakPolarHBondContact O-CG1 3.32Å; S194-R198 VanDerWaalsContact O-CB 3.31Å; S194-R198 WeakPolarHBondContact O-CB 3.47Å; S194-R198 VanDerWaalsContact O-CD 3.26Å; S194-R198 WeakPolarHBondContact O-CD 3.26Å; S194-R198 WeakPolarHBondContact O-CG 3.41Å; S194-R198 PolarHBondContact O-N 2.77Å; S194-N271 VanDerWaalsContact CB-OD1 3.28Å; S194-N271 WeakPolarHBondContact CB-OD1 3.44Å; S194-N271 PolarHBondContact OG-OD1 3.42Å
195	S	82.6	Confident	90.5	Very high	60 Å²	60	51 Å²	51	42%	0.42	24%	0.243	S	C	.	.	H	α-helix	trans	-69.6	-42.4	173.8	42	0	0	0	0	111.9	D172 S193 K199	D172-S195 PolarHBondContact OD1-OG 3.01Å; S193-S195 PolarHBondContact O-N 3.06Å; S193-S195 PolarHBondContact OG-N 2.87Å; S193-S195 PolarHBondContact OG-OG 3.02Å; S195-K199 VanDerWaalsContact O-CB 3.28Å; S195-K199 WeakPolarHBondContact O-CB 3.35Å; S195-K199 PolarHBondContact O-N 2.88Å
196	Y	84.8	Confident	90.5	Very high	24 Å²	24	58.3 Å²	58.3	9%	0.094	28%	0.275	C	S	.	.	H	α-helix	trans	-60.8	-56.9	177.7	167.6	-115.7	0	0	0	111.5	C173 P174 V175 S193 R198 K199 V200	C173-Y196 WeakPolarHBondContact O-CE2 3.43Å; P174-Y196 WeakPolarHBondContact CA-OH 3.44Å; P174-Y196 HydrophobicContact CB-CE2 4.07Å; P174-Y196 HydrophobicContact CG-CE2 4.09Å; V175-Y196 PolarHBondContact N-OH 3.33Å; V175-Y196 PolarHBondContact O-OH 3.41Å; V175-Y196 VanDerWaalsContact O-OH 3.12Å; S193-Y196 WeakPolarHBondContact O-CB 3.43Å; S193-Y196 PolarHBondContact O-N 3.15Å; Y196-R198 VanDerWaalsContact C-N 3.28Å; Y196-R198 PolarHBondContact O-N 3.19Å; Y196-K199 WeakPolarHBondContact O-CA 3.38Å; Y196-K199 WeakPolarHBondContact O-CB 3.46Å; Y196-K199 PolarHBondContact O-N 3.21Å; Y196-V200 HydrophobicContact CD2-CG2 3.84Å; Y196-V200 HydrophobicContact CE1-CG2 4.31Å; Y196-V200 HydrophobicContact CE2-CG2 3.21Å; Y196-V200 WeakPolarHBondContact O-CG2 3.28Å; Y196-V200 PolarHBondContact O-N 2.86Å
197	I	88.3	Confident	90.5	Very high	0 Å²	0	57 Å²	57	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.1	-39.9	-175.4	68	-170	0	0	0	111.7	L192 S193 S194 K199 V200 F201 F214 A218 W248 W255	L192-I197 HydrophobicContact CB-CG2 3.89Å; L192-I197 HydrophobicContact CD1-CG2 4.32Å; S193-I197 PolarHBondContact O-N 3.14Å; S194-I197 WeakPolarHBondContact O-CG1 3.32Å; I197-K199 PolarHBondContact O-N 2.99Å; I197-V200 PolarHBondContact O-N 2.95Å; I197-F201 WeakPolarHBondContact O-CB 3.19Å; I197-F201 PolarHBondContact O-N 3.26Å; I197-F214 HydrophobicContact CB-CE1 4.43Å; I197-F214 HydrophobicContact CG1-CE1 4.28Å; I197-A218 HydrophobicContact CD1-CB 3.74Å; I197-A218 HydrophobicContact CG1-CB 4.38Å; I197-W248 HydrophobicContact CB-CH2 3.86Å; I197-W248 HydrophobicContact CB-CZ3 3.72Å; I197-W248 HydrophobicContact CG2-CE3 4.45Å; I197-W248 HydrophobicContact CG2-CH2 3.94Å; I197-W248 HydrophobicContact CG2-CZ3 3.5Å; I197-W255 HydrophobicContact CD1-CB 3.82Å; I197-W255 HydrophobicContact CD1-CD2 3.96Å; I197-W255 HydrophobicContact CD1-CE3 3.44Å; I197-W255 VanDerWaalsContact CD1-CE3 3.44Å; I197-W255 HydrophobicContact CD1-CG 4.15Å; I197-W255 HydrophobicContact CD1-CZ3 4.28Å; I197-W255 HydrophobicContact CG2-CB 4.23Å
198	R	90	Very high	90.7	Very high	92 Å²	92	57 Å²	57	35%	0.347	26%	0.264	S	S	.	.	H	α-helix	trans	-66.3	-38.4	176.6	-71.7	173.8	179.1	-172.8	-3.8	111.3	S194 Y196 K202 A215 A218	S194-R198 VanDerWaalsContact O-CB 3.31Å; S194-R198 WeakPolarHBondContact O-CB 3.47Å; S194-R198 VanDerWaalsContact O-CD 3.26Å; S194-R198 WeakPolarHBondContact O-CD 3.26Å; S194-R198 WeakPolarHBondContact O-CG 3.41Å; S194-R198 PolarHBondContact O-N 2.77Å; Y196-R198 VanDerWaalsContact C-N 3.28Å; Y196-R198 PolarHBondContact O-N 3.19Å; R198-K202 WeakPolarHBondContact O-CB 3.3Å; R198-K202 PolarHBondContact O-N 3.18Å; R198-A215 PolarHBondContact NH2-O 3.29Å; R198-A218 HydrophobicContact CG-CB 4.42Å
199	K	88.2	Confident	90.8	Very high	105 Å²	105	61.6 Å²	61.6	46%	0.457	29%	0.287	S	S	.	.	H	α-helix	trans	-65.1	-42.8	176.4	-174	-177.8	-176.7	-176.6	0	111.4	S195 Y196 I197 R203	S195-K199 VanDerWaalsContact O-CB 3.28Å; S195-K199 WeakPolarHBondContact O-CB 3.35Å; S195-K199 PolarHBondContact O-N 2.88Å; Y196-K199 WeakPolarHBondContact O-CA 3.38Å; Y196-K199 WeakPolarHBondContact O-CB 3.46Å; Y196-K199 PolarHBondContact O-N 3.21Å; I197-K199 PolarHBondContact O-N 2.99Å; K199-R203 VanDerWaalsContact O-CG 3.31Å; K199-R203 WeakPolarHBondContact O-CG 3.49Å; K199-R203 PolarHBondContact O-N 3.18Å
200	V	88.5	Confident	90.9	Very high	32 Å²	32	57.1 Å²	57.1	19%	0.194	27%	0.271	C	S	.	.	H	α-helix	trans	-62.7	-49.9	175.7	177.4	0	0	0	0	110.3	Y196 I197 K202 R203 K204 W248	Y196-V200 HydrophobicContact CD2-CG2 3.84Å; Y196-V200 HydrophobicContact CE1-CG2 4.31Å; Y196-V200 HydrophobicContact CE2-CG2 3.21Å; Y196-V200 WeakPolarHBondContact O-CG2 3.28Å; Y196-V200 PolarHBondContact O-N 2.86Å; I197-V200 PolarHBondContact O-N 2.95Å; V200-K202 PolarHBondContact O-N 3.38Å; V200-R203 WeakPolarHBondContact O-CB 3.46Å; V200-R203 PolarHBondContact O-N 2.94Å; V200-R203 VanDerWaalsContact O-N 3.14Å; V200-K204 PolarHBondContact O-N 3.4Å; V200-W248 HydrophobicContact CB-CH2 4.24Å; V200-W248 HydrophobicContact CB-CZ2 4.06Å; V200-W248 HydrophobicContact CG1-CH2 4.27Å; V200-W248 HydrophobicContact CG1-CZ2 3.78Å
201	F	93	Very high	91.1	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.2	-47.3	179	-173.2	-93.2	0	0	0	112.1	I197 R203 K204 F205 A210 F214 M233 V240 Y243 V244	I197-F201 WeakPolarHBondContact O-CB 3.19Å; I197-F201 PolarHBondContact O-N 3.26Å; F201-R203 PolarHBondContact O-N 3.22Å; F201-K204 PolarHBondContact O-N 3.43Å; F201-K204 VanDerWaalsContact O-N 3.09Å; F201-F205 HydrophobicContact CD2-CD2 4.22Å; F201-F205 HydrophobicContact CE1-CB 4.29Å; F201-F205 AromaticContact CE2-CD2 3.8Å; F201-F205 HydrophobicContact CE2-CD2 3.8Å; F201-F205 HydrophobicContact CE2-CE2 4.28Å; F201-F205 HydrophobicContact CZ-CB 4.39Å; F201-F205 AromaticContact CZ-CD2 3.98Å; F201-F205 HydrophobicContact CZ-CD2 3.98Å; F201-F205 HydrophobicContact CZ-CG 4.42Å; F201-F205 PolarHBondContact O-N 3.31Å; F201-A210 HydrophobicContact CE1-CB 4.32Å; F201-A210 HydrophobicContact CZ-CB 4.39Å; F201-F214 HydrophobicContact CB-CD1 3.66Å; F201-F214 HydrophobicContact CB-CE1 3.59Å; F201-F214 HydrophobicContact CB-CG 4.18Å; F201-F214 HydrophobicContact CB-CZ 4.06Å; F201-F214 HydrophobicContact CD1-CB 3.71Å; F201-F214 AromaticContact CD1-CD1 3.86Å; F201-F214 HydrophobicContact CD1-CD1 3.86Å; F201-F214 HydrophobicContact CD1-CD2 4.33Å; F201-F214 AromaticContact CD1-CG 3.7Å; F201-F214 HydrophobicContact CD1-CG 3.7Å; F201-F214 HydrophobicContact CD2-CB 4.39Å; F201-F214 HydrophobicContact CD2-CD1 4.07Å; F201-F214 AromaticContact CD2-CD2 3.51Å; F201-F214 HydrophobicContact CD2-CD2 3.51Å; F201-F214 HydrophobicContact CD2-CE1 4.22Å; F201-F214 AromaticContact CD2-CE2 3.68Å; F201-F214 HydrophobicContact CD2-CE2 3.68Å; F201-F214 AromaticContact CD2-CG 3.72Å; F201-F214 HydrophobicContact CD2-CG 3.72Å; F201-F214 HydrophobicContact CD2-CZ 4.04Å; F201-F214 HydrophobicContact CE1-CB 3.58Å; F201-F214 HydrophobicContact CE1-CD2 4.42Å; F201-F214 AromaticContact CE1-CG 3.96Å; F201-F214 HydrophobicContact CE1-CG 3.96Å; F201-F214 HydrophobicContact CE2-CB 4.3Å; F201-F214 AromaticContact CE2-CD2 3.64Å; F201-F214 HydrophobicContact CE2-CD2 3.64Å; F201-F214 HydrophobicContact CE2-CE2 4.14Å; F201-F214 AromaticContact CE2-CG 3.99Å; F201-F214 HydrophobicContact CE2-CG 3.99Å; F201-F214 HydrophobicContact CG-CB 4.11Å; F201-F214 AromaticContact CG-CD1 3.57Å; F201-F214 HydrophobicContact CG-CD1 3.57Å; F201-F214 AromaticContact CG-CD2 3.88Å; F201-F214 HydrophobicContact CG-CD2 3.88Å; F201-F214 AromaticContact CG-CE1 3.9Å; F201-F214 HydrophobicContact CG-CE1 3.9Å; F201-F214 HydrophobicContact CG-CE2 4.18Å; F201-F214 AromaticContact CG-CG 3.57Å; F201-F214 HydrophobicContact CG-CG 3.57Å; F201-F214 HydrophobicContact CG-CZ 4.19Å; F201-F214 HydrophobicContact CZ-CB 3.89Å; F201-F214 HydrophobicContact CZ-CD2 4.09Å; F201-F214 HydrophobicContact CZ-CG 4.09Å; F201-M233 HydrophobicContact CZ-CE 4.17Å; F201-V240 HydrophobicContact CE2-CG1 4.18Å; F201-V240 HydrophobicContact CZ-CG1 3.71Å; F201-Y243 HydrophobicContact CD2-CD1 4.46Å; F201-Y243 HydrophobicContact CD2-CE1 4.14Å; F201-Y243 HydrophobicContact CE2-CD1 4.35Å; F201-Y243 HydrophobicContact CE2-CE1 4.48Å; F201-V244 HydrophobicContact CD2-CG2 4.28Å; F201-V244 HydrophobicContact CE2-CG2 3.58Å; F201-V244 HydrophobicContact CZ-CG2 4.45Å
202	K	93.6	Very high	91.4	Very high	131 Å²	131	63.2 Å²	63.2	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-64.8	-24.1	177.9	-171.9	174.9	178.9	179.3	0	113.8	R198 V200 K206 N211	R198-K202 WeakPolarHBondContact O-CB 3.3Å; R198-K202 PolarHBondContact O-N 3.18Å; V200-K202 PolarHBondContact O-N 3.38Å; K202-K206 PolarHBondContact O-NZ 2.89Å; K202-N211 VanDerWaalsContact CA-OD1 3.24Å; K202-N211 WeakPolarHBondContact CA-OD1 3.4Å; K202-N211 VanDerWaalsContact CB-OD1 3.23Å; K202-N211 WeakPolarHBondContact CB-OD1 3.2Å
203	R	91.3	Very high	91.7	Very high	147 Å²	147	63.8 Å²	63.8	56%	0.555	31%	0.306	S	S	*	.	H	α-helix	trans	-70.4	-43	172	-79.3	171.3	173.3	179.1	-6.8	110.8	K199 V200 F201	K199-R203 VanDerWaalsContact O-CG 3.31Å; K199-R203 WeakPolarHBondContact O-CG 3.49Å; K199-R203 PolarHBondContact O-N 3.18Å; V200-R203 WeakPolarHBondContact O-CB 3.46Å; V200-R203 PolarHBondContact O-N 2.94Å; V200-R203 VanDerWaalsContact O-N 3.14Å; F201-R203 PolarHBondContact O-N 3.22Å
204	K	92.9	Very high	92.2	Very high	138 Å²	138	63.8 Å²	63.8	60%	0.6	31%	0.306	S	S	*	.	H	α-helix	trans	-74.8	-42.5	-179.5	-168.2	71.5	174	-176.3	0	112.9	V200 F201 Y243	V200-K204 PolarHBondContact O-N 3.4Å; F201-K204 PolarHBondContact O-N 3.43Å; F201-K204 VanDerWaalsContact O-N 3.09Å; K204-Y243 HydrophobicContact CG-CE2 4.23Å
205	F	94.9	Very high	92.6	Very high	35 Å²	35	63.9 Å²	63.9	15%	0.154	31%	0.308	C	S	.	.			trans	-122.5	118.7	-177.4	-60.7	-80.5	0	0	0	111.3	F201 N211 V240 Y243	F201-F205 HydrophobicContact CD2-CD2 4.22Å; F201-F205 HydrophobicContact CE1-CB 4.29Å; F201-F205 AromaticContact CE2-CD2 3.8Å; F201-F205 HydrophobicContact CE2-CD2 3.8Å; F201-F205 HydrophobicContact CE2-CE2 4.28Å; F201-F205 HydrophobicContact CZ-CB 4.39Å; F201-F205 AromaticContact CZ-CD2 3.98Å; F201-F205 HydrophobicContact CZ-CD2 3.98Å; F201-F205 HydrophobicContact CZ-CG 4.42Å; F201-F205 PolarHBondContact O-N 3.31Å; F205-N211 PolarHBondContact O-ND2 2.87Å; F205-V240 HydrophobicContact CD1-CG2 3.61Å; F205-V240 HydrophobicContact CE1-CB 4.41Å; F205-V240 HydrophobicContact CE1-CG2 3.71Å; F205-V240 HydrophobicContact CG-CG2 4.19Å; F205-V240 HydrophobicContact CZ-CG2 4.4Å; F205-Y243 HydrophobicContact CD2-CD1 4.28Å; F205-Y243 HydrophobicContact CD2-CE1 4.47Å; F205-Y243 AromaticContact CE2-CD1 3.34Å; F205-Y243 HydrophobicContact CE2-CD1 3.34Å; F205-Y243 HydrophobicContact CE2-CD2 4.26Å; F205-Y243 AromaticContact CE2-CE1 3.79Å; F205-Y243 HydrophobicContact CE2-CE1 3.79Å; F205-Y243 AromaticContact CE2-CG 3.56Å; F205-Y243 HydrophobicContact CE2-CG 3.56Å; F205-Y243 HydrophobicContact CZ-CD1 4.08Å; F205-Y243 HydrophobicContact CZ-CD2 4.48Å; F205-Y243 AromaticContact CZ-CG 3.84Å; F205-Y243 HydrophobicContact CZ-CG 3.84Å
206	K	93.9	Very high	93.2	Very high	153 Å²	153	64.3 Å²	64.3	67%	0.665	30%	0.304	S	S	*	.			trans	-86.1	-9.5	178.7	-58.5	-59.2	177	-167.3	0	114.1	K202 P208	K202-K206 PolarHBondContact O-NZ 2.89Å; K206-P208 VanDerWaalsContact O-CD 3.29Å; K206-P208 WeakPolarHBondContact O-CD 3.4Å
207	N	94	Very high	93.7	Very high	61 Å²	61	63.2 Å²	63.2	33%	0.326	30%	0.299	S	S	.	.			trans	-62.1	117.7	-179.6	-178.6	-37.7	0	0	0	110.9	I209 A210 N211	N207-I209 VanDerWaalsContact C-N 3.34Å; N207-I209 PolarHBondContact O-N 3.02Å; N207-I209 WeakPolarHBondContact OD1-CB 3.41Å; N207-I209 PolarHBondContact OD1-N 2.92Å; N207-A210 HydrophobicContact CB-CB 3.95Å; N207-A210 PolarHBondContact O-N 3.41Å; N207-A210 PolarHBondContact OD1-N 3Å; N207-N211 PolarHBondContact O-N 3.05Å; N207-N211 VanDerWaalsContact O-N 3.08Å; N207-N211 PolarHBondContact O-ND2 3.38Å
208	P	95.5	Very high	93.9	Very high	91 Å²	91	63.2 Å²	63.2	59%	0.591	30%	0.299	S	S	*	.	H	α-helix	trans	-61.6	-37.2	-177.8	-24.9	35.1	0	0	0	114	K206 N211 N212	K206-P208 VanDerWaalsContact O-CD 3.29Å; K206-P208 WeakPolarHBondContact O-CD 3.4Å; P208-N211 PolarHBondContact O-N 3.16Å; P208-N212 VanDerWaalsContact O-CG 3.29Å; P208-N212 PolarHBondContact O-N 3.28Å
209	I	96	Very high	94	Very high	100 Å²	100	61.6 Å²	61.6	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-66.9	-45.8	-179.8	-57.1	174.3	0	0	0	109.7	N207 N211 N212 I213 L236	N207-I209 VanDerWaalsContact C-N 3.34Å; N207-I209 PolarHBondContact O-N 3.02Å; N207-I209 WeakPolarHBondContact OD1-CB 3.41Å; N207-I209 PolarHBondContact OD1-N 2.92Å; I209-N211 VanDerWaalsContact C-N 3.3Å; I209-N211 PolarHBondContact O-N 3.04Å; I209-N212 PolarHBondContact O-N 3.47Å; I209-I213 HydrophobicContact CG2-CD1 4.15Å; I209-I213 WeakPolarHBondContact O-CG1 3.06Å; I209-I213 PolarHBondContact O-N 2.68Å; I209-L236 HydrophobicContact CB-CD1 4.39Å; I209-L236 HydrophobicContact CB-CD2 4.28Å; I209-L236 HydrophobicContact CG2-CD1 3.96Å; I209-L236 HydrophobicContact CG2-CD2 3.98Å
210	A	96.2	Very high	94.2	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.2	-43.1	175.7	0	0	0	0	0	111.6	F201 N207 N212 I213 F214 L236 V240	F201-A210 HydrophobicContact CE1-CB 4.32Å; F201-A210 HydrophobicContact CZ-CB 4.39Å; N207-A210 HydrophobicContact CB-CB 3.95Å; N207-A210 PolarHBondContact O-N 3.41Å; N207-A210 PolarHBondContact OD1-N 3Å; A210-N212 VanDerWaalsContact C-N 3.35Å; A210-N212 PolarHBondContact O-N 3.28Å; A210-I213 PolarHBondContact O-N 3.02Å; A210-F214 WeakPolarHBondContact O-CB 3.47Å; A210-F214 PolarHBondContact O-N 3.4Å; A210-L236 HydrophobicContact CB-CD2 3.79Å; A210-V240 HydrophobicContact CB-CG1 4.17Å; A210-V240 HydrophobicContact CB-CG2 4.42Å
211	N	96.2	Very high	94.3	Very high	25 Å²	25	61.6 Å²	61.6	13%	0.134	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-40.2	176.4	-81.6	-78.9	0	0	0	112.4	K202 F205 N207 P208 I209 F214 A215	K202-N211 VanDerWaalsContact CA-OD1 3.24Å; K202-N211 WeakPolarHBondContact CA-OD1 3.4Å; K202-N211 VanDerWaalsContact CB-OD1 3.23Å; K202-N211 WeakPolarHBondContact CB-OD1 3.2Å; F205-N211 PolarHBondContact O-ND2 2.87Å; N207-N211 PolarHBondContact O-N 3.05Å; N207-N211 VanDerWaalsContact O-N 3.08Å; N207-N211 PolarHBondContact O-ND2 3.38Å; P208-N211 PolarHBondContact O-N 3.16Å; I209-N211 VanDerWaalsContact C-N 3.3Å; I209-N211 PolarHBondContact O-N 3.04Å; N211-F214 PolarHBondContact O-N 2.76Å; N211-A215 VanDerWaalsContact O-CB 3.3Å; N211-A215 WeakPolarHBondContact O-CB 3.33Å; N211-A215 PolarHBondContact O-N 2.86Å
212	N	96.7	Very high	94.4	Very high	107 Å²	107	64.3 Å²	64.3	57%	0.572	32%	0.324	S	S	*	.	H	α-helix	trans	-65.8	-45.9	177.1	-72.1	-14.1	0	0	0	111.6	P208 I209 A210 F214 A215 E216	P208-N212 VanDerWaalsContact O-CG 3.29Å; P208-N212 PolarHBondContact O-N 3.28Å; I209-N212 PolarHBondContact O-N 3.47Å; A210-N212 VanDerWaalsContact C-N 3.35Å; A210-N212 PolarHBondContact O-N 3.28Å; N212-F214 VanDerWaalsContact C-N 3.33Å; N212-F214 PolarHBondContact O-N 2.96Å; N212-A215 WeakPolarHBondContact O-CB 3.27Å; N212-A215 PolarHBondContact O-N 3.44Å; N212-E216 WeakPolarHBondContact O-CG 3.45Å; N212-E216 PolarHBondContact O-N 3.49Å
213	I	96.5	Very high	94.4	Very high	16 Å²	16	60.4 Å²	60.4	8%	0.082	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-44.1	176.9	-61.3	169.6	0	0	0	110.5	I209 A210 A215 E216 L217 N229 K232 M233 L236	I209-I213 HydrophobicContact CG2-CD1 4.15Å; I209-I213 WeakPolarHBondContact O-CG1 3.06Å; I209-I213 PolarHBondContact O-N 2.68Å; A210-I213 PolarHBondContact O-N 3.02Å; I213-A215 VanDerWaalsContact C-N 3.33Å; I213-A215 PolarHBondContact O-N 3.08Å; I213-E216 PolarHBondContact O-N 2.86Å; I213-L217 PolarHBondContact O-N 3.38Å; I213-N229 HydrophobicContact CG2-CB 4.21Å; I213-N229 VanDerWaalsContact CG2-O 3.28Å; I213-N229 WeakPolarHBondContact CG2-O 2.96Å; I213-K232 HydrophobicContact CD1-CB 4.16Å; I213-K232 HydrophobicContact CG2-CB 4.47Å; I213-M233 HydrophobicContact CB-CE 4.09Å; I213-M233 HydrophobicContact CG2-CB 4.12Å; I213-M233 HydrophobicContact CG2-CE 3.89Å; I213-L236 HydrophobicContact CD1-CD2 4Å
214	F	96.2	Very high	94.7	Very high	1 Å²	1	59 Å²	59	0%	0.004	32%	0.315	C	S	.	.	H	α-helix	trans	-63.7	-39	176.6	-168.4	-95.6	0	0	0	112.2	I197 F201 A210 N211 N212 E216 L217 A218 M233 V244 W248 W255	I197-F214 HydrophobicContact CB-CE1 4.43Å; I197-F214 HydrophobicContact CG1-CE1 4.28Å; F201-F214 HydrophobicContact CB-CD1 3.66Å; F201-F214 HydrophobicContact CB-CE1 3.59Å; F201-F214 HydrophobicContact CB-CG 4.18Å; F201-F214 HydrophobicContact CB-CZ 4.06Å; F201-F214 HydrophobicContact CD1-CB 3.71Å; F201-F214 AromaticContact CD1-CD1 3.86Å; F201-F214 HydrophobicContact CD1-CD1 3.86Å; F201-F214 HydrophobicContact CD1-CD2 4.33Å; F201-F214 AromaticContact CD1-CG 3.7Å; F201-F214 HydrophobicContact CD1-CG 3.7Å; F201-F214 HydrophobicContact CD2-CB 4.39Å; F201-F214 HydrophobicContact CD2-CD1 4.07Å; F201-F214 AromaticContact CD2-CD2 3.51Å; F201-F214 HydrophobicContact CD2-CD2 3.51Å; F201-F214 HydrophobicContact CD2-CE1 4.22Å; F201-F214 AromaticContact CD2-CE2 3.68Å; F201-F214 HydrophobicContact CD2-CE2 3.68Å; F201-F214 AromaticContact CD2-CG 3.72Å; F201-F214 HydrophobicContact CD2-CG 3.72Å; F201-F214 HydrophobicContact CD2-CZ 4.04Å; F201-F214 HydrophobicContact CE1-CB 3.58Å; F201-F214 HydrophobicContact CE1-CD2 4.42Å; F201-F214 AromaticContact CE1-CG 3.96Å; F201-F214 HydrophobicContact CE1-CG 3.96Å; F201-F214 HydrophobicContact CE2-CB 4.3Å; F201-F214 AromaticContact CE2-CD2 3.64Å; F201-F214 HydrophobicContact CE2-CD2 3.64Å; F201-F214 HydrophobicContact CE2-CE2 4.14Å; F201-F214 AromaticContact CE2-CG 3.99Å; F201-F214 HydrophobicContact CE2-CG 3.99Å; F201-F214 HydrophobicContact CG-CB 4.11Å; F201-F214 AromaticContact CG-CD1 3.57Å; F201-F214 HydrophobicContact CG-CD1 3.57Å; F201-F214 AromaticContact CG-CD2 3.88Å; F201-F214 HydrophobicContact CG-CD2 3.88Å; F201-F214 AromaticContact CG-CE1 3.9Å; F201-F214 HydrophobicContact CG-CE1 3.9Å; F201-F214 HydrophobicContact CG-CE2 4.18Å; F201-F214 AromaticContact CG-CG 3.57Å; F201-F214 HydrophobicContact CG-CG 3.57Å; F201-F214 HydrophobicContact CG-CZ 4.19Å; F201-F214 HydrophobicContact CZ-CB 3.89Å; F201-F214 HydrophobicContact CZ-CD2 4.09Å; F201-F214 HydrophobicContact CZ-CG 4.09Å; A210-F214 WeakPolarHBondContact O-CB 3.47Å; A210-F214 PolarHBondContact O-N 3.4Å; N211-F214 PolarHBondContact O-N 2.76Å; N212-F214 VanDerWaalsContact C-N 3.33Å; N212-F214 PolarHBondContact O-N 2.96Å; F214-E216 VanDerWaalsContact C-N 3.29Å; F214-E216 PolarHBondContact O-N 3.1Å; F214-L217 HydrophobicContact CD2-CD1 4.43Å; F214-L217 WeakPolarHBondContact O-CB 3.44Å; F214-L217 PolarHBondContact O-N 3.18Å; F214-A218 WeakPolarHBondContact O-CB 3.33Å; F214-A218 PolarHBondContact O-N 3.06Å; F214-M233 HydrophobicContact CB-CE 3.96Å; F214-M233 HydrophobicContact CD2-CE 4.32Å; F214-V244 HydrophobicContact CD2-CG2 3.99Å; F214-V244 HydrophobicContact CE2-CG2 4.06Å; F214-W248 HydrophobicContact CE2-CB 4.43Å; F214-W248 HydrophobicContact CE2-CD2 4.3Å; F214-W248 AromaticContact CE2-CG 4Å; F214-W248 HydrophobicContact CE2-CG 4Å; F214-W248 AromaticContact CZ-CD2 3.9Å; F214-W248 HydrophobicContact CZ-CD2 3.9Å; F214-W248 HydrophobicContact CZ-CE3 4.33Å; F214-W248 HydrophobicContact CZ-CG 4.09Å; F214-W255 HydrophobicContact CE2-CH2 4.18Å; F214-W255 HydrophobicContact CZ-CH2 4.3Å; F214-W255 HydrophobicContact CZ-CZ3 4.4Å
215	A	94.9	Very high	94.9	Very high	23 Å²	23	57.6 Å²	57.6	19%	0.19	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-40	175	0	0	0	0	0	111.6	R198 N211 N212 I213 A218 S219	R198-A215 PolarHBondContact NH2-O 3.29Å; N211-A215 VanDerWaalsContact O-CB 3.3Å; N211-A215 WeakPolarHBondContact O-CB 3.33Å; N211-A215 PolarHBondContact O-N 2.86Å; N212-A215 WeakPolarHBondContact O-CB 3.27Å; N212-A215 PolarHBondContact O-N 3.44Å; I213-A215 VanDerWaalsContact C-N 3.33Å; I213-A215 PolarHBondContact O-N 3.08Å; A215-A218 PolarHBondContact O-N 2.81Å; A215-S219 PolarHBondContact O-N 3.34Å; A215-S219 PolarHBondContact O-OG 2.89Å; A215-S219 VanDerWaalsContact O-OG 3.05Å
216	E	95.6	Very high	94.9	Very high	70 Å²	70	56.3 Å²	56.3	33%	0.327	30%	0.304	S	S	.	.	H	α-helix	trans	-66.6	-40	175	-66.8	-176.6	-157.1	0	0	112.7	N212 I213 F214 A218 S219 T220 N229	N212-E216 WeakPolarHBondContact O-CG 3.45Å; N212-E216 PolarHBondContact O-N 3.49Å; I213-E216 PolarHBondContact O-N 2.86Å; F214-E216 VanDerWaalsContact C-N 3.29Å; F214-E216 PolarHBondContact O-N 3.1Å; E216-A218 PolarHBondContact O-N 3.38Å; E216-S219 PolarHBondContact O-N 3.49Å; E216-S219 PolarHBondContact O-OG 3.25Å; E216-T220 WeakPolarHBondContact O-CB 3.27Å; E216-T220 PolarHBondContact O-N 3.37Å; E216-N229 WeakPolarHBondContact CB-ND2 3.44Å; E216-N229 PolarHBondContact OE2-ND2 3.34Å; E216-N229 PolarHBondContact OE2-OD1 3.01Å
217	L	95.2	Very high	95.1	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.6	-42.5	171.4	-70.1	170.9	0	0	0	110.7	I213 F214 S219 T220 F226 N229 L230 M233 W255	I213-L217 PolarHBondContact O-N 3.38Å; F214-L217 HydrophobicContact CD2-CD1 4.43Å; F214-L217 WeakPolarHBondContact O-CB 3.44Å; F214-L217 PolarHBondContact O-N 3.18Å; L217-S219 VanDerWaalsContact C-N 3.25Å; L217-S219 PolarHBondContact O-N 2.92Å; L217-T220 WeakPolarHBondContact O-CG2 3.3Å; L217-F226 HydrophobicContact CB-CD2 4.39Å; L217-F226 HydrophobicContact CB-CE2 4.26Å; L217-F226 HydrophobicContact CD2-CD2 3.58Å; L217-F226 HydrophobicContact CD2-CE2 3.72Å; L217-F226 HydrophobicContact CD2-CG 4.11Å; L217-F226 HydrophobicContact CD2-CZ 4.38Å; L217-F226 VanDerWaalsContact CD2-O 3.32Å; L217-F226 WeakPolarHBondContact CD2-O 3.38Å; L217-N229 HydrophobicContact CD2-CB 3.58Å; L217-N229 HydrophobicContact CG-CB 3.98Å; L217-L230 HydrophobicContact CD2-CB 4.47Å; L217-M233 HydrophobicContact CD1-CE 4.15Å; L217-M233 HydrophobicContact CD1-SD 4.42Å; L217-W255 HydrophobicContact CB-CH2 3.97Å; L217-W255 HydrophobicContact CB-CZ3 4.1Å
218	A	92.2	Very high	95.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-6.5	-178.5	0	0	0	0	0	115.1	I197 R198 F214 A215 E216 W255	I197-A218 HydrophobicContact CD1-CB 3.74Å; I197-A218 HydrophobicContact CG1-CB 4.38Å; R198-A218 HydrophobicContact CG-CB 4.42Å; F214-A218 WeakPolarHBondContact O-CB 3.33Å; F214-A218 PolarHBondContact O-N 3.06Å; A215-A218 PolarHBondContact O-N 2.81Å; E216-A218 PolarHBondContact O-N 3.38Å; A218-W255 HydrophobicContact CB-CE3 4.07Å; A218-W255 HydrophobicContact CB-CZ3 3.87Å
219	S	91.7	Very high	95.3	Very high	59 Å²	59	53.2 Å²	53.2	41%	0.413	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.1	-6.5	-178.5	56.7	0	0	0	0	114.4	A215 E216 L217	A215-S219 PolarHBondContact O-N 3.34Å; A215-S219 PolarHBondContact O-OG 2.89Å; A215-S219 VanDerWaalsContact O-OG 3.05Å; E216-S219 PolarHBondContact O-N 3.49Å; E216-S219 PolarHBondContact O-OG 3.25Å; L217-S219 VanDerWaalsContact C-N 3.25Å; L217-S219 PolarHBondContact O-N 2.92Å
220	T	92.7	Very high	95.3	Very high	8 Å²	8	49.8 Å²	49.8	5%	0.049	26%	0.261	C	S	.	.			trans	-71.5	134.9	-176.7	-172.7	0	0	0	0	111.3	E216 L217 C222 F226 V256 A258	E216-T220 WeakPolarHBondContact O-CB 3.27Å; E216-T220 PolarHBondContact O-N 3.37Å; L217-T220 WeakPolarHBondContact O-CG2 3.3Å; T220-C222 PolarHBondContact OG1-N 2.82Å; T220-C222 VanDerWaalsContact OG1-N 3.16Å; T220-C222 PolarHBondContact OG1-O 2.88Å; T220-C222 VanDerWaalsContact OG1-O 3.09Å; T220-F226 HydrophobicContact CG2-CB 3.71Å; T220-F226 HydrophobicContact CG2-CD2 3.99Å; T220-F226 HydrophobicContact CG2-CG 4.37Å; T220-V256 HydrophobicContact CG2-CG1 4.12Å; T220-A258 WeakPolarHBondContact O-CB 3.34Å; T220-A258 PolarHBondContact O-N 2.77Å
221	L	91.5	Very high	95.3	Very high	129 Å²	129	55.5 Å²	55.5	68%	0.675	29%	0.288	S	S	*	.			trans	-93.8	-8.7	169.1	-66.3	166.7	0	0	0	112	P257 A258	L221-P257 HydrophobicContact CD2-CB 3.5Å; L221-P257 HydrophobicContact CG-CB 4.36Å; L221-A258 VanDerWaalsContact C-CB 3.46Å; L221-A258 WeakPolarHBondContact O-CB 3.32Å
222	C	94.2	Very high	95.3	Very high	56 Å²	56	58.1 Å²	58.1	38%	0.378	30%	0.298	S	S	.	.			trans	-106.7	119.8	-175.7	177.8	0	0	0	0	110.8	T220 N224 K225 F226	T220-C222 PolarHBondContact OG1-N 2.82Å; T220-C222 VanDerWaalsContact OG1-N 3.16Å; T220-C222 PolarHBondContact OG1-O 2.88Å; T220-C222 VanDerWaalsContact OG1-O 3.09Å; C222-N224 VanDerWaalsContact C-N 3.27Å; C222-N224 PolarHBondContact O-N 2.77Å; C222-K225 HydrophobicContact CB-CB 3.92Å; C222-K225 PolarHBondContact O-N 3Å; C222-F226 PolarHBondContact O-N 2.84Å
223	P	95.2	Very high	95.2	Very high	49 Å²	49	53 Å²	53	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-58.6	-33.8	175.8	-27.6	35.9	0	0	0	114	F226 K227 A258 F259	P223-F226 WeakPolarHBondContact O-CB 3.4Å; P223-F226 PolarHBondContact O-N 2.83Å; P223-K227 WeakPolarHBondContact O-CG 3.16Å; P223-K227 PolarHBondContact O-N 2.85Å; P223-A258 HydrophobicContact CG-CB 4.23Å; P223-F259 HydrophobicContact CB-CE1 4.05Å; P223-F259 HydrophobicContact CB-CZ 4.32Å; P223-F259 HydrophobicContact CG-CE1 4.21Å
224	N	96.6	Very high	95.2	Very high	117 Å²	117	58.4 Å²	58.4	63%	0.626	29%	0.293	S	S	*	.	H	α-helix	trans	-69.9	-41.1	177.8	-70.5	-19.5	0	0	0	111.8	C222 F226 K227 F228	C222-N224 VanDerWaalsContact C-N 3.27Å; C222-N224 PolarHBondContact O-N 2.77Å; N224-F226 VanDerWaalsContact C-N 3.29Å; N224-F226 PolarHBondContact O-N 2.93Å; N224-K227 PolarHBondContact O-N 2.89Å; N224-F228 WeakPolarHBondContact O-CB 3.41Å; N224-F228 PolarHBondContact O-N 3.25Å
225	K	96.2	Very high	95.2	Very high	109 Å²	109	67.2 Å²	67.2	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-64.8	-35.1	173.4	-174	172.1	-176.3	174.9	0	111.7	C222 F228 N229	C222-K225 HydrophobicContact CB-CB 3.92Å; C222-K225 PolarHBondContact O-N 3Å; K225-F228 PolarHBondContact O-N 2.86Å; K225-N229 WeakPolarHBondContact O-CB 3.47Å; K225-N229 PolarHBondContact O-N 3.32Å
226	F	96.7	Very high	95.1	Very high	9 Å²	9	69 Å²	69	4%	0.039	34%	0.337	C	S	.	.	H	α-helix	trans	-58.6	-52.7	171.6	-178.1	-93.4	0	0	0	111.6	L217 T220 C222 P223 N224 F228 N229 L230 I249 K252 W255 V256 F259	L217-F226 HydrophobicContact CB-CD2 4.39Å; L217-F226 HydrophobicContact CB-CE2 4.26Å; L217-F226 HydrophobicContact CD2-CD2 3.58Å; L217-F226 HydrophobicContact CD2-CE2 3.72Å; L217-F226 HydrophobicContact CD2-CG 4.11Å; L217-F226 HydrophobicContact CD2-CZ 4.38Å; L217-F226 VanDerWaalsContact CD2-O 3.32Å; L217-F226 WeakPolarHBondContact CD2-O 3.38Å; T220-F226 HydrophobicContact CG2-CB 3.71Å; T220-F226 HydrophobicContact CG2-CD2 3.99Å; T220-F226 HydrophobicContact CG2-CG 4.37Å; C222-F226 PolarHBondContact O-N 2.84Å; P223-F226 WeakPolarHBondContact O-CB 3.4Å; P223-F226 PolarHBondContact O-N 2.83Å; N224-F226 VanDerWaalsContact C-N 3.29Å; N224-F226 PolarHBondContact O-N 2.93Å; F226-F228 VanDerWaalsContact C-N 3.32Å; F226-F228 PolarHBondContact O-N 3.24Å; F226-N229 PolarHBondContact O-N 3.44Å; F226-L230 PolarHBondContact O-N 3.46Å; F226-I249 HydrophobicContact CE1-CD1 4.05Å; F226-I249 HydrophobicContact CZ-CD1 3.64Å; F226-K252 HydrophobicContact CE1-CD 4.36Å; F226-K252 HydrophobicContact CZ-CB 4.28Å; F226-K252 HydrophobicContact CZ-CD 4.45Å; F226-W255 HydrophobicContact CE2-CH2 4.16Å; F226-W255 HydrophobicContact CE2-CZ2 4.5Å; F226-V256 HydrophobicContact CD2-CG1 3.64Å; F226-V256 HydrophobicContact CD2-CG2 4.07Å; F226-V256 HydrophobicContact CE2-CB 4.34Å; F226-V256 HydrophobicContact CE2-CG1 3.94Å; F226-V256 HydrophobicContact CE2-CG2 3.46Å; F226-V256 VanDerWaalsContact CE2-CG2 3.46Å; F226-V256 HydrophobicContact CG-CG1 4.47Å; F226-V256 HydrophobicContact CZ-CG2 4.2Å; F226-F259 AromaticContact CD1-CE2 3.77Å; F226-F259 HydrophobicContact CD1-CE2 3.77Å; F226-F259 AromaticContact CD1-CZ 3.93Å; F226-F259 HydrophobicContact CD1-CZ 3.93Å; F226-F259 HydrophobicContact CD2-CE2 4.15Å; F226-F259 AromaticContact CE1-CE2 3.91Å; F226-F259 HydrophobicContact CE1-CE2 3.91Å; F226-F259 HydrophobicContact CE1-CZ 4.37Å; F226-F259 HydrophobicContact CE2-CE2 4.28Å; F226-F259 AromaticContact CG-CE2 3.89Å; F226-F259 HydrophobicContact CG-CE2 3.89Å; F226-F259 HydrophobicContact CG-CZ 4.21Å; F226-F259 HydrophobicContact CZ-CE2 4.16Å
227	K	96.6	Very high	95	Very high	132 Å²	132	68.3 Å²	68.3	57%	0.574	34%	0.336	S	S	*	.	H	α-helix	trans	-58	-43.4	177.2	-70.7	177.5	-178.6	177.4	0	112.1	P223 N224 L230 Q231	P223-K227 WeakPolarHBondContact O-CG 3.16Å; P223-K227 PolarHBondContact O-N 2.85Å; N224-K227 PolarHBondContact O-N 2.89Å; K227-L230 PolarHBondContact O-N 2.91Å; K227-Q231 WeakPolarHBondContact O-CG 3.37Å; K227-Q231 PolarHBondContact O-N 2.82Å
228	F	97.2	Very high	94.9	Very high	106 Å²	106	71.8 Å²	71.8	47%	0.465	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-44.3	178	176.7	-109.9	0	0	0	112.8	N224 K225 F226 L230 Q231 K232	N224-F228 WeakPolarHBondContact O-CB 3.41Å; N224-F228 PolarHBondContact O-N 3.25Å; K225-F228 PolarHBondContact O-N 2.86Å; F226-F228 VanDerWaalsContact C-N 3.32Å; F226-F228 PolarHBondContact O-N 3.24Å; F228-L230 VanDerWaalsContact C-N 3.34Å; F228-L230 PolarHBondContact O-N 3.37Å; F228-Q231 WeakPolarHBondContact O-CB 3.41Å; F228-Q231 PolarHBondContact O-N 3.43Å; F228-K232 HydrophobicContact CD1-CD 4.35Å; F228-K232 HydrophobicContact CE1-CD 3.97Å; F228-K232 VanDerWaalsContact CE1-NZ 3.32Å; F228-K232 HydrophobicContact CZ-CD 4.36Å; F228-K232 VanDerWaalsContact CZ-CE 3.42Å; F228-K232 PolarHBondContact O-N 2.91Å
229	N	96.5	Very high	95.1	Very high	1 Å²	1	79.3 Å²	79.3	1%	0.005	39%	0.393	C	S	.	.	H	α-helix	trans	-69.5	-32.5	178.5	-76.1	-14.6	0	0	0	112.6	I213 E216 L217 K225 F226 Q231 K232 M233	I213-N229 HydrophobicContact CG2-CB 4.21Å; I213-N229 VanDerWaalsContact CG2-O 3.28Å; I213-N229 WeakPolarHBondContact CG2-O 2.96Å; E216-N229 WeakPolarHBondContact CB-ND2 3.44Å; E216-N229 PolarHBondContact OE2-ND2 3.34Å; E216-N229 PolarHBondContact OE2-OD1 3.01Å; L217-N229 HydrophobicContact CD2-CB 3.58Å; L217-N229 HydrophobicContact CG-CB 3.98Å; K225-N229 WeakPolarHBondContact O-CB 3.47Å; K225-N229 PolarHBondContact O-N 3.32Å; F226-N229 PolarHBondContact O-N 3.44Å; N229-Q231 VanDerWaalsContact C-N 3.34Å; N229-K232 WeakPolarHBondContact O-CB 3.41Å; N229-K232 PolarHBondContact O-N 2.98Å; N229-M233 PolarHBondContact O-N 3.23Å
230	L	96.3	Very high	95.2	Very high	29 Å²	29	76.5 Å²	76.5	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-39.8	172	-173.9	60.1	0	0	0	111.4	L217 F226 K227 F228 M233 K234 Y241 V244 I249	L217-L230 HydrophobicContact CD2-CB 4.47Å; F226-L230 PolarHBondContact O-N 3.46Å; K227-L230 PolarHBondContact O-N 2.91Å; F228-L230 VanDerWaalsContact C-N 3.34Å; F228-L230 PolarHBondContact O-N 3.37Å; L230-M233 WeakPolarHBondContact O-CB 3.33Å; L230-M233 PolarHBondContact O-N 3.35Å; L230-K234 PolarHBondContact O-N 2.91Å; L230-Y241 HydrophobicContact CD1-CD2 4.06Å; L230-Y241 HydrophobicContact CD1-CE2 3.8Å; L230-Y241 HydrophobicContact CG-CE2 3.93Å; L230-V244 HydrophobicContact CD1-CG1 4.19Å; L230-I249 HydrophobicContact CD1-CD1 4.06Å; L230-I249 HydrophobicContact CD1-CG1 4.46Å; L230-I249 HydrophobicContact CD2-CD1 3.98Å; L230-I249 HydrophobicContact CD2-CG1 4.47Å
231	Q	96.4	Very high	95.5	Very high	120 Å²	120	78.5 Å²	78.5	56%	0.561	38%	0.381	S	S	*	.	H	α-helix	trans	-66	-39.3	173.5	-70.6	177.3	-6.9	0	0	112.7	K227 F228 N229 M233 K234 K235	K227-Q231 WeakPolarHBondContact O-CG 3.37Å; K227-Q231 PolarHBondContact O-N 2.82Å; F228-Q231 WeakPolarHBondContact O-CB 3.41Å; F228-Q231 PolarHBondContact O-N 3.43Å; N229-Q231 VanDerWaalsContact C-N 3.34Å; Q231-M233 VanDerWaalsContact C-N 3.29Å; Q231-M233 PolarHBondContact O-N 3.02Å; Q231-K234 WeakPolarHBondContact O-CB 3.44Å; Q231-K234 PolarHBondContact O-N 3.05Å; Q231-K235 PolarHBondContact O-N 3.49Å; Q231-K235 VanDerWaalsContact O-N 3.15Å
232	K	96.2	Very high	95.7	Very high	80 Å²	80	76.5 Å²	76.5	35%	0.348	37%	0.371	S	S	.	.	H	α-helix	trans	-58.9	-42.8	172.2	-77.2	179.6	167.1	172.5	0	111.5	I213 F228 N229 K235 L236	I213-K232 HydrophobicContact CD1-CB 4.16Å; I213-K232 HydrophobicContact CG2-CB 4.47Å; F228-K232 HydrophobicContact CD1-CD 4.35Å; F228-K232 HydrophobicContact CE1-CD 3.97Å; F228-K232 VanDerWaalsContact CE1-NZ 3.32Å; F228-K232 HydrophobicContact CZ-CD 4.36Å; F228-K232 VanDerWaalsContact CZ-CE 3.42Å; F228-K232 PolarHBondContact O-N 2.91Å; N229-K232 WeakPolarHBondContact O-CB 3.41Å; N229-K232 PolarHBondContact O-N 2.98Å; K232-K235 PolarHBondContact O-N 3.47Å; K232-L236 PolarHBondContact O-N 2.93Å; K232-L236 VanDerWaalsContact O-N 3.07Å
233	M	95.5	Very high	95.8	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-63	-41.7	177.5	-170.9	166	-81	0	0	111.9	F201 I213 F214 L217 N229 L230 Q231 K235 L236 D237 V240 V244	F201-M233 HydrophobicContact CZ-CE 4.17Å; I213-M233 HydrophobicContact CB-CE 4.09Å; I213-M233 HydrophobicContact CG2-CB 4.12Å; I213-M233 HydrophobicContact CG2-CE 3.89Å; F214-M233 HydrophobicContact CB-CE 3.96Å; F214-M233 HydrophobicContact CD2-CE 4.32Å; L217-M233 HydrophobicContact CD1-CE 4.15Å; L217-M233 HydrophobicContact CD1-SD 4.42Å; N229-M233 PolarHBondContact O-N 3.23Å; L230-M233 WeakPolarHBondContact O-CB 3.33Å; L230-M233 PolarHBondContact O-N 3.35Å; Q231-M233 VanDerWaalsContact C-N 3.29Å; Q231-M233 PolarHBondContact O-N 3.02Å; M233-K235 VanDerWaalsContact C-N 3.28Å; M233-K235 PolarHBondContact O-N 2.99Å; M233-L236 WeakPolarHBondContact O-CB 3.43Å; M233-L236 PolarHBondContact O-N 3.12Å; M233-L236 VanDerWaalsContact O-N 3.13Å; M233-D237 PolarHBondContact O-N 2.66Å; M233-V240 HydrophobicContact CE-CG1 4.18Å; M233-V240 HydrophobicContact CG-CG1 3.87Å; M233-V240 HydrophobicContact SD-CG1 3.83Å; M233-V244 HydrophobicContact CE-CG2 4.38Å; M233-V244 HydrophobicContact SD-CB 3.88Å; M233-V244 HydrophobicContact SD-CG1 4.12Å; M233-V244 HydrophobicContact SD-CG2 3.48Å; M233-V244 WeakPolarHBondContact SD-CG2 3.47Å
234	K	96.3	Very high	95.8	Very high	128 Å²	128	73.3 Å²	73.3	56%	0.557	35%	0.345	S	S	*	.	H	α-helix	trans	-57	-40.5	174.3	-166.5	176	180	177.3	0	112.9	L230 Q231 Y241	L230-K234 PolarHBondContact O-N 2.91Å; Q231-K234 WeakPolarHBondContact O-CB 3.44Å; Q231-K234 PolarHBondContact O-N 3.05Å; K234-Y241 HydrophobicContact CB-CD1 4.44Å; K234-Y241 HydrophobicContact CB-CD2 3.45Å; K234-Y241 VanDerWaalsContact CB-CD2 3.45Å; K234-Y241 HydrophobicContact CB-CE2 3.66Å; K234-Y241 HydrophobicContact CB-CG 3.86Å; K234-Y241 HydrophobicContact CD-CE1 4.15Å; K234-Y241 HydrophobicContact CD-CE2 4.11Å; K234-Y241 HydrophobicContact CG-CD1 4.04Å; K234-Y241 HydrophobicContact CG-CD2 3.95Å; K234-Y241 HydrophobicContact CG-CE1 4.14Å; K234-Y241 HydrophobicContact CG-CE2 4Å; K234-Y241 HydrophobicContact CG-CG 3.95Å
235	K	95.4	Very high	95.8	Very high	186 Å²	186	70.2 Å²	70.2	81%	0.809	33%	0.33	S	S	*	.	H	α-helix	trans	-73.7	-26.7	178.4	-68.7	-179.2	-179.5	-175.9	0	113.2	Q231 K232 M233	Q231-K235 PolarHBondContact O-N 3.49Å; Q231-K235 VanDerWaalsContact O-N 3.15Å; K232-K235 PolarHBondContact O-N 3.47Å; M233-K235 VanDerWaalsContact C-N 3.28Å; M233-K235 PolarHBondContact O-N 2.99Å
236	L	94	Very high	95.7	Very high	60 Å²	60	71.6 Å²	71.6	31%	0.314	34%	0.338	S	S	.	.	H	α-helix	trans	-74.2	-56	-177.9	178.5	69.5	0	0	0	111.8	I209 A210 I213 K232 M233	I209-L236 HydrophobicContact CB-CD1 4.39Å; I209-L236 HydrophobicContact CB-CD2 4.28Å; I209-L236 HydrophobicContact CG2-CD1 3.96Å; I209-L236 HydrophobicContact CG2-CD2 3.98Å; A210-L236 HydrophobicContact CB-CD2 3.79Å; I213-L236 HydrophobicContact CD1-CD2 4Å; K232-L236 PolarHBondContact O-N 2.93Å; K232-L236 VanDerWaalsContact O-N 3.07Å; M233-L236 WeakPolarHBondContact O-CB 3.43Å; M233-L236 PolarHBondContact O-N 3.12Å; M233-L236 VanDerWaalsContact O-N 3.13Å
237	D	92	Very high	95.4	Very high	56 Å²	56	75.4 Å²	75.4	30%	0.299	36%	0.356	S	S	.	.			trans	-159.6	119.5	-173.4	-176.1	-22	0	0	0	109.5	M233 K239 V240 Y241	M233-D237 PolarHBondContact O-N 2.66Å; D237-K239 VanDerWaalsContact C-N 3.3Å; D237-K239 PolarHBondContact O-N 3.05Å; D237-K239 WeakPolarHBondContact OD1-CB 3.36Å; D237-K239 PolarHBondContact OD1-N 3.06Å; D237-V240 HydrophobicContact CB-CB 4.08Å; D237-V240 HydrophobicContact CB-CG2 3.76Å; D237-V240 PolarHBondContact O-N 3.3Å; D237-Y241 WeakPolarHBondContact O-CB 3.03Å; D237-Y241 PolarHBondContact O-N 3.41Å
238	S	94.1	Very high	95.2	Very high	74 Å²	74	69.8 Å²	69.8	52%	0.517	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-37.2	-179.7	63.3	0	0	0	0	112.1	V240 Y241 D242	S238-V240 PolarHBondContact O-N 2.8Å; S238-Y241 PolarHBondContact O-N 3.34Å; S238-D242 WeakPolarHBondContact O-CB 3.07Å; S238-D242 PolarHBondContact O-N 3.3Å
239	K	95.3	Very high	95.1	Very high	157 Å²	157	66.1 Å²	66.1	68%	0.683	32%	0.316	S	S	*	.	H	α-helix	trans	-66.1	-39.1	-179.9	-65.3	-178.3	178.9	178.4	0	111.9	D237 Y243	D237-K239 VanDerWaalsContact C-N 3.3Å; D237-K239 PolarHBondContact O-N 3.05Å; D237-K239 WeakPolarHBondContact OD1-CB 3.36Å; D237-K239 PolarHBondContact OD1-N 3.06Å; K239-Y243 WeakPolarHBondContact O-CB 3.22Å; K239-Y243 PolarHBondContact O-N 3.26Å; K239-Y243 VanDerWaalsContact O-N 3.11Å
240	V	95.6	Very high	94.9	Very high	1 Å²	1	70.2 Å²	70.2	1%	0.006	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-46.2	175.4	178.7	0	0	0	0	109.8	F201 F205 A210 M233 D237 S238 Y243 V244	F201-V240 HydrophobicContact CE2-CG1 4.18Å; F201-V240 HydrophobicContact CZ-CG1 3.71Å; F205-V240 HydrophobicContact CD1-CG2 3.61Å; F205-V240 HydrophobicContact CE1-CB 4.41Å; F205-V240 HydrophobicContact CE1-CG2 3.71Å; F205-V240 HydrophobicContact CG-CG2 4.19Å; F205-V240 HydrophobicContact CZ-CG2 4.4Å; A210-V240 HydrophobicContact CB-CG1 4.17Å; A210-V240 HydrophobicContact CB-CG2 4.42Å; M233-V240 HydrophobicContact CE-CG1 4.18Å; M233-V240 HydrophobicContact CG-CG1 3.87Å; M233-V240 HydrophobicContact SD-CG1 3.83Å; D237-V240 HydrophobicContact CB-CB 4.08Å; D237-V240 HydrophobicContact CB-CG2 3.76Å; D237-V240 PolarHBondContact O-N 3.3Å; S238-V240 PolarHBondContact O-N 2.8Å; V240-Y243 PolarHBondContact O-N 3.43Å; V240-V244 WeakPolarHBondContact O-CG2 3.35Å; V240-V244 PolarHBondContact O-N 3.01Å
241	Y	97.1	Very high	94.7	Very high	49 Å²	49	70.3 Å²	70.3	19%	0.192	34%	0.343	C	S	.	.	H	α-helix	trans	-61.2	-45.7	178.8	173.9	-94.6	0	0	0	112.4	L230 K234 D237 S238 Y243 V244 T245	L230-Y241 HydrophobicContact CD1-CD2 4.06Å; L230-Y241 HydrophobicContact CD1-CE2 3.8Å; L230-Y241 HydrophobicContact CG-CE2 3.93Å; K234-Y241 HydrophobicContact CB-CD1 4.44Å; K234-Y241 HydrophobicContact CB-CD2 3.45Å; K234-Y241 VanDerWaalsContact CB-CD2 3.45Å; K234-Y241 HydrophobicContact CB-CE2 3.66Å; K234-Y241 HydrophobicContact CB-CG 3.86Å; K234-Y241 HydrophobicContact CD-CE1 4.15Å; K234-Y241 HydrophobicContact CD-CE2 4.11Å; K234-Y241 HydrophobicContact CG-CD1 4.04Å; K234-Y241 HydrophobicContact CG-CD2 3.95Å; K234-Y241 HydrophobicContact CG-CE1 4.14Å; K234-Y241 HydrophobicContact CG-CE2 4Å; K234-Y241 HydrophobicContact CG-CG 3.95Å; D237-Y241 WeakPolarHBondContact O-CB 3.03Å; D237-Y241 PolarHBondContact O-N 3.41Å; S238-Y241 PolarHBondContact O-N 3.34Å; Y241-Y243 VanDerWaalsContact C-N 3.34Å; Y241-Y243 PolarHBondContact O-N 2.9Å; Y241-V244 PolarHBondContact O-N 3Å; Y241-T245 VanDerWaalsContact O-CB 3.32Å; Y241-T245 WeakPolarHBondContact O-CB 3.47Å; Y241-T245 PolarHBondContact O-N 3.42Å; Y241-T245 PolarHBondContact O-OG1 3.12Å
242	D	96.8	Very high	94.6	Very high	88 Å²	88	67.3 Å²	67.3	47%	0.471	33%	0.328	S	S	.	.	H	α-helix	trans	-61.8	-44.3	178.5	-66.3	-20.7	0	0	0	110.4	S238 V244 T245 Q246	S238-D242 WeakPolarHBondContact O-CB 3.07Å; S238-D242 PolarHBondContact O-N 3.3Å; D242-V244 PolarHBondContact O-N 2.66Å; D242-T245 PolarHBondContact O-N 3.46Å; D242-Q246 VanDerWaalsContact O-CB 3.24Å; D242-Q246 WeakPolarHBondContact O-CB 3.46Å; D242-Q246 PolarHBondContact O-N 3.04Å
243	Y	95.7	Very high	94.4	Very high	38 Å²	38	67 Å²	67	15%	0.149	33%	0.328	C	S	.	.	H	α-helix	trans	-59	-47.3	174.9	174.9	-95.8	0	0	0	112.3	F201 K204 F205 K239 V240 Y241 Q246 H247 W248	F201-Y243 HydrophobicContact CD2-CD1 4.46Å; F201-Y243 HydrophobicContact CD2-CE1 4.14Å; F201-Y243 HydrophobicContact CE2-CD1 4.35Å; F201-Y243 HydrophobicContact CE2-CE1 4.48Å; K204-Y243 HydrophobicContact CG-CE2 4.23Å; F205-Y243 HydrophobicContact CD2-CD1 4.28Å; F205-Y243 HydrophobicContact CD2-CE1 4.47Å; F205-Y243 AromaticContact CE2-CD1 3.34Å; F205-Y243 HydrophobicContact CE2-CD1 3.34Å; F205-Y243 HydrophobicContact CE2-CD2 4.26Å; F205-Y243 AromaticContact CE2-CE1 3.79Å; F205-Y243 HydrophobicContact CE2-CE1 3.79Å; F205-Y243 AromaticContact CE2-CG 3.56Å; F205-Y243 HydrophobicContact CE2-CG 3.56Å; F205-Y243 HydrophobicContact CZ-CD1 4.08Å; F205-Y243 HydrophobicContact CZ-CD2 4.48Å; F205-Y243 AromaticContact CZ-CG 3.84Å; F205-Y243 HydrophobicContact CZ-CG 3.84Å; K239-Y243 WeakPolarHBondContact O-CB 3.22Å; K239-Y243 PolarHBondContact O-N 3.26Å; K239-Y243 VanDerWaalsContact O-N 3.11Å; V240-Y243 PolarHBondContact O-N 3.43Å; Y241-Y243 VanDerWaalsContact C-N 3.34Å; Y241-Y243 PolarHBondContact O-N 2.9Å; Y243-Q246 PolarHBondContact O-N 2.86Å; Y243-H247 AromaticContact CD2-CE1 3.71Å; Y243-H247 AromaticContact CD2-ND1 3.41Å; Y243-H247 WeakPolarHBondContact CD2-ND1 3.22Å; Y243-H247 HydrophobicContact CE2-CB 4.43Å; Y243-H247 AromaticContact CE2-CG 3.92Å; Y243-H247 AromaticContact CE2-ND1 3.68Å; Y243-H247 WeakPolarHBondContact O-CB 3.44Å; Y243-H247 PolarHBondContact O-N 3.33Å; Y243-H247 PolarHBondContact O-ND1 3.49Å; Y243-W248 AromaticContact CE1-CD1 3.68Å; Y243-W248 AromaticContact CE1-NE1 3.18Å; Y243-W248 AromaticContact CZ-NE1 3.67Å
244	V	95.4	Very high	94.2	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63.4	-43.3	178.3	170.2	0	0	0	0	111.4	F201 F214 L230 M233 V240 Y241 D242 Q246 W248 I249	F201-V244 HydrophobicContact CD2-CG2 4.28Å; F201-V244 HydrophobicContact CE2-CG2 3.58Å; F201-V244 HydrophobicContact CZ-CG2 4.45Å; F214-V244 HydrophobicContact CD2-CG2 3.99Å; F214-V244 HydrophobicContact CE2-CG2 4.06Å; L230-V244 HydrophobicContact CD1-CG1 4.19Å; M233-V244 HydrophobicContact CE-CG2 4.38Å; M233-V244 HydrophobicContact SD-CB 3.88Å; M233-V244 HydrophobicContact SD-CG1 4.12Å; M233-V244 HydrophobicContact SD-CG2 3.48Å; M233-V244 WeakPolarHBondContact SD-CG2 3.47Å; V240-V244 WeakPolarHBondContact O-CG2 3.35Å; V240-V244 PolarHBondContact O-N 3.01Å; Y241-V244 PolarHBondContact O-N 3Å; D242-V244 PolarHBondContact O-N 2.66Å; V244-Q246 VanDerWaalsContact C-N 3.34Å; V244-Q246 PolarHBondContact O-N 3.38Å; V244-W248 HydrophobicContact CG1-CB 4.28Å; V244-W248 WeakPolarHBondContact O-CA 3.49Å; V244-W248 WeakPolarHBondContact O-CB 3.19Å; V244-W248 PolarHBondContact O-N 3.24Å; V244-I249 HydrophobicContact CG1-CD1 4.17Å; V244-I249 HydrophobicContact CG1-CG1 4.19Å; V244-I249 WeakPolarHBondContact O-CG1 3.16Å; V244-I249 PolarHBondContact O-N 2.97Å
245	T	95.9	Very high	93.9	Very high	51 Å²	51	62.5 Å²	62.5	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-65.1	-38.2	-179.6	-57.2	0	0	0	0	111.9	Y241 D242 P250	Y241-T245 VanDerWaalsContact O-CB 3.32Å; Y241-T245 WeakPolarHBondContact O-CB 3.47Å; Y241-T245 PolarHBondContact O-N 3.42Å; Y241-T245 PolarHBondContact O-OG1 3.12Å; D242-T245 PolarHBondContact O-N 3.46Å; T245-P250 WeakPolarHBondContact O-CD 3.47Å
246	Q	94.3	Very high	93.8	Very high	139 Å²	139	53.6 Å²	53.6	65%	0.65	27%	0.271	S	S	*	.	H	α-helix	trans	-78.7	-37.2	-179.2	-175.5	180	10.8	0	0	113.2	D242 Y243 V244	D242-Q246 VanDerWaalsContact O-CB 3.24Å; D242-Q246 WeakPolarHBondContact O-CB 3.46Å; D242-Q246 PolarHBondContact O-N 3.04Å; Y243-Q246 PolarHBondContact O-N 2.86Å; V244-Q246 VanDerWaalsContact C-N 3.34Å; V244-Q246 PolarHBondContact O-N 3.38Å
247	H	91.2	Very high	93.6	Very high	89 Å²	89	51.3 Å²	51.3	41%	0.412	26%	0.259	S	S	.	.	H	α-helix	trans	-110.7	-27.6	-168.2	-57.9	83.1	0	0	0	114.7	Y243	Y243-H247 AromaticContact CD2-CE1 3.71Å; Y243-H247 AromaticContact CD2-ND1 3.41Å; Y243-H247 WeakPolarHBondContact CD2-ND1 3.22Å; Y243-H247 HydrophobicContact CE2-CB 4.43Å; Y243-H247 AromaticContact CE2-CG 3.92Å; Y243-H247 AromaticContact CE2-ND1 3.68Å; Y243-H247 WeakPolarHBondContact O-CB 3.44Å; Y243-H247 PolarHBondContact O-N 3.33Å; Y243-H247 PolarHBondContact O-ND1 3.49Å
248	W	93.1	Very high	93.7	Very high	14 Å²	14	48.9 Å²	48.9	5%	0.053	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-34.4	-171.5	-66.2	97.8	0	0	0	113.3	I197 V200 F214 Y243 V244 I251 K252 W255	I197-W248 HydrophobicContact CB-CH2 3.86Å; I197-W248 HydrophobicContact CB-CZ3 3.72Å; I197-W248 HydrophobicContact CG2-CE3 4.45Å; I197-W248 HydrophobicContact CG2-CH2 3.94Å; I197-W248 HydrophobicContact CG2-CZ3 3.5Å; V200-W248 HydrophobicContact CB-CH2 4.24Å; V200-W248 HydrophobicContact CB-CZ2 4.06Å; V200-W248 HydrophobicContact CG1-CH2 4.27Å; V200-W248 HydrophobicContact CG1-CZ2 3.78Å; F214-W248 HydrophobicContact CE2-CB 4.43Å; F214-W248 HydrophobicContact CE2-CD2 4.3Å; F214-W248 AromaticContact CE2-CG 4Å; F214-W248 HydrophobicContact CE2-CG 4Å; F214-W248 AromaticContact CZ-CD2 3.9Å; F214-W248 HydrophobicContact CZ-CD2 3.9Å; F214-W248 HydrophobicContact CZ-CE3 4.33Å; F214-W248 HydrophobicContact CZ-CG 4.09Å; Y243-W248 AromaticContact CE1-CD1 3.68Å; Y243-W248 AromaticContact CE1-NE1 3.18Å; Y243-W248 AromaticContact CZ-NE1 3.67Å; V244-W248 HydrophobicContact CG1-CB 4.28Å; V244-W248 WeakPolarHBondContact O-CA 3.49Å; V244-W248 WeakPolarHBondContact O-CB 3.19Å; V244-W248 PolarHBondContact O-N 3.24Å; W248-I251 HydrophobicContact CE3-CD1 4.25Å; W248-I251 HydrophobicContact CZ3-CD1 4.49Å; W248-I251 CarbonylContact O-C 3.6Å; W248-I251 WeakPolarHBondContact O-CG1 3.12Å; W248-I251 PolarHBondContact O-N 3.49Å; W248-K252 PolarHBondContact O-N 2.97Å; W248-W255 HydrophobicContact CB-CZ2 3.86Å; W248-W255 AromaticContact CE3-NE1 3.99Å; W248-W255 PolarHBondContact O-NE1 2.88Å
249	I	94.3	Very high	93.6	Very high	29 Å²	29	47.9 Å²	47.9	15%	0.149	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-64	-39.6	177.5	-62.1	-55.9	0	0	0	113.2	F226 L230 V244 I251 K252	F226-I249 HydrophobicContact CE1-CD1 4.05Å; F226-I249 HydrophobicContact CZ-CD1 3.64Å; L230-I249 HydrophobicContact CD1-CD1 4.06Å; L230-I249 HydrophobicContact CD1-CG1 4.46Å; L230-I249 HydrophobicContact CD2-CD1 3.98Å; L230-I249 HydrophobicContact CD2-CG1 4.47Å; V244-I249 HydrophobicContact CG1-CD1 4.17Å; V244-I249 HydrophobicContact CG1-CG1 4.19Å; V244-I249 WeakPolarHBondContact O-CG1 3.16Å; V244-I249 PolarHBondContact O-N 2.97Å; I249-I251 PolarHBondContact O-N 3.48Å; I249-K252 WeakPolarHBondContact O-CG 3.37Å; I249-K252 PolarHBondContact O-N 3.49Å
250	P	93.1	Very high	93.4	Very high	87 Å²	87	40.6 Å²	40.6	57%	0.565	20%	0.202	S	C	*	.	G	3₁₀ helix	trans	-63.2	-20.5	178.7	-25.1	36.8	0	0	0	114.2	T245	T245-P250 WeakPolarHBondContact O-CD 3.47Å
251	I	91.6	Very high	92.8	Very high	30 Å²	30	47.1 Å²	47.1	15%	0.154	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-117.6	20.2	-177.8	61.2	168.7	0	0	0	112.4	P178 L192 W248 I249 E253 M254	P178-I251 HydrophobicContact CG-CD1 4.49Å; L192-I251 HydrophobicContact CD1-CD1 4.19Å; W248-I251 HydrophobicContact CE3-CD1 4.25Å; W248-I251 HydrophobicContact CZ3-CD1 4.49Å; W248-I251 CarbonylContact O-C 3.6Å; W248-I251 WeakPolarHBondContact O-CG1 3.12Å; W248-I251 PolarHBondContact O-N 3.49Å; I249-I251 PolarHBondContact O-N 3.48Å; I251-E253 PolarHBondContact O-N 3.03Å; I251-E253 VanDerWaalsContact O-N 3.16Å; I251-M254 HydrophobicContact CB-CG 4.5Å; I251-M254 HydrophobicContact CB-SD 4.1Å; I251-M254 HydrophobicContact CG2-SD 4.31Å; I251-M254 WeakPolarHBondContact O-CB 3.49Å; I251-M254 PolarHBondContact O-N 2.74Å
252	K	93.1	Very high	92.3	Very high	57 Å²	57	49.7 Å²	49.7	25%	0.248	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-57.8	-30.2	-175.7	66.4	-170.2	174.9	-152.6	0	113.3	F226 W248 I249 M254 W255 V256 F259	F226-K252 HydrophobicContact CE1-CD 4.36Å; F226-K252 HydrophobicContact CZ-CB 4.28Å; F226-K252 HydrophobicContact CZ-CD 4.45Å; W248-K252 PolarHBondContact O-N 2.97Å; I249-K252 WeakPolarHBondContact O-CG 3.37Å; I249-K252 PolarHBondContact O-N 3.49Å; K252-M254 PolarHBondContact O-N 3.13Å; K252-W255 PolarHBondContact O-N 2.92Å; K252-V256 HydrophobicContact CB-CG2 3.93Å; K252-V256 WeakPolarHBondContact O-CB 3.36Å; K252-V256 WeakPolarHBondContact O-CG2 3.45Å; K252-V256 PolarHBondContact O-N 3.21Å; K252-F259 HydrophobicContact CB-CD2 4.19Å; K252-F259 HydrophobicContact CB-CE2 4.48Å; K252-F259 HydrophobicContact CD-CD2 4.11Å; K252-F259 HydrophobicContact CD-CE2 3.92Å; K252-F259 HydrophobicContact CG-CD2 3.92Å; K252-F259 HydrophobicContact CG-CE2 4.22Å
253	E	92.1	Very high	92.1	Very high	73 Å²	73	45.5 Å²	45.5	34%	0.341	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-67.7	-5.6	175.3	-63.5	77.3	-170.5	0	0	113.2	R189 I251 F259 L260	R189-E253 PolarHBondContact NH2-O 3.1Å; I251-E253 PolarHBondContact O-N 3.03Å; I251-E253 VanDerWaalsContact O-N 3.16Å; E253-F259 HydrophobicContact CG-CB 4.36Å; E253-L260 WeakPolarHBondContact O-CD2 3.34Å
254	M	91.7	Very high	92.1	Very high	33 Å²	33	44.3 Å²	44.3	16%	0.163	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-101.1	-16.3	174.7	-59.5	-179.1	174.6	0	0	113.2	P178 I190 V191 L192 I251 K252	P178-M254 HydrophobicContact CB-CE 4.34Å; P178-M254 HydrophobicContact CB-SD 3.8Å; I190-M254 HydrophobicContact CB-CE 4.41Å; I190-M254 HydrophobicContact CB-SD 4.32Å; I190-M254 HydrophobicContact CG2-SD 4.47Å; I190-M254 WeakPolarHBondContact O-CA 3.44Å; I190-M254 WeakPolarHBondContact O-CB 3.33Å; V191-M254 CarbonylContact C-O 3.57Å; V191-M254 VanDerWaalsContact CA-O 3.31Å; V191-M254 WeakPolarHBondContact CA-O 3.46Å; L192-M254 HydrophobicContact CD1-CB 4.4Å; L192-M254 HydrophobicContact CG-CB 4.19Å; L192-M254 PolarHBondContact N-O 2.86Å; I251-M254 HydrophobicContact CB-CG 4.5Å; I251-M254 HydrophobicContact CB-SD 4.1Å; I251-M254 HydrophobicContact CG2-SD 4.31Å; I251-M254 WeakPolarHBondContact O-CB 3.49Å; I251-M254 PolarHBondContact O-N 2.74Å; K252-M254 PolarHBondContact O-N 3.13Å
255	W	90.9	Very high	91.9	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139.7	-12.9	-169.5	67.1	-94.5	0	0	0	115.9	L192 I197 F214 L217 A218 F226 W248 K252 P257	L192-W255 HydrophobicContact CB-CB 4.11Å; I197-W255 HydrophobicContact CD1-CB 3.82Å; I197-W255 HydrophobicContact CD1-CD2 3.96Å; I197-W255 HydrophobicContact CD1-CE3 3.44Å; I197-W255 VanDerWaalsContact CD1-CE3 3.44Å; I197-W255 HydrophobicContact CD1-CG 4.15Å; I197-W255 HydrophobicContact CD1-CZ3 4.28Å; I197-W255 HydrophobicContact CG2-CB 4.23Å; F214-W255 HydrophobicContact CE2-CH2 4.18Å; F214-W255 HydrophobicContact CZ-CH2 4.3Å; F214-W255 HydrophobicContact CZ-CZ3 4.4Å; L217-W255 HydrophobicContact CB-CH2 3.97Å; L217-W255 HydrophobicContact CB-CZ3 4.1Å; A218-W255 HydrophobicContact CB-CE3 4.07Å; A218-W255 HydrophobicContact CB-CZ3 3.87Å; F226-W255 HydrophobicContact CE2-CH2 4.16Å; F226-W255 HydrophobicContact CE2-CZ2 4.5Å; W248-W255 HydrophobicContact CB-CZ2 3.86Å; W248-W255 AromaticContact CE3-NE1 3.99Å; W248-W255 PolarHBondContact O-NE1 2.88Å; K252-W255 PolarHBondContact O-N 2.92Å; W255-P257 WeakPolarHBondContact O-CD 3.46Å
256	V	92.2	Very high	91.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.212	C	C	.	.			trans	-97.9	116.9	180	-177.7	0	0	0	0	109.1	T220 F226 K252 A258 F259 L260	T220-V256 HydrophobicContact CG2-CG1 4.12Å; F226-V256 HydrophobicContact CD2-CG1 3.64Å; F226-V256 HydrophobicContact CD2-CG2 4.07Å; F226-V256 HydrophobicContact CE2-CB 4.34Å; F226-V256 HydrophobicContact CE2-CG1 3.94Å; F226-V256 HydrophobicContact CE2-CG2 3.46Å; F226-V256 VanDerWaalsContact CE2-CG2 3.46Å; F226-V256 HydrophobicContact CG-CG1 4.47Å; F226-V256 HydrophobicContact CZ-CG2 4.2Å; K252-V256 HydrophobicContact CB-CG2 3.93Å; K252-V256 WeakPolarHBondContact O-CB 3.36Å; K252-V256 WeakPolarHBondContact O-CG2 3.45Å; K252-V256 PolarHBondContact O-N 3.21Å; V256-A258 HydrophobicContact CG1-CB 3.95Å; V256-A258 PolarHBondContact O-N 3.4Å; V256-F259 HydrophobicContact CB-CD2 3.69Å; V256-F259 HydrophobicContact CB-CE2 4.27Å; V256-F259 HydrophobicContact CG1-CD2 3.71Å; V256-F259 HydrophobicContact CG1-CE2 3.91Å; V256-F259 HydrophobicContact CG2-CD2 4.27Å; V256-F259 PolarHBondContact O-N 2.86Å; V256-L260 WeakPolarHBondContact O-CD1 3.48Å; V256-L260 WeakPolarHBondContact O-CG 3.44Å
257	P	91.2	Very high	91.3	Very high	12 Å²	12	37.2 Å²	37.2	8%	0.078	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-53.9	-32.6	-179.2	-29.9	37.4	0	0	0	114.6	L221 W255 F259 L260	L221-P257 HydrophobicContact CD2-CB 3.5Å; L221-P257 HydrophobicContact CG-CB 4.36Å; W255-P257 WeakPolarHBondContact O-CD 3.46Å; P257-F259 PolarHBondContact O-N 3.22Å; P257-L260 PolarHBondContact O-N 2.82Å
258	A	92.3	Very high	90.8	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.033	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-59.3	-23.1	175.8	0	0	0	0	0	114.7	T220 L221 P223 V256	T220-A258 WeakPolarHBondContact O-CB 3.34Å; T220-A258 PolarHBondContact O-N 2.77Å; L221-A258 VanDerWaalsContact C-CB 3.46Å; L221-A258 WeakPolarHBondContact O-CB 3.32Å; P223-A258 HydrophobicContact CG-CB 4.23Å; V256-A258 HydrophobicContact CG1-CB 3.95Å; V256-A258 PolarHBondContact O-N 3.4Å
259	F	93.4	Very high	90.1	Very high	54 Å²	54	42.9 Å²	42.9	24%	0.237	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-114.9	15.2	-178	-52.9	-59.5	0	0	0	112.5	P223 F226 K252 E253 V256 P257	P223-F259 HydrophobicContact CB-CE1 4.05Å; P223-F259 HydrophobicContact CB-CZ 4.32Å; P223-F259 HydrophobicContact CG-CE1 4.21Å; F226-F259 AromaticContact CD1-CE2 3.77Å; F226-F259 HydrophobicContact CD1-CE2 3.77Å; F226-F259 AromaticContact CD1-CZ 3.93Å; F226-F259 HydrophobicContact CD1-CZ 3.93Å; F226-F259 HydrophobicContact CD2-CE2 4.15Å; F226-F259 AromaticContact CE1-CE2 3.91Å; F226-F259 HydrophobicContact CE1-CE2 3.91Å; F226-F259 HydrophobicContact CE1-CZ 4.37Å; F226-F259 HydrophobicContact CE2-CE2 4.28Å; F226-F259 AromaticContact CG-CE2 3.89Å; F226-F259 HydrophobicContact CG-CE2 3.89Å; F226-F259 HydrophobicContact CG-CZ 4.21Å; F226-F259 HydrophobicContact CZ-CE2 4.16Å; K252-F259 HydrophobicContact CB-CD2 4.19Å; K252-F259 HydrophobicContact CB-CE2 4.48Å; K252-F259 HydrophobicContact CD-CD2 4.11Å; K252-F259 HydrophobicContact CD-CE2 3.92Å; K252-F259 HydrophobicContact CG-CD2 3.92Å; K252-F259 HydrophobicContact CG-CE2 4.22Å; E253-F259 HydrophobicContact CG-CB 4.36Å; V256-F259 HydrophobicContact CB-CD2 3.69Å; V256-F259 HydrophobicContact CB-CE2 4.27Å; V256-F259 HydrophobicContact CG1-CD2 3.71Å; V256-F259 HydrophobicContact CG1-CE2 3.91Å; V256-F259 HydrophobicContact CG2-CD2 4.27Å; V256-F259 PolarHBondContact O-N 2.86Å; P257-F259 PolarHBondContact O-N 3.22Å
260	L	90.7	Very high	89	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.021	22%	0.222	C	C	.	.			trans	-118.3	25.3	-177.9	-71.9	165.8	0	0	0	111.6	V191 E253 V256 P257 D262 V263 V270	V191-L260 HydrophobicContact CG1-CD1 4.46Å; V191-L260 HydrophobicContact CG2-CD2 4.15Å; E253-L260 WeakPolarHBondContact O-CD2 3.34Å; V256-L260 WeakPolarHBondContact O-CD1 3.48Å; V256-L260 WeakPolarHBondContact O-CG 3.44Å; P257-L260 PolarHBondContact O-N 2.82Å; L260-D262 VanDerWaalsContact C-N 3.3Å; L260-D262 PolarHBondContact O-N 3.31Å; L260-V263 HydrophobicContact CB-CG2 4.21Å; L260-V263 HydrophobicContact CD2-CG2 3.6Å; L260-V263 PolarHBondContact O-N 3.18Å; L260-V270 HydrophobicContact CB-CG1 4.25Å; L260-V270 HydrophobicContact CB-CG2 4.32Å; L260-V270 HydrophobicContact CD1-CG1 3.63Å; L260-V270 HydrophobicContact CG-CG1 4.45Å
261	Q	83.4	Confident	87.8	Confident	138 Å²	138	40.9 Å²	40.9	65%	0.645	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-22.6	-169.5	-64.2	-175.5	-3.6	0	0	113.9	V389	Q261-V389 VanDerWaalsContact O-CG2 3.23Å; Q261-V389 WeakPolarHBondContact O-CG2 3.32Å
262	D	86.8	Confident	86.7	Confident	102 Å²	102	41.1 Å²	41.1	55%	0.545	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	2.2	-178.5	63.5	-30.8	0	0	0	113.2	L260	L260-D262 VanDerWaalsContact C-N 3.3Å; L260-D262 PolarHBondContact O-N 3.31Å
263	V	92.6	Very high	85.5	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	21%	0.207	C	C	.	.	S	Bend	trans	-77.4	134.6	-178.3	174.4	0	0	0	0	110.5	T168 R189 V191 L260 T265 V389	T168-V263 HydrophobicContact CG2-CG1 3.69Å; T168-V263 WeakPolarHBondContact OG1-CG1 3.39Å; R189-V263 HydrophobicContact CB-CG1 4.36Å; R189-V263 HydrophobicContact CB-CG2 4.03Å; R189-V263 HydrophobicContact CG-CG2 4.19Å; V191-V263 HydrophobicContact CG2-CG1 3.74Å; L260-V263 HydrophobicContact CB-CG2 4.21Å; L260-V263 HydrophobicContact CD2-CG2 3.6Å; L260-V263 PolarHBondContact O-N 3.18Å; V263-T265 PolarHBondContact O-N 3.06Å; V263-V389 VanDerWaalsContact O-CG1 3.29Å; V263-V389 WeakPolarHBondContact O-CG1 3.15Å
264	V	94.4	Very high	84	Confident	13 Å²	13	35.1 Å²	35.1	8%	0.079	19%	0.191	C	C	.	.			trans	-68.6	118.8	176.1	177.4	0	0	0	0	110.1	V105 L167 T168 L266 V389 L391	V105-V264 HydrophobicContact CG2-CG1 3.98Å; L167-V264 HydrophobicContact CB-CB 4.17Å; L167-V264 HydrophobicContact CB-CG2 4.03Å; L167-V264 HydrophobicContact CD1-CB 4.5Å; L167-V264 HydrophobicContact CD1-CG1 4.44Å; L167-V264 HydrophobicContact CD1-CG2 3.86Å; T168-V264 WeakPolarHBondContact CB-O 3.45Å; T168-V264 PolarHBondContact OG1-O 2.81Å; T168-V264 VanDerWaalsContact OG1-O 3.08Å; V264-L266 HydrophobicContact CG1-CD2 3.97Å; V264-L266 HydrophobicContact CG1-CG 4.28Å; V264-V389 CarbonylContact C-O 3.52Å; V264-V389 WeakPolarHBondContact CA-O 2.98Å; V264-L391 HydrophobicContact CG1-CD1 3.9Å; V264-L391 HydrophobicContact CG1-CD2 4.11Å; V264-L391 HydrophobicContact CG1-CG 3.84Å; V264-L391 HydrophobicContact CG2-CD2 4Å
265	T	90.9	Very high	82.9	Confident	11 Å²	11	40.4 Å²	40.4	7%	0.067	21%	0.213	C	C	.	.			trans	-123.1	-5.6	-177.9	60.9	0	0	0	0	113.9	V263 G267 T268 V270 V273 V389	V263-T265 PolarHBondContact O-N 3.06Å; T265-G267 PolarHBondContact O-N 3.32Å; T265-G267 VanDerWaalsContact O-N 3.13Å; T265-T268 WeakPolarHBondContact CB-O 3.22Å; T265-T268 PolarHBondContact O-N 3.27Å; T265-T268 PolarHBondContact O-OG1 3.48Å; T265-T268 PolarHBondContact OG1-O 3.3Å; T265-T268 VanDerWaalsContact OG1-O 3.13Å; T265-V270 HydrophobicContact CG2-CB 4.49Å; T265-V270 HydrophobicContact CG2-CG2 3.77Å; T265-V273 HydrophobicContact CG2-CG2 3.91Å; T265-V389 HydrophobicContact CG2-CG1 4.37Å; T265-V389 PolarHBondContact N-O 3.37Å; T265-V389 WeakPolarHBondContact OG1-CG1 3.28Å
266	L	92.7	Very high	81.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	28.9	-179.1	-52.5	173	0	0	0	112.9	V105 T127 L131 V264 T268 V389 L391 W417	V105-L266 HydrophobicContact CB-CD1 3.83Å; V105-L266 HydrophobicContact CB-CG 4.5Å; V105-L266 HydrophobicContact CG2-CD1 3.5Å; V105-L266 HydrophobicContact CG2-CD2 4.45Å; V105-L266 HydrophobicContact CG2-CG 3.66Å; T127-L266 HydrophobicContact CG2-CD1 4.05Å; L131-L266 HydrophobicContact CD2-CB 4.03Å; L131-L266 WeakPolarHBondContact CD2-O 3.48Å; V264-L266 HydrophobicContact CG1-CD2 3.97Å; V264-L266 HydrophobicContact CG1-CG 4.28Å; L266-T268 VanDerWaalsContact C-N 3.33Å; L266-V389 PolarHBondContact N-O 3.21Å; L266-L391 HydrophobicContact CD2-CB 4.41Å; L266-L391 HydrophobicContact CD2-CD1 3.82Å; L266-L391 HydrophobicContact CD2-CG 4.03Å; L266-W417 HydrophobicContact CB-CH2 4.23Å; L266-W417 HydrophobicContact CB-CZ2 4.31Å; L266-W417 HydrophobicContact CD2-CH2 4.41Å; L266-W417 HydrophobicContact CD2-CZ2 3.83Å
267	G	84.5	Confident	80.1	Confident	29 Å²	29	43.4 Å²	43.4	30%	0.299	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	-0.8	-179.4	0	0	0	0	0	115.1	T265 E390	T265-G267 PolarHBondContact O-N 3.32Å; T265-G267 VanDerWaalsContact O-N 3.13Å; G267-E390 VanDerWaalsContact CA-OE2 3.27Å; G267-E390 WeakPolarHBondContact CA-OE2 3.42Å
268	T	82.5	Confident	79.1	Confident	39 Å²	39	45.9 Å²	45.9	24%	0.239	24%	0.242	C	C	.	.	S	Bend	trans	-79.6	153.7	167.5	68.1	0	0	0	0	110.3	T265 L266 V273	T265-T268 WeakPolarHBondContact CB-O 3.22Å; T265-T268 PolarHBondContact O-N 3.27Å; T265-T268 PolarHBondContact O-OG1 3.48Å; T265-T268 PolarHBondContact OG1-O 3.3Å; T265-T268 VanDerWaalsContact OG1-O 3.13Å; L266-T268 VanDerWaalsContact C-N 3.33Å; T268-V273 WeakPolarHBondContact OG1-CG2 3.41Å
269	K	78.4	Confident	78.2	Confident	183 Å²	183	50.2 Å²	50.2	80%	0.796	27%	0.27	S	S	*	.			trans	-63.1	145.9	167.5	-64.9	-178	-179	179.4	0	107.8	N271 G272 V273	K269-N271 PolarHBondContact O-N 3.39Å; K269-N271 VanDerWaalsContact O-N 3.08Å; K269-G272 CarbonylContact O-C 3.42Å; K269-G272 WeakPolarHBondContact O-CA 3.25Å; K269-G272 PolarHBondContact O-N 3.08Å; K269-V273 PolarHBondContact O-N 2.67Å; K269-V273 VanDerWaalsContact O-N 3.1Å
270	V	70.2	Confident	77.5	Confident	25 Å²	25	53.8 Å²	53.8	15%	0.152	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	-43	176	177.7	0	0	0	0	112.3	V191 L260 T265 G272 V273	V191-V270 HydrophobicContact CG1-CG1 3.57Å; L260-V270 HydrophobicContact CB-CG1 4.25Å; L260-V270 HydrophobicContact CB-CG2 4.32Å; L260-V270 HydrophobicContact CD1-CG1 3.63Å; L260-V270 HydrophobicContact CG-CG1 4.45Å; T265-V270 HydrophobicContact CG2-CB 4.49Å; T265-V270 HydrophobicContact CG2-CG2 3.77Å; V270-G272 VanDerWaalsContact C-N 3.3Å; V270-G272 PolarHBondContact O-N 2.88Å; V270-V273 WeakPolarHBondContact O-CB 3.42Å; V270-V273 WeakPolarHBondContact O-CG2 3.46Å; V270-V273 PolarHBondContact O-N 3.42Å
271	N	68.6	Low	77.2	Confident	50 Å²	50	54 Å²	54	27%	0.267	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23.2	175.2	-74.6	-34.7	0	0	0	114.6	S194 K269	S194-N271 VanDerWaalsContact CB-OD1 3.28Å; S194-N271 WeakPolarHBondContact CB-OD1 3.44Å; S194-N271 PolarHBondContact OG-OD1 3.42Å; K269-N271 PolarHBondContact O-N 3.39Å; K269-N271 VanDerWaalsContact O-N 3.08Å
272	G	67.3	Low	77.1	Confident	35 Å²	35	54.6 Å²	54.6	36%	0.361	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-30.6	175.6	0	0	0	0	0	112.9	K269 V270 V274 K275	K269-G272 CarbonylContact O-C 3.42Å; K269-G272 WeakPolarHBondContact O-CA 3.25Å; K269-G272 PolarHBondContact O-N 3.08Å; V270-G272 VanDerWaalsContact C-N 3.3Å; V270-G272 PolarHBondContact O-N 2.88Å; G272-V274 PolarHBondContact O-N 2.85Å; G272-K275 PolarHBondContact O-N 2.88Å
273	V	67.6	Low	77	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.024	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-29.2	174.8	-170.6	0	0	0	0	111.2	V105 S107 T168 A170 T265 T268 K269 V270 K275	V105-V273 HydrophobicContact CG1-CG1 3.38Å; S107-V273 WeakPolarHBondContact CB-O 3.33Å; S107-V273 PolarHBondContact OG-O 3.05Å; T168-V273 HydrophobicContact CG2-CG1 4.45Å; A170-V273 HydrophobicContact CB-CB 4.06Å; A170-V273 HydrophobicContact CB-CG1 3.52Å; T265-V273 HydrophobicContact CG2-CG2 3.91Å; T268-V273 WeakPolarHBondContact OG1-CG2 3.41Å; K269-V273 PolarHBondContact O-N 2.67Å; K269-V273 VanDerWaalsContact O-N 3.1Å; V270-V273 WeakPolarHBondContact O-CB 3.42Å; V270-V273 WeakPolarHBondContact O-CG2 3.46Å; V270-V273 PolarHBondContact O-N 3.42Å; V273-K275 PolarHBondContact O-N 2.84Å
274	V	61.6	Low	76.7	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	3	-165.8	-152.2	0	0	0	0	115.3	A170 V171 D172 V191 S193 G272	A170-V274 HydrophobicContact CB-CB 4.09Å; A170-V274 HydrophobicContact CB-CG1 3.98Å; A170-V274 HydrophobicContact CB-CG2 3.9Å; V171-V274 WeakPolarHBondContact O-CG1 3.46Å; D172-V274 HydrophobicContact CB-CG1 3.82Å; D172-V274 WeakPolarHBondContact CB-O 3.35Å; V191-V274 HydrophobicContact CG1-CG2 4.26Å; S193-V274 VanDerWaalsContact CB-CG1 3.42Å; G272-V274 PolarHBondContact O-N 2.85Å
275	K	67.7	Low	76.4	Confident	144 Å²	144	55.4 Å²	55.4	63%	0.626	29%	0.288	S	S	*	.			trans	-102.6	112.1	-174.1	-66.7	-175.1	179.4	-177.3	0	112	G272 V273	G272-K275 PolarHBondContact O-N 2.88Å; V273-K275 PolarHBondContact O-N 2.84Å
276	C	64.2	Low	76.2	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.027	30%	0.301	C	S	.	.			trans	-119.7	-15.8	178.3	-19.3	0	0	0	0	115.3	S107 S109 Q123 A125 T133 H278	S107-C276 WeakPolarHBondContact CB-SG 3.24Å; S107-C276 PolarHBondContact O-SG 3.32Å; S109-C276 WeakPolarHBondContact OG-CB 3.27Å; Q123-C276 VanDerWaalsContact CD-O 3.24Å; Q123-C276 PolarHBondContact NE2-O 3.36Å; Q123-C276 PolarHBondContact OE1-O 3.12Å; A125-C276 HydrophobicContact CB-CB 3.91Å; T133-C276 HydrophobicContact CG2-CB 4.11Å; C276-H278 PolarHBondContact O-N 3.11Å
277	V	60.9	Low	75.6	Confident	60 Å²	60	62.5 Å²	62.5	36%	0.364	32%	0.32	S	S	.	.			trans	-67.2	113.9	-171.7	-176.9	0	0	0	0	110.4	T111 P279	T111-V277 WeakPolarHBondContact OG1-CG1 3.12Å; T111-V277 WeakPolarHBondContact OG1-CG2 3.08Å; V277-P279 WeakPolarHBondContact O-CD 3.49Å
278	H	69.6	Low	75.5	Confident	64 Å²	64	63.7 Å²	63.7	30%	0.296	32%	0.317	S	S	.	.			trans	-79.9	117.2	171.3	-87.9	-75	0	0	0	109.5	T133 C276 H280 I281	T133-H278 PolarHBondContact O-NE2 2.89Å; C276-H278 PolarHBondContact O-N 3.11Å; H278-H280 PolarHBondContact O-N 3.47Å; H278-I281 HydrophobicContact CB-CD1 3.96Å; H278-I281 HydrophobicContact CB-CG1 3.98Å; H278-I281 PolarHBondContact O-N 2.88Å
279	P	74.3	Confident	75.3	Confident	95 Å²	95	62.4 Å²	62.4	62%	0.617	31%	0.309	S	S	*	.	H	α-helix	trans	-52.5	-31.3	178.6	-27.9	35.8	0	0	0	113.5	V277 I281 R282 E283	V277-P279 WeakPolarHBondContact O-CD 3.49Å; P279-I281 PolarHBondContact O-N 2.87Å; P279-R282 PolarHBondContact O-N 3.26Å; P279-E283 WeakPolarHBondContact O-CB 3.45Å; P279-E283 PolarHBondContact O-N 3.23Å; P279-E283 VanDerWaalsContact O-N 3.08Å
280	H	79.1	Confident	75.5	Confident	128 Å²	128	54.8 Å²	54.8	59%	0.593	28%	0.279	S	S	*	.	H	α-helix	trans	-64.1	-34.6	178.5	-62.6	-63.1	0	0	0	114	H278 E283 A284	H278-H280 PolarHBondContact O-N 3.47Å; H280-E283 PolarHBondContact O-N 3.45Å; H280-A284 WeakPolarHBondContact O-CB 3.31Å; H280-A284 PolarHBondContact O-N 3.15Å
281	I	83.3	Confident	76.3	Confident	10 Å²	10	55.2 Å²	55.2	5%	0.051	28%	0.28	C	S	.	.	H	α-helix	trans	-69.1	-44.3	179.8	-61.8	178.6	0	0	0	109.9	I121 F138 H278 P279 E283 A284 L285 L298	I121-I281 HydrophobicContact CD1-CG2 3.78Å; F138-I281 HydrophobicContact CD1-CD1 4.32Å; F138-I281 HydrophobicContact CE1-CD1 3.28Å; F138-I281 HydrophobicContact CZ-CD1 3.62Å; H278-I281 HydrophobicContact CB-CD1 3.96Å; H278-I281 HydrophobicContact CB-CG1 3.98Å; H278-I281 PolarHBondContact O-N 2.88Å; P279-I281 PolarHBondContact O-N 2.87Å; I281-E283 VanDerWaalsContact C-N 3.28Å; I281-E283 PolarHBondContact O-N 3.11Å; I281-A284 PolarHBondContact O-N 2.97Å; I281-L285 HydrophobicContact CG2-CD1 3.89Å; I281-L285 HydrophobicContact CG2-CG 4.43Å; I281-L285 VanDerWaalsContact O-CG 3.29Å; I281-L285 WeakPolarHBondContact O-CG 3.36Å; I281-L285 PolarHBondContact O-N 2.94Å; I281-L298 HydrophobicContact CG2-CD1 4.12Å
282	R	81.9	Confident	77.2	Confident	149 Å²	149	55.7 Å²	55.7	56%	0.562	28%	0.281	S	S	*	.	H	α-helix	trans	-60.2	-42.9	174.6	-175.4	-180	179.8	-166.1	-1.8	111	P279 A284 L285 K286	P279-R282 PolarHBondContact O-N 3.26Å; R282-A284 VanDerWaalsContact C-N 3.34Å; R282-L285 PolarHBondContact O-N 3.39Å; R282-K286 WeakPolarHBondContact O-CB 3.18Å; R282-K286 PolarHBondContact O-N 2.92Å; R282-K286 VanDerWaalsContact O-N 3.07Å
283	E	85.5	Confident	78.2	Confident	108 Å²	108	56.8 Å²	56.8	51%	0.505	28%	0.278	S	S	.	.	H	α-helix	trans	-64.3	-38.2	178.1	-173.1	63.4	-164.7	0	0	112.4	P279 H280 I281 K286	P279-E283 WeakPolarHBondContact O-CB 3.45Å; P279-E283 PolarHBondContact O-N 3.23Å; P279-E283 VanDerWaalsContact O-N 3.08Å; H280-E283 PolarHBondContact O-N 3.45Å; I281-E283 VanDerWaalsContact C-N 3.28Å; I281-E283 PolarHBondContact O-N 3.11Å; E283-K286 WeakPolarHBondContact O-CG 3.48Å; E283-K286 WeakPolarHBondContact OE1-CE 3.33Å; E283-K286 IonicContact OE1-NZ 2.75Å; E283-K286 PolarHBondContact OE1-NZ 3.33Å; E283-K286 WeakPolarHBondContact OE2-CD 3.17Å; E283-K286 WeakPolarHBondContact OE2-CE 3.42Å; E283-K286 IonicContact OE2-NZ 2.64Å; E283-K286 PolarHBondContact OE2-NZ 3.05Å
284	A	86.1	Confident	79.3	Confident	25 Å²	25	56.6 Å²	56.6	21%	0.207	28%	0.277	C	S	.	.	H	α-helix	trans	-68	-35.6	177.2	0	0	0	0	0	112.3	H280 I281 R282 H288 E301	H280-A284 WeakPolarHBondContact O-CB 3.31Å; H280-A284 PolarHBondContact O-N 3.15Å; I281-A284 PolarHBondContact O-N 2.97Å; R282-A284 VanDerWaalsContact C-N 3.34Å; A284-H288 PolarHBondContact O-CD2 2.84Å; A284-H288 PolarHBondContact O-NE2 3.24Å; A284-E301 HydrophobicContact CB-CG 3.8Å
285	L	88.4	Confident	80.7	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-87.8	-25.9	-174.6	-63.2	178	0	0	0	114.3	V114 I121 L140 I281 R282 E287 H288 C294 A297 L298	V114-L285 HydrophobicContact CB-CB 4.19Å; V114-L285 HydrophobicContact CB-CD1 4.13Å; V114-L285 HydrophobicContact CG2-CB 4.38Å; V114-L285 HydrophobicContact CG2-CD1 3.8Å; V114-L285 CarbonylContact O-C 3.59Å; V114-L285 VanDerWaalsContact O-CB 3.23Å; V114-L285 WeakPolarHBondContact O-CB 3.48Å; I121-L285 HydrophobicContact CD1-CD1 3.99Å; L140-L285 HydrophobicContact CD2-CD1 4.32Å; I281-L285 HydrophobicContact CG2-CD1 3.89Å; I281-L285 HydrophobicContact CG2-CG 4.43Å; I281-L285 VanDerWaalsContact O-CG 3.29Å; I281-L285 WeakPolarHBondContact O-CG 3.36Å; I281-L285 PolarHBondContact O-N 2.94Å; R282-L285 PolarHBondContact O-N 3.39Å; L285-E287 PolarHBondContact O-N 3.41Å; L285-E287 VanDerWaalsContact O-N 3.08Å; L285-H288 PolarHBondContact O-N 2.97Å; L285-H288 VanDerWaalsContact O-N 3.07Å; L285-C294 HydrophobicContact CD2-CB 3.97Å; L285-C294 VanDerWaalsContact CD2-O 3.3Å; L285-C294 WeakPolarHBondContact CD2-O 3.44Å; L285-A297 HydrophobicContact CD2-CB 3.99Å; L285-L298 HydrophobicContact CD2-CB 4.45Å
286	K	85.1	Confident	81.9	Confident	75 Å²	75	52 Å²	52	33%	0.326	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.7	-167	74.2	-176.5	-177.4	176.7	0	115.5	V114 R282 E283	V114-K286 WeakPolarHBondContact O-CA 3.49Å; V114-K286 PolarHBondContact O-N 2.88Å; R282-K286 WeakPolarHBondContact O-CB 3.18Å; R282-K286 PolarHBondContact O-N 2.92Å; R282-K286 VanDerWaalsContact O-N 3.07Å; E283-K286 WeakPolarHBondContact O-CG 3.48Å; E283-K286 WeakPolarHBondContact OE1-CE 3.33Å; E283-K286 IonicContact OE1-NZ 2.75Å; E283-K286 PolarHBondContact OE1-NZ 3.33Å; E283-K286 WeakPolarHBondContact OE2-CD 3.17Å; E283-K286 WeakPolarHBondContact OE2-CE 3.42Å; E283-K286 IonicContact OE2-NZ 2.64Å; E283-K286 PolarHBondContact OE2-NZ 3.05Å
287	E	80.8	Confident	83.2	Confident	85 Å²	85	52.4 Å²	52.4	40%	0.397	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-4.5	-176.5	-60.1	-62.6	152.5	0	0	112.7	L285	L285-E287 PolarHBondContact O-N 3.41Å; L285-E287 VanDerWaalsContact O-N 3.08Å
288	H	83.1	Confident	84.7	Confident	54 Å²	54	49.6 Å²	49.6	25%	0.25	25%	0.245	C	C	.	.			trans	-92.1	141.2	-177.6	-65.8	-56.7	0	0	0	111.5	S115 L116 A284 L285 D293	S115-H288 WeakPolarHBondContact CB-O 3.29Å; L116-H288 WeakPolarHBondContact CB-O 3.37Å; L116-H288 PolarHBondContact N-O 2.87Å; A284-H288 PolarHBondContact O-CD2 2.84Å; A284-H288 PolarHBondContact O-NE2 3.24Å; L285-H288 PolarHBondContact O-N 2.97Å; L285-H288 VanDerWaalsContact O-N 3.07Å; H288-D293 HydrophobicContact CB-CB 3.98Å; H288-D293 WeakPolarHBondContact ND1-CB 3.41Å
289	D	78.2	Confident	85.7	Confident	11 Å²	11	47.6 Å²	47.6	6%	0.059	24%	0.236	C	C	.	.			trans	-119.5	2.3	-177.8	63.4	-10.6	0	0	0	113.3	M29 K50 L116 V117	M29-D289 WeakPolarHBondContact CB-OD2 3.38Å; M29-D289 WeakPolarHBondContact CE-OD2 3.04Å; K50-D289 WeakPolarHBondContact CE-O 3.41Å; K50-D289 PolarHBondContact NZ-O 3.03Å; L116-D289 HydrophobicContact CB-CB 4.03Å; L116-D289 HydrophobicContact CD1-CB 4.12Å; V117-D289 WeakPolarHBondContact CG1-O 3.44Å
290	S	81.9	Confident	86.5	Confident	24 Å²	24	48.5 Å²	48.5	17%	0.168	23%	0.23	C	C	.	.	S	Bend	trans	-122.2	157.5	176	74	0	0	0	0	110.8	E292 D293 C294	S290-E292 VanDerWaalsContact C-N 3.34Å; S290-E292 WeakPolarHBondContact CB-OE2 3.18Å; S290-D293 WeakPolarHBondContact OG-CB 3.12Å; S290-D293 PolarHBondContact OG-N 3.47Å; S290-D293 PolarHBondContact OG-OD2 3.25Å; S290-C294 PolarHBondContact O-N 3.45Å; S290-C294 PolarHBondContact O-SG 2.88Å
291	L	86.4	Confident	87	Confident	33 Å²	33	44.1 Å²	44.1	17%	0.173	21%	0.21	C	C	.	.	H	α-helix	trans	-69.7	-40	176.1	174.7	60.8	0	0	0	109.9	L63 I85 V88 L119 L140 C294 L295	L63-L291 HydrophobicContact CD1-CD2 4.41Å; L63-L291 HydrophobicContact CD1-CG 4.48Å; L63-L291 HydrophobicContact CD2-CD2 4.02Å; I85-L291 HydrophobicContact CB-CD2 4.18Å; I85-L291 HydrophobicContact CG2-CD2 3.88Å; V88-L291 HydrophobicContact CG2-CD2 4.35Å; L119-L291 HydrophobicContact CD1-CD1 4.11Å; L140-L291 HydrophobicContact CD1-CD1 4.19Å; L291-C294 WeakPolarHBondContact O-CB 3.34Å; L291-C294 PolarHBondContact O-N 3.42Å; L291-L295 HydrophobicContact CD1-CD1 4.18Å; L291-L295 HydrophobicContact CD1-CG 4.16Å; L291-L295 HydrophobicContact CG-CD1 3.92Å; L291-L295 HydrophobicContact CG-CG 4.35Å; L291-L295 WeakPolarHBondContact O-CB 3.4Å; L291-L295 VanDerWaalsContact O-CG 3.31Å; L291-L295 WeakPolarHBondContact O-CG 3.42Å; L291-L295 PolarHBondContact O-N 3.48Å
292	E	88.2	Confident	87.3	Confident	61 Å²	61	43.6 Å²	43.6	29%	0.285	21%	0.208	S	C	.	.	H	α-helix	trans	-55.5	-52.6	177.8	-63.1	80.3	179.1	0	0	111	L63 V66 S290 C294 L295 I296	L63-E292 HydrophobicContact CB-CG 4.13Å; L63-E292 HydrophobicContact CD1-CG 3.99Å; V66-E292 HydrophobicContact CG2-CB 4.19Å; V66-E292 HydrophobicContact CG2-CG 4.4Å; S290-E292 VanDerWaalsContact C-N 3.34Å; S290-E292 WeakPolarHBondContact CB-OE2 3.18Å; E292-C294 VanDerWaalsContact C-N 3.33Å; E292-C294 PolarHBondContact O-N 3.21Å; E292-L295 PolarHBondContact O-N 3.05Å; E292-I296 VanDerWaalsContact O-CG1 3.29Å; E292-I296 WeakPolarHBondContact O-CG1 3.26Å; E292-I296 PolarHBondContact O-N 3.2Å
293	D	87.8	Confident	87.6	Confident	57 Å²	57	40.9 Å²	40.9	31%	0.305	20%	0.2	S	C	.	.	H	α-helix	trans	-65.6	-39.1	179.3	-68.1	-40.5	0	0	0	111.5	H288 S290 L295 I296 A297	H288-D293 HydrophobicContact CB-CB 3.98Å; H288-D293 WeakPolarHBondContact ND1-CB 3.41Å; S290-D293 WeakPolarHBondContact OG-CB 3.12Å; S290-D293 PolarHBondContact OG-N 3.47Å; S290-D293 PolarHBondContact OG-OD2 3.25Å; D293-L295 VanDerWaalsContact C-N 3.34Å; D293-L295 PolarHBondContact O-N 3.48Å; D293-I296 PolarHBondContact O-N 3.13Å; D293-A297 VanDerWaalsContact O-CB 3.3Å; D293-A297 WeakPolarHBondContact O-CB 3.49Å; D293-A297 PolarHBondContact O-N 3.05Å
294	C	90.3	Very high	87.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-42.7	175.2	-70.3	0	0	0	0	111.4	S115 L119 L140 L285 S290 L291 E292 A297 L298	S115-C294 VanDerWaalsContact CB-SG 3.57Å; L119-C294 HydrophobicContact CD1-CB 4.05Å; L140-C294 HydrophobicContact CD1-CB 4.01Å; L285-C294 HydrophobicContact CD2-CB 3.97Å; L285-C294 VanDerWaalsContact CD2-O 3.3Å; L285-C294 WeakPolarHBondContact CD2-O 3.44Å; S290-C294 PolarHBondContact O-N 3.45Å; S290-C294 PolarHBondContact O-SG 2.88Å; L291-C294 WeakPolarHBondContact O-CB 3.34Å; L291-C294 PolarHBondContact O-N 3.42Å; E292-C294 VanDerWaalsContact C-N 3.33Å; E292-C294 PolarHBondContact O-N 3.21Å; C294-A297 PolarHBondContact O-N 2.78Å; C294-L298 WeakPolarHBondContact O-CB 3.16Å; C294-L298 PolarHBondContact O-N 3.49Å
295	L	92.5	Very high	87.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.3	-44.1	177.3	-75.6	170.4	0	0	0	111.7	L63 V66 L67 I70 V88 L90 L140 L291 E292 D293 A297 L298 H299	L63-L295 HydrophobicContact CD1-CD1 3.62Å; V66-L295 HydrophobicContact CG1-CB 4.08Å; L67-L295 HydrophobicContact CD2-CD1 4.16Å; I70-L295 HydrophobicContact CD1-CB 3.95Å; V88-L295 HydrophobicContact CB-CD2 4.02Å; V88-L295 HydrophobicContact CG1-CD1 4.35Å; V88-L295 HydrophobicContact CG1-CD2 3.61Å; V88-L295 HydrophobicContact CG2-CD1 4.43Å; L90-L295 HydrophobicContact CD2-CD2 4.03Å; L140-L295 HydrophobicContact CD1-CD2 3.82Å; L140-L295 HydrophobicContact CD1-CG 4.14Å; L291-L295 HydrophobicContact CD1-CD1 4.18Å; L291-L295 HydrophobicContact CD1-CG 4.16Å; L291-L295 HydrophobicContact CG-CD1 3.92Å; L291-L295 HydrophobicContact CG-CG 4.35Å; L291-L295 WeakPolarHBondContact O-CB 3.4Å; L291-L295 VanDerWaalsContact O-CG 3.31Å; L291-L295 WeakPolarHBondContact O-CG 3.42Å; L291-L295 PolarHBondContact O-N 3.48Å; E292-L295 PolarHBondContact O-N 3.05Å; D293-L295 VanDerWaalsContact C-N 3.34Å; D293-L295 PolarHBondContact O-N 3.48Å; L295-A297 PolarHBondContact O-N 2.96Å; L295-L298 PolarHBondContact O-N 3.09Å; L295-H299 WeakPolarHBondContact O-CB 3.44Å; L295-H299 PolarHBondContact O-N 2.68Å
296	I	91.6	Very high	87.3	Confident	48 Å²	48	43.6 Å²	43.6	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-45.6	176	-68.5	167.1	0	0	0	110.7	V66 E292 D293 K300	V66-I296 HydrophobicContact CG1-CD1 4.35Å; V66-I296 HydrophobicContact CG1-CG1 3.75Å; V66-I296 HydrophobicContact CG2-CD1 4.03Å; V66-I296 HydrophobicContact CG2-CG1 4.34Å; E292-I296 VanDerWaalsContact O-CG1 3.29Å; E292-I296 WeakPolarHBondContact O-CG1 3.26Å; E292-I296 PolarHBondContact O-N 3.2Å; D293-I296 PolarHBondContact O-N 3.13Å; I296-K300 HydrophobicContact CG2-CD 4.15Å; I296-K300 VanDerWaalsContact O-CG 3.3Å; I296-K300 WeakPolarHBondContact O-CG 3.27Å; I296-K300 PolarHBondContact O-N 2.8Å
297	A	91.4	Very high	87.1	Confident	12 Å²	12	43.7 Å²	43.7	10%	0.099	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-45.8	178.4	0	0	0	0	0	111.4	L285 D293 C294 L295 K300 E301	L285-A297 HydrophobicContact CD2-CB 3.99Å; D293-A297 VanDerWaalsContact O-CB 3.3Å; D293-A297 WeakPolarHBondContact O-CB 3.49Å; D293-A297 PolarHBondContact O-N 3.05Å; C294-A297 PolarHBondContact O-N 2.78Å; L295-A297 PolarHBondContact O-N 2.96Å; A297-K300 PolarHBondContact O-N 3.5Å; A297-E301 WeakPolarHBondContact O-CG 3.29Å; A297-E301 PolarHBondContact O-N 3.42Å
298	L	92.3	Very high	87.1	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-44.7	178.7	-176.8	59.3	0	0	0	112.2	L90 I121 F138 L140 I281 L285 C294 L295 K300 E301 A302	L90-L298 HydrophobicContact CD2-CD2 4.03Å; L90-L298 HydrophobicContact CD2-CG 4.47Å; I121-L298 HydrophobicContact CD1-CD1 3.65Å; I121-L298 HydrophobicContact CD1-CD2 4.13Å; F138-L298 HydrophobicContact CB-CD1 4.02Å; F138-L298 HydrophobicContact CB-CD2 3.69Å; F138-L298 HydrophobicContact CB-CG 4.12Å; F138-L298 HydrophobicContact CD1-CD1 3.84Å; F138-L298 HydrophobicContact CD2-CD1 3.87Å; F138-L298 HydrophobicContact CD2-CG 4.2Å; F138-L298 HydrophobicContact CE1-CD1 4.21Å; F138-L298 HydrophobicContact CE2-CD1 4.22Å; F138-L298 HydrophobicContact CG-CD1 3.63Å; F138-L298 HydrophobicContact CG-CD2 4.24Å; F138-L298 HydrophobicContact CG-CG 4.14Å; F138-L298 HydrophobicContact CZ-CD1 4.35Å; L140-L298 HydrophobicContact CD1-CD2 3.96Å; L140-L298 HydrophobicContact CD2-CD2 4.34Å; L140-L298 HydrophobicContact CG-CD2 3.87Å; I281-L298 HydrophobicContact CG2-CD1 4.12Å; L285-L298 HydrophobicContact CD2-CB 4.45Å; C294-L298 WeakPolarHBondContact O-CB 3.16Å; C294-L298 PolarHBondContact O-N 3.49Å; L295-L298 PolarHBondContact O-N 3.09Å; L298-K300 PolarHBondContact O-N 3.14Å; L298-E301 PolarHBondContact O-N 3.33Å; L298-A302 WeakPolarHBondContact O-CB 3.48Å; L298-A302 PolarHBondContact O-N 3.46Å
299	H	92.4	Very high	86.8	Confident	23 Å²	23	42.9 Å²	42.9	11%	0.106	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-42.7	175.3	169.8	71.2	0	0	0	111.9	I70 D73 H92 L295 E301 A302 K303	I70-H299 HydrophobicContact CD1-CB 4.13Å; I70-H299 HydrophobicContact CG1-CB 3.95Å; D73-H299 IonicContact OD1-CE1 3.55Å; D73-H299 PolarHBondContact OD1-CE1 3.38Å; D73-H299 IonicContact OD1-ND1 3.96Å; D73-H299 IonicContact OD2-CE1 3.26Å; H92-H299 AromaticContact CE1-CE1 3.31Å; H92-H299 PolarHBondContact CE1-CE1 3.4Å; H92-H299 AromaticContact CE1-ND1 3.21Å; H92-H299 PolarHBondContact CE1-ND1 2.97Å; H92-H299 AromaticContact NE2-CE1 3.69Å; H92-H299 AromaticContact NE2-ND1 3.06Å; H92-H299 PolarHBondContact NE2-ND1 2.9Å; L295-H299 WeakPolarHBondContact O-CB 3.44Å; L295-H299 PolarHBondContact O-N 2.68Å; H299-E301 PolarHBondContact O-N 3.08Å; H299-A302 PolarHBondContact O-N 3.01Å; H299-K303 WeakPolarHBondContact O-CB 3.23Å; H299-K303 PolarHBondContact O-N 3.4Å
300	K	91.3	Very high	86.5	Confident	114 Å²	114	46 Å²	46	50%	0.496	22%	0.219	S	C	.	.	H	α-helix	trans	-61.8	-43.1	173.9	-74.5	170.9	-178.6	173.3	0	112.2	I296 A297 L298 K303 R304	I296-K300 HydrophobicContact CG2-CD 4.15Å; I296-K300 VanDerWaalsContact O-CG 3.3Å; I296-K300 WeakPolarHBondContact O-CG 3.27Å; I296-K300 PolarHBondContact O-N 2.8Å; A297-K300 PolarHBondContact O-N 3.5Å; L298-K300 PolarHBondContact O-N 3.14Å; K300-K303 PolarHBondContact O-N 2.83Å; K300-R304 WeakPolarHBondContact O-CB 3.42Å; K300-R304 VanDerWaalsContact O-CG 3.26Å; K300-R304 WeakPolarHBondContact O-CG 3.35Å; K300-R304 PolarHBondContact O-N 2.75Å
301	E	89.6	Confident	86	Confident	35 Å²	35	50 Å²	50	16%	0.164	24%	0.238	C	C	.	.	H	α-helix	trans	-66.1	-40.3	177.3	-72.6	-55.7	125.5	0	0	112.3	A284 A297 L298 H299 K303 R304 S305	A284-E301 HydrophobicContact CB-CG 3.8Å; A297-E301 WeakPolarHBondContact O-CG 3.29Å; A297-E301 PolarHBondContact O-N 3.42Å; L298-E301 PolarHBondContact O-N 3.33Å; H299-E301 PolarHBondContact O-N 3.08Å; E301-K303 PolarHBondContact O-N 3.21Å; E301-R304 PolarHBondContact O-N 3.46Å; E301-R304 IonicContact OE1-CZ 3.05Å; E301-R304 IonicContact OE1-NE 3.98Å; E301-R304 IonicContact OE1-NH1 2.58Å; E301-R304 PolarHBondContact OE1-NH1 3.48Å; E301-S305 PolarHBondContact O-N 3.19Å
302	A	89.4	Confident	85.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.5	-49.1	174.6	0	0	0	0	0	111.2	H92 F138 L298 H299 R304 S305 C306	H92-A302 VanDerWaalsContact CD2-CB 3.49Å; H92-A302 WeakPolarHBondContact CD2-CB 3.22Å; F138-A302 HydrophobicContact CD2-CB 4.28Å; F138-A302 HydrophobicContact CE2-CB 3.71Å; L298-A302 WeakPolarHBondContact O-CB 3.48Å; L298-A302 PolarHBondContact O-N 3.46Å; H299-A302 PolarHBondContact O-N 3.01Å; A302-R304 PolarHBondContact O-N 3.13Å; A302-S305 WeakPolarHBondContact O-CB 3.28Å; A302-S305 PolarHBondContact O-N 2.8Å; A302-C306 PolarHBondContact O-N 3.26Å; A302-C306 VanDerWaalsContact O-N 3.08Å; A302-C306 PolarHBondContact O-SG 3.45Å
303	K	87.9	Confident	84.1	Confident	92 Å²	92	47.2 Å²	47.2	40%	0.4	23%	0.227	S	C	.	.	H	α-helix	trans	-61.8	-42.1	177.3	-165.9	166.3	-165	142.4	0	112.9	D73 H299 K300 E301 S305 C306 N307	D73-K303 IonicContact OD2-NZ 3.58Å; D73-K303 PolarHBondContact OD2-NZ 3Å; H299-K303 WeakPolarHBondContact O-CB 3.23Å; H299-K303 PolarHBondContact O-N 3.4Å; K300-K303 PolarHBondContact O-N 2.83Å; E301-K303 PolarHBondContact O-N 3.21Å; K303-S305 VanDerWaalsContact C-N 3.33Å; K303-S305 PolarHBondContact O-N 3.08Å; K303-C306 PolarHBondContact O-N 3.31Å; K303-N307 VanDerWaalsContact O-CG 3.26Å; K303-N307 PolarHBondContact O-N 2.96Å
304	R	86.8	Confident	82.9	Confident	155 Å²	155	47.4 Å²	47.4	59%	0.585	23%	0.233	S	C	*	.	H	α-helix	trans	-58.7	-44.1	174	-76.3	170.7	-179.2	-178.4	-2.4	111.7	K300 E301 A302 N307 F308	K300-R304 WeakPolarHBondContact O-CB 3.42Å; K300-R304 VanDerWaalsContact O-CG 3.26Å; K300-R304 WeakPolarHBondContact O-CG 3.35Å; K300-R304 PolarHBondContact O-N 2.75Å; E301-R304 PolarHBondContact O-N 3.46Å; E301-R304 IonicContact OE1-CZ 3.05Å; E301-R304 IonicContact OE1-NE 3.98Å; E301-R304 IonicContact OE1-NH1 2.58Å; E301-R304 PolarHBondContact OE1-NH1 3.48Å; A302-R304 PolarHBondContact O-N 3.13Å; R304-N307 PolarHBondContact O-N 3.23Å; R304-F308 WeakPolarHBondContact O-CB 3.41Å; R304-F308 PolarHBondContact O-N 2.69Å
305	S	84.3	Confident	81.5	Confident	28 Å²	28	55.3 Å²	55.3	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-61.6	-43.6	177.9	179	0	0	0	0	112.2	E301 A302 K303 F308 L309	E301-S305 PolarHBondContact O-N 3.19Å; A302-S305 WeakPolarHBondContact O-CB 3.28Å; A302-S305 PolarHBondContact O-N 2.8Å; K303-S305 VanDerWaalsContact C-N 3.33Å; K303-S305 PolarHBondContact O-N 3.08Å; S305-F308 PolarHBondContact O-N 3.41Å; S305-L309 PolarHBondContact O-N 3.34Å
306	C	82.3	Confident	80	Confident	8 Å²	8	61.5 Å²	61.5	5%	0.054	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-46.8	176.1	-66.4	0	0	0	0	112.2	E94 A302 K303 F308 L309 Q310	E94-C306 HydrophobicContact CB-CB 4.26Å; A302-C306 PolarHBondContact O-N 3.26Å; A302-C306 VanDerWaalsContact O-N 3.08Å; A302-C306 PolarHBondContact O-SG 3.45Å; K303-C306 PolarHBondContact O-N 3.31Å; C306-F308 VanDerWaalsContact C-N 3.31Å; C306-F308 PolarHBondContact O-N 3.48Å; C306-L309 PolarHBondContact O-N 3.13Å; C306-Q310 PolarHBondContact O-N 3.07Å
307	N	81	Confident	78.6	Confident	76 Å²	76	59.4 Å²	59.4	41%	0.406	28%	0.281	S	S	.	.	H	α-helix	trans	-61.9	-39.9	178.5	-69.2	-12.8	0	0	0	112.1	K303 R304 L309 Q310 N311	K303-N307 VanDerWaalsContact O-CG 3.26Å; K303-N307 PolarHBondContact O-N 2.96Å; R304-N307 PolarHBondContact O-N 3.23Å; N307-L309 VanDerWaalsContact C-N 3.33Å; N307-L309 PolarHBondContact O-N 3.48Å; N307-Q310 PolarHBondContact O-N 2.89Å; N307-N311 PolarHBondContact O-N 3.28Å; N307-N311 PolarHBondContact O-ND2 3.22Å
308	F	79.5	Confident	77.3	Confident	100 Å²	100	64.6 Å²	64.6	44%	0.439	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-40	178.6	-174.6	-108.2	0	0	0	112.1	R304 S305 C306 N311 E312	R304-F308 WeakPolarHBondContact O-CB 3.41Å; R304-F308 PolarHBondContact O-N 2.69Å; S305-F308 PolarHBondContact O-N 3.41Å; C306-F308 VanDerWaalsContact C-N 3.31Å; C306-F308 PolarHBondContact O-N 3.48Å; F308-N311 PolarHBondContact O-N 3.24Å; F308-E312 HydrophobicContact CD1-CG 4.05Å; F308-E312 HydrophobicContact CD2-CG 4.47Å; F308-E312 HydrophobicContact CE1-CG 3.65Å; F308-E312 WeakPolarHBondContact CE1-OE1 3.32Å; F308-E312 WeakPolarHBondContact CE1-OE2 3.49Å; F308-E312 HydrophobicContact CE2-CG 4.09Å; F308-E312 HydrophobicContact CG-CG 4.45Å; F308-E312 HydrophobicContact CZ-CG 3.67Å; F308-E312 WeakPolarHBondContact CZ-OE1 3.46Å; F308-E312 WeakPolarHBondContact O-CG 3.37Å; F308-E312 PolarHBondContact O-N 3.03Å
309	L	76.6	Confident	76.2	Confident	23 Å²	23	72.1 Å²	72.1	12%	0.12	34%	0.339	C	S	.	.	H	α-helix	trans	-61.9	-43.5	176.4	174.8	58.9	0	0	0	112.2	L98 S305 C306 N307 N311 E312 G313 L426	L98-L309 HydrophobicContact CD1-CD2 3.5Å; L98-L309 VanDerWaalsContact CD1-CD2 3.5Å; L98-L309 HydrophobicContact CD2-CD2 3.82Å; L98-L309 HydrophobicContact CG-CD2 4.31Å; S305-L309 PolarHBondContact O-N 3.34Å; C306-L309 PolarHBondContact O-N 3.13Å; N307-L309 VanDerWaalsContact C-N 3.33Å; N307-L309 PolarHBondContact O-N 3.48Å; L309-N311 VanDerWaalsContact C-N 3.27Å; L309-N311 PolarHBondContact O-N 3.34Å; L309-E312 PolarHBondContact O-N 3.34Å; L309-G313 PolarHBondContact O-N 3.35Å; L309-L426 HydrophobicContact CD2-CD1 3.49Å; L309-L426 VanDerWaalsContact CD2-CD1 3.49Å; L309-L426 HydrophobicContact CG-CD1 4.24Å
310	Q	72.3	Confident	75.5	Confident	76 Å²	76	77.8 Å²	77.8	36%	0.355	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-37.6	176.8	-68.6	178.5	-11.1	0	0	112	C306 N307 S314	C306-Q310 PolarHBondContact O-N 3.07Å; N307-Q310 PolarHBondContact O-N 2.89Å; Q310-S314 PolarHBondContact O-OG 3.26Å
311	N	71.8	Confident	75.1	Confident	107 Å²	107	74.8 Å²	74.8	57%	0.572	35%	0.352	S	S	*	.	H	α-helix	trans	-74.7	-36.7	178.4	-68.5	-25.5	0	0	0	113	N307 F308 L309 F315	N307-N311 PolarHBondContact O-N 3.28Å; N307-N311 PolarHBondContact O-ND2 3.22Å; F308-N311 PolarHBondContact O-N 3.24Å; L309-N311 VanDerWaalsContact C-N 3.27Å; L309-N311 PolarHBondContact O-N 3.34Å; N311-F315 WeakPolarHBondContact O-CD2 3.19Å
312	E	72.4	Confident	75	Confident	26 Å²	26	84.8 Å²	84.8	12%	0.121	39%	0.388	C	S	.	.	H	α-helix	trans	-71.6	-38.9	-177.1	-77.7	-161.7	131.5	0	0	114	R132 R134 F308 L309 S314 F315	R132-E312 IonicContact CZ-OE1 3.31Å; R132-E312 IonicContact CZ-OE2 2.68Å; R132-E312 VanDerWaalsContact CZ-OE2 3.32Å; R132-E312 IonicContact NE-OE2 3.53Å; R132-E312 VanDerWaalsContact NH1-CD 3.3Å; R132-E312 IonicContact NH1-OE1 3.87Å; R132-E312 PolarHBondContact NH1-OE1 3.37Å; R132-E312 IonicContact NH1-OE2 2.82Å; R132-E312 PolarHBondContact NH1-OE2 2.95Å; R132-E312 VanDerWaalsContact NH1-OE2 3.14Å; R132-E312 IonicContact NH2-OE1 2.96Å; R132-E312 PolarHBondContact NH2-OE1 3.04Å; R132-E312 IonicContact NH2-OE2 2.75Å; R134-E312 IonicContact CZ-OE2 3.74Å; R134-E312 IonicContact NH1-OE2 2.75Å; R134-E312 PolarHBondContact NH1-OE2 3.01Å; R134-E312 IonicContact NH2-OE2 2.76Å; R134-E312 PolarHBondContact NH2-OE2 3.36Å; F308-E312 HydrophobicContact CD1-CG 4.05Å; F308-E312 HydrophobicContact CD2-CG 4.47Å; F308-E312 HydrophobicContact CE1-CG 3.65Å; F308-E312 WeakPolarHBondContact CE1-OE1 3.32Å; F308-E312 WeakPolarHBondContact CE1-OE2 3.49Å; F308-E312 HydrophobicContact CE2-CG 4.09Å; F308-E312 HydrophobicContact CG-CG 4.45Å; F308-E312 HydrophobicContact CZ-CG 3.67Å; F308-E312 WeakPolarHBondContact CZ-OE1 3.46Å; F308-E312 WeakPolarHBondContact O-CG 3.37Å; F308-E312 PolarHBondContact O-N 3.03Å; L309-E312 PolarHBondContact O-N 3.34Å; E312-S314 VanDerWaalsContact C-N 3.25Å; E312-S314 PolarHBondContact O-N 3.4Å; E312-F315 PolarHBondContact O-N 3.03Å
313	G	62.8	Low	75	Confident	10 Å²	10	85.8 Å²	85.8	10%	0.103	39%	0.392	C	S	.	.	H	α-helix	trans	-59.1	-39.4	-177.2	0	0	0	0	0	112.4	L309 F315	L309-G313 PolarHBondContact O-N 3.35Å; G313-F315 PolarHBondContact O-N 2.86Å
314	S	61.5	Low	75.1	Confident	62 Å²	62	88.3 Å²	88.3	43%	0.434	41%	0.411	S	S	.	.	H	α-helix	trans	-65.9	-35.3	-175.3	-56.2	0	0	0	0	113.7	Q310 E312 L318	Q310-S314 PolarHBondContact O-OG 3.26Å; E312-S314 VanDerWaalsContact C-N 3.25Å; E312-S314 PolarHBondContact O-N 3.4Å; S314-L318 WeakPolarHBondContact O-CD1 3.29Å; S314-L318 VanDerWaalsContact O-CG 3.22Å; S314-L318 WeakPolarHBondContact O-CG 3.33Å
315	F	61.3	Low	75.3	Confident	166 Å²	166	82.9 Å²	82.9	73%	0.728	40%	0.395	S	S	*	.	H	α-helix	trans	-85.4	-34.9	-174.1	-79.6	-78.5	0	0	0	114.4	N311 E312 G313	N311-F315 WeakPolarHBondContact O-CD2 3.19Å; E312-F315 PolarHBondContact O-N 3.03Å; G313-F315 PolarHBondContact O-N 2.86Å
316	R	60.6	Low	75.6	Confident	130 Å²	130	85.7 Å²	85.7	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-84.1	-38.2	-172.1	-69.2	-170.8	175.6	-161	-2.2	112.7	L318	R316-L318 VanDerWaalsContact C-N 3.3Å; R316-L318 PolarHBondContact O-N 3.03Å
317	L	63.3	Low	76.1	Confident	4 Å²	4	93.4 Å²	93.4	2%	0.021	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-5.4	-170.9	-61.4	172.6	0	0	0	114.2	L130 T337 R419 N422 L423	L130-L317 HydrophobicContact CD2-CD2 4.11Å; L317-T337 HydrophobicContact CD2-CG2 4.09Å; L317-R419 HydrophobicContact CD2-CG 4.22Å; L317-R419 WeakPolarHBondContact O-CD 3.48Å; L317-R419 PolarHBondContact O-NH1 3.49Å; L317-N422 HydrophobicContact CD1-CB 3.45Å; L317-N422 VanDerWaalsContact CD1-CB 3.45Å; L317-L423 HydrophobicContact CB-CD1 4.31Å; L317-L423 HydrophobicContact CB-CD2 3.99Å; L317-L423 HydrophobicContact CB-CG 4.18Å; L317-L423 HydrophobicContact CD1-CD2 3.93Å; L317-L423 HydrophobicContact CD1-CG 3.89Å
318	L	63.3	Low	76.6	Confident	120 Å²	120	97 Å²	97	63%	0.628	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-19.4	179	-67.4	175.6	0	0	0	113.7	S314 R316 H320	S314-L318 WeakPolarHBondContact O-CD1 3.29Å; S314-L318 VanDerWaalsContact O-CG 3.22Å; S314-L318 WeakPolarHBondContact O-CG 3.33Å; R316-L318 VanDerWaalsContact C-N 3.3Å; R316-L318 PolarHBondContact O-N 3.03Å; L318-H320 PolarHBondContact O-N 3.21Å; L318-H320 PolarHBondContact O-ND1 3.32Å
319	K	69.8	Low	77.3	Confident	160 Å²	160	92.6 Å²	92.6	70%	0.696	44%	0.436	S	S	*	.			trans	-82.5	112.8	-176.4	-67.5	-172.4	-179.6	-176.7	0	110.4	R419	K319-R419 PolarHBondContact O-NH1 3.02Å; K319-R419 PolarHBondContact O-NH2 2.68Å
320	H	77.1	Confident	78.1	Confident	142 Å²	142	94.2 Å²	94.2	66%	0.657	44%	0.442	S	S	*	.			trans	-73.9	138.5	170.5	-70.2	74.1	0	0	0	110	L318 N334	L318-H320 PolarHBondContact O-N 3.21Å; L318-H320 PolarHBondContact O-ND1 3.32Å; H320-N334 WeakPolarHBondContact CA-OD1 3.43Å
321	K	83.9	Confident	79.1	Confident	50 Å²	50	96.5 Å²	96.5	22%	0.217	45%	0.453	C	S	.	.			trans	-99.5	150.8	179.6	-73.1	-178.8	178.4	178.1	0	109.9	F323 H330 N334 D338 D342	K321-F323 HydrophobicContact CB-CD2 4.35Å; K321-F323 HydrophobicContact CB-CE1 4.27Å; K321-F323 HydrophobicContact CB-CE2 3.62Å; K321-F323 HydrophobicContact CB-CZ 3.56Å; K321-F323 HydrophobicContact CD-CE1 4.43Å; K321-F323 HydrophobicContact CD-CZ 3.87Å; K321-F323 HydrophobicContact CG-CZ 4.36Å; K321-H330 PolarHBondContact O-CE1 2.94Å; K321-N334 PolarHBondContact N-OD1 3.26Å; K321-N334 PolarHBondContact O-ND2 2.73Å; K321-N334 PolarHBondContact O-OD1 3.43Å; K321-D338 PolarHBondContact NZ-O 3.46Å; K321-D338 VanDerWaalsContact NZ-O 3.15Å; K321-D342 IonicContact NZ-OD1 2.84Å; K321-D342 PolarHBondContact NZ-OD1 3.35Å; K321-D342 IonicContact NZ-OD2 3.42Å; K321-D342 PolarHBondContact NZ-OD2 3.15Å
322	R	86.7	Confident	80.1	Confident	245 Å²	245	92.1 Å²	92.1	93%	0.925	43%	0.429	S	S	*	.			trans	-94.2	114.4	172.8	-69.1	-173.4	-179	176.3	-0.1	109.3
323	F	90.2	Very high	81.2	Confident	21 Å²	21	90.9 Å²	90.9	9%	0.092	42%	0.423	C	S	.	.			trans	-109.7	138.6	174.2	-58.7	-72.9	0	0	0	109.6	K321 V325 H330 L333 Y345	K321-F323 HydrophobicContact CB-CD2 4.35Å; K321-F323 HydrophobicContact CB-CE1 4.27Å; K321-F323 HydrophobicContact CB-CE2 3.62Å; K321-F323 HydrophobicContact CB-CZ 3.56Å; K321-F323 HydrophobicContact CD-CE1 4.43Å; K321-F323 HydrophobicContact CD-CZ 3.87Å; K321-F323 HydrophobicContact CG-CZ 4.36Å; F323-V325 HydrophobicContact CB-CG2 3.86Å; F323-V325 PolarHBondContact O-N 3.17Å; F323-H330 PolarHBondContact O-ND1 2.89Å; F323-L333 HydrophobicContact CB-CD1 4.1Å; F323-L333 HydrophobicContact CD1-CD1 4.16Å; F323-L333 HydrophobicContact CD2-CB 3.73Å; F323-L333 HydrophobicContact CD2-CD1 3.9Å; F323-L333 HydrophobicContact CD2-CG 4.49Å; F323-L333 HydrophobicContact CE2-CB 3.63Å; F323-L333 HydrophobicContact CE2-CD1 4.37Å; F323-L333 HydrophobicContact CG-CB 4.45Å; F323-L333 HydrophobicContact CG-CD1 3.79Å; F323-L333 HydrophobicContact CZ-CB 4.28Å; F323-Y345 HydrophobicContact CB-CD2 4.17Å; F323-Y345 HydrophobicContact CB-CE2 4.17Å; F323-Y345 HydrophobicContact CD1-CD1 4.03Å; F323-Y345 AromaticContact CD1-CD2 3.7Å; F323-Y345 HydrophobicContact CD1-CD2 3.7Å; F323-Y345 HydrophobicContact CD1-CE1 4.47Å; F323-Y345 HydrophobicContact CD1-CE2 4.2Å; F323-Y345 AromaticContact CD1-CG 3.61Å; F323-Y345 HydrophobicContact CD1-CG 3.61Å; F323-Y345 HydrophobicContact CE1-CD1 4.39Å; F323-Y345 HydrophobicContact CE1-CG 4.06Å; F323-Y345 HydrophobicContact CG-CD2 4.28Å
324	N	90.7	Very high	82.6	Confident	146 Å²	146	91 Å²	91	78%	0.781	42%	0.421	S	S	*	.	S	Bend	trans	-86.2	76.1	175.1	-172.3	32.6	0	0	0	110.2
325	V	89.9	Confident	84	Confident	41 Å²	41	92.8 Å²	92.8	25%	0.248	42%	0.423	C	S	.	.	S	Bend	trans	-145.8	173.8	-178.3	-64.2	0	0	0	0	109.7	F323 L329 H330 L333 Y345	F323-V325 HydrophobicContact CB-CG2 3.86Å; F323-V325 PolarHBondContact O-N 3.17Å; V325-L329 HydrophobicContact CB-CB 4.25Å; V325-L329 HydrophobicContact CB-CD2 3.85Å; V325-L329 HydrophobicContact CB-CG 4.11Å; V325-L329 HydrophobicContact CG1-CD2 3.81Å; V325-L329 HydrophobicContact CG1-CG 4.37Å; V325-L329 HydrophobicContact CG2-CB 4.06Å; V325-L329 HydrophobicContact CG2-CD2 4.27Å; V325-L329 HydrophobicContact CG2-CG 3.97Å; V325-H330 HydrophobicContact CG2-CB 3.89Å; V325-L333 HydrophobicContact CG2-CD1 4.21Å; V325-Y345 HydrophobicContact CG1-CD2 4.05Å; V325-Y345 HydrophobicContact CG1-CE2 3.78Å
326	D	90.6	Very high	85.5	Confident	86 Å²	86	85 Å²	85	46%	0.46	39%	0.389	S	S	.	.			trans	-61.7	159.8	172.6	69.2	93.2	0	0	0	112.6	K328 L329 H330	D326-K328 VanDerWaalsContact C-N 3.34Å; D326-K328 PolarHBondContact O-N 2.9Å; D326-K328 WeakPolarHBondContact OD1-CB 3.39Å; D326-K328 PolarHBondContact OD1-N 3.11Å; D326-K328 VanDerWaalsContact OD1-N 3.15Å; D326-L329 PolarHBondContact O-N 2.71Å; D326-L329 PolarHBondContact OD1-N 2.78Å; D326-L329 WeakPolarHBondContact OD2-CB 3.31Å; D326-H330 VanDerWaalsContact O-CB 3.29Å; D326-H330 WeakPolarHBondContact O-CB 3.46Å; D326-H330 PolarHBondContact O-N 2.75Å
327	E	93.2	Very high	86.9	Confident	170 Å²	170	78.8 Å²	78.8	79%	0.794	37%	0.365	S	S	*	.	H	α-helix	trans	-59.1	-40.5	-173.9	-172.9	174.9	-167.2	0	0	113.3	H330 E331	E327-H330 WeakPolarHBondContact O-CB 3.4Å; E327-H330 PolarHBondContact O-N 2.89Å; E327-E331 PolarHBondContact O-N 3.16Å
328	K	92.2	Very high	88.1	Confident	152 Å²	152	80.5 Å²	80.5	66%	0.661	37%	0.374	S	S	*	.	H	α-helix	trans	-68.8	-43.7	-178.8	-65.8	-177.2	177.7	-179.8	0	111.2	D326 H330 E331 F332 F402	D326-K328 VanDerWaalsContact C-N 3.34Å; D326-K328 PolarHBondContact O-N 2.9Å; D326-K328 WeakPolarHBondContact OD1-CB 3.39Å; D326-K328 PolarHBondContact OD1-N 3.11Å; D326-K328 VanDerWaalsContact OD1-N 3.15Å; K328-H330 VanDerWaalsContact C-N 3.32Å; K328-E331 PolarHBondContact O-N 2.97Å; K328-F332 PolarHBondContact O-N 3.23Å; K328-F402 HydrophobicContact CB-CE1 3.84Å; K328-F402 HydrophobicContact CB-CZ 4.38Å; K328-F402 HydrophobicContact CD-CE1 4.41Å
329	L	92.6	Very high	89.4	Confident	8 Å²	8	77 Å²	77	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-67.2	-36.5	175.4	-178.1	55.8	0	0	0	111.4	V325 D326 F332 L333 I348 I398 F402	V325-L329 HydrophobicContact CB-CB 4.25Å; V325-L329 HydrophobicContact CB-CD2 3.85Å; V325-L329 HydrophobicContact CB-CG 4.11Å; V325-L329 HydrophobicContact CG1-CD2 3.81Å; V325-L329 HydrophobicContact CG1-CG 4.37Å; V325-L329 HydrophobicContact CG2-CB 4.06Å; V325-L329 HydrophobicContact CG2-CD2 4.27Å; V325-L329 HydrophobicContact CG2-CG 3.97Å; D326-L329 PolarHBondContact O-N 2.71Å; D326-L329 PolarHBondContact OD1-N 2.78Å; D326-L329 WeakPolarHBondContact OD2-CB 3.31Å; L329-F332 HydrophobicContact CD1-CD1 4.07Å; L329-F332 PolarHBondContact O-N 3.18Å; L329-L333 HydrophobicContact CD1-CD1 4.36Å; L329-L333 HydrophobicContact CD1-CG 4.13Å; L329-L333 HydrophobicContact CG-CD1 4.14Å; L329-L333 HydrophobicContact CG-CG 4.39Å; L329-L333 WeakPolarHBondContact O-CB 3.49Å; L329-L333 VanDerWaalsContact O-CG 3.29Å; L329-L333 WeakPolarHBondContact O-CG 3.36Å; L329-L333 PolarHBondContact O-N 3.44Å; L329-I348 HydrophobicContact CD1-CD1 3.94Å; L329-I348 HydrophobicContact CD2-CD1 4.07Å; L329-I348 HydrophobicContact CD2-CG2 4.15Å; L329-I398 HydrophobicContact CD1-CD1 4.27Å; L329-I398 HydrophobicContact CD1-CG2 4.1Å; L329-F402 HydrophobicContact CD1-CE2 4.1Å
330	H	93.7	Very high	90.5	Very high	57 Å²	57	69.4 Å²	69.4	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-61.2	-45	175.4	-174.3	90.9	0	0	0	111.9	K321 F323 V325 D326 E327 K328 N334	K321-H330 PolarHBondContact O-CE1 2.94Å; F323-H330 PolarHBondContact O-ND1 2.89Å; V325-H330 HydrophobicContact CG2-CB 3.89Å; D326-H330 VanDerWaalsContact O-CB 3.29Å; D326-H330 WeakPolarHBondContact O-CB 3.46Å; D326-H330 PolarHBondContact O-N 2.75Å; E327-H330 WeakPolarHBondContact O-CB 3.4Å; E327-H330 PolarHBondContact O-N 2.89Å; K328-H330 VanDerWaalsContact C-N 3.32Å; H330-N334 PolarHBondContact CD2-ND2 3.46Å; H330-N334 VanDerWaalsContact CD2-ND2 3.29Å; H330-N334 PolarHBondContact NE2-ND2 2.95Å; H330-N334 PolarHBondContact O-N 3.48Å; H330-N334 VanDerWaalsContact O-N 3.15Å; H330-N334 PolarHBondContact O-ND2 2.79Å
331	E	92.8	Very high	91.3	Very high	123 Å²	123	62.7 Å²	62.7	58%	0.575	29%	0.289	S	S	*	.	H	α-helix	trans	-61.9	-48.9	175.8	-171.8	-179.3	178.8	0	0	110.8	E327 K328 L333 N334 Q335	E327-E331 PolarHBondContact O-N 3.16Å; K328-E331 PolarHBondContact O-N 2.97Å; E331-L333 PolarHBondContact O-N 2.94Å; E331-N334 PolarHBondContact O-N 3.34Å; E331-Q335 WeakPolarHBondContact O-CG 3.38Å; E331-Q335 PolarHBondContact O-N 3.4Å
332	F	93.7	Very high	91.7	Very high	15 Å²	15	63.4 Å²	63.4	7%	0.066	30%	0.295	C	S	.	.	H	α-helix	trans	-56.6	-48.8	177	170.5	-102.9	0	0	0	112.6	K328 L329 N334 Q335 L336 P393 I398 P411 C412	K328-F332 PolarHBondContact O-N 3.23Å; L329-F332 HydrophobicContact CD1-CD1 4.07Å; L329-F332 PolarHBondContact O-N 3.18Å; F332-N334 VanDerWaalsContact C-N 3.26Å; F332-N334 PolarHBondContact O-N 3.08Å; F332-Q335 WeakPolarHBondContact O-CB 3.21Å; F332-Q335 PolarHBondContact O-N 3.45Å; F332-L336 HydrophobicContact CE1-CD1 3.81Å; F332-L336 HydrophobicContact CE1-CG 4.44Å; F332-L336 HydrophobicContact CE2-CD2 4.37Å; F332-L336 HydrophobicContact CZ-CD1 3.93Å; F332-L336 HydrophobicContact CZ-CD2 4.14Å; F332-L336 HydrophobicContact CZ-CG 4.27Å; F332-P393 HydrophobicContact CE1-CB 4.26Å; F332-P393 HydrophobicContact CE1-CG 4.32Å; F332-P393 HydrophobicContact CZ-CB 4.05Å; F332-P393 HydrophobicContact CZ-CG 3.79Å; F332-I398 HydrophobicContact CD1-CD1 3.97Å; F332-I398 HydrophobicContact CE1-CD1 3.53Å; F332-I398 HydrophobicContact CZ-CD1 4.24Å; F332-P411 HydrophobicContact CD2-CG 4.12Å; F332-P411 HydrophobicContact CE1-CG 4.07Å; F332-P411 HydrophobicContact CE2-CG 3.62Å; F332-P411 HydrophobicContact CZ-CB 4.37Å; F332-P411 HydrophobicContact CZ-CG 3.59Å; F332-C412 HydrophobicContact CE2-CB 3.76Å; F332-C412 HydrophobicContact CZ-CB 3.91Å
333	L	94.6	Very high	92.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-35.8	-179.8	-72	172.3	0	0	0	111.9	F323 V325 L329 E331 Q335 L336 S341 T344 Y345	F323-L333 HydrophobicContact CB-CD1 4.1Å; F323-L333 HydrophobicContact CD1-CD1 4.16Å; F323-L333 HydrophobicContact CD2-CB 3.73Å; F323-L333 HydrophobicContact CD2-CD1 3.9Å; F323-L333 HydrophobicContact CD2-CG 4.49Å; F323-L333 HydrophobicContact CE2-CB 3.63Å; F323-L333 HydrophobicContact CE2-CD1 4.37Å; F323-L333 HydrophobicContact CG-CB 4.45Å; F323-L333 HydrophobicContact CG-CD1 3.79Å; F323-L333 HydrophobicContact CZ-CB 4.28Å; V325-L333 HydrophobicContact CG2-CD1 4.21Å; L329-L333 HydrophobicContact CD1-CD1 4.36Å; L329-L333 HydrophobicContact CD1-CG 4.13Å; L329-L333 HydrophobicContact CG-CD1 4.14Å; L329-L333 HydrophobicContact CG-CG 4.39Å; L329-L333 WeakPolarHBondContact O-CB 3.49Å; L329-L333 VanDerWaalsContact O-CG 3.29Å; L329-L333 WeakPolarHBondContact O-CG 3.36Å; L329-L333 PolarHBondContact O-N 3.44Å; E331-L333 PolarHBondContact O-N 2.94Å; L333-Q335 VanDerWaalsContact C-N 3.25Å; L333-Q335 PolarHBondContact O-N 3.18Å; L333-L336 HydrophobicContact CD2-CD1 4.37Å; L333-L336 WeakPolarHBondContact O-CB 3.32Å; L333-L336 PolarHBondContact O-N 3.19Å; L333-L336 VanDerWaalsContact O-N 3.15Å; L333-S341 VanDerWaalsContact O-CB 3.26Å; L333-S341 WeakPolarHBondContact O-CB 3.34Å; L333-T344 HydrophobicContact CD2-CG2 3.85Å; L333-Y345 HydrophobicContact CD1-CD2 4.11Å
334	N	92.3	Very high	92.3	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.07	26%	0.263	C	S	.	.	H	α-helix	trans	-73.2	-13.8	176.4	-83.1	-62.8	0	0	0	114.1	H320 K321 H330 E331 F332 L336 R419	H320-N334 WeakPolarHBondContact CA-OD1 3.43Å; K321-N334 PolarHBondContact N-OD1 3.26Å; K321-N334 PolarHBondContact O-ND2 2.73Å; K321-N334 PolarHBondContact O-OD1 3.43Å; H330-N334 PolarHBondContact CD2-ND2 3.46Å; H330-N334 VanDerWaalsContact CD2-ND2 3.29Å; H330-N334 PolarHBondContact NE2-ND2 2.95Å; H330-N334 PolarHBondContact O-N 3.48Å; H330-N334 VanDerWaalsContact O-N 3.15Å; H330-N334 PolarHBondContact O-ND2 2.79Å; E331-N334 PolarHBondContact O-N 3.34Å; F332-N334 VanDerWaalsContact C-N 3.26Å; F332-N334 PolarHBondContact O-N 3.08Å; N334-L336 VanDerWaalsContact C-N 3.3Å; N334-R419 VanDerWaalsContact O-CD 3.23Å; N334-R419 WeakPolarHBondContact O-CD 3.26Å; N334-R419 PolarHBondContact O-NE 3.48Å; N334-R419 PolarHBondContact O-NH1 3.32Å
335	Q	92.1	Very high	92.5	Very high	100 Å²	100	50 Å²	50	47%	0.467	24%	0.235	S	C	.	.	H	α-helix	trans	-79.1	-15	169.4	-63.9	173.1	13.8	0	0	112.4	E331 F332 L333 S418 R419	E331-Q335 WeakPolarHBondContact O-CG 3.38Å; E331-Q335 PolarHBondContact O-N 3.4Å; F332-Q335 WeakPolarHBondContact O-CB 3.21Å; F332-Q335 PolarHBondContact O-N 3.45Å; L333-Q335 VanDerWaalsContact C-N 3.25Å; L333-Q335 PolarHBondContact O-N 3.18Å; Q335-S418 CarbonylContact O-C 3.09Å; Q335-S418 WeakPolarHBondContact O-CA 3.07Å; Q335-R419 WeakPolarHBondContact O-CG 3.49Å; Q335-R419 PolarHBondContact O-N 3.17Å
336	L	92.7	Very high	92.7	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-89.4	155.1	179.5	-56.5	179.5	0	0	0	112.5	F332 L333 N334 A340 P393 C412 W417 R419	F332-L336 HydrophobicContact CE1-CD1 3.81Å; F332-L336 HydrophobicContact CE1-CG 4.44Å; F332-L336 HydrophobicContact CE2-CD2 4.37Å; F332-L336 HydrophobicContact CZ-CD1 3.93Å; F332-L336 HydrophobicContact CZ-CD2 4.14Å; F332-L336 HydrophobicContact CZ-CG 4.27Å; L333-L336 HydrophobicContact CD2-CD1 4.37Å; L333-L336 WeakPolarHBondContact O-CB 3.32Å; L333-L336 PolarHBondContact O-N 3.19Å; L333-L336 VanDerWaalsContact O-N 3.15Å; N334-L336 VanDerWaalsContact C-N 3.3Å; L336-A340 HydrophobicContact CB-CB 4.05Å; L336-A340 HydrophobicContact CD1-CB 4.41Å; L336-P393 HydrophobicContact CD1-CG 4.14Å; L336-C412 HydrophobicContact CD2-CB 3.97Å; L336-W417 CarbonylContact C-O 3.56Å; L336-W417 WeakPolarHBondContact CA-O 3.48Å; L336-W417 HydrophobicContact CD2-CB 4.45Å; L336-R419 VanDerWaalsContact C-CG 3.45Å; L336-R419 WeakPolarHBondContact O-CD 3.12Å; L336-R419 WeakPolarHBondContact O-CG 3.03Å; L336-R419 PolarHBondContact O-NE 3.21Å
337	T	90.4	Very high	92.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.228	C	C	.	.			trans	-56	157.6	169.4	60.2	0	0	0	0	111	L317 Y339 A340 S341 W417 N422	L317-T337 HydrophobicContact CD2-CG2 4.09Å; T337-Y339 PolarHBondContact O-N 2.72Å; T337-A340 PolarHBondContact O-N 3.13Å; T337-A340 VanDerWaalsContact O-N 3.16Å; T337-A340 VanDerWaalsContact OG1-CB 3.31Å; T337-A340 WeakPolarHBondContact OG1-CB 3.33Å; T337-A340 PolarHBondContact OG1-N 2.88Å; T337-S341 WeakPolarHBondContact O-CB 3.48Å; T337-S341 PolarHBondContact O-N 2.97Å; T337-S341 PolarHBondContact O-OG 3.25Å; T337-W417 PolarHBondContact N-O 3.35Å; T337-N422 WeakPolarHBondContact CG2-ND2 3.32Å
338	D	88.7	Confident	92.9	Very high	39 Å²	39	42.6 Å²	42.6	21%	0.209	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-37.9	-178.6	-72.4	-6.6	0	0	0	113.1	K321 S341 D342 R419	K321-D338 PolarHBondContact NZ-O 3.46Å; K321-D338 VanDerWaalsContact NZ-O 3.15Å; D338-S341 WeakPolarHBondContact CA-OG 3.43Å; D338-S341 PolarHBondContact O-OG 3.36Å; D338-D342 WeakPolarHBondContact O-CB 3.1Å; D338-D342 PolarHBondContact O-N 3.29Å; D338-R419 IonicContact OD1-CZ 3.02Å; D338-R419 IonicContact OD1-NH2 2.69Å; D338-R419 PolarHBondContact OD1-NH2 2.84Å
339	Y	89.6	Confident	92.8	Very high	48 Å²	48	38.7 Å²	38.7	19%	0.188	19%	0.189	C	C	.	.	H	α-helix	trans	-65.5	-52.7	175.6	174.2	-100.6	0	0	0	111.7	L131 T337 D342 K343 E390 L392 W417	L131-Y339 HydrophobicContact CD1-CD1 3.85Å; L131-Y339 HydrophobicContact CD1-CD2 3.52Å; L131-Y339 HydrophobicContact CD1-CE1 3.7Å; L131-Y339 HydrophobicContact CD1-CE2 3.34Å; L131-Y339 HydrophobicContact CD1-CG 3.78Å; L131-Y339 VanDerWaalsContact CD1-CZ 3.46Å; L131-Y339 HydrophobicContact CD2-CE1 4.39Å; L131-Y339 HydrophobicContact CG-CD1 4.13Å; L131-Y339 HydrophobicContact CG-CD2 4.4Å; L131-Y339 HydrophobicContact CG-CE1 4.29Å; L131-Y339 HydrophobicContact CG-CG 4.2Å; T337-Y339 PolarHBondContact O-N 2.72Å; Y339-D342 PolarHBondContact O-N 3.25Å; Y339-K343 HydrophobicContact CD2-CG 4.29Å; Y339-K343 HydrophobicContact CE1-CG 4.16Å; Y339-K343 HydrophobicContact CE2-CD 4.43Å; Y339-K343 HydrophobicContact CE2-CG 3.76Å; Y339-K343 WeakPolarHBondContact O-CB 3.42Å; Y339-K343 WeakPolarHBondContact O-CG 3.29Å; Y339-K343 PolarHBondContact O-N 3.37Å; Y339-K343 WeakPolarHBondContact OH-CE 3.19Å; Y339-E390 PolarHBondContact OH-OE2 3.1Å; Y339-L392 HydrophobicContact CE1-CD1 3.91Å; Y339-W417 HydrophobicContact CD1-CE3 4.37Å; Y339-W417 HydrophobicContact CD1-CH2 4.13Å; Y339-W417 AromaticContact CD1-CZ3 3.77Å; Y339-W417 HydrophobicContact CD1-CZ3 3.77Å; Y339-W417 HydrophobicContact CE1-CH2 4.14Å; Y339-W417 HydrophobicContact CE1-CZ3 4.25Å
340	A	93.5	Very high	92.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.3	-42.2	-175.8	0	0	0	0	0	111.8	L336 T337 K343 T344 L392 W417	L336-A340 HydrophobicContact CB-CB 4.05Å; L336-A340 HydrophobicContact CD1-CB 4.41Å; T337-A340 PolarHBondContact O-N 3.13Å; T337-A340 VanDerWaalsContact O-N 3.16Å; T337-A340 VanDerWaalsContact OG1-CB 3.31Å; T337-A340 WeakPolarHBondContact OG1-CB 3.33Å; T337-A340 PolarHBondContact OG1-N 2.88Å; A340-K343 PolarHBondContact O-N 3.17Å; A340-T344 WeakPolarHBondContact O-CB 3.44Å; A340-T344 PolarHBondContact O-N 2.95Å; A340-T344 PolarHBondContact O-OG1 3.19Å; A340-L392 HydrophobicContact CB-CD2 3.38Å; A340-W417 HydrophobicContact CB-CB 3.8Å; A340-W417 HydrophobicContact CB-CD2 4.13Å; A340-W417 HydrophobicContact CB-CE3 4.02Å; A340-W417 HydrophobicContact CB-CG 4.08Å
341	S	94	Very high	91.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.7	-48.5	176.4	55.2	0	0	0	0	112.1	L333 T337 D338 K343 T344 Y345	L333-S341 VanDerWaalsContact O-CB 3.26Å; L333-S341 WeakPolarHBondContact O-CB 3.34Å; T337-S341 WeakPolarHBondContact O-CB 3.48Å; T337-S341 PolarHBondContact O-N 2.97Å; T337-S341 PolarHBondContact O-OG 3.25Å; D338-S341 WeakPolarHBondContact CA-OG 3.43Å; D338-S341 PolarHBondContact O-OG 3.36Å; S341-K343 PolarHBondContact O-N 3.2Å; S341-T344 PolarHBondContact O-N 3Å; S341-Y345 WeakPolarHBondContact O-CB 3.39Å; S341-Y345 PolarHBondContact O-N 2.88Å
342	D	92.6	Very high	90.3	Very high	65 Å²	65	47.3 Å²	47.3	35%	0.348	23%	0.225	S	C	.	.	H	α-helix	trans	-62.9	-45.2	178.6	-73.4	-13.8	0	0	0	112	K321 D338 Y339 N346	K321-D342 IonicContact NZ-OD1 2.84Å; K321-D342 PolarHBondContact NZ-OD1 3.35Å; K321-D342 IonicContact NZ-OD2 3.42Å; K321-D342 PolarHBondContact NZ-OD2 3.15Å; D338-D342 WeakPolarHBondContact O-CB 3.1Å; D338-D342 PolarHBondContact O-N 3.29Å; Y339-D342 PolarHBondContact O-N 3.25Å; D342-N346 VanDerWaalsContact O-CB 3.31Å; D342-N346 WeakPolarHBondContact O-CB 3.26Å; D342-N346 PolarHBondContact O-N 3.29Å; D342-N346 PolarHBondContact O-ND2 3.46Å
343	K	93.9	Very high	89.7	Confident	78 Å²	78	53.5 Å²	53.5	34%	0.339	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-46.1	179.5	-81	-73.8	-166.8	142.6	0	112.1	Y339 A340 S341 N346 D347 E390 L392	Y339-K343 HydrophobicContact CD2-CG 4.29Å; Y339-K343 HydrophobicContact CE1-CG 4.16Å; Y339-K343 HydrophobicContact CE2-CD 4.43Å; Y339-K343 HydrophobicContact CE2-CG 3.76Å; Y339-K343 WeakPolarHBondContact O-CB 3.42Å; Y339-K343 WeakPolarHBondContact O-CG 3.29Å; Y339-K343 PolarHBondContact O-N 3.37Å; Y339-K343 WeakPolarHBondContact OH-CE 3.19Å; A340-K343 PolarHBondContact O-N 3.17Å; S341-K343 PolarHBondContact O-N 3.2Å; K343-N346 PolarHBondContact O-N 3.06Å; K343-D347 PolarHBondContact O-N 3.33Å; K343-E390 IonicContact NZ-OE1 3.26Å; K343-E390 IonicContact NZ-OE2 3.48Å; K343-L392 HydrophobicContact CB-CD1 3.73Å; K343-L392 HydrophobicContact CG-CD1 4.22Å
344	T	95	Very high	89.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.9	-46.6	177.9	-56	0	0	0	0	110.4	L333 A340 S341 N346 D347 I348 P393	L333-T344 HydrophobicContact CD2-CG2 3.85Å; A340-T344 WeakPolarHBondContact O-CB 3.44Å; A340-T344 PolarHBondContact O-N 2.95Å; A340-T344 PolarHBondContact O-OG1 3.19Å; S341-T344 PolarHBondContact O-N 3Å; T344-N346 PolarHBondContact O-N 3.17Å; T344-D347 WeakPolarHBondContact O-CB 3.43Å; T344-D347 PolarHBondContact O-N 2.87Å; T344-I348 HydrophobicContact CG2-CD1 3.74Å; T344-I348 HydrophobicContact CG2-CG1 4.44Å; T344-I348 WeakPolarHBondContact O-CD1 3.32Å; T344-I348 VanDerWaalsContact O-CG1 3.26Å; T344-I348 WeakPolarHBondContact O-CG1 3.33Å; T344-I348 PolarHBondContact O-N 3.29Å; T344-P393 HydrophobicContact CG2-CB 4Å; T344-P393 PolarHBondContact OG1-O 2.61Å
345	Y	95.3	Very high	89.6	Confident	52 Å²	52	57.6 Å²	57.6	20%	0.204	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-49.3	176.8	174.8	-107.6	0	0	0	112	F323 V325 L333 S341 D347 I348 V349	F323-Y345 HydrophobicContact CB-CD2 4.17Å; F323-Y345 HydrophobicContact CB-CE2 4.17Å; F323-Y345 HydrophobicContact CD1-CD1 4.03Å; F323-Y345 AromaticContact CD1-CD2 3.7Å; F323-Y345 HydrophobicContact CD1-CD2 3.7Å; F323-Y345 HydrophobicContact CD1-CE1 4.47Å; F323-Y345 HydrophobicContact CD1-CE2 4.2Å; F323-Y345 AromaticContact CD1-CG 3.61Å; F323-Y345 HydrophobicContact CD1-CG 3.61Å; F323-Y345 HydrophobicContact CE1-CD1 4.39Å; F323-Y345 HydrophobicContact CE1-CG 4.06Å; F323-Y345 HydrophobicContact CG-CD2 4.28Å; V325-Y345 HydrophobicContact CG1-CD2 4.05Å; V325-Y345 HydrophobicContact CG1-CE2 3.78Å; L333-Y345 HydrophobicContact CD1-CD2 4.11Å; S341-Y345 WeakPolarHBondContact O-CB 3.39Å; S341-Y345 PolarHBondContact O-N 2.88Å; Y345-D347 PolarHBondContact O-N 3.46Å; Y345-I348 PolarHBondContact O-N 3.06Å; Y345-I348 VanDerWaalsContact O-N 3.12Å; Y345-V349 HydrophobicContact CD2-CG1 3.84Å; Y345-V349 HydrophobicContact CE1-CG1 4.22Å; Y345-V349 HydrophobicContact CE1-CG2 4.48Å; Y345-V349 HydrophobicContact CE2-CG1 3.34Å; Y345-V349 HydrophobicContact CG-CG1 4.44Å; Y345-V349 WeakPolarHBondContact O-CG2 3.29Å; Y345-V349 PolarHBondContact O-N 3.37Å
346	N	94.1	Very high	89.6	Confident	92 Å²	92	55.4 Å²	55.4	49%	0.492	28%	0.275	S	S	.	.	H	α-helix	trans	-64.2	-23.7	178.8	-72.6	-38.6	0	0	0	113.6	D342 K343 T344 R350	D342-N346 VanDerWaalsContact O-CB 3.31Å; D342-N346 WeakPolarHBondContact O-CB 3.26Å; D342-N346 PolarHBondContact O-N 3.29Å; D342-N346 PolarHBondContact O-ND2 3.46Å; K343-N346 PolarHBondContact O-N 3.06Å; T344-N346 PolarHBondContact O-N 3.17Å; N346-R350 WeakPolarHBondContact O-CG 3.48Å
347	D	94.2	Very high	89.5	Confident	10 Å²	10	60.9 Å²	60.9	5%	0.053	30%	0.3	C	S	.	.	H	α-helix	trans	-78.4	-39.9	173.3	-166.6	60.9	0	0	0	111.4	K343 T344 Y345 R350 L386 R395	K343-D347 PolarHBondContact O-N 3.33Å; T344-D347 WeakPolarHBondContact O-CB 3.43Å; T344-D347 PolarHBondContact O-N 2.87Å; Y345-D347 PolarHBondContact O-N 3.46Å; D347-R350 WeakPolarHBondContact O-CG 3.37Å; D347-R350 IonicContact OD1-CZ 3.46Å; D347-R350 IonicContact OD1-NE 3.57Å; D347-R350 IonicContact OD1-NH1 3.7Å; D347-R350 PolarHBondContact OD1-NH1 3.33Å; D347-R350 IonicContact OD1-NH2 3.08Å; D347-L386 HydrophobicContact CB-CD2 3.54Å; D347-L386 VanDerWaalsContact OD2-CD2 3.32Å; D347-L386 WeakPolarHBondContact OD2-CD2 3.09Å; D347-R395 WeakPolarHBondContact O-CD 3.44Å; D347-R395 WeakPolarHBondContact OD2-CB 3.34Å; D347-R395 WeakPolarHBondContact OD2-CG 3.17Å; D347-R395 PolarHBondContact OD2-N 3Å
348	I	92.6	Very high	89.3	Confident	40 Å²	40	65.7 Å²	65.7	21%	0.205	32%	0.323	C	S	.	.	H	α-helix	trans	-69.3	-42.7	-179.2	-66	162.7	0	0	0	112.2	L329 T344 Y345 R350 R395 I398	L329-I348 HydrophobicContact CD1-CD1 3.94Å; L329-I348 HydrophobicContact CD2-CD1 4.07Å; L329-I348 HydrophobicContact CD2-CG2 4.15Å; T344-I348 HydrophobicContact CG2-CD1 3.74Å; T344-I348 HydrophobicContact CG2-CG1 4.44Å; T344-I348 WeakPolarHBondContact O-CD1 3.32Å; T344-I348 VanDerWaalsContact O-CG1 3.26Å; T344-I348 WeakPolarHBondContact O-CG1 3.33Å; T344-I348 PolarHBondContact O-N 3.29Å; Y345-I348 PolarHBondContact O-N 3.06Å; Y345-I348 VanDerWaalsContact O-N 3.12Å; I348-R350 PolarHBondContact O-N 3.44Å; I348-R395 HydrophobicContact CG1-CB 4.39Å; I348-I398 HydrophobicContact CD1-CB 4.4Å; I348-I398 HydrophobicContact CD1-CD1 4.46Å; I348-I398 HydrophobicContact CD1-CG1 3.97Å; I348-I398 HydrophobicContact CD1-CG2 4.03Å; I348-I398 HydrophobicContact CG1-CG1 4.36Å; I348-I398 HydrophobicContact CG1-CG2 4.36Å
349	V	90.8	Very high	89.1	Confident	71 Å²	71	67.9 Å²	67.9	43%	0.43	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	4.7	-174.5	-59.7	0	0	0	0	114.5	Y345	Y345-V349 HydrophobicContact CD2-CG1 3.84Å; Y345-V349 HydrophobicContact CE1-CG1 4.22Å; Y345-V349 HydrophobicContact CE1-CG2 4.48Å; Y345-V349 HydrophobicContact CE2-CG1 3.34Å; Y345-V349 HydrophobicContact CG-CG1 4.44Å; Y345-V349 WeakPolarHBondContact O-CG2 3.29Å; Y345-V349 PolarHBondContact O-N 3.37Å
350	R	86.9	Confident	89	Confident	142 Å²	142	69.5 Å²	69.5	54%	0.536	35%	0.347	S	S	.	.	S	Bend	trans	-62.4	146.2	173.9	-69.9	-178.9	-179.8	171.9	8.6	109.9	N346 D347 I348 S352 R395	N346-R350 WeakPolarHBondContact O-CG 3.48Å; D347-R350 WeakPolarHBondContact O-CG 3.37Å; D347-R350 IonicContact OD1-CZ 3.46Å; D347-R350 IonicContact OD1-NE 3.57Å; D347-R350 IonicContact OD1-NH1 3.7Å; D347-R350 PolarHBondContact OD1-NH1 3.33Å; D347-R350 IonicContact OD1-NH2 3.08Å; I348-R350 PolarHBondContact O-N 3.44Å; R350-S352 PolarHBondContact O-N 3.1Å; R350-S352 VanDerWaalsContact O-N 3.17Å; R350-R395 VanDerWaalsContact CB-NH1 3.3Å
351	E	67.2	Low	88.7	Confident	200 Å²	200	76 Å²	76	94%	0.935	38%	0.381	S	S	*	.	S	Bend	trans	-69.4	-10	-174.4	-65.9	178.5	173.1	0	0	114.4
352	S	72.1	Confident	88.6	Confident	26 Å²	26	79.3 Å²	79.3	18%	0.182	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-78.7	132.1	-177.2	72.8	0	0	0	0	112.4	R350 D368 D369 R395	R350-S352 PolarHBondContact O-N 3.1Å; R350-S352 VanDerWaalsContact O-N 3.17Å; S352-D368 PolarHBondContact OG-OD1 3.01Å; S352-D369 VanDerWaalsContact CB-CG 3.5Å; S352-D369 WeakPolarHBondContact CB-OD1 3.34Å; S352-D369 PolarHBondContact OG-OD2 3.22Å; S352-R395 PolarHBondContact OG-NH1 2.82Å; S352-R395 PolarHBondContact OG-NH2 2.87Å; S352-R395 VanDerWaalsContact OG-NH2 3.12Å
353	D	82.2	Confident	88.7	Confident	146 Å²	146	78.2 Å²	78.2	78%	0.781	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-77.9	128.6	173.7	-76.2	-38.2	0	0	0	110.6
354	I	91	Very high	88.8	Confident	25 Å²	25	74.5 Å²	74.5	13%	0.128	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-91.8	121	172.6	-54.7	167.6	0	0	0	108.7	C366 S367 D368 R395 K399	I354-C366 HydrophobicContact CG2-CB 3.81Å; I354-S367 WeakPolarHBondContact CA-O 3.49Å; I354-D368 HydrophobicContact CG1-CB 4.29Å; I354-R395 HydrophobicContact CD1-CB 3.65Å; I354-R395 HydrophobicContact CD1-CG 3.46Å; I354-R395 VanDerWaalsContact CD1-CG 3.46Å; I354-R395 HydrophobicContact CG1-CG 4.4Å; I354-K399 HydrophobicContact CB-CG 4.35Å; I354-K399 HydrophobicContact CD1-CB 4.21Å; I354-K399 HydrophobicContact CG2-CG 4.21Å
355	T	92.6	Very high	88.8	Confident	74 Å²	74	77 Å²	77	45%	0.454	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	133.5	174.8	58.2	0	0	0	0	111	C366 S367	T355-C366 CarbonylContact O-C 3.56Å; T355-C366 VanDerWaalsContact O-CA 3.29Å; T355-C366 WeakPolarHBondContact O-CA 3.4Å; T355-S367 PolarHBondContact N-O 2.91Å; T355-S367 PolarHBondContact O-N 3.38Å
356	I	92.8	Very high	88.8	Confident	54 Å²	54	74.5 Å²	74.5	28%	0.277	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	115.5	172.3	-64.2	169.3	0	0	0	107.4	V359 I364 K399 I404	I356-V359 HydrophobicContact CG2-CG2 3.73Å; I356-I364 HydrophobicContact CG1-CG2 4.49Å; I356-I364 HydrophobicContact CG2-CG2 3.63Å; I356-K399 HydrophobicContact CD1-CG 4.41Å; I356-I404 HydrophobicContact CD1-CD1 3.82Å; I356-I404 HydrophobicContact CD1-CG1 4.3Å; I356-I404 HydrophobicContact CG2-CD1 4.11Å
357	E	90	Very high	88.8	Confident	117 Å²	117	71.2 Å²	71.2	55%	0.547	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-42.5	-172.9	-62.2	-174.3	142.1	0	0	112.3	F365 S367	E357-F365 PolarHBondContact N-O 3.02Å; E357-S367 WeakPolarHBondContact OE1-CB 3.45Å; E357-S367 PolarHBondContact OE1-OG 3.35Å
358	Q	85.7	Confident	88.7	Confident	100 Å²	100	70.9 Å²	70.9	47%	0.467	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	136.3	-176.2	-176.6	175.4	-13.8	0	0	110.2	E360 F365	Q358-E360 HydrophobicContact CG-CG 4.45Å; Q358-E360 PolarHBondContact NE2-OE1 3.41Å; Q358-F365 HydrophobicContact CB-CB 4.27Å; Q358-F365 HydrophobicContact CB-CD2 4.09Å; Q358-F365 HydrophobicContact CG-CD2 4.4Å; Q358-F365 PolarHBondContact O-N 3.06Å
359	V	85.2	Confident	88.6	Confident	86 Å²	86	74.1 Å²	74.1	52%	0.521	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.2	-179.4	179.2	0	0	0	0	107.9	I356 I364 I404	I356-V359 HydrophobicContact CG2-CG2 3.73Å; V359-I364 HydrophobicContact CB-CD1 3.98Å; V359-I364 HydrophobicContact CG1-CD1 3.59Å; V359-I364 HydrophobicContact CG2-CD1 4.11Å; V359-I404 HydrophobicContact CG1-CD1 4.33Å; V359-I404 HydrophobicContact CG2-CD1 3.75Å
360	E	88.2	Confident	88.4	Confident	81 Å²	81	74.3 Å²	74.3	38%	0.379	39%	0.393	S	S	.	.			trans	-106.3	165.2	164.4	-57.5	177.7	176.8	0	0	108.8	Q358 D362 F363	Q358-E360 HydrophobicContact CG-CG 4.45Å; Q358-E360 PolarHBondContact NE2-OE1 3.41Å; E360-D362 VanDerWaalsContact C-N 3.27Å; E360-D362 PolarHBondContact O-N 3.03Å; E360-F363 WeakPolarHBondContact CA-O 3.33Å; E360-F363 WeakPolarHBondContact CB-O 3.45Å; E360-F363 PolarHBondContact N-O 3.33Å
361	D	85.8	Confident	88.7	Confident	136 Å²	136	71.7 Å²	71.7	73%	0.727	39%	0.39	S	S	*	.	S	Bend	trans	-59.3	-39.9	-177.4	-74.3	-24.5	0	0	0	112.3	R377 H407	D361-R377 WeakPolarHBondContact O-CD 3.46Å; D361-R377 PolarHBondContact O-NH1 2.96Å; D361-H407 PolarHBondContact O-NE2 3.21Å; D361-H407 VanDerWaalsContact O-NE2 3.14Å
362	D	93.2	Very high	89.9	Confident	70 Å²	70	65.7 Å²	65.7	37%	0.374	37%	0.369	S	S	.	.	S	Bend	trans	-102	-26.1	-176.3	-66.7	-29.6	0	0	0	113.7	E360 R377 N378	E360-D362 VanDerWaalsContact C-N 3.27Å; E360-D362 PolarHBondContact O-N 3.03Å; D362-R377 WeakPolarHBondContact O-CB 3.43Å; D362-R377 PolarHBondContact O-N 3.16Å; D362-N378 PolarHBondContact OD1-ND2 3.15Å
363	F	94.6	Very high	91	Very high	42 Å²	42	66.9 Å²	66.9	18%	0.184	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.7	-172.3	-57.1	-74.3	0	0	0	112.4	E360 R374 V375 D376	E360-F363 WeakPolarHBondContact CA-O 3.33Å; E360-F363 WeakPolarHBondContact CB-O 3.45Å; E360-F363 PolarHBondContact N-O 3.33Å; F363-R374 HydrophobicContact CB-CG 4.47Å; F363-R374 HydrophobicContact CD1-CG 4.27Å; F363-V375 CarbonylContact C-O 3.58Å; F363-V375 VanDerWaalsContact CA-O 3.3Å; F363-V375 WeakPolarHBondContact CA-O 3.31Å; F363-D376 HydrophobicContact CD1-CB 3.84Å; F363-D376 HydrophobicContact CE1-CB 3.65Å; F363-D376 VanDerWaalsContact CE1-CG 3.46Å; F363-D376 WeakPolarHBondContact CE1-OD2 3.39Å
364	I	95.1	Very high	91.7	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.4	173.4	-52	-61.6	0	0	0	108.9	I356 V359 V375 R377 V400 I404	I356-I364 HydrophobicContact CG1-CG2 4.49Å; I356-I364 HydrophobicContact CG2-CG2 3.63Å; V359-I364 HydrophobicContact CB-CD1 3.98Å; V359-I364 HydrophobicContact CG1-CD1 3.59Å; V359-I364 HydrophobicContact CG2-CD1 4.11Å; I364-V375 HydrophobicContact CB-CB 4.36Å; I364-V375 PolarHBondContact N-O 2.93Å; I364-V375 PolarHBondContact O-N 2.92Å; I364-R377 HydrophobicContact CG1-CG 3.92Å; I364-V400 HydrophobicContact CB-CG1 4.38Å; I364-V400 HydrophobicContact CB-CG2 4.05Å; I364-V400 HydrophobicContact CG1-CG1 3.85Å; I364-V400 HydrophobicContact CG1-CG2 4.39Å; I364-V400 HydrophobicContact CG2-CG2 3.83Å; I364-I404 HydrophobicContact CD1-CD1 3.98Å; I364-I404 HydrophobicContact CG1-CD1 4.45Å; I364-I404 HydrophobicContact CG2-CD1 4.43Å
365	F	95.8	Very high	92	Very high	53 Å²	53	63.9 Å²	63.9	23%	0.232	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126.8	171.3	-66.2	-90.9	0	0	0	109.8	E357 Q358 Y373 R374	E357-F365 PolarHBondContact N-O 3.02Å; Q358-F365 HydrophobicContact CB-CB 4.27Å; Q358-F365 HydrophobicContact CB-CD2 4.09Å; Q358-F365 HydrophobicContact CG-CD2 4.4Å; Q358-F365 PolarHBondContact O-N 3.06Å; F365-Y373 WeakPolarHBondContact CA-O 3.44Å; F365-R374 HydrophobicContact CD1-CB 4.22Å; F365-R374 HydrophobicContact CD1-CG 4.49Å; F365-R374 HydrophobicContact CE1-CB 3.99Å; F365-R374 HydrophobicContact CE1-CG 4.02Å; F365-R374 HydrophobicContact CZ-CG 4.22Å
366	C	94.4	Very high	92.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.6	177.4	-58.5	0	0	0	0	109.5	I354 T355 S372 Y373	I354-C366 HydrophobicContact CG2-CB 3.81Å; T355-C366 CarbonylContact O-C 3.56Å; T355-C366 VanDerWaalsContact O-CA 3.29Å; T355-C366 WeakPolarHBondContact O-CA 3.4Å; C366-S372 CarbonylContact O-C 3.51Å; C366-S372 WeakPolarHBondContact O-CA 3.42Å; C366-Y373 PolarHBondContact N-O 3.39Å; C366-Y373 PolarHBondContact O-N 2.59Å
367	S	93.6	Very high	92.2	Very high	23 Å²	23	60.3 Å²	60.3	16%	0.161	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.5	168.7	172.6	0	0	0	0	110.5	I354 T355 E357 N371	I354-S367 WeakPolarHBondContact CA-O 3.49Å; T355-S367 PolarHBondContact N-O 2.91Å; T355-S367 PolarHBondContact O-N 3.38Å; E357-S367 WeakPolarHBondContact OE1-CB 3.45Å; E357-S367 PolarHBondContact OE1-OG 3.35Å; S367-N371 WeakPolarHBondContact CA-O 3.26Å
368	D	93.3	Very high	92.4	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.011	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	120.6	-171.3	171.6	39.1	0	0	0	109.2	S352 I354 G370 N371 Y373 R395 H396	S352-D368 PolarHBondContact OG-OD1 3.01Å; I354-D368 HydrophobicContact CG1-CB 4.29Å; D368-G370 PolarHBondContact O-N 2.86Å; D368-G370 VanDerWaalsContact O-N 3.16Å; D368-N371 PolarHBondContact N-O 3Å; D368-N371 PolarHBondContact O-N 2.68Å; D368-Y373 HydrophobicContact CB-CD2 4Å; D368-Y373 HydrophobicContact CB-CE2 3.84Å; D368-R395 IonicContact OD1-CZ 3.87Å; D368-R395 IonicContact OD1-NE 3.1Å; D368-R395 PolarHBondContact OD1-NE 2.92Å; D368-R395 IonicContact OD1-NH1 3.6Å; D368-R395 IonicContact OD1-NH2 2.97Å; D368-R395 PolarHBondContact OD1-NH2 3.38Å; D368-R395 IonicContact OD2-CZ 3.29Å; D368-R395 IonicContact OD2-NE 3.2Å; D368-R395 PolarHBondContact OD2-NE 3.37Å; D368-R395 IonicContact OD2-NH2 3.93Å; D368-R395 PolarHBondContact OD2-NH2 2.89Å; D368-H396 VanDerWaalsContact CB-NE2 3.32Å; D368-H396 WeakPolarHBondContact CB-NE2 3.16Å; D368-H396 IonicContact OD2-CE1 3.9Å; D368-H396 PolarHBondContact OD2-CE1 3.13Å; D368-H396 IonicContact OD2-NE2 2.68Å; D368-H396 PolarHBondContact OD2-NE2 3.02Å
369	D	89.6	Confident	92.8	Very high	108 Å²	108	56.7 Å²	56.7	58%	0.578	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	36.9	-174.7	-66.1	-41.9	0	0	0	113.9	S352 N371 R395	S352-D369 VanDerWaalsContact CB-CG 3.5Å; S352-D369 WeakPolarHBondContact CB-OD1 3.34Å; S352-D369 PolarHBondContact OG-OD2 3.22Å; D369-N371 PolarHBondContact O-N 3.33Å; D369-N371 PolarHBondContact O-ND2 2.69Å; D369-R395 IonicContact OD2-CZ 2.92Å; D369-R395 IonicContact OD2-NH2 3.37Å; D369-R395 PolarHBondContact OD2-NH2 3.39Å
370	G	88	Confident	93.2	Very high	75 Å²	75	52.6 Å²	52.6	77%	0.773	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	5.7	-179.2	0	0	0	0	0	115	D368	D368-G370 PolarHBondContact O-N 2.86Å; D368-G370 VanDerWaalsContact O-N 3.16Å
371	N	91.7	Very high	93.5	Very high	88 Å²	88	50.3 Å²	50.3	47%	0.471	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	147.5	173.6	-59.2	-73.1	0	0	0	110.2	S367 D368 D369 Y373	S367-N371 WeakPolarHBondContact CA-O 3.26Å; D368-N371 PolarHBondContact N-O 3Å; D368-N371 PolarHBondContact O-N 2.68Å; D369-N371 PolarHBondContact O-N 3.33Å; D369-N371 PolarHBondContact O-ND2 2.69Å; N371-Y373 HydrophobicContact CB-CE2 3.72Å
372	S	93.6	Very high	94	Very high	73 Å²	73	44.1 Å²	44.1	51%	0.51	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.3	174.6	-171.7	0	0	0	0	110.6	C366	C366-S372 CarbonylContact O-C 3.51Å; C366-S372 WeakPolarHBondContact O-CA 3.42Å
373	Y	95.4	Very high	94.1	Very high	52 Å²	52	44.7 Å²	44.7	20%	0.204	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.3	179.3	-59.8	-80.2	0	0	0	110.1	F365 C366 D368 N371 C384 H396	F365-Y373 WeakPolarHBondContact CA-O 3.44Å; C366-Y373 PolarHBondContact N-O 3.39Å; C366-Y373 PolarHBondContact O-N 2.59Å; D368-Y373 HydrophobicContact CB-CD2 4Å; D368-Y373 HydrophobicContact CB-CE2 3.84Å; N371-Y373 HydrophobicContact CB-CE2 3.72Å; Y373-C384 HydrophobicContact CD1-CB 3.55Å; Y373-C384 HydrophobicContact CE1-CB 3.66Å; Y373-C384 HydrophobicContact CG-CB 4.32Å; Y373-H396 AromaticContact CD2-CD2 3.93Å; Y373-H396 AromaticContact CD2-CE1 3.37Å; Y373-H396 WeakPolarHBondContact CD2-CE1 3.13Å; Y373-H396 AromaticContact CD2-NE2 3.15Å; Y373-H396 WeakPolarHBondContact CD2-NE2 3.45Å; Y373-H396 AromaticContact CE2-CE1 3.61Å; Y373-H396 AromaticContact CE2-NE2 3.55Å; Y373-H396 AromaticContact CG-CE1 3.63Å; Y373-H396 AromaticContact CG-NE2 3.77Å
374	R	96.2	Very high	94.1	Very high	107 Å²	107	43 Å²	43	40%	0.404	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.5	177.5	-178.1	-178.3	173.6	-159.9	3.9	109.3	F363 F365 C382 T383	F363-R374 HydrophobicContact CB-CG 4.47Å; F363-R374 HydrophobicContact CD1-CG 4.27Å; F365-R374 HydrophobicContact CD1-CB 4.22Å; F365-R374 HydrophobicContact CD1-CG 4.49Å; F365-R374 HydrophobicContact CE1-CB 3.99Å; F365-R374 HydrophobicContact CE1-CG 4.02Å; F365-R374 HydrophobicContact CZ-CG 4.22Å; R374-C382 WeakPolarHBondContact O-CA 3.47Å; R374-T383 HydrophobicContact CB-CG2 3.94Å; R374-T383 PolarHBondContact N-OG1 3.44Å; R374-T383 PolarHBondContact O-N 3.24Å
375	V	96.9	Very high	94	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.8	173.3	176.2	0	0	0	0	108.7	F363 I364 V381 C382 H396 L397 V400 L406	F363-V375 CarbonylContact C-O 3.58Å; F363-V375 VanDerWaalsContact CA-O 3.3Å; F363-V375 WeakPolarHBondContact CA-O 3.31Å; I364-V375 HydrophobicContact CB-CB 4.36Å; I364-V375 PolarHBondContact N-O 2.93Å; I364-V375 PolarHBondContact O-N 2.92Å; V375-V381 CarbonylContact C-O 3.55Å; V375-V381 WeakPolarHBondContact CA-O 3.41Å; V375-C382 HydrophobicContact CG2-CB 4.2Å; V375-H396 HydrophobicContact CG2-CB 3.92Å; V375-L397 HydrophobicContact CG1-CD2 3.7Å; V375-V400 HydrophobicContact CB-CG2 4.17Å; V375-V400 HydrophobicContact CG1-CB 4.21Å; V375-V400 HydrophobicContact CG1-CG1 4.1Å; V375-V400 HydrophobicContact CG1-CG2 4.19Å; V375-V400 HydrophobicContact CG2-CG2 4.03Å; V375-L406 HydrophobicContact CG1-CD2 4.12Å
376	D	96	Very high	93.9	Very high	23 Å²	23	45.3 Å²	45.3	12%	0.123	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	116.8	171.9	178.7	-26.5	0	0	0	109.1	F363 N378 N379 G380 V381	F363-D376 HydrophobicContact CD1-CB 3.84Å; F363-D376 HydrophobicContact CE1-CB 3.65Å; F363-D376 VanDerWaalsContact CE1-CG 3.46Å; F363-D376 WeakPolarHBondContact CE1-OD2 3.39Å; D376-N378 WeakPolarHBondContact OD1-CB 3.45Å; D376-N378 PolarHBondContact OD1-N 2.69Å; D376-N379 HydrophobicContact CB-CB 4.24Å; D376-N379 PolarHBondContact OD1-N 3.43Å; D376-N379 WeakPolarHBondContact OD2-CB 3.45Å; D376-N379 PolarHBondContact OD2-ND2 3Å; D376-G380 WeakPolarHBondContact O-CA 3.49Å; D376-G380 PolarHBondContact O-N 3.23Å; D376-V381 HydrophobicContact CB-CG2 3.68Å; D376-V381 PolarHBondContact N-O 3.33Å; D376-V381 PolarHBondContact O-N 3.22Å
377	R	94.9	Very high	94	Very high	30 Å²	30	45.5 Å²	45.5	11%	0.113	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-29.9	-175.4	-61.4	177.5	68.9	-157.1	3.9	113.1	D361 D362 I364 N379 G405 L406 H407	D361-R377 WeakPolarHBondContact O-CD 3.46Å; D361-R377 PolarHBondContact O-NH1 2.96Å; D362-R377 WeakPolarHBondContact O-CB 3.43Å; D362-R377 PolarHBondContact O-N 3.16Å; I364-R377 HydrophobicContact CG1-CG 3.92Å; R377-N379 VanDerWaalsContact C-N 3.35Å; R377-G405 PolarHBondContact NE-O 3.46Å; R377-G405 PolarHBondContact NH2-O 3.4Å; R377-L406 HydrophobicContact CB-CD2 4.41Å; R377-L406 HydrophobicContact CG-CD2 4.33Å; R377-H407 WeakPolarHBondContact O-CB 3.48Å; R377-H407 PolarHBondContact O-N 2.89Å
378	N	93.6	Very high	94	Very high	73 Å²	73	46.6 Å²	46.6	39%	0.39	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-39	177.9	-72.4	-36	0	0	0	110.8	D362 D376 H407 T408	D362-N378 PolarHBondContact OD1-ND2 3.15Å; D376-N378 WeakPolarHBondContact OD1-CB 3.45Å; D376-N378 PolarHBondContact OD1-N 2.69Å; N378-H407 PolarHBondContact OD1-CD2 3.15Å; N378-T408 WeakPolarHBondContact O-CG2 3.47Å
379	N	93.1	Very high	94	Very high	68 Å²	68	47.4 Å²	47.4	36%	0.364	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-18.4	-174.5	-80.9	-57.8	0	0	0	113.5	D376 R377 V381 R413	D376-N379 HydrophobicContact CB-CB 4.24Å; D376-N379 PolarHBondContact OD1-N 3.43Å; D376-N379 WeakPolarHBondContact OD2-CB 3.45Å; D376-N379 PolarHBondContact OD2-ND2 3Å; R377-N379 VanDerWaalsContact C-N 3.35Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 HydrophobicContact CB-CG1 4.29Å; N379-V381 HydrophobicContact CB-CG2 3.89Å; N379-R413 VanDerWaalsContact CA-NH1 3.31Å; N379-R413 WeakPolarHBondContact O-CD 3.47Å; N379-R413 WeakPolarHBondContact O-CG 3.49Å; N379-R413 PolarHBondContact O-NH1 3.04Å; N379-R413 PolarHBondContact OD1-NH1 2.81Å
380	G	93.9	Very high	94.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	40	-173.9	0	0	0	0	0	112.3	D376	D376-G380 WeakPolarHBondContact O-CA 3.49Å; D376-G380 PolarHBondContact O-N 3.23Å
381	V	95.4	Very high	94.7	Very high	34 Å²	34	40.3 Å²	40.3	21%	0.206	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	154.9	179.2	-61.2	0	0	0	0	111.7	V375 D376 N379 N387	V375-V381 CarbonylContact C-O 3.55Å; V375-V381 WeakPolarHBondContact CA-O 3.41Å; D376-V381 HydrophobicContact CB-CG2 3.68Å; D376-V381 PolarHBondContact N-O 3.33Å; D376-V381 PolarHBondContact O-N 3.22Å; N379-V381 VanDerWaalsContact C-N 3.34Å; N379-V381 HydrophobicContact CB-CG1 4.29Å; N379-V381 HydrophobicContact CB-CG2 3.89Å; V381-N387 WeakPolarHBondContact CA-OD1 3.42Å
382	C	95.8	Very high	94.9	Very high	6 Å²	6	36.1 Å²	36.1	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	146.5	177.9	178.7	0	0	0	0	110.5	R374 V375 C384 N387 L397	R374-C382 WeakPolarHBondContact O-CA 3.47Å; V375-C382 HydrophobicContact CG2-CB 4.2Å; C382-C384 PolarHBondContact O-N 3.32Å; C382-C384 PolarHBondContact SG-N 3.37Å; C382-C384 VanDerWaalsContact SG-SG 3.63Å; C382-N387 HydrophobicContact CB-CB 3.96Å; C382-N387 PolarHBondContact N-OD1 3.44Å; C382-N387 PolarHBondContact O-OD1 3.43Å; C382-L397 HydrophobicContact CB-CD1 4.13Å; C382-L397 HydrophobicContact CB-CG 3.92Å
383	T	95.5	Very high	95	Very high	81 Å²	81	32.7 Å²	32.7	50%	0.497	18%	0.176	S	C	.	.	S	Bend	trans	-72.6	-12.1	178.5	56.2	0	0	0	0	114.2	R374 S388	R374-T383 HydrophobicContact CB-CG2 3.94Å; R374-T383 PolarHBondContact N-OG1 3.44Å; R374-T383 PolarHBondContact O-N 3.24Å; T383-S388 PolarHBondContact O-OG 2.66Å
384	C	94.4	Very high	95	Very high	8 Å²	8	30.2 Å²	30.2	5%	0.054	17%	0.166	C	C	.	.	S	Bend	trans	-65.3	148.9	177.4	79.6	0	0	0	0	111.4	Y373 C382 L386 N387 S388 C394	Y373-C384 HydrophobicContact CD1-CB 3.55Å; Y373-C384 HydrophobicContact CE1-CB 3.66Å; Y373-C384 HydrophobicContact CG-CB 4.32Å; C382-C384 PolarHBondContact O-N 3.32Å; C382-C384 PolarHBondContact SG-N 3.37Å; C382-C384 VanDerWaalsContact SG-SG 3.63Å; C384-L386 VanDerWaalsContact C-N 3.25Å; C384-L386 PolarHBondContact O-N 3.25Å; C384-N387 PolarHBondContact O-N 3.17Å; C384-S388 PolarHBondContact O-N 3.07Å; C384-S388 PolarHBondContact O-OG 3.45Å; C384-C394 WeakPolarHBondContact SG-CB 3.17Å; C384-C394 PolarHBondContact SG-SG 3.12Å
385	S	92.6	Very high	95	Very high	84 Å²	84	25.8 Å²	25.8	59%	0.587	15%	0.149	S	C	*	.	H	α-helix	trans	-58.1	-34.2	-175.5	59.5	0	0	0	0	113.6	N387 S388 V389 E390	S385-N387 PolarHBondContact O-N 3.02Å; S385-S388 WeakPolarHBondContact CA-OG 3.31Å; S385-V389 WeakPolarHBondContact O-CA 3.32Å; S385-V389 WeakPolarHBondContact O-CB 3.33Å; S385-V389 PolarHBondContact O-N 3.16Å; S385-E390 PolarHBondContact O-N 3.47Å
386	L	94.3	Very high	94.9	Very high	17 Å²	17	26 Å²	26	9%	0.089	15%	0.15	C	C	.	.	H	α-helix	trans	-60.8	-36.8	179.8	-170.8	62.9	0	0	0	111.6	D347 C384 E390 L391 L392 C394	D347-L386 HydrophobicContact CB-CD2 3.54Å; D347-L386 VanDerWaalsContact OD2-CD2 3.32Å; D347-L386 WeakPolarHBondContact OD2-CD2 3.09Å; C384-L386 VanDerWaalsContact C-N 3.25Å; C384-L386 PolarHBondContact O-N 3.25Å; L386-E390 HydrophobicContact CD1-CB 4.43Å; L386-E390 HydrophobicContact CD1-CG 4.43Å; L386-E390 CarbonylContact O-C 3.54Å; L386-E390 WeakPolarHBondContact O-CB 3.37Å; L386-E390 PolarHBondContact O-N 3.48Å; L386-L391 PolarHBondContact O-N 2.88Å; L386-L392 HydrophobicContact CD1-CB 4.11Å; L386-L392 HydrophobicContact CD1-CD1 3.67Å; L386-L392 HydrophobicContact CG-CB 3.98Å; L386-L392 HydrophobicContact CG-CD1 4.44Å; L386-L392 PolarHBondContact O-N 3.5Å; L386-C394 HydrophobicContact CB-CB 4.16Å; L386-C394 HydrophobicContact CD2-CB 4.08Å; L386-C394 HydrophobicContact CG-CB 4.41Å
387	N	95.5	Very high	94.9	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-88.5	-45.1	175.8	-171.4	-103.9	0	0	0	112.8	V381 C382 C384 S385 L391 L392 L397	V381-N387 WeakPolarHBondContact CA-OD1 3.42Å; C382-N387 HydrophobicContact CB-CB 3.96Å; C382-N387 PolarHBondContact N-OD1 3.44Å; C382-N387 PolarHBondContact O-OD1 3.43Å; C384-N387 PolarHBondContact O-N 3.17Å; S385-N387 PolarHBondContact O-N 3.02Å; N387-L391 WeakPolarHBondContact O-CA 2.96Å; N387-L391 PolarHBondContact O-N 3.49Å; N387-L392 WeakPolarHBondContact CA-O 3.42Å; N387-L392 WeakPolarHBondContact CB-O 3.44Å; N387-L392 PolarHBondContact ND2-O 3.21Å; N387-L397 HydrophobicContact CB-CD1 4.25Å; N387-L397 WeakPolarHBondContact ND2-CD1 3.34Å
388	S	93.9	Very high	94.9	Very high	45 Å²	45	23.9 Å²	23.9	32%	0.315	14%	0.142	S	C	.	.	H	α-helix	trans	-73.2	-31.5	-175.1	59.6	0	0	0	0	113.7	T383 C384 S385	T383-S388 PolarHBondContact O-OG 2.66Å; C384-S388 PolarHBondContact O-N 3.07Å; C384-S388 PolarHBondContact O-OG 3.45Å; S385-S388 WeakPolarHBondContact CA-OG 3.31Å
389	V	94.2	Very high	94.9	Very high	19 Å²	19	24.8 Å²	24.8	12%	0.115	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-39.4	-177.3	169.8	0	0	0	0	112.4	Q261 V263 V264 T265 L266 S385	Q261-V389 VanDerWaalsContact O-CG2 3.23Å; Q261-V389 WeakPolarHBondContact O-CG2 3.32Å; V263-V389 VanDerWaalsContact O-CG1 3.29Å; V263-V389 WeakPolarHBondContact O-CG1 3.15Å; V264-V389 CarbonylContact C-O 3.52Å; V264-V389 WeakPolarHBondContact CA-O 2.98Å; T265-V389 HydrophobicContact CG2-CG1 4.37Å; T265-V389 PolarHBondContact N-O 3.37Å; T265-V389 WeakPolarHBondContact OG1-CG1 3.28Å; L266-V389 PolarHBondContact N-O 3.21Å; S385-V389 WeakPolarHBondContact O-CA 3.32Å; S385-V389 WeakPolarHBondContact O-CB 3.33Å; S385-V389 PolarHBondContact O-N 3.16Å
390	E	95.1	Very high	94.9	Very high	31 Å²	31	21.5 Å²	21.5	15%	0.145	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-6	179.8	-48.5	-166.7	-153.9	0	0	113.6	G267 Y339 K343 S385 L386 L392 W417	G267-E390 VanDerWaalsContact CA-OE2 3.27Å; G267-E390 WeakPolarHBondContact CA-OE2 3.42Å; Y339-E390 PolarHBondContact OH-OE2 3.1Å; K343-E390 IonicContact NZ-OE1 3.26Å; K343-E390 IonicContact NZ-OE2 3.48Å; S385-E390 PolarHBondContact O-N 3.47Å; L386-E390 HydrophobicContact CD1-CB 4.43Å; L386-E390 HydrophobicContact CD1-CG 4.43Å; L386-E390 CarbonylContact O-C 3.54Å; L386-E390 WeakPolarHBondContact O-CB 3.37Å; L386-E390 PolarHBondContact O-N 3.48Å; E390-L392 HydrophobicContact CB-CB 4.49Å; E390-L392 HydrophobicContact CB-CD1 3.93Å; E390-L392 HydrophobicContact CB-CG 4.07Å; E390-L392 PolarHBondContact O-N 3.2Å; E390-L392 VanDerWaalsContact O-N 3.15Å; E390-W417 WeakPolarHBondContact O-CZ2 3.37Å; E390-W417 PolarHBondContact O-NE1 2.91Å
391	L	96.3	Very high	95	Very high	3 Å²	3	23.6 Å²	23.6	2%	0.016	13%	0.134	C	C	.	.			trans	60.2	18.1	-177.4	-50.3	-172.1	0	0	0	113.6	E104 L167 V264 L266 L386 N387 Y414 W417	E104-L391 HydrophobicContact CB-CD1 4.17Å; E104-L391 HydrophobicContact CG-CD1 3.96Å; L167-L391 HydrophobicContact CD1-CD1 4.1Å; L167-L391 HydrophobicContact CD1-CD2 4.38Å; V264-L391 HydrophobicContact CG1-CD1 3.9Å; V264-L391 HydrophobicContact CG1-CD2 4.11Å; V264-L391 HydrophobicContact CG1-CG 3.84Å; V264-L391 HydrophobicContact CG2-CD2 4Å; L266-L391 HydrophobicContact CD2-CB 4.41Å; L266-L391 HydrophobicContact CD2-CD1 3.82Å; L266-L391 HydrophobicContact CD2-CG 4.03Å; L386-L391 PolarHBondContact O-N 2.88Å; N387-L391 WeakPolarHBondContact O-CA 2.96Å; N387-L391 PolarHBondContact O-N 3.49Å; L391-Y414 HydrophobicContact CB-CD1 4.24Å; L391-Y414 HydrophobicContact CB-CD2 3.6Å; L391-Y414 HydrophobicContact CB-CE1 4.44Å; L391-Y414 HydrophobicContact CB-CE2 3.82Å; L391-Y414 HydrophobicContact CB-CG 3.82Å; L391-Y414 HydrophobicContact CD1-CD1 3.86Å; L391-Y414 HydrophobicContact CD1-CE1 3.88Å; L391-Y414 HydrophobicContact CD1-CG 4.26Å; L391-Y414 HydrophobicContact CD2-CE1 4.06Å; L391-Y414 HydrophobicContact CD2-CE2 3.91Å; L391-Y414 HydrophobicContact CG-CD1 4.48Å; L391-Y414 HydrophobicContact CG-CD2 4.47Å; L391-Y414 HydrophobicContact CG-CE1 4.35Å; L391-Y414 HydrophobicContact CG-CE2 4.32Å; L391-Y414 WeakPolarHBondContact O-CD2 3.31Å; L391-W417 VanDerWaalsContact C-NE1 3.29Å; L391-W417 PolarHBondContact O-NE1 2.9Å
392	L	96.3	Very high	94.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.			trans	-88.7	153.4	-176.2	-74.1	171.6	0	0	0	111.5	Y339 A340 K343 L386 N387 E390 C394 W417	Y339-L392 HydrophobicContact CE1-CD1 3.91Å; A340-L392 HydrophobicContact CB-CD2 3.38Å; K343-L392 HydrophobicContact CB-CD1 3.73Å; K343-L392 HydrophobicContact CG-CD1 4.22Å; L386-L392 HydrophobicContact CD1-CB 4.11Å; L386-L392 HydrophobicContact CD1-CD1 3.67Å; L386-L392 HydrophobicContact CG-CB 3.98Å; L386-L392 HydrophobicContact CG-CD1 4.44Å; L386-L392 PolarHBondContact O-N 3.5Å; N387-L392 WeakPolarHBondContact CA-O 3.42Å; N387-L392 WeakPolarHBondContact CB-O 3.44Å; N387-L392 PolarHBondContact ND2-O 3.21Å; E390-L392 HydrophobicContact CB-CB 4.49Å; E390-L392 HydrophobicContact CB-CD1 3.93Å; E390-L392 HydrophobicContact CB-CG 4.07Å; E390-L392 PolarHBondContact O-N 3.2Å; E390-L392 VanDerWaalsContact O-N 3.15Å; L392-C394 PolarHBondContact O-N 2.76Å; L392-W417 HydrophobicContact CD2-CD2 3.66Å; L392-W417 HydrophobicContact CD2-CE3 4.26Å; L392-W417 HydrophobicContact CD2-CG 3.8Å; L392-W417 HydrophobicContact CD2-CZ2 4.25Å; L392-W417 HydrophobicContact CG-CZ2 4.45Å
393	P	95.9	Very high	94.5	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.013	16%	0.162	C	C	.	.			trans	-57.4	132.9	161.5	-17.1	30.2	0	0	0	109.4	F332 L336 T344 I398 C412	F332-P393 HydrophobicContact CE1-CB 4.26Å; F332-P393 HydrophobicContact CE1-CG 4.32Å; F332-P393 HydrophobicContact CZ-CB 4.05Å; F332-P393 HydrophobicContact CZ-CG 3.79Å; L336-P393 HydrophobicContact CD1-CG 4.14Å; T344-P393 HydrophobicContact CG2-CB 4Å; T344-P393 PolarHBondContact OG1-O 2.61Å; P393-I398 HydrophobicContact CB-CD1 4.41Å; P393-C412 HydrophobicContact CG-CB 4.03Å
394	C	95.7	Very high	94.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.153	C	C	.	.			trans	-114.3	164.8	178.1	67.3	0	0	0	0	110.9	C384 L386 L392 H396 L397 I398	C384-C394 WeakPolarHBondContact SG-CB 3.17Å; C384-C394 PolarHBondContact SG-SG 3.12Å; L386-C394 HydrophobicContact CB-CB 4.16Å; L386-C394 HydrophobicContact CD2-CB 4.08Å; L386-C394 HydrophobicContact CG-CB 4.41Å; L392-C394 PolarHBondContact O-N 2.76Å; C394-H396 PolarHBondContact O-N 3.17Å; C394-H396 VanDerWaalsContact O-N 3.13Å; C394-L397 PolarHBondContact O-N 3.25Å; C394-L397 VanDerWaalsContact O-N 3.07Å; C394-L397 PolarHBondContact SG-N 2.67Å; C394-L397 VanDerWaalsContact SG-N 3.42Å; C394-I398 VanDerWaalsContact O-CG1 3.25Å; C394-I398 WeakPolarHBondContact O-CG1 3.43Å; C394-I398 PolarHBondContact O-N 2.58Å
395	R	94.9	Very high	94.2	Very high	13 Å²	13	28.5 Å²	28.5	5%	0.049	16%	0.161	C	C	.	.	H	α-helix	trans	-53.5	-33.9	177.2	66.1	179.4	-177.5	-173.6	-7.1	113.8	D347 I348 R350 S352 I354 D368 D369 I398 K399	D347-R395 WeakPolarHBondContact O-CD 3.44Å; D347-R395 WeakPolarHBondContact OD2-CB 3.34Å; D347-R395 WeakPolarHBondContact OD2-CG 3.17Å; D347-R395 PolarHBondContact OD2-N 3Å; I348-R395 HydrophobicContact CG1-CB 4.39Å; R350-R395 VanDerWaalsContact CB-NH1 3.3Å; S352-R395 PolarHBondContact OG-NH1 2.82Å; S352-R395 PolarHBondContact OG-NH2 2.87Å; S352-R395 VanDerWaalsContact OG-NH2 3.12Å; I354-R395 HydrophobicContact CD1-CB 3.65Å; I354-R395 HydrophobicContact CD1-CG 3.46Å; I354-R395 VanDerWaalsContact CD1-CG 3.46Å; I354-R395 HydrophobicContact CG1-CG 4.4Å; D368-R395 IonicContact OD1-CZ 3.87Å; D368-R395 IonicContact OD1-NE 3.1Å; D368-R395 PolarHBondContact OD1-NE 2.92Å; D368-R395 IonicContact OD1-NH1 3.6Å; D368-R395 IonicContact OD1-NH2 2.97Å; D368-R395 PolarHBondContact OD1-NH2 3.38Å; D368-R395 IonicContact OD2-CZ 3.29Å; D368-R395 IonicContact OD2-NE 3.2Å; D368-R395 PolarHBondContact OD2-NE 3.37Å; D368-R395 IonicContact OD2-NH2 3.93Å; D368-R395 PolarHBondContact OD2-NH2 2.89Å; D369-R395 IonicContact OD2-CZ 2.92Å; D369-R395 IonicContact OD2-NH2 3.37Å; D369-R395 PolarHBondContact OD2-NH2 3.39Å; R395-I398 PolarHBondContact O-N 2.75Å; R395-K399 VanDerWaalsContact O-CB 3.29Å; R395-K399 WeakPolarHBondContact O-CB 3.25Å; R395-K399 PolarHBondContact O-N 3.42Å
396	H	95.5	Very high	94.3	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.019	14%	0.136	C	C	.	.	H	α-helix	trans	-65.1	-48.8	175.2	-50.4	108.7	0	0	0	112.7	D368 Y373 V375 C394 I398 K399 V400	D368-H396 VanDerWaalsContact CB-NE2 3.32Å; D368-H396 WeakPolarHBondContact CB-NE2 3.16Å; D368-H396 IonicContact OD2-CE1 3.9Å; D368-H396 PolarHBondContact OD2-CE1 3.13Å; D368-H396 IonicContact OD2-NE2 2.68Å; D368-H396 PolarHBondContact OD2-NE2 3.02Å; Y373-H396 AromaticContact CD2-CD2 3.93Å; Y373-H396 AromaticContact CD2-CE1 3.37Å; Y373-H396 WeakPolarHBondContact CD2-CE1 3.13Å; Y373-H396 AromaticContact CD2-NE2 3.15Å; Y373-H396 WeakPolarHBondContact CD2-NE2 3.45Å; Y373-H396 AromaticContact CE2-CE1 3.61Å; Y373-H396 AromaticContact CE2-NE2 3.55Å; Y373-H396 AromaticContact CG-CE1 3.63Å; Y373-H396 AromaticContact CG-NE2 3.77Å; V375-H396 HydrophobicContact CG2-CB 3.92Å; C394-H396 PolarHBondContact O-N 3.17Å; C394-H396 VanDerWaalsContact O-N 3.13Å; H396-I398 VanDerWaalsContact C-N 3.29Å; H396-I398 PolarHBondContact O-N 2.96Å; H396-K399 PolarHBondContact O-N 2.76Å; H396-V400 WeakPolarHBondContact O-CG2 3.32Å; H396-V400 PolarHBondContact O-N 2.82Å
397	L	95.7	Very high	94.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.5	-41.6	177.5	-81.3	166.6	0	0	0	111	V375 C382 N387 C394 H401 L406 P411	V375-L397 HydrophobicContact CG1-CD2 3.7Å; C382-L397 HydrophobicContact CB-CD1 4.13Å; C382-L397 HydrophobicContact CB-CG 3.92Å; N387-L397 HydrophobicContact CB-CD1 4.25Å; N387-L397 WeakPolarHBondContact ND2-CD1 3.34Å; C394-L397 PolarHBondContact O-N 3.25Å; C394-L397 VanDerWaalsContact O-N 3.07Å; C394-L397 PolarHBondContact SG-N 2.67Å; C394-L397 VanDerWaalsContact SG-N 3.42Å; L397-H401 WeakPolarHBondContact O-CB 3.33Å; L397-H401 PolarHBondContact O-N 3.16Å; L397-L406 HydrophobicContact CD2-CD1 4.14Å; L397-L406 HydrophobicContact CD2-CD2 4.36Å; L397-P411 HydrophobicContact CB-CB 4.28Å
398	I	94.8	Very high	93.8	Very high	10 Å²	10	31.6 Å²	31.6	5%	0.051	17%	0.17	C	C	.	.	H	α-helix	trans	-63.7	-49.1	177.9	-63.3	-71.5	0	0	0	110	L329 F332 I348 P393 C394 R395 H396 V400 H401 F402 P411	L329-I398 HydrophobicContact CD1-CD1 4.27Å; L329-I398 HydrophobicContact CD1-CG2 4.1Å; F332-I398 HydrophobicContact CD1-CD1 3.97Å; F332-I398 HydrophobicContact CE1-CD1 3.53Å; F332-I398 HydrophobicContact CZ-CD1 4.24Å; I348-I398 HydrophobicContact CD1-CB 4.4Å; I348-I398 HydrophobicContact CD1-CD1 4.46Å; I348-I398 HydrophobicContact CD1-CG1 3.97Å; I348-I398 HydrophobicContact CD1-CG2 4.03Å; I348-I398 HydrophobicContact CG1-CG1 4.36Å; I348-I398 HydrophobicContact CG1-CG2 4.36Å; P393-I398 HydrophobicContact CB-CD1 4.41Å; C394-I398 VanDerWaalsContact O-CG1 3.25Å; C394-I398 WeakPolarHBondContact O-CG1 3.43Å; C394-I398 PolarHBondContact O-N 2.58Å; R395-I398 PolarHBondContact O-N 2.75Å; H396-I398 VanDerWaalsContact C-N 3.29Å; H396-I398 PolarHBondContact O-N 2.96Å; I398-V400 PolarHBondContact O-N 2.73Å; I398-H401 PolarHBondContact O-N 3.49Å; I398-F402 HydrophobicContact CD1-CE2 4.5Å; I398-F402 HydrophobicContact CG2-CD2 3.76Å; I398-F402 HydrophobicContact CG2-CE2 3.92Å; I398-F402 VanDerWaalsContact O-CD2 3.24Å; I398-F402 WeakPolarHBondContact O-CD2 3.2Å; I398-F402 PolarHBondContact O-N 3.41Å; I398-P411 HydrophobicContact CD1-CB 3.89Å; I398-P411 HydrophobicContact CD1-CG 3.67Å
399	K	93.7	Very high	93.6	Very high	91 Å²	91	32.1 Å²	32.1	40%	0.396	18%	0.182	S	C	.	.	H	α-helix	trans	-57.4	-49.3	177.1	-178	64.3	174.3	-175.4	0	111.7	I354 I356 R395 H396 S403	I354-K399 HydrophobicContact CB-CG 4.35Å; I354-K399 HydrophobicContact CD1-CB 4.21Å; I354-K399 HydrophobicContact CG2-CG 4.21Å; I356-K399 HydrophobicContact CD1-CG 4.41Å; R395-K399 VanDerWaalsContact O-CB 3.29Å; R395-K399 WeakPolarHBondContact O-CB 3.25Å; R395-K399 PolarHBondContact O-N 3.42Å; H396-K399 PolarHBondContact O-N 2.76Å; K399-S403 WeakPolarHBondContact O-CB 3.36Å; K399-S403 PolarHBondContact O-N 2.68Å; K399-S403 PolarHBondContact O-OG 2.9Å
400	V	94.4	Very high	93.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-44.6	179.1	171.7	0	0	0	0	111.3	I364 V375 H396 I398 F402 S403 I404 G405 L406	I364-V400 HydrophobicContact CB-CG1 4.38Å; I364-V400 HydrophobicContact CB-CG2 4.05Å; I364-V400 HydrophobicContact CG1-CG1 3.85Å; I364-V400 HydrophobicContact CG1-CG2 4.39Å; I364-V400 HydrophobicContact CG2-CG2 3.83Å; V375-V400 HydrophobicContact CB-CG2 4.17Å; V375-V400 HydrophobicContact CG1-CB 4.21Å; V375-V400 HydrophobicContact CG1-CG1 4.1Å; V375-V400 HydrophobicContact CG1-CG2 4.19Å; V375-V400 HydrophobicContact CG2-CG2 4.03Å; H396-V400 WeakPolarHBondContact O-CG2 3.32Å; H396-V400 PolarHBondContact O-N 2.82Å; I398-V400 PolarHBondContact O-N 2.73Å; V400-F402 PolarHBondContact O-N 2.87Å; V400-S403 PolarHBondContact O-N 3.04Å; V400-I404 PolarHBondContact O-N 3.48Å; V400-G405 PolarHBondContact O-N 2.94Å; V400-L406 HydrophobicContact CG1-CD2 3.88Å
401	H	94.6	Very high	93.4	Very high	44 Å²	44	32.1 Å²	32.1	20%	0.204	18%	0.184	C	C	.	.	H	α-helix	trans	-58.9	-47	179.7	179.4	72.5	0	0	0	112.3	L397 I398 G405 L406 G409 P411	L397-H401 WeakPolarHBondContact O-CB 3.33Å; L397-H401 PolarHBondContact O-N 3.16Å; I398-H401 PolarHBondContact O-N 3.49Å; H401-G405 VanDerWaalsContact O-CA 3.28Å; H401-G405 WeakPolarHBondContact O-CA 3.39Å; H401-G405 PolarHBondContact O-N 3.39Å; H401-L406 HydrophobicContact CB-CD1 3.83Å; H401-L406 HydrophobicContact CB-CG 3.95Å; H401-G409 PolarHBondContact CE1-O 3.42Å; H401-P411 HydrophobicContact CB-CB 4.22Å; H401-P411 HydrophobicContact CB-CG 4.35Å
402	F	91.1	Very high	93.2	Very high	83 Å²	83	32.8 Å²	32.8	36%	0.364	19%	0.189	S	C	.	.	H	α-helix	trans	-82.5	-18.6	-177.9	-72.3	-69.9	0	0	0	114.4	K328 L329 I398 V400	K328-F402 HydrophobicContact CB-CE1 3.84Å; K328-F402 HydrophobicContact CB-CZ 4.38Å; K328-F402 HydrophobicContact CD-CE1 4.41Å; L329-F402 HydrophobicContact CD1-CE2 4.1Å; I398-F402 HydrophobicContact CD1-CE2 4.5Å; I398-F402 HydrophobicContact CG2-CD2 3.76Å; I398-F402 HydrophobicContact CG2-CE2 3.92Å; I398-F402 VanDerWaalsContact O-CD2 3.24Å; I398-F402 WeakPolarHBondContact O-CD2 3.2Å; I398-F402 PolarHBondContact O-N 3.41Å; V400-F402 PolarHBondContact O-N 2.87Å
403	S	90.7	Very high	93	Very high	66 Å²	66	37.7 Å²	37.7	46%	0.462	21%	0.207	S	C	.	.	H	α-helix	trans	-96.2	-39	-179.7	-48.3	0	0	0	0	113.5	K399 V400	K399-S403 WeakPolarHBondContact O-CB 3.36Å; K399-S403 PolarHBondContact O-N 2.68Å; K399-S403 PolarHBondContact O-OG 2.9Å; V400-S403 PolarHBondContact O-N 3.04Å
404	I	91.7	Very high	92.9	Very high	61 Å²	61	39.7 Å²	39.7	31%	0.313	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-31.7	-171.9	-58.3	176.5	0	0	0	111.4	I356 V359 I364 V400	I356-I404 HydrophobicContact CD1-CD1 3.82Å; I356-I404 HydrophobicContact CD1-CG1 4.3Å; I356-I404 HydrophobicContact CG2-CD1 4.11Å; V359-I404 HydrophobicContact CG1-CD1 4.33Å; V359-I404 HydrophobicContact CG2-CD1 3.75Å; I364-I404 HydrophobicContact CD1-CD1 3.98Å; I364-I404 HydrophobicContact CG1-CD1 4.45Å; I364-I404 HydrophobicContact CG2-CD1 4.43Å; V400-I404 PolarHBondContact O-N 3.48Å
405	G	92.3	Very high	92.8	Very high	22 Å²	22	43 Å²	43	23%	0.227	24%	0.237	C	C	.	.			trans	95.7	144.4	-175.5	0	0	0	0	0	113.3	R377 V400 H401	R377-G405 PolarHBondContact NE-O 3.46Å; R377-G405 PolarHBondContact NH2-O 3.4Å; V400-G405 PolarHBondContact O-N 2.94Å; H401-G405 VanDerWaalsContact O-CA 3.28Å; H401-G405 WeakPolarHBondContact O-CA 3.39Å; H401-G405 PolarHBondContact O-N 3.39Å
406	L	93.3	Very high	92.7	Very high	13 Å²	13	42.4 Å²	42.4	7%	0.068	23%	0.234	C	C	.	.			trans	-102.8	142.4	171.2	-63.8	172.6	0	0	0	109.3	V375 R377 L397 V400 H401 T408 G409 P411	V375-L406 HydrophobicContact CG1-CD2 4.12Å; R377-L406 HydrophobicContact CB-CD2 4.41Å; R377-L406 HydrophobicContact CG-CD2 4.33Å; L397-L406 HydrophobicContact CD2-CD1 4.14Å; L397-L406 HydrophobicContact CD2-CD2 4.36Å; V400-L406 HydrophobicContact CG1-CD2 3.88Å; H401-L406 HydrophobicContact CB-CD1 3.83Å; H401-L406 HydrophobicContact CB-CG 3.95Å; L406-T408 PolarHBondContact O-N 3.08Å; L406-G409 PolarHBondContact O-N 2.75Å; L406-P411 HydrophobicContact CD1-CB 4.07Å
407	H	91.2	Very high	92.6	Very high	104 Å²	104	42.2 Å²	42.2	48%	0.481	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.9	178.1	-60.8	-51.1	0	0	0	112.2	D361 R377 N378 G409	D361-H407 PolarHBondContact O-NE2 3.21Å; D361-H407 VanDerWaalsContact O-NE2 3.14Å; R377-H407 WeakPolarHBondContact O-CB 3.48Å; R377-H407 PolarHBondContact O-N 2.89Å; N378-H407 PolarHBondContact OD1-CD2 3.15Å; H407-G409 PolarHBondContact O-N 2.78Å
408	T	87.8	Confident	92.5	Very high	53 Å²	53	43.3 Å²	43.3	33%	0.325	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-15.3	171.1	57.8	0	0	0	0	113.9	N378 L406 T410	N378-T408 WeakPolarHBondContact O-CG2 3.47Å; L406-T408 PolarHBondContact O-N 3.08Å; T408-T410 PolarHBondContact O-N 2.86Å; T408-T410 VanDerWaalsContact O-N 3.15Å; T408-T410 PolarHBondContact OG1-O 2.79Å
409	G	90.8	Very high	92.2	Very high	56 Å²	56	43.5 Å²	43.5	58%	0.577	24%	0.241	S	C	*	.	S	Bend	trans	72.2	-4.5	-175.1	0	0	0	0	0	115.3	H401 L406 H407	H401-G409 PolarHBondContact CE1-O 3.42Å; L406-G409 PolarHBondContact O-N 2.75Å; H407-G409 PolarHBondContact O-N 2.78Å
410	T	91.8	Very high	91.9	Very high	48 Å²	48	43 Å²	43	29%	0.294	25%	0.249	S	C	.	.	S	Bend	trans	-147.1	142.7	179.3	179	0	0	0	0	111.7	T408 C412	T408-T410 PolarHBondContact O-N 2.86Å; T408-T410 VanDerWaalsContact O-N 3.15Å; T408-T410 PolarHBondContact OG1-O 2.79Å; T410-C412 PolarHBondContact O-N 3.06Å; T410-C412 PolarHBondContact OG1-N 2.8Å; T410-C412 VanDerWaalsContact OG1-N 3.16Å
411	P	93	Very high	91.7	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.013	26%	0.258	C	S	.	.	S	Bend	trans	-78.4	-5.8	172.2	27.9	-25.7	0	0	0	113	F332 L397 I398 H401 L406	F332-P411 HydrophobicContact CD2-CG 4.12Å; F332-P411 HydrophobicContact CE1-CG 4.07Å; F332-P411 HydrophobicContact CE2-CG 3.62Å; F332-P411 HydrophobicContact CZ-CB 4.37Å; F332-P411 HydrophobicContact CZ-CG 3.59Å; L397-P411 HydrophobicContact CB-CB 4.28Å; I398-P411 HydrophobicContact CD1-CB 3.89Å; I398-P411 HydrophobicContact CD1-CG 3.67Å; H401-P411 HydrophobicContact CB-CB 4.22Å; H401-P411 HydrophobicContact CB-CG 4.35Å; L406-P411 HydrophobicContact CD1-CB 4.07Å
412	C	93	Very high	91.3	Very high	17 Å²	17	43.7 Å²	43.7	12%	0.115	25%	0.253	C	S	.	.			trans	-100.3	83.5	175.2	-174.4	0	0	0	0	111.6	F332 L336 P393 T410 Y414	F332-C412 HydrophobicContact CE2-CB 3.76Å; F332-C412 HydrophobicContact CZ-CB 3.91Å; L336-C412 HydrophobicContact CD2-CB 3.97Å; P393-C412 HydrophobicContact CG-CB 4.03Å; T410-C412 PolarHBondContact O-N 3.06Å; T410-C412 PolarHBondContact OG1-N 2.8Å; T410-C412 VanDerWaalsContact OG1-N 3.16Å; C412-Y414 VanDerWaalsContact C-N 3.35Å; C412-Y414 PolarHBondContact O-N 2.87Å
413	R	92	Very high	90.8	Very high	102 Å²	102	43.2 Å²	43.2	39%	0.385	25%	0.254	S	S	.	.			trans	-60.5	-40.5	176	178.9	-166.7	171.6	106.8	-6.5	113.1	N379 P415	N379-R413 VanDerWaalsContact CA-NH1 3.31Å; N379-R413 WeakPolarHBondContact O-CD 3.47Å; N379-R413 WeakPolarHBondContact O-CG 3.49Å; N379-R413 PolarHBondContact O-NH1 3.04Å; N379-R413 PolarHBondContact OD1-NH1 2.81Å; R413-P415 WeakPolarHBondContact O-CD 3.4Å
414	Y	93.8	Very high	90.4	Very high	44 Å²	44	45.4 Å²	45.4	17%	0.173	26%	0.257	C	S	.	.			trans	-93.6	110.8	-168.1	-62.5	-84.1	0	0	0	111	L391 C412 R416 W417	L391-Y414 HydrophobicContact CB-CD1 4.24Å; L391-Y414 HydrophobicContact CB-CD2 3.6Å; L391-Y414 HydrophobicContact CB-CE1 4.44Å; L391-Y414 HydrophobicContact CB-CE2 3.82Å; L391-Y414 HydrophobicContact CB-CG 3.82Å; L391-Y414 HydrophobicContact CD1-CD1 3.86Å; L391-Y414 HydrophobicContact CD1-CE1 3.88Å; L391-Y414 HydrophobicContact CD1-CG 4.26Å; L391-Y414 HydrophobicContact CD2-CE1 4.06Å; L391-Y414 HydrophobicContact CD2-CE2 3.91Å; L391-Y414 HydrophobicContact CG-CD1 4.48Å; L391-Y414 HydrophobicContact CG-CD2 4.47Å; L391-Y414 HydrophobicContact CG-CE1 4.35Å; L391-Y414 HydrophobicContact CG-CE2 4.32Å; L391-Y414 WeakPolarHBondContact O-CD2 3.31Å; C412-Y414 VanDerWaalsContact C-N 3.35Å; C412-Y414 PolarHBondContact O-N 2.87Å; Y414-R416 PolarHBondContact O-N 3.29Å; Y414-W417 PolarHBondContact O-N 2.96Å; Y414-W417 VanDerWaalsContact O-N 3.17Å
415	P	92.8	Very high	89.8	Confident	70 Å²	70	47 Å²	47	46%	0.455	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-58	-27.3	-175	-26.3	36.2	0	0	0	113.2	R413 W417 S418 H421	R413-P415 WeakPolarHBondContact O-CD 3.4Å; P415-W417 PolarHBondContact O-N 2.71Å; P415-S418 WeakPolarHBondContact O-CB 3.22Å; P415-S418 PolarHBondContact O-N 3.48Å; P415-S418 PolarHBondContact O-OG 3.32Å; P415-H421 HydrophobicContact CB-CB 4.07Å; P415-H421 WeakPolarHBondContact O-CB 3.48Å; P415-H421 PolarHBondContact O-CD2 3.36Å
416	R	92.9	Very high	89.1	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-49.2	-29.6	177.9	85.4	-176	-34.2	-71.6	-7.8	114.2	F102 E104 T127 D128 Y414 N422	F102-R416 HydrophobicContact CD1-CB 3.98Å; F102-R416 HydrophobicContact CE1-CB 4.11Å; E104-R416 VanDerWaalsContact CD-NE 3.25Å; E104-R416 VanDerWaalsContact OE1-CD 3.29Å; E104-R416 WeakPolarHBondContact OE1-CD 3.48Å; E104-R416 IonicContact OE1-NE 2.73Å; E104-R416 PolarHBondContact OE1-NE 3.01Å; E104-R416 VanDerWaalsContact OE1-NE 3.1Å; E104-R416 IonicContact OE2-CZ 2.95Å; E104-R416 IonicContact OE2-NE 3.73Å; E104-R416 PolarHBondContact OE2-NE 2.79Å; E104-R416 IonicContact OE2-NH2 3.7Å; E104-R416 PolarHBondContact OE2-NH2 2.8Å; T127-R416 PolarHBondContact O-NH2 3.41Å; D128-R416 PolarHBondContact O-NH1 3.09Å; Y414-R416 PolarHBondContact O-N 3.29Å; R416-N422 PolarHBondContact O-ND2 3.02Å
417	W	94.1	Very high	87.7	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-91.2	-8	-178.5	-59.7	129.6	0	0	0	113.7	L131 L266 L336 T337 Y339 A340 E390 L391 L392 Y414 P415	L131-W417 HydrophobicContact CD2-CH2 3.71Å; L131-W417 HydrophobicContact CD2-CZ3 4.12Å; L266-W417 HydrophobicContact CB-CH2 4.23Å; L266-W417 HydrophobicContact CB-CZ2 4.31Å; L266-W417 HydrophobicContact CD2-CH2 4.41Å; L266-W417 HydrophobicContact CD2-CZ2 3.83Å; L336-W417 CarbonylContact C-O 3.56Å; L336-W417 WeakPolarHBondContact CA-O 3.48Å; L336-W417 HydrophobicContact CD2-CB 4.45Å; T337-W417 PolarHBondContact N-O 3.35Å; Y339-W417 HydrophobicContact CD1-CE3 4.37Å; Y339-W417 HydrophobicContact CD1-CH2 4.13Å; Y339-W417 AromaticContact CD1-CZ3 3.77Å; Y339-W417 HydrophobicContact CD1-CZ3 3.77Å; Y339-W417 HydrophobicContact CE1-CH2 4.14Å; Y339-W417 HydrophobicContact CE1-CZ3 4.25Å; A340-W417 HydrophobicContact CB-CB 3.8Å; A340-W417 HydrophobicContact CB-CD2 4.13Å; A340-W417 HydrophobicContact CB-CE3 4.02Å; A340-W417 HydrophobicContact CB-CG 4.08Å; E390-W417 WeakPolarHBondContact O-CZ2 3.37Å; E390-W417 PolarHBondContact O-NE1 2.91Å; L391-W417 VanDerWaalsContact C-NE1 3.29Å; L391-W417 PolarHBondContact O-NE1 2.9Å; L392-W417 HydrophobicContact CD2-CD2 3.66Å; L392-W417 HydrophobicContact CD2-CE3 4.26Å; L392-W417 HydrophobicContact CD2-CG 3.8Å; L392-W417 HydrophobicContact CD2-CZ2 4.25Å; L392-W417 HydrophobicContact CG-CZ2 4.45Å; Y414-W417 PolarHBondContact O-N 2.96Å; Y414-W417 VanDerWaalsContact O-N 3.17Å; P415-W417 PolarHBondContact O-N 2.71Å
418	S	91.8	Very high	85.7	Confident	22 Å²	22	48.5 Å²	48.5	15%	0.154	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-83.3	142.3	175.8	71.6	0	0	0	0	111.6	Q335 P415 H421 N422	Q335-S418 CarbonylContact O-C 3.09Å; Q335-S418 WeakPolarHBondContact O-CA 3.07Å; P415-S418 WeakPolarHBondContact O-CB 3.22Å; P415-S418 PolarHBondContact O-N 3.48Å; P415-S418 PolarHBondContact O-OG 3.32Å; S418-H421 WeakPolarHBondContact OG-CB 3.21Å; S418-H421 PolarHBondContact OG-N 2.79Å; S418-N422 PolarHBondContact O-N 3.44Å; S418-N422 PolarHBondContact O-ND2 3.12Å
419	R	89.1	Confident	83.2	Confident	15 Å²	15	49.9 Å²	49.9	6%	0.057	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-44	177.2	-65.4	-171.5	170.8	-174.8	-18.1	111.8	L317 K319 N334 Q335 L336 D338 H421 N422 L423	L317-R419 HydrophobicContact CD2-CG 4.22Å; L317-R419 WeakPolarHBondContact O-CD 3.48Å; L317-R419 PolarHBondContact O-NH1 3.49Å; K319-R419 PolarHBondContact O-NH1 3.02Å; K319-R419 PolarHBondContact O-NH2 2.68Å; N334-R419 VanDerWaalsContact O-CD 3.23Å; N334-R419 WeakPolarHBondContact O-CD 3.26Å; N334-R419 PolarHBondContact O-NE 3.48Å; N334-R419 PolarHBondContact O-NH1 3.32Å; Q335-R419 WeakPolarHBondContact O-CG 3.49Å; Q335-R419 PolarHBondContact O-N 3.17Å; L336-R419 VanDerWaalsContact C-CG 3.45Å; L336-R419 WeakPolarHBondContact O-CD 3.12Å; L336-R419 WeakPolarHBondContact O-CG 3.03Å; L336-R419 PolarHBondContact O-NE 3.21Å; D338-R419 IonicContact OD1-CZ 3.02Å; D338-R419 IonicContact OD1-NH2 2.69Å; D338-R419 PolarHBondContact OD1-NH2 2.84Å; R419-H421 VanDerWaalsContact C-N 3.32Å; R419-H421 PolarHBondContact O-N 3.3Å; R419-N422 PolarHBondContact O-N 3.25Å; R419-L423 WeakPolarHBondContact O-CG 3.38Å; R419-L423 PolarHBondContact O-N 3.4Å
420	S	87.7	Confident	80.8	Confident	81 Å²	81	52.6 Å²	52.6	57%	0.566	30%	0.304	S	S	*	.	H	α-helix	trans	-56.2	-47.9	178.9	53.6	0	0	0	0	111.1	N422 L423 Q424	S420-N422 PolarHBondContact O-N 3.17Å; S420-L423 PolarHBondContact O-N 3.01Å; S420-Q424 PolarHBondContact O-N 2.86Å
421	H	89.2	Confident	78.1	Confident	38 Å²	38	59.8 Å²	59.8	18%	0.176	33%	0.331	C	S	.	.	H	α-helix	trans	-69.1	-12	176	-174.7	78.3	0	0	0	113.6	R101 P415 S418 R419	R101-H421 WeakPolarHBondContact CG-NE2 3.26Å; R101-H421 PolarHBondContact NE-O 3.34Å; R101-H421 VanDerWaalsContact NH2-C 3.26Å; R101-H421 PolarHBondContact NH2-O 3.49Å; R101-H421 PolarHBondContact O-NE2 3.3Å; P415-H421 HydrophobicContact CB-CB 4.07Å; P415-H421 WeakPolarHBondContact O-CB 3.48Å; P415-H421 PolarHBondContact O-CD2 3.36Å; S418-H421 WeakPolarHBondContact OG-CB 3.21Å; S418-H421 PolarHBondContact OG-N 2.79Å; R419-H421 VanDerWaalsContact C-N 3.32Å; R419-H421 PolarHBondContact O-N 3.3Å
422	N	87.2	Confident	75.3	Confident	20 Å²	20	65.9 Å²	65.9	11%	0.107	35%	0.354	C	S	.	.	H	α-helix	trans	-97	-17.6	171.7	-79.4	-96.7	0	0	0	113.1	R101 F102 G129 L317 T337 R416 S418 R419 S420	R101-N422 PolarHBondContact NH2-O 3.17Å; F102-N422 WeakPolarHBondContact CZ-OD1 3.28Å; G129-N422 VanDerWaalsContact CA-OD1 3.32Å; G129-N422 WeakPolarHBondContact CA-OD1 3.44Å; L317-N422 HydrophobicContact CD1-CB 3.45Å; L317-N422 VanDerWaalsContact CD1-CB 3.45Å; T337-N422 WeakPolarHBondContact CG2-ND2 3.32Å; R416-N422 PolarHBondContact O-ND2 3.02Å; S418-N422 PolarHBondContact O-N 3.44Å; S418-N422 PolarHBondContact O-ND2 3.12Å; R419-N422 PolarHBondContact O-N 3.25Å; S420-N422 PolarHBondContact O-N 3.17Å
423	L	80.5	Confident	72.6	Confident	73 Å²	73	71 Å²	71	38%	0.382	38%	0.38	S	S	.	.	H	α-helix	trans	-89	-18.9	-178.8	-74.7	171.8	0	0	0	114.2	L317 R419 S420	L317-L423 HydrophobicContact CB-CD1 4.31Å; L317-L423 HydrophobicContact CB-CD2 3.99Å; L317-L423 HydrophobicContact CB-CG 4.18Å; L317-L423 HydrophobicContact CD1-CD2 3.93Å; L317-L423 HydrophobicContact CD1-CG 3.89Å; R419-L423 WeakPolarHBondContact O-CG 3.38Å; R419-L423 PolarHBondContact O-N 3.4Å; S420-L423 PolarHBondContact O-N 3.01Å
424	Q	82	Confident	70	Confident	111 Å²	111	73.7 Å²	73.7	52%	0.519	39%	0.394	S	S	.	.	S	Bend	trans	-57.2	137.1	176	-65.1	167.1	-25.7	0	0	110.9	R101 S420	R101-Q424 VanDerWaalsContact CZ-O 3.27Å; R101-Q424 PolarHBondContact NH1-O 2.87Å; R101-Q424 VanDerWaalsContact NH2-CB 3.33Å; R101-Q424 PolarHBondContact NH2-O 3.46Å; S420-Q424 PolarHBondContact O-N 2.86Å
425	P	79.3	Confident	67.4	Low	95 Å²	95	79 Å²	79	62%	0.617	42%	0.421	S	S	*	.			trans	-59.1	141.1	172.7	-23.1	33.6	0	0	0	111.4	S427	P425-S427 PolarHBondContact O-N 2.83Å
426	L	77.5	Confident	65.1	Low	11 Å²	11	80.5 Å²	80.5	6%	0.058	43%	0.428	C	S	.	.	S	Bend	trans	-73	-18.5	169.9	-68.3	173.2	0	0	0	112.2	E94 E97 L98 L309 T428	E94-L426 HydrophobicContact CB-CB 4.32Å; E97-L426 HydrophobicContact CB-CD2 4.38Å; E97-L426 WeakPolarHBondContact CG-O 3.46Å; L98-L426 HydrophobicContact CB-CD1 4.39Å; L98-L426 HydrophobicContact CB-CD2 4.31Å; L98-L426 HydrophobicContact CD1-CD1 4.13Å; L98-L426 HydrophobicContact CD1-CD2 4.09Å; L309-L426 HydrophobicContact CD2-CD1 3.49Å; L309-L426 VanDerWaalsContact CD2-CD1 3.49Å; L309-L426 HydrophobicContact CG-CD1 4.24Å; L426-T428 VanDerWaalsContact C-N 3.34Å; L426-T428 PolarHBondContact O-N 2.85Å; L426-T428 VanDerWaalsContact O-N 3.15Å
427	S	64.7	Low	63.1	Low	67 Å²	67	85.1 Å²	85.1	47%	0.469	45%	0.453	S	S	.	.			trans	-83.3	81	170.7	63.8	0	0	0	0	109.1	P425 A429	P425-S427 PolarHBondContact O-N 2.83Å; S427-A429 PolarHBondContact O-N 3.15Å; S427-A429 VanDerWaalsContact O-N 3.08Å
428	T	49	Very low	61.1	Low	92 Å²	92	88.4 Å²	88.4	56%	0.564	47%	0.473	S	S	*	.			trans	-67.7	94.4	134	38.7	0	0	0	0	104.1	L426 L430	L426-T428 VanDerWaalsContact C-N 3.34Å; L426-T428 PolarHBondContact O-N 2.85Å; L426-T428 VanDerWaalsContact O-N 3.15Å; T428-L430 PolarHBondContact O-N 3.39Å
429	A	35.6	Very low	59.4	Low	83 Å²	83	93.3 Å²	93.3	69%	0.686	50%	0.498	S	S	*	.			trans	-46.7	106.1	156.8	0	0	0	0	0	104.8	S427 K431	S427-A429 PolarHBondContact O-N 3.15Å; S427-A429 VanDerWaalsContact O-N 3.08Å; A429-K431 PolarHBondContact O-N 2.8Å
430	L	39.2	Very low	57.9	Low	113 Å²	113	96 Å²	96	59%	0.592	52%	0.519	S	S	*	.			trans	-55	98.4	138.9	-84.2	106.5	0	0	0	102.8	T428 R432	T428-L430 PolarHBondContact O-N 3.39Å; L430-R432 HydrophobicContact CB-CB 4.26Å; L430-R432 HydrophobicContact CB-CG 3.5Å; L430-R432 HydrophobicContact CD2-CB 4.4Å; L430-R432 HydrophobicContact CD2-CG 3.35Å; L430-R432 HydrophobicContact CG-CG 4.01Å; L430-R432 PolarHBondContact O-N 3.31Å
431	K	35.3	Very low	56.6	Low	198 Å²	198	94.3 Å²	94.3	86%	0.861	51%	0.51	S	S	*	.				-48.9	81.2	119.5	-73.2	-174.7	178	-177.4	0	104	A429 D433	A429-K431 PolarHBondContact O-N 2.8Å; K431-D433 VanDerWaalsContact C-N 3.26Å; K431-D433 PolarHBondContact O-N 2.75Å
432	R	35.4	Very low	55.4	Low	130 Å²	130	97 Å²	97	49%	0.491	52%	0.523	S	S	.	.			trans	-60.4	114.1	160.3	-82.2	-168.2	-170.7	152.2	9	99.3	Y93 L430 K434	Y93-R432 PolarHBondContact OH-NH1 3.47Å; Y93-R432 PolarHBondContact OH-NH2 3.29Å; L430-R432 HydrophobicContact CB-CB 4.26Å; L430-R432 HydrophobicContact CB-CG 3.5Å; L430-R432 HydrophobicContact CD2-CB 4.4Å; L430-R432 HydrophobicContact CD2-CG 3.35Å; L430-R432 HydrophobicContact CG-CG 4.01Å; L430-R432 PolarHBondContact O-N 3.31Å; R432-K434 PolarHBondContact O-N 2.85Å; R432-K434 VanDerWaalsContact O-N 3.09Å
433	D	34.7	Very low	54.5	Low	126 Å²	126	98.9 Å²	98.9	67%	0.674	54%	0.542	S	S	*	.			trans	-32.8	125.2	145.3	-82.6	-44.5	0	0	0	106.4	K431 Q435	K431-D433 VanDerWaalsContact C-N 3.26Å; K431-D433 PolarHBondContact O-N 2.75Å; D433-Q435 HydrophobicContact CB-CB 4.36Å; D433-Q435 CarbonylContact O-C 3.58Å; D433-Q435 WeakPolarHBondContact O-CA 3.47Å; D433-Q435 PolarHBondContact O-N 2.81Å
434	K	38	Very low	54	Low	157 Å²	157	101.2 Å²	101.2	68%	0.683	55%	0.552	S	S	*	*	S	Bend	trans	-59.4	20.4	170.1	-73.8	-179.5	174.9	-179.8	0	112.2	R432 V436	R432-K434 PolarHBondContact O-N 2.85Å; R432-K434 VanDerWaalsContact O-N 3.09Å; K434-V436 PolarHBondContact O-N 3.39Å
435	Q	39.6	Very low	53.5	Low	157 Å²	157	98.9 Å²	98.9	73%	0.734	55%	0.546	S	S	*	.			trans	-66.1	70.8	144.8	-89.7	162.9	-17	0	0	109.1	D433 D437	D433-Q435 HydrophobicContact CB-CB 4.36Å; D433-Q435 CarbonylContact O-C 3.58Å; D433-Q435 WeakPolarHBondContact O-CA 3.47Å; D433-Q435 PolarHBondContact O-N 2.81Å; Q435-D437 PolarHBondContact O-N 3.33Å
436	V	44.3	Very low	53.2	Low	100 Å²	100	98.7 Å²	98.7	61%	0.606	54%	0.538	S	S	*	.			trans	-32.7	132.2	130.5	175.8	0	0	0	0	106.4	K434 V438 A441	K434-V436 PolarHBondContact O-N 3.39Å; V436-V438 VanDerWaalsContact O-CG2 3.26Å; V436-V438 WeakPolarHBondContact O-CG2 3.23Å; V436-V438 PolarHBondContact O-N 2.93Å; V436-A441 HydrophobicContact CG1-CB 4.27Å
437	D	51	Low	53.1	Low	98 Å²	98	99.9 Å²	99.9	52%	0.524	55%	0.553	S	S	.	*			trans	-56.1	86.9	171.6	-178.5	-3.7	0	0	0	108.3	Q435 N439 S440 A441	Q435-D437 PolarHBondContact O-N 3.33Å; D437-N439 PolarHBondContact O-N 2.74Å; D437-N439 VanDerWaalsContact O-N 3.16Å; D437-N439 WeakPolarHBondContact OD1-CB 3.43Å; D437-N439 PolarHBondContact OD1-N 2.98Å; D437-S440 PolarHBondContact O-N 3.28Å; D437-S440 VanDerWaalsContact O-N 3.11Å; D437-S440 PolarHBondContact OD1-N 3.34Å; D437-S440 WeakPolarHBondContact OD2-CB 3.48Å; D437-A441 WeakPolarHBondContact O-CB 3.37Å; D437-A441 PolarHBondContact O-N 3.23Å
438	V	52.5	Low	53.5	Low	69 Å²	69	102.8 Å²	102.8	42%	0.418	56%	0.557	S	S	.	*	H	α-helix	trans	-59.8	-29.8	-176.8	176.8	0	0	0	0	107.4	V436 M442	V436-V438 VanDerWaalsContact O-CG2 3.26Å; V436-V438 WeakPolarHBondContact O-CG2 3.23Å; V436-V438 PolarHBondContact O-N 2.93Å; V438-M442 HydrophobicContact CG1-CE 3.7Å; V438-M442 HydrophobicContact CG1-CG 4Å; V438-M442 HydrophobicContact CG1-SD 3.95Å; V438-M442 WeakPolarHBondContact O-CA 3.43Å; V438-M442 WeakPolarHBondContact O-CB 3.15Å; V438-M442 WeakPolarHBondContact O-CG 3.21Å; V438-M442 PolarHBondContact O-N 2.81Å
439	N	55.8	Low	54.5	Low	126 Å²	126	100.1 Å²	100.1	67%	0.674	54%	0.539	S	S	*	.	H	α-helix	trans	-71.7	-43.7	178.1	-61.5	-30.4	0	0	0	111.9	D437 A443	D437-N439 PolarHBondContact O-N 2.74Å; D437-N439 VanDerWaalsContact O-N 3.16Å; D437-N439 WeakPolarHBondContact OD1-CB 3.43Å; D437-N439 PolarHBondContact OD1-N 2.98Å; N439-A443 WeakPolarHBondContact O-CB 3.29Å; N439-A443 PolarHBondContact O-N 2.92Å
440	S	57.5	Low	56.3	Low	71 Å²	71	102.3 Å²	102.3	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-70.8	-38.7	175.3	-175.3	0	0	0	0	112.4	D437 A443 M444	D437-S440 PolarHBondContact O-N 3.28Å; D437-S440 VanDerWaalsContact O-N 3.11Å; D437-S440 PolarHBondContact OD1-N 3.34Å; D437-S440 WeakPolarHBondContact OD2-CB 3.48Å; S440-A443 PolarHBondContact O-N 3.2Å; S440-M444 WeakPolarHBondContact O-CB 3.36Å; S440-M444 PolarHBondContact O-N 3.43Å
441	A	59.5	Low	57.9	Low	45 Å²	45	102.5 Å²	102.5	37%	0.372	53%	0.533	S	S	.	.	H	α-helix	trans	-65.7	-44.3	173.9	0	0	0	0	0	111.2	V436 D437 M444 V445	V436-A441 HydrophobicContact CG1-CB 4.27Å; D437-A441 WeakPolarHBondContact O-CB 3.37Å; D437-A441 PolarHBondContact O-N 3.23Å; A441-M444 PolarHBondContact O-N 3.13Å; A441-V445 VanDerWaalsContact O-CG2 3.31Å; A441-V445 WeakPolarHBondContact O-CG2 3.25Å; A441-V445 PolarHBondContact O-N 2.92Å
442	M	65.2	Low	59.5	Low	94 Å²	94	95.5 Å²	95.5	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-63.6	-41.1	173.8	-80.3	-171.7	176.5	0	0	111.7	V438 M444 V445 I446	V438-M442 HydrophobicContact CG1-CE 3.7Å; V438-M442 HydrophobicContact CG1-CG 4Å; V438-M442 HydrophobicContact CG1-SD 3.95Å; V438-M442 WeakPolarHBondContact O-CA 3.43Å; V438-M442 WeakPolarHBondContact O-CB 3.15Å; V438-M442 WeakPolarHBondContact O-CG 3.21Å; V438-M442 PolarHBondContact O-N 2.81Å; M442-M444 VanDerWaalsContact C-N 3.31Å; M442-M444 PolarHBondContact O-N 2.86Å; M442-V445 PolarHBondContact O-N 3.01Å; M442-I446 WeakPolarHBondContact O-CB 2.99Å; M442-I446 WeakPolarHBondContact O-CD1 3.44Å; M442-I446 WeakPolarHBondContact O-CG1 3.46Å; M442-I446 PolarHBondContact O-N 3.07Å
443	A	68.4	Low	61.3	Low	60 Å²	60	95.4 Å²	95.4	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-61	-40.7	176.9	0	0	0	0	0	111.7	N439 S440 I446 G447	N439-A443 WeakPolarHBondContact O-CB 3.29Å; N439-A443 PolarHBondContact O-N 2.92Å; S440-A443 PolarHBondContact O-N 3.2Å; A443-I446 PolarHBondContact O-N 3.33Å; A443-G447 PolarHBondContact O-N 2.9Å
444	M	68.7	Low	63.2	Low	123 Å²	123	96.1 Å²	96.1	61%	0.606	51%	0.513	S	S	*	.	H	α-helix	trans	-67.3	-41.1	175.7	-168.2	-178.9	169.5	0	0	112.2	S440 A441 M442 G447 K448	S440-M444 WeakPolarHBondContact O-CB 3.36Å; S440-M444 PolarHBondContact O-N 3.43Å; A441-M444 PolarHBondContact O-N 3.13Å; M442-M444 VanDerWaalsContact C-N 3.31Å; M442-M444 PolarHBondContact O-N 2.86Å; M444-G447 PolarHBondContact O-N 3.49Å; M444-K448 PolarHBondContact O-N 2.77Å
445	V	71.4	Confident	64.9	Low	62 Å²	62	95.8 Å²	95.8	38%	0.376	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-44.4	174.5	171.1	0	0	0	0	111.2	A441 M442 G447 K448 L449 I468	A441-V445 VanDerWaalsContact O-CG2 3.31Å; A441-V445 WeakPolarHBondContact O-CG2 3.25Å; A441-V445 PolarHBondContact O-N 2.92Å; M442-V445 PolarHBondContact O-N 3.01Å; V445-G447 VanDerWaalsContact C-N 3.34Å; V445-G447 PolarHBondContact O-N 3.16Å; V445-K448 PolarHBondContact O-N 2.99Å; V445-L449 HydrophobicContact CG1-CD1 3.9Å; V445-L449 HydrophobicContact CG1-CG 4.41Å; V445-L449 WeakPolarHBondContact O-CB 3.29Å; V445-L449 WeakPolarHBondContact O-CG 3.32Å; V445-L449 PolarHBondContact O-N 3.47Å; V445-I468 HydrophobicContact CG1-CD1 4.07Å; V445-I468 HydrophobicContact CG1-CG2 4.45Å
446	I	74	Confident	66.6	Low	91 Å²	91	90.9 Å²	90.9	47%	0.467	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-42.6	175.9	-70.9	165.4	0	0	0	110.6	M442 A443 L449 K450	M442-I446 WeakPolarHBondContact O-CB 2.99Å; M442-I446 WeakPolarHBondContact O-CD1 3.44Å; M442-I446 WeakPolarHBondContact O-CG1 3.46Å; M442-I446 PolarHBondContact O-N 3.07Å; A443-I446 PolarHBondContact O-N 3.33Å; I446-L449 PolarHBondContact O-N 2.82Å; I446-K450 WeakPolarHBondContact O-CG 3.42Å; I446-K450 PolarHBondContact O-N 2.92Å
447	G	74.8	Confident	68.3	Low	36 Å²	36	88.9 Å²	88.9	37%	0.371	49%	0.487	S	S	.	.	H	α-helix	trans	-60	-45.5	175.9	0	0	0	0	0	112.6	A443 M444 V445 K450 M451	A443-G447 PolarHBondContact O-N 2.9Å; M444-G447 PolarHBondContact O-N 3.49Å; V445-G447 VanDerWaalsContact C-N 3.34Å; V445-G447 PolarHBondContact O-N 3.16Å; G447-K450 PolarHBondContact O-N 3.04Å; G447-M451 PolarHBondContact O-N 2.94Å
448	K	73	Confident	69.5	Low	127 Å²	127	89.5 Å²	89.5	55%	0.552	50%	0.496	S	S	*	.	H	α-helix	trans	-67.1	-37.7	175.8	-73.3	-171.3	175.9	-171.4	0	112.8	M444 V445 M451 I452	M444-K448 PolarHBondContact O-N 2.77Å; V445-K448 PolarHBondContact O-N 2.99Å; K448-M451 PolarHBondContact O-N 2.9Å; K448-I452 WeakPolarHBondContact O-CG1 3.45Å; K448-I452 PolarHBondContact O-N 2.87Å
449	L	71	Confident	70.8	Confident	36 Å²	36	91.1 Å²	91.1	19%	0.188	51%	0.507	C	S	.	.	H	α-helix	trans	-64.4	-38.3	176.4	-78.4	169.8	0	0	0	112.2	V445 I446 I452 Q453 T464 V465 I468	V445-L449 HydrophobicContact CG1-CD1 3.9Å; V445-L449 HydrophobicContact CG1-CG 4.41Å; V445-L449 WeakPolarHBondContact O-CB 3.29Å; V445-L449 WeakPolarHBondContact O-CG 3.32Å; V445-L449 PolarHBondContact O-N 3.47Å; I446-L449 PolarHBondContact O-N 2.82Å; L449-I452 PolarHBondContact O-N 2.84Å; L449-Q453 WeakPolarHBondContact O-CB 3.33Å; L449-Q453 PolarHBondContact O-N 3.39Å; L449-T464 HydrophobicContact CD2-CG2 4.24Å; L449-V465 HydrophobicContact CD2-CG2 3.96Å; L449-I468 HydrophobicContact CD1-CD1 4.07Å; L449-I468 HydrophobicContact CD2-CD1 3.91Å; L449-I468 HydrophobicContact CG-CD1 4.21Å
450	K	73.8	Confident	71.7	Confident	130 Å²	130	88.2 Å²	88.2	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-62.7	-43	173.1	-74.9	179.4	176.9	-178.7	0	112.1	I446 G447 I452 Q453 D454	I446-K450 WeakPolarHBondContact O-CG 3.42Å; I446-K450 PolarHBondContact O-N 2.92Å; G447-K450 PolarHBondContact O-N 3.04Å; K450-I452 VanDerWaalsContact C-N 3.32Å; K450-I452 PolarHBondContact O-N 3.41Å; K450-Q453 WeakPolarHBondContact O-CB 3.3Å; K450-Q453 PolarHBondContact O-N 3.39Å; K450-D454 PolarHBondContact O-N 2.89Å
451	M	72.7	Confident	72.4	Confident	116 Å²	116	86.1 Å²	86.1	57%	0.571	48%	0.477	S	S	*	.	H	α-helix	trans	-60.8	-39.7	174.4	-77.6	-167.1	69.3	0	0	113	G447 K448 Q453 D454 Q455	G447-M451 PolarHBondContact O-N 2.94Å; K448-M451 PolarHBondContact O-N 2.9Å; M451-Q453 VanDerWaalsContact C-N 3.34Å; M451-D454 PolarHBondContact O-N 2.78Å; M451-Q455 WeakPolarHBondContact O-CG 3.49Å; M451-Q455 PolarHBondContact O-N 3.34Å
452	I	68.6	Low	73.2	Confident	51 Å²	51	90.6 Å²	90.6	26%	0.262	49%	0.489	S	S	.	.	H	α-helix	trans	-68.6	-36.5	177.1	-65	167.9	0	0	0	110.5	K448 L449 K450 D454 Q455 C456 V461 T464	K448-I452 WeakPolarHBondContact O-CG1 3.45Å; K448-I452 PolarHBondContact O-N 2.87Å; L449-I452 PolarHBondContact O-N 2.84Å; K450-I452 VanDerWaalsContact C-N 3.32Å; K450-I452 PolarHBondContact O-N 3.41Å; I452-D454 VanDerWaalsContact C-N 3.27Å; I452-D454 PolarHBondContact O-N 3.18Å; I452-Q455 PolarHBondContact O-N 3.37Å; I452-C456 HydrophobicContact CG2-CB 3.93Å; I452-C456 VanDerWaalsContact O-CB 3.26Å; I452-C456 WeakPolarHBondContact O-CB 3.41Å; I452-C456 PolarHBondContact O-N 3.03Å; I452-V461 HydrophobicContact CG2-CG2 4.14Å; I452-T464 HydrophobicContact CD1-CG2 4.41Å
453	Q	73.7	Confident	73.9	Confident	129 Å²	129	93.9 Å²	93.9	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-62.2	-33.5	177.1	-172.1	175.8	-3.2	0	0	112.7	L449 K450 M451 V461	L449-Q453 WeakPolarHBondContact O-CB 3.33Å; L449-Q453 PolarHBondContact O-N 3.39Å; K450-Q453 WeakPolarHBondContact O-CB 3.3Å; K450-Q453 PolarHBondContact O-N 3.39Å; M451-Q453 VanDerWaalsContact C-N 3.34Å; Q453-V461 HydrophobicContact CB-CG2 4.49Å
454	D	73.5	Confident	74.2	Confident	140 Å²	140	93.1 Å²	93.1	75%	0.749	49%	0.489	S	S	*	.	H	α-helix	trans	-80.8	-16.5	178.5	-65.5	-24.6	0	0	0	113.4	K450 M451 I452	K450-D454 PolarHBondContact O-N 2.89Å; M451-D454 PolarHBondContact O-N 2.78Å; I452-D454 VanDerWaalsContact C-N 3.27Å; I452-D454 PolarHBondContact O-N 3.18Å
455	Q	74.3	Confident	74.6	Confident	151 Å²	151	89.5 Å²	89.5	71%	0.706	47%	0.474	S	S	*	.	H	α-helix	trans	-120.1	-13.1	-170.9	-65.3	-176.6	1.9	0	0	114.9	M451 I452	M451-Q455 WeakPolarHBondContact O-CG 3.49Å; M451-Q455 PolarHBondContact O-N 3.34Å; I452-Q455 PolarHBondContact O-N 3.37Å
456	C	74.3	Confident	75	Confident	53 Å²	53	90.5 Å²	90.5	36%	0.358	48%	0.477	S	S	.	.	S	Bend	trans	-126.8	157.4	-172.6	-67.1	0	0	0	0	112.5	I452 V460	I452-C456 HydrophobicContact CG2-CB 3.93Å; I452-C456 VanDerWaalsContact O-CB 3.26Å; I452-C456 WeakPolarHBondContact O-CB 3.41Å; I452-C456 PolarHBondContact O-N 3.03Å; C456-V460 HydrophobicContact CB-CB 3.99Å; C456-V460 HydrophobicContact CB-CG1 3.94Å
457	S	80.6	Confident	75.2	Confident	59 Å²	59	95.4 Å²	95.4	41%	0.413	49%	0.49	S	S	.	.			trans	-64	151.6	175.8	77.8	0	0	0	0	111.5	T459 V460 V461	S457-T459 PolarHBondContact O-N 3.29Å; S457-V460 PolarHBondContact O-N 2.98Å; S457-V461 PolarHBondContact O-N 3.37Å
458	P	77.3	Confident	75.2	Confident	111 Å²	111	95.8 Å²	95.8	72%	0.721	48%	0.483	S	S	*	.	H	α-helix	trans	-51.4	-31.5	178	-28	34.3	0	0	0	113.6	F462	P458-F462 WeakPolarHBondContact O-CB 3.21Å; P458-F462 PolarHBondContact O-N 3.35Å
459	T	78.5	Confident	75.3	Confident	103 Å²	103	93.5 Å²	93.5	63%	0.632	48%	0.477	S	S	*	.	H	α-helix	trans	-66.1	-37.4	178.1	-36.3	0	0	0	0	112.9	S457 K463	S457-T459 PolarHBondContact O-N 3.29Å; T459-K463 PolarHBondContact O-N 3.37Å; T459-K463 VanDerWaalsContact O-N 3.12Å
460	V	74.9	Confident	75.5	Confident	64 Å²	64	94 Å²	94	39%	0.388	49%	0.487	S	S	.	.	H	α-helix	trans	-73.3	-41.2	178.9	174.9	0	0	0	0	110.6	C456 S457 F462 K463 T464	C456-V460 HydrophobicContact CB-CB 3.99Å; C456-V460 HydrophobicContact CB-CG1 3.94Å; S457-V460 PolarHBondContact O-N 2.98Å; V460-F462 VanDerWaalsContact C-N 3.35Å; V460-K463 PolarHBondContact O-N 3.31Å; V460-T464 WeakPolarHBondContact O-CB 3.49Å; V460-T464 PolarHBondContact O-N 3.2Å; V460-T464 PolarHBondContact O-OG1 3.04Å
461	V	73.2	Confident	75.4	Confident	27 Å²	27	92.6 Å²	92.6	16%	0.164	48%	0.484	C	S	.	.	H	α-helix	trans	-58.3	-49.5	173.9	-179.8	0	0	0	0	109.8	I452 Q453 S457 K463 T464 V465	I452-V461 HydrophobicContact CG2-CG2 4.14Å; Q453-V461 HydrophobicContact CB-CG2 4.49Å; S457-V461 PolarHBondContact O-N 3.37Å; V461-K463 PolarHBondContact O-N 2.97Å; V461-T464 PolarHBondContact O-N 2.9Å; V461-T464 VanDerWaalsContact O-N 3.13Å; V461-V465 HydrophobicContact CG1-CG2 4.44Å; V461-V465 WeakPolarHBondContact O-CG2 3.22Å; V461-V465 PolarHBondContact O-N 3Å
462	F	76.3	Confident	75.3	Confident	140 Å²	140	91 Å²	91	61%	0.614	48%	0.477	S	S	*	.	H	α-helix	trans	-61.4	-42.9	-179.1	-157.9	-93	0	0	0	112.8	P458 V460 T464 V465 N466	P458-F462 WeakPolarHBondContact O-CB 3.21Å; P458-F462 PolarHBondContact O-N 3.35Å; V460-F462 VanDerWaalsContact C-N 3.35Å; F462-T464 VanDerWaalsContact C-N 3.31Å; F462-T464 PolarHBondContact O-N 3.43Å; F462-V465 PolarHBondContact O-N 3.45Å; F462-N466 WeakPolarHBondContact CD1-ND2 3.29Å; F462-N466 VanDerWaalsContact CE1-ND2 3.33Å; F462-N466 WeakPolarHBondContact CE1-ND2 3.47Å; F462-N466 PolarHBondContact O-N 3.43Å; F462-N466 VanDerWaalsContact O-N 3.09Å; F462-N466 PolarHBondContact O-ND2 3.15Å
463	K	79.2	Confident	75.3	Confident	162 Å²	162	94.8 Å²	94.8	70%	0.704	49%	0.494	S	S	*	.	H	α-helix	trans	-61.1	-39	174.4	-108	-176.4	176.6	-179.8	0	112.7	T459 V460 V461 R467	T459-K463 PolarHBondContact O-N 3.37Å; T459-K463 VanDerWaalsContact O-N 3.12Å; V460-K463 PolarHBondContact O-N 3.31Å; V461-K463 PolarHBondContact O-N 2.97Å; K463-R467 PolarHBondContact O-N 3.31Å
464	T	75.3	Confident	75	Confident	44 Å²	44	95.1 Å²	95.1	27%	0.27	50%	0.495	S	S	.	.	H	α-helix	trans	-70.7	-44.4	-178.3	-54.9	0	0	0	0	111.1	L449 I452 V460 V461 F462 N466 R467 I468	L449-T464 HydrophobicContact CD2-CG2 4.24Å; I452-T464 HydrophobicContact CD1-CG2 4.41Å; V460-T464 WeakPolarHBondContact O-CB 3.49Å; V460-T464 PolarHBondContact O-N 3.2Å; V460-T464 PolarHBondContact O-OG1 3.04Å; V461-T464 PolarHBondContact O-N 2.9Å; V461-T464 VanDerWaalsContact O-N 3.13Å; F462-T464 VanDerWaalsContact C-N 3.31Å; F462-T464 PolarHBondContact O-N 3.43Å; T464-N466 PolarHBondContact O-N 3.38Å; T464-R467 WeakPolarHBondContact O-CB 3.46Å; T464-R467 PolarHBondContact O-N 3.21Å; T464-I468 HydrophobicContact CG2-CD1 4.19Å; T464-I468 WeakPolarHBondContact O-CG1 3.36Å; T464-I468 PolarHBondContact O-N 3.02Å
465	V	77.4	Confident	74.4	Confident	48 Å²	48	91 Å²	91	29%	0.291	48%	0.478	S	S	.	.	H	α-helix	trans	-60.2	-44.7	175.7	172.2	0	0	0	0	111.3	L449 V461 F462 R467 I468 N469	L449-V465 HydrophobicContact CD2-CG2 3.96Å; V461-V465 HydrophobicContact CG1-CG2 4.44Å; V461-V465 WeakPolarHBondContact O-CG2 3.22Å; V461-V465 PolarHBondContact O-N 3Å; F462-V465 PolarHBondContact O-N 3.45Å; V465-R467 VanDerWaalsContact C-N 3.28Å; V465-R467 PolarHBondContact O-N 2.84Å; V465-I468 PolarHBondContact O-N 2.67Å; V465-N469 PolarHBondContact O-N 3.33Å
466	N	78.8	Confident	73.5	Confident	82 Å²	82	86.3 Å²	86.3	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-36.3	177	-73.7	-15.8	0	0	0	112.9	F462 T464 A470	F462-N466 WeakPolarHBondContact CD1-ND2 3.29Å; F462-N466 VanDerWaalsContact CE1-ND2 3.33Å; F462-N466 WeakPolarHBondContact CE1-ND2 3.47Å; F462-N466 PolarHBondContact O-N 3.43Å; F462-N466 VanDerWaalsContact O-N 3.09Å; F462-N466 PolarHBondContact O-ND2 3.15Å; T464-N466 PolarHBondContact O-N 3.38Å; N466-A470 PolarHBondContact O-N 3.31Å; N466-A470 VanDerWaalsContact O-N 3.08Å
467	R	77.2	Confident	72.4	Confident	195 Å²	195	89 Å²	89	74%	0.736	47%	0.474	S	S	*	.	H	α-helix	trans	-66.5	-41.2	175.5	-118.3	175.3	170	177.8	-4.7	112.2	K463 T464 V465 A470 I471	K463-R467 PolarHBondContact O-N 3.31Å; T464-R467 WeakPolarHBondContact O-CB 3.46Å; T464-R467 PolarHBondContact O-N 3.21Å; V465-R467 VanDerWaalsContact C-N 3.28Å; V465-R467 PolarHBondContact O-N 2.84Å; R467-A470 PolarHBondContact O-N 3.44Å; R467-I471 WeakPolarHBondContact O-CD1 3.48Å; R467-I471 VanDerWaalsContact O-CG1 3.32Å; R467-I471 WeakPolarHBondContact O-CG1 3.12Å; R467-I471 PolarHBondContact O-N 2.99Å
468	I	76.3	Confident	70.8	Confident	43 Å²	43	93 Å²	93	22%	0.221	49%	0.486	C	S	.	.	H	α-helix	trans	-65.3	-44.3	176.9	-67.9	165.8	0	0	0	110.2	V445 L449 T464 V465 A470 I471 I472	V445-I468 HydrophobicContact CG1-CD1 4.07Å; V445-I468 HydrophobicContact CG1-CG2 4.45Å; L449-I468 HydrophobicContact CD1-CD1 4.07Å; L449-I468 HydrophobicContact CD2-CD1 3.91Å; L449-I468 HydrophobicContact CG-CD1 4.21Å; T464-I468 HydrophobicContact CG2-CD1 4.19Å; T464-I468 WeakPolarHBondContact O-CG1 3.36Å; T464-I468 PolarHBondContact O-N 3.02Å; V465-I468 PolarHBondContact O-N 2.67Å; I468-A470 VanDerWaalsContact C-N 3.34Å; I468-A470 PolarHBondContact O-N 3.38Å; I468-I471 PolarHBondContact O-N 2.92Å; I468-I472 HydrophobicContact CG2-CD1 3.73Å; I468-I472 HydrophobicContact CG2-CG1 4.38Å; I468-I472 WeakPolarHBondContact O-CG1 3.24Å; I468-I472 PolarHBondContact O-N 2.88Å
469	N	73.6	Confident	69.1	Low	80 Å²	80	91.7 Å²	91.7	43%	0.428	47%	0.473	S	S	.	.	H	α-helix	trans	-60.4	-42.6	177.2	-76.2	-10.1	0	0	0	112.1	V465 I471 I472 E473	V465-N469 PolarHBondContact O-N 3.33Å; N469-I471 VanDerWaalsContact C-N 3.35Å; N469-I471 PolarHBondContact O-N 3.01Å; N469-I472 PolarHBondContact O-N 2.85Å; N469-E473 WeakPolarHBondContact O-CG 3.18Å; N469-E473 PolarHBondContact O-N 3.34Å
470	A	75.7	Confident	67.2	Low	47 Å²	47	93 Å²	93	39%	0.388	48%	0.475	S	S	.	.	H	α-helix	trans	-60.3	-42.3	175.9	0	0	0	0	0	112.5	N466 R467 I468 E473 E474	N466-A470 PolarHBondContact O-N 3.31Å; N466-A470 VanDerWaalsContact O-N 3.08Å; R467-A470 PolarHBondContact O-N 3.44Å; I468-A470 VanDerWaalsContact C-N 3.34Å; I468-A470 PolarHBondContact O-N 3.38Å; A470-E473 PolarHBondContact O-N 2.81Å; A470-E474 PolarHBondContact O-N 3.05Å
471	I	72.5	Confident	65.4	Low	99 Å²	99	94.7 Å²	94.7	51%	0.508	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-39.5	177.2	-66.4	164.6	0	0	0	111.1	R467 I468 N469 S475	R467-I471 WeakPolarHBondContact O-CD1 3.48Å; R467-I471 VanDerWaalsContact O-CG1 3.32Å; R467-I471 WeakPolarHBondContact O-CG1 3.12Å; R467-I471 PolarHBondContact O-N 2.99Å; I468-I471 PolarHBondContact O-N 2.92Å; N469-I471 VanDerWaalsContact C-N 3.35Å; N469-I471 PolarHBondContact O-N 3.01Å; I471-S475 WeakPolarHBondContact O-CB 3.28Å; I471-S475 PolarHBondContact O-N 2.97Å; I471-S475 PolarHBondContact O-OG 3.33Å
472	I	69.6	Low	63.8	Low	83 Å²	83	99 Å²	99	43%	0.426	51%	0.51	S	S	.	.	H	α-helix	trans	-66.1	-42.9	177.6	-68.2	169	0	0	0	110.6	I468 N469 S475 A476	I468-I472 HydrophobicContact CG2-CD1 3.73Å; I468-I472 HydrophobicContact CG2-CG1 4.38Å; I468-I472 WeakPolarHBondContact O-CG1 3.24Å; I468-I472 PolarHBondContact O-N 2.88Å; N469-I472 PolarHBondContact O-N 2.85Å; I472-S475 PolarHBondContact O-N 3.3Å; I472-A476 WeakPolarHBondContact O-CB 3.49Å; I472-A476 PolarHBondContact O-N 3.15Å
473	E	68.8	Low	61.8	Low	131 Å²	131	97 Å²	97	61%	0.612	51%	0.513	S	S	*	.	H	α-helix	trans	-63	-44.7	176.8	-75.3	177.3	177.5	0	0	111.8	N469 A470 S475 A476 I477	N469-E473 WeakPolarHBondContact O-CG 3.18Å; N469-E473 PolarHBondContact O-N 3.34Å; A470-E473 PolarHBondContact O-N 2.81Å; E473-S475 VanDerWaalsContact C-N 3.33Å; E473-S475 PolarHBondContact O-N 3.14Å; E473-A476 PolarHBondContact O-N 3.15Å; E473-I477 WeakPolarHBondContact O-CD1 3.44Å; E473-I477 VanDerWaalsContact O-CG1 3.31Å; E473-I477 WeakPolarHBondContact O-CG1 3.29Å; E473-I477 PolarHBondContact O-N 3.33Å
474	E	68.3	Low	59.5	Low	136 Å²	136	93.7 Å²	93.7	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-60	-42.3	173.9	-78.1	178.9	164.4	0	0	111.9	A470 A476 I477 E478	A470-E474 PolarHBondContact O-N 3.05Å; E474-A476 PolarHBondContact O-N 3.12Å; E474-I477 PolarHBondContact O-N 3.23Å; E474-E478 PolarHBondContact O-N 3.38Å
475	S	61.2	Low	57.4	Low	54 Å²	54	98.1 Å²	98.1	38%	0.378	54%	0.538	S	S	.	.	H	α-helix	trans	-70.4	-29.6	-179.8	-55.1	0	0	0	0	113.4	I471 I472 E473 N479	I471-S475 WeakPolarHBondContact O-CB 3.28Å; I471-S475 PolarHBondContact O-N 2.97Å; I471-S475 PolarHBondContact O-OG 3.33Å; I472-S475 PolarHBondContact O-N 3.3Å; E473-S475 VanDerWaalsContact C-N 3.33Å; E473-S475 PolarHBondContact O-N 3.14Å; S475-N479 PolarHBondContact O-N 2.84Å; S475-N479 PolarHBondContact O-ND2 3.32Å
476	A	55.6	Low	55.3	Low	51 Å²	51	101.4 Å²	101.4	42%	0.421	56%	0.563	S	S	.	*	H	α-helix	trans	-73.7	-35	177	0	0	0	0	0	111.6	I472 E473 E474 L480	I472-A476 WeakPolarHBondContact O-CB 3.49Å; I472-A476 PolarHBondContact O-N 3.15Å; E473-A476 PolarHBondContact O-N 3.15Å; E474-A476 PolarHBondContact O-N 3.12Å; A476-L480 PolarHBondContact O-N 2.93Å
477	I	50.1	Low	52.9	Low	111 Å²	111	102.5 Å²	102.5	57%	0.569	58%	0.577	S	S	*	*	H	α-helix	trans	-68.7	-41.3	177.1	-65.7	165.7	0	0	0	110.8	E473 E474 N479 L480	E473-I477 WeakPolarHBondContact O-CD1 3.44Å; E473-I477 VanDerWaalsContact O-CG1 3.31Å; E473-I477 WeakPolarHBondContact O-CG1 3.29Å; E473-I477 PolarHBondContact O-N 3.33Å; E474-I477 PolarHBondContact O-N 3.23Å; I477-N479 VanDerWaalsContact C-N 3.33Å; I477-N479 PolarHBondContact O-N 2.96Å; I477-L480 PolarHBondContact O-N 3.45Å
478	E	46.6	Very low	50.6	Low	142 Å²	142	100 Å²	100	66%	0.664	58%	0.579	S	S	*	*	H	α-helix	trans	-65.6	-30.7	178	-76.8	-170.7	160.1	0	0	113.8	E474	E474-E478 PolarHBondContact O-N 3.38Å
479	N	41.4	Very low	48.5	Very low	84 Å²	84	105.6 Å²	105.6	45%	0.449	61%	0.608	S	S	.	*	H	α-helix	trans	-80.5	-23.8	179.7	-76.3	-54.3	0	0	0	113.5	S475 I477	S475-N479 PolarHBondContact O-N 2.84Å; S475-N479 PolarHBondContact O-ND2 3.32Å; I477-N479 VanDerWaalsContact C-N 3.33Å; I477-N479 PolarHBondContact O-N 2.96Å
480	L	38.8	Very low	46.6	Very low	130 Å²	130	115 Å²	115	68%	0.681	65%	0.645	S	S	*	*	H	α-helix	trans	-72.3	-30	174.8	-83.4	155.5	0	0	0	112.3	A476 I477 I482 S483	A476-L480 PolarHBondContact O-N 2.93Å; I477-L480 PolarHBondContact O-N 3.45Å; L480-I482 VanDerWaalsContact C-N 3.32Å; L480-I482 PolarHBondContact O-N 3.4Å; L480-S483 PolarHBondContact O-OG 3.21Å
481	C	38.6	Very low	45.1	Very low	100 Å²	100	118.4 Å²	118.4	68%	0.676	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-6.6	-178.6	-70.6	0	0	0	0	115.4
482	I	38.4	Very low	43.7	Very low	116 Å²	116	119.4 Å²	119.4	60%	0.595	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-6.7	-176.2	-59	172.1	0	0	0	112.2	L480	L480-I482 VanDerWaalsContact C-N 3.32Å; L480-I482 PolarHBondContact O-N 3.4Å
483	S	34.7	Very low	42.2	Very low	99 Å²	99	121.4 Å²	121.4	69%	0.692	68%	0.68	S	S	*	*	S	Bend	trans	-92.4	-0.6	-170.4	66.3	0	0	0	0	116.4	L480	L480-S483 PolarHBondContact O-OG 3.21Å
484	S	30.7	Very low	40.7	Very low	93 Å²	93	120.9 Å²	120.9	65%	0.65	68%	0.684	S	S	*	*			trans	-115	78.8	-179.3	62	0	0	0	0	111.6
485	T	31.9	Very low	38.9	Very low	136 Å²	136	119.9 Å²	119.9	83%	0.834	69%	0.687	S	S	*	*			trans	-172.8	134.3	156.4	26	0	0	0	0	111.2
486	S	32	Very low	37.5	Very low	117 Å²	117	124.3 Å²	124.3	82%	0.818	71%	0.707	S	S	*	*			trans	84.8	61.7	172.7	103.6	0	0	0	0	118.6
487	S	28.6	Very low	36.2	Very low	106 Å²	106	129.6 Å²	129.6	74%	0.741	73%	0.728	S	S	*	*				-85.3	119	125.8	53.7	0	0	0	0	106.7
488	D	29.7	Very low	35.1	Very low	143 Å²	143	131 Å²	131	77%	0.765	74%	0.74	S	S	*	*			trans	144.2	119.3	160	-73.1	-18.7	0	0	0	110.2
489	L	31.5	Very low	34.1	Very low	160 Å²	160	130.1 Å²	130.1	84%	0.838	75%	0.746	S	S	*	*			trans	125.3	111.5	158	-67.6	155	0	0	0	115.8
490	F	33.5	Very low	33.5	Very low	277 Å²	277	134.3 Å²	134.3	100%	1.215	77%	0.773	S	S	*	*			trans	84	0	168	-70.4	-78.7	0	0	0	120

Retrieved 490 of 490 residues in 1419 ms (Link to these results)

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