A0A087XGS2_POEFO Loading...

vesicle-fusing ATPase

AlphaFold DB , UniProt , Accession A0A087XGS2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 437 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	40.2	Very low	72.6	Confident	247 Å²	247	90.1 Å²	90.1	100%	1.217	48%	0.476	S	S	*	.				0	51.3	0	-60.7	-178.5	-158.9	0	0	111.2
2	A	45.2	Very low	74.1	Confident	75 Å²	75	85.6 Å²	85.6	62%	0.62	45%	0.452	S	S	*	.			trans	-106.9	0.8	-169.1	0	0	0	0	0	115.2
3	N	54.6	Low	75.2	Confident	137 Å²	137	79.2 Å²	79.2	73%	0.733	42%	0.419	S	S	*	.	S	Bend	trans	-105.3	2.4	-173.4	-93.6	-7	0	0	0	115.2
4	N	70.9	Confident	76.3	Confident	103 Å²	103	78.1 Å²	78.1	55%	0.551	42%	0.421	S	S	*	.	H	α-helix	trans	-83.6	-31.8	-168.5	-150.4	-0.6	0	0	0	113.2	K8	N4-K8 WeakPolarHBondContact O-CB 3.44Å; N4-K8 WeakPolarHBondContact O-CD 3.1Å; N4-K8 WeakPolarHBondContact O-CG 3.45Å; N4-K8 PolarHBondContact O-N 2.97Å
5	N	77.4	Confident	77.3	Confident	41 Å²	41	80.9 Å²	80.9	22%	0.219	43%	0.428	C	S	.	.	H	α-helix	trans	-85.3	-36.4	-174.2	-68.4	-33.1	0	0	0	113.3	K8 A9 V42 E46	N5-K8 PolarHBondContact O-N 3.01Å; N5-A9 WeakPolarHBondContact O-CB 3.35Å; N5-A9 PolarHBondContact O-N 3.31Å; N5-V42 HydrophobicContact CB-CG2 4.04Å; N5-E46 PolarHBondContact ND2-OE1 3.09Å
6	L	80.1	Confident	78.1	Confident	55 Å²	55	75.8 Å²	75.8	29%	0.288	40%	0.401	S	S	.	.	H	α-helix	trans	-65.1	-42.3	173.2	179.1	59.9	0	0	0	111.8	A9 I10 F39 V42 I56	L6-A9 WeakPolarHBondContact O-CB 3.45Å; L6-A9 PolarHBondContact O-N 3.23Å; L6-I10 HydrophobicContact CD1-CD1 4.25Å; L6-I10 HydrophobicContact CD1-CG1 4.5Å; L6-I10 HydrophobicContact CG-CD1 4.15Å; L6-I10 WeakPolarHBondContact O-CG1 3.46Å; L6-I10 PolarHBondContact O-N 3.41Å; L6-F39 HydrophobicContact CD1-CD1 4.15Å; L6-F39 HydrophobicContact CD1-CE1 3.83Å; L6-V42 HydrophobicContact CB-CG1 4.23Å; L6-V42 HydrophobicContact CB-CG2 4.17Å; L6-V42 HydrophobicContact CD1-CG1 4.22Å; L6-I56 HydrophobicContact CD1-CD1 4.48Å
7	Q	83.4	Confident	78.7	Confident	97 Å²	97	73.4 Å²	73.4	45%	0.453	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-44	176.9	-169.6	60.4	43.3	0	0	111.2	A9 I10 D11	Q7-A9 VanDerWaalsContact C-N 3.3Å; Q7-A9 PolarHBondContact O-N 3.29Å; Q7-I10 PolarHBondContact O-N 3.41Å; Q7-D11 PolarHBondContact NE2-OD1 3.47Å; Q7-D11 PolarHBondContact O-N 3.04Å
8	K	85.4	Confident	79.4	Confident	88 Å²	88	75.9 Å²	75.9	38%	0.383	40%	0.403	S	S	.	.	H	α-helix	trans	-58.1	-40.1	173.1	-77.7	174.5	-176.8	-177.1	0	112.9	N4 N5 D11 L12	N4-K8 WeakPolarHBondContact O-CB 3.44Å; N4-K8 WeakPolarHBondContact O-CD 3.1Å; N4-K8 WeakPolarHBondContact O-CG 3.45Å; N4-K8 PolarHBondContact O-N 2.97Å; N5-K8 PolarHBondContact O-N 3.01Å; K8-D11 PolarHBondContact O-N 3.43Å; K8-L12 WeakPolarHBondContact O-CB 3.36Å; K8-L12 VanDerWaalsContact O-CG 3.26Å; K8-L12 WeakPolarHBondContact O-CG 3.2Å; K8-L12 PolarHBondContact O-N 2.88Å
9	A	85.2	Confident	79.8	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.4	-42	177	0	0	0	0	0	112	N5 L6 Q7 A13 F39	N5-A9 WeakPolarHBondContact O-CB 3.35Å; N5-A9 PolarHBondContact O-N 3.31Å; L6-A9 WeakPolarHBondContact O-CB 3.45Å; L6-A9 PolarHBondContact O-N 3.23Å; Q7-A9 VanDerWaalsContact C-N 3.3Å; Q7-A9 PolarHBondContact O-N 3.29Å; A9-A13 WeakPolarHBondContact O-CB 3.31Å; A9-A13 PolarHBondContact O-N 3.26Å; A9-F39 HydrophobicContact CB-CD1 3.69Å; A9-F39 HydrophobicContact CB-CD2 3.92Å; A9-F39 HydrophobicContact CB-CE1 3.63Å; A9-F39 HydrophobicContact CB-CE2 3.84Å; A9-F39 HydrophobicContact CB-CG 3.82Å; A9-F39 HydrophobicContact CB-CZ 3.7Å
10	I	87.4	Confident	80.2	Confident	76 Å²	76	72.3 Å²	72.3	39%	0.39	38%	0.382	S	S	.	.	H	α-helix	trans	-66.7	-43.6	177.2	-66	166.6	0	0	0	110.9	L6 Q7 L12 A13 S14 F39	L6-I10 HydrophobicContact CD1-CD1 4.25Å; L6-I10 HydrophobicContact CD1-CG1 4.5Å; L6-I10 HydrophobicContact CG-CD1 4.15Å; L6-I10 WeakPolarHBondContact O-CG1 3.46Å; L6-I10 PolarHBondContact O-N 3.41Å; Q7-I10 PolarHBondContact O-N 3.41Å; I10-L12 PolarHBondContact O-N 2.87Å; I10-A13 PolarHBondContact O-N 3.34Å; I10-S14 WeakPolarHBondContact O-CB 2.97Å; I10-S14 PolarHBondContact O-N 2.74Å; I10-F39 HydrophobicContact CG1-CE1 4.17Å; I10-F39 HydrophobicContact CG1-CZ 4.03Å
11	D	89.1	Confident	80.6	Confident	72 Å²	72	77.5 Å²	77.5	39%	0.385	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-41.1	179.6	-64.5	-15.4	0	0	0	111.3	Q7 K8 S14 K15	Q7-D11 PolarHBondContact NE2-OD1 3.47Å; Q7-D11 PolarHBondContact O-N 3.04Å; K8-D11 PolarHBondContact O-N 3.43Å; D11-S14 PolarHBondContact O-N 3.35Å; D11-K15 WeakPolarHBondContact O-CG 3.12Å; D11-K15 PolarHBondContact O-N 3.4Å
12	L	90	Very high	82.9	Confident	36 Å²	36	69 Å²	69	19%	0.188	37%	0.371	C	S	.	.	H	α-helix	trans	-65.2	-42.3	175	-73.6	170.7	0	0	0	112	K8 I10 K15 A16 L31 A34 A35 Y38	K8-L12 WeakPolarHBondContact O-CB 3.36Å; K8-L12 VanDerWaalsContact O-CG 3.26Å; K8-L12 WeakPolarHBondContact O-CG 3.2Å; K8-L12 PolarHBondContact O-N 2.88Å; I10-L12 PolarHBondContact O-N 2.87Å; L12-K15 PolarHBondContact O-N 2.9Å; L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 3.46Å; L12-L31 HydrophobicContact CD2-CD2 3.93Å; L12-A34 HydrophobicContact CD1-CB 4.4Å; L12-A35 HydrophobicContact CB-CB 3.96Å; L12-Y38 HydrophobicContact CD1-CD2 3.65Å; L12-Y38 HydrophobicContact CD1-CE2 3.92Å
13	A	88.7	Confident	84.8	Confident	3 Å²	3	72.6 Å²	72.6	3%	0.025	37%	0.374	C	S	.	.	H	α-helix	trans	-66.1	-37.6	176.8	0	0	0	0	0	112.5	A9 I10 A16 A17 A35 F39 Y63	A9-A13 WeakPolarHBondContact O-CB 3.31Å; A9-A13 PolarHBondContact O-N 3.26Å; I10-A13 PolarHBondContact O-N 3.34Å; A13-A16 PolarHBondContact O-N 3.35Å; A13-A17 PolarHBondContact O-N 3.49Å; A13-A35 HydrophobicContact CB-CB 4.07Å; A13-F39 HydrophobicContact CB-CE2 4.14Å; A13-Y63 HydrophobicContact CB-CD2 4.37Å; A13-Y63 HydrophobicContact CB-CE1 4.35Å; A13-Y63 HydrophobicContact CB-CE2 3.73Å
14	S	91	Very high	86.4	Confident	64 Å²	64	69.5 Å²	69.5	45%	0.448	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-44.3	175.5	-171.3	0	0	0	0	111.5	I10 D11 A17 Q18	I10-S14 WeakPolarHBondContact O-CB 2.97Å; I10-S14 PolarHBondContact O-N 2.74Å; D11-S14 PolarHBondContact O-N 3.35Å; S14-A17 PolarHBondContact O-N 3.14Å; S14-Q18 WeakPolarHBondContact O-CG 3.15Å; S14-Q18 PolarHBondContact O-N 2.89Å; S14-Q18 VanDerWaalsContact O-N 3.09Å
15	K	91	Very high	87.2	Confident	119 Å²	119	66.1 Å²	66.1	52%	0.517	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-42.7	173.4	-74.1	178.5	-178.5	-178.1	0	112	D11 L12 A17 Q18 E19 L31	D11-K15 WeakPolarHBondContact O-CG 3.12Å; D11-K15 PolarHBondContact O-N 3.4Å; L12-K15 PolarHBondContact O-N 2.9Å; K15-A17 VanDerWaalsContact C-N 3.29Å; K15-A17 PolarHBondContact O-N 3.23Å; K15-Q18 WeakPolarHBondContact O-CB 3.46Å; K15-Q18 PolarHBondContact O-N 2.85Å; K15-Q18 VanDerWaalsContact O-N 3.1Å; K15-E19 PolarHBondContact O-N 3.3Å; K15-L31 HydrophobicContact CB-CD1 4.18Å
16	A	89.6	Confident	87.6	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-57.5	-43.2	176	0	0	0	0	0	111.8	L12 A13 Q18 E19 D20 L31 Y32	L12-A16 WeakPolarHBondContact O-CB 3.34Å; L12-A16 PolarHBondContact O-N 3.46Å; A13-A16 PolarHBondContact O-N 3.35Å; A16-Q18 VanDerWaalsContact C-N 3.33Å; A16-Q18 PolarHBondContact O-N 2.92Å; A16-E19 PolarHBondContact O-N 3.39Å; A16-D20 VanDerWaalsContact O-CB 3.28Å; A16-D20 WeakPolarHBondContact O-CB 3.48Å; A16-D20 PolarHBondContact O-N 2.86Å; A16-L31 HydrophobicContact CB-CB 3.64Å; A16-Y32 HydrophobicContact CB-CD1 3.63Å; A16-Y32 HydrophobicContact CB-CD2 3.87Å; A16-Y32 HydrophobicContact CB-CE1 3.66Å; A16-Y32 HydrophobicContact CB-CE2 3.9Å; A16-Y32 HydrophobicContact CB-CG 3.72Å
17	A	88.9	Confident	87.9	Confident	34 Å²	34	70.3 Å²	70.3	28%	0.281	36%	0.355	S	S	.	.	H	α-helix	trans	-68.9	-28.4	177.3	0	0	0	0	0	113.6	A13 S14 K15 K21 Y32	A13-A17 PolarHBondContact O-N 3.49Å; S14-A17 PolarHBondContact O-N 3.14Å; K15-A17 VanDerWaalsContact C-N 3.29Å; K15-A17 PolarHBondContact O-N 3.23Å; A17-K21 WeakPolarHBondContact O-CG 3.25Å; A17-K21 PolarHBondContact O-N 2.95Å; A17-Y32 WeakPolarHBondContact CA-OH 3.3Å
18	Q	90.5	Very high	88.1	Confident	120 Å²	120	65.7 Å²	65.7	56%	0.561	33%	0.334	S	S	*	.	H	α-helix	trans	-71.8	-46.2	173.5	-71.5	174.6	2.2	0	0	111.3	S14 K15 A16 D20 K21 A22	S14-Q18 WeakPolarHBondContact O-CG 3.15Å; S14-Q18 PolarHBondContact O-N 2.89Å; S14-Q18 VanDerWaalsContact O-N 3.09Å; K15-Q18 WeakPolarHBondContact O-CB 3.46Å; K15-Q18 PolarHBondContact O-N 2.85Å; K15-Q18 VanDerWaalsContact O-N 3.1Å; A16-Q18 VanDerWaalsContact C-N 3.33Å; A16-Q18 PolarHBondContact O-N 2.92Å; Q18-D20 VanDerWaalsContact C-N 3.32Å; Q18-D20 PolarHBondContact O-N 3.29Å; Q18-K21 PolarHBondContact O-N 2.86Å; Q18-A22 WeakPolarHBondContact O-CB 3.41Å; Q18-A22 PolarHBondContact O-N 2.95Å
19	E	87.6	Confident	88.2	Confident	61 Å²	61	62.6 Å²	62.6	29%	0.285	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-36.4	176.7	-67.3	-60	144.8	0	0	111.9	K15 A16 A22 Q23 N24 E27 A28 L31	K15-E19 PolarHBondContact O-N 3.3Å; A16-E19 PolarHBondContact O-N 3.39Å; E19-A22 CarbonylContact O-C 3.58Å; E19-A22 PolarHBondContact O-N 2.83Å; E19-Q23 PolarHBondContact O-N 3.28Å; E19-Q23 VanDerWaalsContact O-N 3.13Å; E19-N24 HydrophobicContact CB-CB 4.39Å; E19-N24 PolarHBondContact O-N 3.23Å; E19-N24 VanDerWaalsContact OE2-CB 3.27Å; E19-N24 WeakPolarHBondContact OE2-CB 3.33Å; E19-N24 PolarHBondContact OE2-ND2 3.14Å; E19-E27 HydrophobicContact CG-CG 4.43Å; E19-A28 HydrophobicContact CB-CB 4Å; E19-L31 HydrophobicContact CG-CD1 3.94Å
20	D	87.6	Confident	88.5	Confident	18 Å²	18	70 Å²	70	10%	0.096	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-41.4	174.5	-168.6	7.7	0	0	0	111.6	A16 Q18 A22 Q23 A28 Y32 R66	A16-D20 VanDerWaalsContact O-CB 3.28Å; A16-D20 WeakPolarHBondContact O-CB 3.48Å; A16-D20 PolarHBondContact O-N 2.86Å; Q18-D20 VanDerWaalsContact C-N 3.32Å; Q18-D20 PolarHBondContact O-N 3.29Å; D20-A22 VanDerWaalsContact C-N 3.32Å; D20-A22 PolarHBondContact O-N 3.05Å; D20-Q23 PolarHBondContact O-N 3Å; D20-A28 HydrophobicContact CB-CB 4.01Å; D20-Y32 HydrophobicContact CB-CE2 4.19Å; D20-R66 VanDerWaalsContact CG-NH2 3.27Å; D20-R66 IonicContact OD1-CZ 2.7Å; D20-R66 IonicContact OD1-NE 2.66Å; D20-R66 IonicContact OD1-NH2 3.64Å; D20-R66 PolarHBondContact OD1-NH2 2.86Å; D20-R66 IonicContact OD2-CZ 2.65Å; D20-R66 VanDerWaalsContact OD2-CZ 3.26Å; D20-R66 IonicContact OD2-NE 3.45Å; D20-R66 PolarHBondContact OD2-NE 3.45Å; D20-R66 IonicContact OD2-NH2 3.7Å; D20-R66 PolarHBondContact OD2-NH2 3.02Å
21	K	88.8	Confident	88.6	Confident	181 Å²	181	67.4 Å²	67.4	79%	0.787	34%	0.336	S	S	*	.	H	α-helix	trans	-66.4	-33	171.7	-75.7	176.4	-177.6	-179.5	0	112.7	A17 Q18 Q23	A17-K21 WeakPolarHBondContact O-CG 3.25Å; A17-K21 PolarHBondContact O-N 2.95Å; Q18-K21 PolarHBondContact O-N 2.86Å; K21-Q23 PolarHBondContact O-N 3.43Å
22	A	87.7	Confident	88.6	Confident	70 Å²	70	64.6 Å²	64.6	58%	0.579	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	3.6	175.7	0	0	0	0	0	113.4	Q18 E19 D20 N24	Q18-A22 WeakPolarHBondContact O-CB 3.41Å; Q18-A22 PolarHBondContact O-N 2.95Å; E19-A22 CarbonylContact O-C 3.58Å; E19-A22 PolarHBondContact O-N 2.83Å; D20-A22 VanDerWaalsContact C-N 3.32Å; D20-A22 PolarHBondContact O-N 3.05Å; A22-N24 PolarHBondContact O-N 3.27Å
23	Q	86.1	Confident	88.5	Confident	149 Å²	149	67 Å²	67	70%	0.696	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.4	19.5	-177.9	-55.3	-173.8	-35.9	0	0	114.6	E19 D20 K21 F25	E19-Q23 PolarHBondContact O-N 3.28Å; E19-Q23 VanDerWaalsContact O-N 3.13Å; D20-Q23 PolarHBondContact O-N 3Å; K21-Q23 PolarHBondContact O-N 3.43Å; Q23-F25 VanDerWaalsContact C-N 3.28Å; Q23-F25 HydrophobicContact CB-CE1 4.37Å; Q23-F25 HydrophobicContact CB-CE2 3.93Å; Q23-F25 HydrophobicContact CB-CZ 3.77Å; Q23-F25 HydrophobicContact CG-CE2 4.47Å; Q23-F25 HydrophobicContact CG-CZ 3.94Å; Q23-F25 WeakPolarHBondContact O-CD2 3.32Å; Q23-F25 PolarHBondContact O-N 3.09Å; Q23-F25 VanDerWaalsContact O-N 3.11Å
24	N	87.7	Confident	88.5	Confident	72 Å²	72	68.2 Å²	68.2	39%	0.385	34%	0.34	S	S	.	.			trans	-87.9	70	174.2	-168.6	6.1	0	0	0	110.1	E19 A22 E26 E27 A28	E19-N24 HydrophobicContact CB-CB 4.39Å; E19-N24 PolarHBondContact O-N 3.23Å; E19-N24 VanDerWaalsContact OE2-CB 3.27Å; E19-N24 WeakPolarHBondContact OE2-CB 3.33Å; E19-N24 PolarHBondContact OE2-ND2 3.14Å; A22-N24 PolarHBondContact O-N 3.27Å; N24-E26 VanDerWaalsContact C-N 3.33Å; N24-E26 PolarHBondContact O-N 3.23Å; N24-E27 PolarHBondContact O-N 2.87Å; N24-A28 WeakPolarHBondContact O-CB 3.43Å; N24-A28 PolarHBondContact O-N 2.6Å
25	F	87	Confident	88.3	Confident	33 Å²	33	65.2 Å²	65.2	15%	0.145	32%	0.319	C	S	.	.	H	α-helix	trans	-67.9	-26.7	-165.9	-58.5	-54.9	0	0	0	114.6	Q23 L29 L70 Y73 L74	Q23-F25 VanDerWaalsContact C-N 3.28Å; Q23-F25 HydrophobicContact CB-CE1 4.37Å; Q23-F25 HydrophobicContact CB-CE2 3.93Å; Q23-F25 HydrophobicContact CB-CZ 3.77Å; Q23-F25 HydrophobicContact CG-CE2 4.47Å; Q23-F25 HydrophobicContact CG-CZ 3.94Å; Q23-F25 WeakPolarHBondContact O-CD2 3.32Å; Q23-F25 PolarHBondContact O-N 3.09Å; Q23-F25 VanDerWaalsContact O-N 3.11Å; F25-L29 VanDerWaalsContact O-CB 3.3Å; F25-L29 WeakPolarHBondContact O-CB 3.29Å; F25-L29 PolarHBondContact O-N 3.28Å; F25-L70 HydrophobicContact CB-CD2 4.15Å; F25-L70 HydrophobicContact CD1-CD2 3.39Å; F25-L70 HydrophobicContact CE1-CD2 4.07Å; F25-L70 HydrophobicContact CG-CD2 4.03Å; F25-Y73 AromaticContact CD2-CD1 3.92Å; F25-Y73 HydrophobicContact CD2-CD1 3.92Å; F25-Y73 AromaticContact CD2-CE1 3.5Å; F25-Y73 HydrophobicContact CD2-CE1 3.5Å; F25-Y73 VanDerWaalsContact CD2-CE1 3.5Å; F25-Y73 HydrophobicContact CE2-CD1 4.27Å; F25-Y73 AromaticContact CE2-CE1 3.57Å; F25-Y73 HydrophobicContact CE2-CE1 3.57Å; F25-Y73 HydrophobicContact CG-CD1 4.37Å; F25-Y73 HydrophobicContact CG-CE1 4.37Å; F25-Y73 HydrophobicContact CZ-CE1 4.5Å; F25-L74 HydrophobicContact CB-CD2 4.06Å; F25-L74 HydrophobicContact CB-CG 4.36Å
26	E	86.8	Confident	88.2	Confident	131 Å²	131	59.8 Å²	59.8	61%	0.612	30%	0.296	S	S	*	.	H	α-helix	trans	-69.8	-47.5	176.6	-72.9	176.3	-162.6	0	0	111.6	N24 L29 R30 L74	N24-E26 VanDerWaalsContact C-N 3.33Å; N24-E26 PolarHBondContact O-N 3.23Å; E26-L29 PolarHBondContact O-N 3.09Å; E26-R30 PolarHBondContact O-N 3.22Å; E26-L74 HydrophobicContact CG-CD1 3.94Å; E26-L74 HydrophobicContact CG-CD2 3.85Å
27	E	86.2	Confident	88.1	Confident	53 Å²	53	66.5 Å²	66.5	25%	0.248	33%	0.327	C	S	.	.	H	α-helix	trans	-72.1	-37.1	178.4	-171.4	57.6	-158.1	0	0	111.2	E19 N24 L29 R30 L31	E19-E27 HydrophobicContact CG-CG 4.43Å; N24-E27 PolarHBondContact O-N 2.87Å; E27-L29 VanDerWaalsContact C-N 3.34Å; E27-L29 PolarHBondContact O-N 3.01Å; E27-R30 PolarHBondContact O-N 3.14Å; E27-R30 IonicContact OE1-CZ 3.48Å; E27-R30 VanDerWaalsContact OE1-CZ 3.31Å; E27-R30 IonicContact OE1-NE 3.86Å; E27-R30 PolarHBondContact OE1-NE 3.44Å; E27-R30 IonicContact OE1-NH2 2.7Å; E27-R30 PolarHBondContact OE1-NH2 2.83Å; E27-R30 IonicContact OE2-CZ 3.43Å; E27-R30 IonicContact OE2-NE 2.72Å; E27-R30 PolarHBondContact OE2-NE 3.39Å; E27-R30 VanDerWaalsContact OE2-NE 3.11Å; E27-R30 IonicContact OE2-NH2 3.41Å; E27-R30 PolarHBondContact OE2-NH2 3.45Å; E27-L31 HydrophobicContact CG-CD1 4Å; E27-L31 HydrophobicContact CG-CG 4.38Å; E27-L31 WeakPolarHBondContact O-CB 3.43Å; E27-L31 VanDerWaalsContact O-CG 3.29Å; E27-L31 WeakPolarHBondContact O-CG 3.46Å; E27-L31 PolarHBondContact O-N 3.49Å
28	A	87.4	Confident	87.8	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58.3	-44.4	172.5	0	0	0	0	0	111.8	E19 D20 N24 R30 L31 Y32 L70	E19-A28 HydrophobicContact CB-CB 4Å; D20-A28 HydrophobicContact CB-CB 4.01Å; N24-A28 WeakPolarHBondContact O-CB 3.43Å; N24-A28 PolarHBondContact O-N 2.6Å; A28-R30 PolarHBondContact O-N 3.11Å; A28-L31 PolarHBondContact O-N 3.48Å; A28-Y32 WeakPolarHBondContact O-CB 3.17Å; A28-Y32 WeakPolarHBondContact O-CD2 3.31Å; A28-Y32 PolarHBondContact O-N 3.03Å; A28-L70 HydrophobicContact CB-CD1 4.04Å
29	L	88.6	Confident	87.5	Confident	22 Å²	22	64 Å²	64	12%	0.115	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-46.1	176.5	177	61.5	0	0	0	111.7	F25 E26 E27 Y32 Q33 A67 L70 K71 L74	F25-L29 VanDerWaalsContact O-CB 3.3Å; F25-L29 WeakPolarHBondContact O-CB 3.29Å; F25-L29 PolarHBondContact O-N 3.28Å; E26-L29 PolarHBondContact O-N 3.09Å; E27-L29 VanDerWaalsContact C-N 3.34Å; E27-L29 PolarHBondContact O-N 3.01Å; L29-Y32 PolarHBondContact O-N 2.92Å; L29-Q33 HydrophobicContact CD1-CG 4.5Å; L29-Q33 WeakPolarHBondContact O-CG 3.48Å; L29-Q33 PolarHBondContact O-N 3.3Å; L29-Q33 VanDerWaalsContact O-N 3.09Å; L29-A67 HydrophobicContact CD1-CB 3.8Å; L29-A67 WeakPolarHBondContact CD1-O 3.47Å; L29-L70 HydrophobicContact CD1-CB 4.49Å; L29-K71 HydrophobicContact CD1-CB 4.25Å; L29-K71 HydrophobicContact CD2-CB 4.09Å; L29-K71 HydrophobicContact CD2-CG 4.34Å; L29-L74 HydrophobicContact CD2-CD1 3.98Å
30	R	90.1	Very high	87.3	Confident	155 Å²	155	65.4 Å²	65.4	59%	0.585	32%	0.316	S	S	*	.	H	α-helix	trans	-61.7	-45	178.4	-168.7	-179.8	78.3	149.8	3.3	111.6	E26 E27 A28 Q33 A34	E26-R30 PolarHBondContact O-N 3.22Å; E27-R30 PolarHBondContact O-N 3.14Å; E27-R30 IonicContact OE1-CZ 3.48Å; E27-R30 VanDerWaalsContact OE1-CZ 3.31Å; E27-R30 IonicContact OE1-NE 3.86Å; E27-R30 PolarHBondContact OE1-NE 3.44Å; E27-R30 IonicContact OE1-NH2 2.7Å; E27-R30 PolarHBondContact OE1-NH2 2.83Å; E27-R30 IonicContact OE2-CZ 3.43Å; E27-R30 IonicContact OE2-NE 2.72Å; E27-R30 PolarHBondContact OE2-NE 3.39Å; E27-R30 VanDerWaalsContact OE2-NE 3.11Å; E27-R30 IonicContact OE2-NH2 3.41Å; E27-R30 PolarHBondContact OE2-NH2 3.45Å; A28-R30 PolarHBondContact O-N 3.11Å; R30-Q33 PolarHBondContact O-N 3.34Å; R30-A34 WeakPolarHBondContact O-CB 3.47Å; R30-A34 PolarHBondContact O-N 2.85Å
31	L	89.3	Confident	87.1	Confident	22 Å²	22	68.4 Å²	68.4	12%	0.115	33%	0.329	C	S	.	.	H	α-helix	trans	-68.7	-37.7	-179.7	-69.2	171.4	0	0	0	112.3	L12 K15 A16 E19 E27 A28 A34 A35	L12-L31 HydrophobicContact CD2-CD2 3.93Å; K15-L31 HydrophobicContact CB-CD1 4.18Å; A16-L31 HydrophobicContact CB-CB 3.64Å; E19-L31 HydrophobicContact CG-CD1 3.94Å; E27-L31 HydrophobicContact CG-CD1 4Å; E27-L31 HydrophobicContact CG-CG 4.38Å; E27-L31 WeakPolarHBondContact O-CB 3.43Å; E27-L31 VanDerWaalsContact O-CG 3.29Å; E27-L31 WeakPolarHBondContact O-CG 3.46Å; E27-L31 PolarHBondContact O-N 3.49Å; A28-L31 PolarHBondContact O-N 3.48Å; L31-A34 PolarHBondContact O-N 3.28Å; L31-A35 WeakPolarHBondContact O-CB 3.29Å; L31-A35 PolarHBondContact O-N 3.06Å
32	Y	89.7	Confident	86.8	Confident	13 Å²	13	60 Å²	60	5%	0.051	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-43.2	173.5	-82.5	-57.2	0	0	0	112	A16 A17 D20 A28 L29 A35 V36 Y63 R66 L70	A16-Y32 HydrophobicContact CB-CD1 3.63Å; A16-Y32 HydrophobicContact CB-CD2 3.87Å; A16-Y32 HydrophobicContact CB-CE1 3.66Å; A16-Y32 HydrophobicContact CB-CE2 3.9Å; A16-Y32 HydrophobicContact CB-CG 3.72Å; A17-Y32 WeakPolarHBondContact CA-OH 3.3Å; D20-Y32 HydrophobicContact CB-CE2 4.19Å; A28-Y32 WeakPolarHBondContact O-CB 3.17Å; A28-Y32 WeakPolarHBondContact O-CD2 3.31Å; A28-Y32 PolarHBondContact O-N 3.03Å; L29-Y32 PolarHBondContact O-N 2.92Å; Y32-A35 PolarHBondContact O-N 3.31Å; Y32-V36 VanDerWaalsContact O-CG2 3.28Å; Y32-V36 WeakPolarHBondContact O-CG2 3.49Å; Y32-V36 PolarHBondContact O-N 3.1Å; Y32-Y63 AromaticContact CD1-CD1 3.85Å; Y32-Y63 HydrophobicContact CD1-CD1 3.85Å; Y32-Y63 HydrophobicContact CD1-CG 4.08Å; Y32-Y63 AromaticContact CE1-CD1 3.53Å; Y32-Y63 HydrophobicContact CE1-CD1 3.53Å; Y32-Y63 HydrophobicContact CE1-CE1 4.11Å; Y32-Y63 HydrophobicContact CE1-CG 4.23Å; Y32-R66 HydrophobicContact CE2-CG 3.94Å; Y32-L70 HydrophobicContact CD2-CD1 3.96Å; Y32-L70 HydrophobicContact CE2-CD1 4.04Å
33	Q	88.3	Confident	86.6	Confident	88 Å²	88	57.1 Å²	57.1	41%	0.411	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-42.8	176.3	-72.4	176.1	-8.3	0	0	112.1	L29 R30 V36 Q37	L29-Q33 HydrophobicContact CD1-CG 4.5Å; L29-Q33 WeakPolarHBondContact O-CG 3.48Å; L29-Q33 PolarHBondContact O-N 3.3Å; L29-Q33 VanDerWaalsContact O-N 3.09Å; R30-Q33 PolarHBondContact O-N 3.34Å; Q33-V36 PolarHBondContact O-N 3.24Å; Q33-Q37 WeakPolarHBondContact O-CG 3.36Å; Q33-Q37 PolarHBondContact O-N 2.98Å; Q33-Q37 VanDerWaalsContact O-N 3.14Å
34	A	88.3	Confident	86.4	Confident	28 Å²	28	57.2 Å²	57.2	23%	0.231	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-45.1	175.8	0	0	0	0	0	111.7	L12 R30 L31 V36 Q37 Y38	L12-A34 HydrophobicContact CD1-CB 4.4Å; R30-A34 WeakPolarHBondContact O-CB 3.47Å; R30-A34 PolarHBondContact O-N 2.85Å; L31-A34 PolarHBondContact O-N 3.28Å; A34-V36 VanDerWaalsContact C-N 3.33Å; A34-V36 PolarHBondContact O-N 3.42Å; A34-Q37 PolarHBondContact O-N 3.48Å; A34-Y38 VanDerWaalsContact O-CD2 3.31Å; A34-Y38 WeakPolarHBondContact O-CD2 3.41Å; A34-Y38 PolarHBondContact O-N 3.01Å; A34-Y38 VanDerWaalsContact O-N 3.15Å
35	A	87.9	Confident	85.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-43.5	178	0	0	0	0	0	112	L12 A13 L31 Y32 Q37 Y38 F39	L12-A35 HydrophobicContact CB-CB 3.96Å; A13-A35 HydrophobicContact CB-CB 4.07Å; L31-A35 WeakPolarHBondContact O-CB 3.29Å; L31-A35 PolarHBondContact O-N 3.06Å; Y32-A35 PolarHBondContact O-N 3.31Å; A35-Q37 PolarHBondContact O-N 2.87Å; A35-Y38 PolarHBondContact O-N 3.35Å; A35-F39 HydrophobicContact CB-CE2 4.46Å; A35-F39 WeakPolarHBondContact O-CD2 3.43Å; A35-F39 PolarHBondContact O-N 2.9Å
36	V	88.3	Confident	85.1	Confident	6 Å²	6	62.1 Å²	62.1	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-42.3	177.9	171.7	0	0	0	0	111.7	Y32 Q33 A34 Y38 F39 L40 L64	Y32-V36 VanDerWaalsContact O-CG2 3.28Å; Y32-V36 WeakPolarHBondContact O-CG2 3.49Å; Y32-V36 PolarHBondContact O-N 3.1Å; Q33-V36 PolarHBondContact O-N 3.24Å; A34-V36 VanDerWaalsContact C-N 3.33Å; A34-V36 PolarHBondContact O-N 3.42Å; V36-Y38 VanDerWaalsContact C-N 3.32Å; V36-Y38 PolarHBondContact O-N 2.79Å; V36-F39 PolarHBondContact O-N 3.34Å; V36-L40 HydrophobicContact CG1-CD1 3.99Å; V36-L40 HydrophobicContact CG1-CG 4.3Å; V36-L40 WeakPolarHBondContact O-CB 3.29Å; V36-L40 WeakPolarHBondContact O-CG 3.17Å; V36-L40 PolarHBondContact O-N 2.82Å; V36-L64 HydrophobicContact CB-CG 4.48Å; V36-L64 HydrophobicContact CG1-CD1 3.96Å; V36-L64 HydrophobicContact CG1-CD2 3.95Å; V36-L64 HydrophobicContact CG1-CG 3.84Å; V36-L64 HydrophobicContact CG2-CD2 4.26Å; V36-L64 HydrophobicContact CG2-CG 3.92Å
37	Q	86.8	Confident	84.4	Confident	140 Å²	140	56.7 Å²	56.7	65%	0.654	26%	0.259	S	S	*	.	H	α-helix	trans	-59.7	-43	176.6	-72.5	179.8	3.3	0	0	111.8	Q33 A34 A35 L40 H41	Q33-Q37 WeakPolarHBondContact O-CG 3.36Å; Q33-Q37 PolarHBondContact O-N 2.98Å; Q33-Q37 VanDerWaalsContact O-N 3.14Å; A34-Q37 PolarHBondContact O-N 3.48Å; A35-Q37 PolarHBondContact O-N 2.87Å; Q37-L40 PolarHBondContact O-N 3.27Å; Q37-H41 PolarHBondContact O-N 3.5Å
38	Y	84.1	Confident	83.3	Confident	95 Å²	95	63.2 Å²	63.2	37%	0.373	29%	0.289	S	S	.	.	H	α-helix	trans	-67.2	-41.4	176.1	-82.6	-76.7	0	0	0	112.5	L12 A34 A35 V36 L40 H41 V42	L12-Y38 HydrophobicContact CD1-CD2 3.65Å; L12-Y38 HydrophobicContact CD1-CE2 3.92Å; A34-Y38 VanDerWaalsContact O-CD2 3.31Å; A34-Y38 WeakPolarHBondContact O-CD2 3.41Å; A34-Y38 PolarHBondContact O-N 3.01Å; A34-Y38 VanDerWaalsContact O-N 3.15Å; A35-Y38 PolarHBondContact O-N 3.35Å; V36-Y38 VanDerWaalsContact C-N 3.32Å; V36-Y38 PolarHBondContact O-N 2.79Å; Y38-L40 VanDerWaalsContact C-N 3.35Å; Y38-L40 PolarHBondContact O-N 3.33Å; Y38-H41 WeakPolarHBondContact O-CB 3.37Å; Y38-H41 PolarHBondContact O-N 3.3Å; Y38-V42 VanDerWaalsContact O-CG2 3.32Å; Y38-V42 WeakPolarHBondContact O-CG2 3.38Å; Y38-V42 PolarHBondContact O-N 3.37Å
39	F	84.1	Confident	82.6	Confident	7 Å²	7	65.3 Å²	65.3	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-38.1	175.6	-78.5	-62.3	0	0	0	112.8	L6 A9 I10 A13 A35 V36 H41 V42 V43 I56 C60 Y63	L6-F39 HydrophobicContact CD1-CD1 4.15Å; L6-F39 HydrophobicContact CD1-CE1 3.83Å; A9-F39 HydrophobicContact CB-CD1 3.69Å; A9-F39 HydrophobicContact CB-CD2 3.92Å; A9-F39 HydrophobicContact CB-CE1 3.63Å; A9-F39 HydrophobicContact CB-CE2 3.84Å; A9-F39 HydrophobicContact CB-CG 3.82Å; A9-F39 HydrophobicContact CB-CZ 3.7Å; I10-F39 HydrophobicContact CG1-CE1 4.17Å; I10-F39 HydrophobicContact CG1-CZ 4.03Å; A13-F39 HydrophobicContact CB-CE2 4.14Å; A35-F39 HydrophobicContact CB-CE2 4.46Å; A35-F39 WeakPolarHBondContact O-CD2 3.43Å; A35-F39 PolarHBondContact O-N 2.9Å; V36-F39 PolarHBondContact O-N 3.34Å; F39-H41 VanDerWaalsContact C-N 3.35Å; F39-V42 PolarHBondContact O-N 3.07Å; F39-V43 WeakPolarHBondContact O-CG2 3.21Å; F39-V43 PolarHBondContact O-N 3.43Å; F39-I56 HydrophobicContact CB-CG2 3.94Å; F39-I56 HydrophobicContact CD1-CG2 3.63Å; F39-I56 HydrophobicContact CG-CG2 4.14Å; F39-C60 WeakPolarHBondContact CB-SG 3.35Å; F39-Y63 HydrophobicContact CD2-CD2 4.34Å; F39-Y63 HydrophobicContact CD2-CE2 4.4Å; F39-Y63 HydrophobicContact CE2-CD2 4.05Å; F39-Y63 AromaticContact CE2-CE2 3.7Å; F39-Y63 HydrophobicContact CE2-CE2 3.7Å; F39-Y63 HydrophobicContact CZ-CE2 4.33Å
40	L	82.6	Confident	81.8	Confident	91 Å²	91	70.1 Å²	70.1	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-65.4	-38.5	174.6	-72.1	174.4	0	0	0	112	V36 Q37 Y38 V43 K44	V36-L40 HydrophobicContact CG1-CD1 3.99Å; V36-L40 HydrophobicContact CG1-CG 4.3Å; V36-L40 WeakPolarHBondContact O-CB 3.29Å; V36-L40 WeakPolarHBondContact O-CG 3.17Å; V36-L40 PolarHBondContact O-N 2.82Å; Q37-L40 PolarHBondContact O-N 3.27Å; Y38-L40 VanDerWaalsContact C-N 3.35Å; Y38-L40 PolarHBondContact O-N 3.33Å; L40-V43 PolarHBondContact O-N 3.06Å; L40-K44 WeakPolarHBondContact O-CB 3.32Å; L40-K44 PolarHBondContact O-N 3.16Å
41	H	84.1	Confident	81	Confident	81 Å²	81	71.6 Å²	71.6	38%	0.375	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-44.9	173.3	-172.8	-81.3	0	0	0	111.4	Q37 Y38 F39 V43 K44 Y45	Q37-H41 PolarHBondContact O-N 3.5Å; Y38-H41 WeakPolarHBondContact O-CB 3.37Å; Y38-H41 PolarHBondContact O-N 3.3Å; F39-H41 VanDerWaalsContact C-N 3.35Å; H41-V43 PolarHBondContact O-N 3.34Å; H41-K44 PolarHBondContact O-N 3.17Å; H41-Y45 AromaticContact CD2-CD2 3.72Å; H41-Y45 AromaticContact CD2-CE2 3.89Å; H41-Y45 AromaticContact CE1-CD2 3.81Å; H41-Y45 AromaticContact NE2-CD2 3.57Å; H41-Y45 AromaticContact NE2-CE2 3.93Å; H41-Y45 WeakPolarHBondContact O-CD2 3.32Å; H41-Y45 PolarHBondContact O-N 3.43Å
42	V	82.7	Confident	80.3	Confident	4 Å²	4	72.8 Å²	72.8	2%	0.024	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-42.9	176.8	173.5	0	0	0	0	111.3	N5 L6 Y38 F39 K44 E46 A47 I56	N5-V42 HydrophobicContact CB-CG2 4.04Å; L6-V42 HydrophobicContact CB-CG1 4.23Å; L6-V42 HydrophobicContact CB-CG2 4.17Å; L6-V42 HydrophobicContact CD1-CG1 4.22Å; Y38-V42 VanDerWaalsContact O-CG2 3.32Å; Y38-V42 WeakPolarHBondContact O-CG2 3.38Å; Y38-V42 PolarHBondContact O-N 3.37Å; F39-V42 PolarHBondContact O-N 3.07Å; V42-K44 VanDerWaalsContact C-N 3.29Å; V42-K44 PolarHBondContact O-N 3.49Å; V42-E46 HydrophobicContact CG1-CB 4.19Å; V42-E46 CarbonylContact O-C 3.59Å; V42-E46 WeakPolarHBondContact O-CA 3.43Å; V42-E46 PolarHBondContact O-N 2.98Å; V42-A47 PolarHBondContact O-N 3.05Å; V42-I56 HydrophobicContact CG1-CD1 4.19Å
43	V	83.3	Confident	79.7	Confident	10 Å²	10	74.9 Å²	74.9	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-63	-36.1	177.2	169.7	0	0	0	0	112.2	F39 L40 H41 K53 I56 R57	F39-V43 WeakPolarHBondContact O-CG2 3.21Å; F39-V43 PolarHBondContact O-N 3.43Å; L40-V43 PolarHBondContact O-N 3.06Å; H41-V43 PolarHBondContact O-N 3.34Å; V43-K53 HydrophobicContact CG1-CG 4.42Å; V43-I56 HydrophobicContact CG2-CB 3.81Å; V43-I56 HydrophobicContact CG2-CG2 3.45Å; V43-I56 VanDerWaalsContact CG2-CG2 3.45Å; V43-R57 HydrophobicContact CG1-CG 4.32Å; V43-R57 HydrophobicContact CG2-CG 4.4Å
44	K	80.9	Confident	79.3	Confident	150 Å²	150	76.7 Å²	76.7	65%	0.652	38%	0.378	S	S	*	.	H	α-helix	trans	-79.4	-37.5	-175.9	-169.2	173.1	178.4	-169.8	0	112.9	L40 H41 V42	L40-K44 WeakPolarHBondContact O-CB 3.32Å; L40-K44 PolarHBondContact O-N 3.16Å; H41-K44 PolarHBondContact O-N 3.17Å; V42-K44 VanDerWaalsContact C-N 3.29Å; V42-K44 PolarHBondContact O-N 3.49Å
45	Y	77.4	Confident	78.9	Confident	147 Å²	147	78.7 Å²	78.7	58%	0.576	39%	0.391	S	S	*	.	H	α-helix	trans	-122.5	-21.1	-168.2	-58.4	-68.5	0	0	0	115.5	H41	H41-Y45 AromaticContact CD2-CD2 3.72Å; H41-Y45 AromaticContact CD2-CE2 3.89Å; H41-Y45 AromaticContact CE1-CD2 3.81Å; H41-Y45 AromaticContact NE2-CD2 3.57Å; H41-Y45 AromaticContact NE2-CE2 3.93Å; H41-Y45 WeakPolarHBondContact O-CD2 3.32Å; H41-Y45 PolarHBondContact O-N 3.43Å
46	E	71.3	Confident	78.6	Confident	62 Å²	62	79.7 Å²	79.7	29%	0.29	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-30.9	-169.1	-65.4	179.4	-171.8	0	0	114.2	N5 V42 Q48	N5-E46 PolarHBondContact ND2-OE1 3.09Å; V42-E46 HydrophobicContact CG1-CB 4.19Å; V42-E46 CarbonylContact O-C 3.59Å; V42-E46 WeakPolarHBondContact O-CA 3.43Å; V42-E46 PolarHBondContact O-N 2.98Å; E46-Q48 PolarHBondContact O-N 3.42Å
47	A	70.4	Confident	78.3	Confident	16 Å²	16	86.2 Å²	86.2	13%	0.132	42%	0.42	C	S	.	.			trans	-75.7	122.8	-177.9	0	0	0	0	0	111.9	V42 K53 I56	V42-A47 PolarHBondContact O-N 3.05Å; A47-K53 HydrophobicContact CB-CG 3.75Å; A47-K53 WeakPolarHBondContact O-CE 3.46Å; A47-K53 PolarHBondContact O-NZ 3.27Å; A47-I56 HydrophobicContact CB-CD1 4.44Å
48	Q	63.3	Low	78.1	Confident	190 Å²	190	82.5 Å²	82.5	89%	0.888	41%	0.413	S	S	*	.			trans	-108.5	124.6	168.4	-64.6	-165.8	-7.1	0	0	110.1	E46	E46-Q48 PolarHBondContact O-N 3.42Å
49	G	73.8	Confident	78	Confident	44 Å²	44	82.9 Å²	82.9	45%	0.454	42%	0.417	S	S	.	.	S	Bend	trans	108.7	132	-178.1	0	0	0	0	0	114.5	K51 A52 K53	G49-K51 PolarHBondContact O-N 3.09Å; G49-A52 PolarHBondContact O-N 3.31Å; G49-K53 PolarHBondContact O-N 3.48Å
50	D	70.2	Confident	78	Confident	124 Å²	124	82.8 Å²	82.8	66%	0.663	42%	0.417	S	S	*	.	H	α-helix	trans	-67.5	-34.5	-172.5	-69.1	-41.8	0	0	0	113.8	K53 Q54	D50-K53 PolarHBondContact O-N 2.91Å; D50-Q54 WeakPolarHBondContact O-CB 3.49Å; D50-Q54 VanDerWaalsContact O-CG 3.29Å; D50-Q54 WeakPolarHBondContact O-CG 3.11Å; D50-Q54 PolarHBondContact O-N 2.84Å
51	K	75.2	Confident	78	Confident	186 Å²	186	81.2 Å²	81.2	81%	0.809	42%	0.417	S	S	*	.	H	α-helix	trans	-65.1	-39.7	177	-71.9	-175.2	178.1	179.4	0	112.6	G49 Q54 S55	G49-K51 PolarHBondContact O-N 3.09Å; K51-Q54 PolarHBondContact O-N 3.05Å; K51-S55 PolarHBondContact O-N 3.18Å
52	A	73.6	Confident	78	Confident	47 Å²	47	83.5 Å²	83.5	39%	0.388	43%	0.428	S	S	.	.	H	α-helix	trans	-69.4	-42	178.1	0	0	0	0	0	111.4	G49 Q54 S55 I56	G49-A52 PolarHBondContact O-N 3.31Å; A52-Q54 VanDerWaalsContact C-N 3.35Å; A52-Q54 PolarHBondContact O-N 2.95Å; A52-S55 PolarHBondContact O-N 2.66Å; A52-I56 VanDerWaalsContact O-CG1 3.31Å; A52-I56 WeakPolarHBondContact O-CG1 3.38Å; A52-I56 PolarHBondContact O-N 3.39Å
53	K	77.6	Confident	78.3	Confident	57 Å²	57	85.5 Å²	85.5	25%	0.248	44%	0.435	C	S	.	.	H	α-helix	trans	-61.7	-41.2	174.5	-71.1	-177.8	-178.5	-179.8	0	112.3	V43 A47 G49 D50 R57	V43-K53 HydrophobicContact CG1-CG 4.42Å; A47-K53 HydrophobicContact CB-CG 3.75Å; A47-K53 WeakPolarHBondContact O-CE 3.46Å; A47-K53 PolarHBondContact O-NZ 3.27Å; G49-K53 PolarHBondContact O-N 3.48Å; D50-K53 PolarHBondContact O-N 2.91Å; K53-R57 WeakPolarHBondContact O-CB 3.41Å; K53-R57 VanDerWaalsContact O-CG 3.25Å; K53-R57 WeakPolarHBondContact O-CG 3.48Å; K53-R57 PolarHBondContact O-N 3.35Å
54	Q	80.2	Confident	78.4	Confident	125 Å²	125	88.5 Å²	88.5	58%	0.584	45%	0.451	S	S	*	.	H	α-helix	trans	-64.3	-44.1	176.1	-76	173.8	0.7	0	0	111.9	D50 K51 A52 I56 R57 A58	D50-Q54 WeakPolarHBondContact O-CB 3.49Å; D50-Q54 VanDerWaalsContact O-CG 3.29Å; D50-Q54 WeakPolarHBondContact O-CG 3.11Å; D50-Q54 PolarHBondContact O-N 2.84Å; K51-Q54 PolarHBondContact O-N 3.05Å; A52-Q54 VanDerWaalsContact C-N 3.35Å; A52-Q54 PolarHBondContact O-N 2.95Å; Q54-I56 PolarHBondContact O-N 2.93Å; Q54-R57 PolarHBondContact O-N 2.99Å; Q54-A58 WeakPolarHBondContact O-CB 3.19Å; Q54-A58 PolarHBondContact O-N 3.3Å
55	S	78.9	Confident	78.7	Confident	70 Å²	70	85 Å²	85	49%	0.49	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-41.7	177.6	-173.3	0	0	0	0	112.6	K51 A52 A58 K59	K51-S55 PolarHBondContact O-N 3.18Å; A52-S55 PolarHBondContact O-N 2.66Å; S55-A58 PolarHBondContact O-N 2.95Å; S55-K59 PolarHBondContact O-N 3.24Å
56	I	81.5	Confident	79.2	Confident	22 Å²	22	82.8 Å²	82.8	11%	0.113	43%	0.43	C	S	.	.	H	α-helix	trans	-68.5	-40.1	177.2	-62.8	165.8	0	0	0	111	L6 F39 V42 V43 A47 A52 Q54 A58 K59 C60	L6-I56 HydrophobicContact CD1-CD1 4.48Å; F39-I56 HydrophobicContact CB-CG2 3.94Å; F39-I56 HydrophobicContact CD1-CG2 3.63Å; F39-I56 HydrophobicContact CG-CG2 4.14Å; V42-I56 HydrophobicContact CG1-CD1 4.19Å; V43-I56 HydrophobicContact CG2-CB 3.81Å; V43-I56 HydrophobicContact CG2-CG2 3.45Å; V43-I56 VanDerWaalsContact CG2-CG2 3.45Å; A47-I56 HydrophobicContact CB-CD1 4.44Å; A52-I56 VanDerWaalsContact O-CG1 3.31Å; A52-I56 WeakPolarHBondContact O-CG1 3.38Å; A52-I56 PolarHBondContact O-N 3.39Å; Q54-I56 PolarHBondContact O-N 2.93Å; I56-A58 PolarHBondContact O-N 3.36Å; I56-K59 PolarHBondContact O-N 2.93Å; I56-C60 PolarHBondContact O-N 2.81Å; I56-C60 PolarHBondContact O-SG 2.84Å
57	R	81.6	Confident	79.8	Confident	143 Å²	143	80 Å²	80	54%	0.54	42%	0.418	S	S	.	.	H	α-helix	trans	-63.4	-39.3	175.6	-77.7	176.7	-179.2	157.9	0.7	112.6	V43 K53 Q54 K59 C60 A61	V43-R57 HydrophobicContact CG1-CG 4.32Å; V43-R57 HydrophobicContact CG2-CG 4.4Å; K53-R57 WeakPolarHBondContact O-CB 3.41Å; K53-R57 VanDerWaalsContact O-CG 3.25Å; K53-R57 WeakPolarHBondContact O-CG 3.48Å; K53-R57 PolarHBondContact O-N 3.35Å; Q54-R57 PolarHBondContact O-N 2.99Å; R57-K59 VanDerWaalsContact C-N 3.35Å; R57-K59 PolarHBondContact O-N 3.09Å; R57-C60 WeakPolarHBondContact O-CB 3.49Å; R57-C60 PolarHBondContact O-N 3.48Å; R57-A61 PolarHBondContact O-N 3.44Å
58	A	84.1	Confident	80.5	Confident	62 Å²	62	85.2 Å²	85.2	51%	0.512	44%	0.439	S	S	.	.	H	α-helix	trans	-60.8	-44.3	175.5	0	0	0	0	0	111.5	Q54 S55 I56 A61 E62	Q54-A58 WeakPolarHBondContact O-CB 3.19Å; Q54-A58 PolarHBondContact O-N 3.3Å; S55-A58 PolarHBondContact O-N 2.95Å; I56-A58 PolarHBondContact O-N 3.36Å; A58-A61 PolarHBondContact O-N 2.6Å; A58-E62 PolarHBondContact O-N 2.93Å
59	K	80.4	Confident	81.7	Confident	102 Å²	102	81.3 Å²	81.3	44%	0.443	42%	0.419	S	S	.	.	H	α-helix	trans	-65.8	-36.7	174.8	-70.6	-171.7	176.1	-173.6	0	113.2	S55 I56 R57 A61 E62 Y63	S55-K59 PolarHBondContact O-N 3.24Å; I56-K59 PolarHBondContact O-N 2.93Å; R57-K59 VanDerWaalsContact C-N 3.35Å; R57-K59 PolarHBondContact O-N 3.09Å; K59-A61 VanDerWaalsContact C-N 3.31Å; K59-A61 PolarHBondContact O-N 3.31Å; K59-E62 PolarHBondContact O-N 2.89Å; K59-Y63 HydrophobicContact CB-CE2 4.19Å; K59-Y63 WeakPolarHBondContact O-CD2 3.46Å; K59-Y63 PolarHBondContact O-N 2.73Å; K59-Y63 VanDerWaalsContact O-N 3.07Å
60	C	84.2	Confident	82.2	Confident	5 Å²	5	79.4 Å²	79.4	3%	0.034	40%	0.399	C	S	.	.	H	α-helix	trans	-60.6	-42.4	174	-66.5	0	0	0	0	111.8	F39 I56 R57 E62 Y63 L64	F39-C60 WeakPolarHBondContact CB-SG 3.35Å; I56-C60 PolarHBondContact O-N 2.81Å; I56-C60 PolarHBondContact O-SG 2.84Å; R57-C60 WeakPolarHBondContact O-CB 3.49Å; R57-C60 PolarHBondContact O-N 3.48Å; C60-E62 VanDerWaalsContact C-N 3.34Å; C60-Y63 PolarHBondContact O-N 2.91Å; C60-L64 WeakPolarHBondContact O-CB 3.39Å; C60-L64 WeakPolarHBondContact O-CG 3.43Å; C60-L64 PolarHBondContact O-N 3Å
61	A	82.8	Confident	83	Confident	58 Å²	58	79.6 Å²	79.6	48%	0.479	39%	0.394	S	S	.	.	H	α-helix	trans	-63.5	-40.9	178.8	0	0	0	0	0	111.6	R57 A58 K59 L64 D65	R57-A61 PolarHBondContact O-N 3.44Å; A58-A61 PolarHBondContact O-N 2.6Å; K59-A61 VanDerWaalsContact C-N 3.31Å; K59-A61 PolarHBondContact O-N 3.31Å; A61-L64 PolarHBondContact O-N 2.9Å; A61-D65 WeakPolarHBondContact O-CB 3.45Å; A61-D65 PolarHBondContact O-N 2.94Å
62	E	85.8	Confident	83.5	Confident	129 Å²	129	76.4 Å²	76.4	60%	0.603	38%	0.382	S	S	*	.	H	α-helix	trans	-62.7	-45.3	175.9	-170.4	-176.7	170.4	0	0	112.2	A58 K59 C60 D65 R66	A58-E62 PolarHBondContact O-N 2.93Å; K59-E62 PolarHBondContact O-N 2.89Å; C60-E62 VanDerWaalsContact C-N 3.34Å; E62-D65 PolarHBondContact O-N 3.02Å; E62-R66 PolarHBondContact O-N 2.72Å; E62-R66 VanDerWaalsContact O-N 3.08Å
63	Y	87.8	Confident	83.9	Confident	46 Å²	46	80 Å²	80	18%	0.18	39%	0.386	C	S	.	.	H	α-helix	trans	-69.5	-33.4	178.1	-62.6	-37.8	0	0	0	113.1	A13 Y32 F39 K59 C60 A67	A13-Y63 HydrophobicContact CB-CD2 4.37Å; A13-Y63 HydrophobicContact CB-CE1 4.35Å; A13-Y63 HydrophobicContact CB-CE2 3.73Å; Y32-Y63 AromaticContact CD1-CD1 3.85Å; Y32-Y63 HydrophobicContact CD1-CD1 3.85Å; Y32-Y63 HydrophobicContact CD1-CG 4.08Å; Y32-Y63 AromaticContact CE1-CD1 3.53Å; Y32-Y63 HydrophobicContact CE1-CD1 3.53Å; Y32-Y63 HydrophobicContact CE1-CE1 4.11Å; Y32-Y63 HydrophobicContact CE1-CG 4.23Å; F39-Y63 HydrophobicContact CD2-CD2 4.34Å; F39-Y63 HydrophobicContact CD2-CE2 4.4Å; F39-Y63 HydrophobicContact CE2-CD2 4.05Å; F39-Y63 AromaticContact CE2-CE2 3.7Å; F39-Y63 HydrophobicContact CE2-CE2 3.7Å; F39-Y63 HydrophobicContact CZ-CE2 4.33Å; K59-Y63 HydrophobicContact CB-CE2 4.19Å; K59-Y63 WeakPolarHBondContact O-CD2 3.46Å; K59-Y63 PolarHBondContact O-N 2.73Å; K59-Y63 VanDerWaalsContact O-N 3.07Å; C60-Y63 PolarHBondContact O-N 2.91Å; Y63-A67 WeakPolarHBondContact O-CB 3.43Å; Y63-A67 PolarHBondContact O-N 2.81Å
64	L	86.6	Confident	84.2	Confident	73 Å²	73	78.1 Å²	78.1	38%	0.382	38%	0.379	S	S	.	.	H	α-helix	trans	-66.4	-46.7	173.6	-81.2	167.3	0	0	0	111.9	V36 C60 A61 R66 A67 E68	V36-L64 HydrophobicContact CB-CG 4.48Å; V36-L64 HydrophobicContact CG1-CD1 3.96Å; V36-L64 HydrophobicContact CG1-CD2 3.95Å; V36-L64 HydrophobicContact CG1-CG 3.84Å; V36-L64 HydrophobicContact CG2-CD2 4.26Å; V36-L64 HydrophobicContact CG2-CG 3.92Å; C60-L64 WeakPolarHBondContact O-CB 3.39Å; C60-L64 WeakPolarHBondContact O-CG 3.43Å; C60-L64 PolarHBondContact O-N 3Å; A61-L64 PolarHBondContact O-N 2.9Å; L64-R66 VanDerWaalsContact C-N 3.29Å; L64-R66 PolarHBondContact O-N 3.3Å; L64-A67 WeakPolarHBondContact O-CB 3.48Å; L64-A67 PolarHBondContact O-N 2.96Å; L64-E68 PolarHBondContact O-N 3.03Å
65	D	86.3	Confident	84.3	Confident	78 Å²	78	79 Å²	79	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-60.4	-40.1	176.9	177.5	72.5	0	0	0	111.4	A61 E62 E68 K69	A61-D65 WeakPolarHBondContact O-CB 3.45Å; A61-D65 PolarHBondContact O-N 2.94Å; E62-D65 PolarHBondContact O-N 3.02Å; D65-E68 PolarHBondContact O-N 3.44Å; D65-K69 WeakPolarHBondContact O-CG 3.23Å; D65-K69 PolarHBondContact O-N 3.2Å; D65-K69 VanDerWaalsContact O-N 3.11Å; D65-K69 IonicContact OD1-NZ 3.66Å; D65-K69 WeakPolarHBondContact OD2-CE 3.2Å; D65-K69 IonicContact OD2-NZ 3.28Å; D65-K69 PolarHBondContact OD2-NZ 3.48Å
66	R	86.8	Confident	84.4	Confident	99 Å²	99	82.9 Å²	82.9	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-66.1	-42.6	174.7	-172.3	59.6	178.7	168	5.8	112.3	D20 Y32 E62 L64 E68 K69 L70	D20-R66 VanDerWaalsContact CG-NH2 3.27Å; D20-R66 IonicContact OD1-CZ 2.7Å; D20-R66 IonicContact OD1-NE 2.66Å; D20-R66 IonicContact OD1-NH2 3.64Å; D20-R66 PolarHBondContact OD1-NH2 2.86Å; D20-R66 IonicContact OD2-CZ 2.65Å; D20-R66 VanDerWaalsContact OD2-CZ 3.26Å; D20-R66 IonicContact OD2-NE 3.45Å; D20-R66 PolarHBondContact OD2-NE 3.45Å; D20-R66 IonicContact OD2-NH2 3.7Å; D20-R66 PolarHBondContact OD2-NH2 3.02Å; Y32-R66 HydrophobicContact CE2-CG 3.94Å; E62-R66 PolarHBondContact O-N 2.72Å; E62-R66 VanDerWaalsContact O-N 3.08Å; L64-R66 VanDerWaalsContact C-N 3.29Å; L64-R66 PolarHBondContact O-N 3.3Å; R66-E68 VanDerWaalsContact C-N 3.33Å; R66-E68 PolarHBondContact O-N 3.16Å; R66-K69 PolarHBondContact O-N 3.27Å; R66-L70 HydrophobicContact CG-CD1 4.49Å; R66-L70 WeakPolarHBondContact O-CG 3.35Å; R66-L70 PolarHBondContact O-N 3.13Å
67	A	85.6	Confident	83.9	Confident	5 Å²	5	88 Å²	88	4%	0.041	41%	0.41	C	S	.	.	H	α-helix	trans	-62	-39.3	176.5	0	0	0	0	0	112.2	L29 Y63 L64 L70 K71	L29-A67 HydrophobicContact CD1-CB 3.8Å; L29-A67 WeakPolarHBondContact CD1-O 3.47Å; Y63-A67 WeakPolarHBondContact O-CB 3.43Å; Y63-A67 PolarHBondContact O-N 2.81Å; L64-A67 WeakPolarHBondContact O-CB 3.48Å; L64-A67 PolarHBondContact O-N 2.96Å; A67-L70 PolarHBondContact O-N 3.49Å; A67-K71 WeakPolarHBondContact O-CB 3.37Å; A67-K71 PolarHBondContact O-N 3.24Å
68	E	84.6	Confident	83.1	Confident	124 Å²	124	87.6 Å²	87.6	58%	0.579	42%	0.418	S	S	*	.	H	α-helix	trans	-64.4	-44.2	175.6	-75.1	-179	175.6	0	0	112	L64 D65 R66 L70 K71 E72	L64-E68 PolarHBondContact O-N 3.03Å; D65-E68 PolarHBondContact O-N 3.44Å; R66-E68 VanDerWaalsContact C-N 3.33Å; R66-E68 PolarHBondContact O-N 3.16Å; E68-L70 VanDerWaalsContact C-N 3.35Å; E68-L70 PolarHBondContact O-N 3.47Å; E68-K71 WeakPolarHBondContact O-CB 3.31Å; E68-K71 PolarHBondContact O-N 3.19Å; E68-E72 PolarHBondContact O-N 3.44Å
69	K	88.3	Confident	82	Confident	108 Å²	108	92.6 Å²	92.6	47%	0.47	43%	0.429	S	S	.	.	H	α-helix	trans	-59.9	-42.3	174.8	-73.4	168.5	179.3	163.2	0	112.6	D65 R66 E72 Y73	D65-K69 WeakPolarHBondContact O-CG 3.23Å; D65-K69 PolarHBondContact O-N 3.2Å; D65-K69 VanDerWaalsContact O-N 3.11Å; D65-K69 IonicContact OD1-NZ 3.66Å; D65-K69 WeakPolarHBondContact OD2-CE 3.2Å; D65-K69 IonicContact OD2-NZ 3.28Å; D65-K69 PolarHBondContact OD2-NZ 3.48Å; R66-K69 PolarHBondContact O-N 3.27Å; K69-E72 PolarHBondContact O-N 2.98Å; K69-Y73 WeakPolarHBondContact O-CB 3.45Å; K69-Y73 PolarHBondContact O-N 2.99Å
70	L	84.5	Confident	80.3	Confident	5 Å²	5	91 Å²	91	3%	0.026	44%	0.435	C	S	.	.	H	α-helix	trans	-65.8	-40.3	176.2	-71.6	177.3	0	0	0	111.8	F25 A28 L29 Y32 R66 A67 E68 Y73 L74	F25-L70 HydrophobicContact CB-CD2 4.15Å; F25-L70 HydrophobicContact CD1-CD2 3.39Å; F25-L70 HydrophobicContact CE1-CD2 4.07Å; F25-L70 HydrophobicContact CG-CD2 4.03Å; A28-L70 HydrophobicContact CB-CD1 4.04Å; L29-L70 HydrophobicContact CD1-CB 4.49Å; Y32-L70 HydrophobicContact CD2-CD1 3.96Å; Y32-L70 HydrophobicContact CE2-CD1 4.04Å; R66-L70 HydrophobicContact CG-CD1 4.49Å; R66-L70 WeakPolarHBondContact O-CG 3.35Å; R66-L70 PolarHBondContact O-N 3.13Å; A67-L70 PolarHBondContact O-N 3.49Å; E68-L70 VanDerWaalsContact C-N 3.35Å; E68-L70 PolarHBondContact O-N 3.47Å; L70-Y73 PolarHBondContact O-N 2.76Å; L70-L74 WeakPolarHBondContact O-CG 3.4Å; L70-L74 PolarHBondContact O-N 3.22Å
71	K	87.4	Confident	78.3	Confident	127 Å²	127	96.3 Å²	96.3	55%	0.552	47%	0.469	S	S	*	.	H	α-helix	trans	-63.9	-41.1	176.6	-170.5	179.1	-178.3	-178.7	0	112	L29 A67 E68 K75	L29-K71 HydrophobicContact CD1-CB 4.25Å; L29-K71 HydrophobicContact CD2-CB 4.09Å; L29-K71 HydrophobicContact CD2-CG 4.34Å; A67-K71 WeakPolarHBondContact O-CB 3.37Å; A67-K71 PolarHBondContact O-N 3.24Å; E68-K71 WeakPolarHBondContact O-CB 3.31Å; E68-K71 PolarHBondContact O-N 3.19Å; K71-K75 VanDerWaalsContact O-CB 3.3Å; K71-K75 WeakPolarHBondContact O-CB 3.44Å; K71-K75 PolarHBondContact O-N 2.93Å
72	E	84.8	Confident	76.2	Confident	120 Å²	120	99.7 Å²	99.7	56%	0.561	49%	0.486	S	S	*	.	H	α-helix	trans	-66.2	-39.9	173.9	-73.5	-167.4	166.6	0	0	112.5	E68 K69 K75 K76	E68-E72 PolarHBondContact O-N 3.44Å; K69-E72 PolarHBondContact O-N 2.98Å; E72-K75 PolarHBondContact O-N 3.27Å; E72-K76 WeakPolarHBondContact O-CG 2.98Å; E72-K76 PolarHBondContact O-N 2.88Å
73	Y	83	Confident	73.9	Confident	121 Å²	121	98.2 Å²	98.2	48%	0.475	50%	0.496	S	S	.	.	H	α-helix	trans	-62	-46.6	176.4	179.6	-97.1	0	0	0	111.8	F25 K69 L70 K76 K77	F25-Y73 AromaticContact CD2-CD1 3.92Å; F25-Y73 HydrophobicContact CD2-CD1 3.92Å; F25-Y73 AromaticContact CD2-CE1 3.5Å; F25-Y73 HydrophobicContact CD2-CE1 3.5Å; F25-Y73 VanDerWaalsContact CD2-CE1 3.5Å; F25-Y73 HydrophobicContact CE2-CD1 4.27Å; F25-Y73 AromaticContact CE2-CE1 3.57Å; F25-Y73 HydrophobicContact CE2-CE1 3.57Å; F25-Y73 HydrophobicContact CG-CD1 4.37Å; F25-Y73 HydrophobicContact CG-CE1 4.37Å; F25-Y73 HydrophobicContact CZ-CE1 4.5Å; K69-Y73 WeakPolarHBondContact O-CB 3.45Å; K69-Y73 PolarHBondContact O-N 2.99Å; L70-Y73 PolarHBondContact O-N 2.76Å; Y73-K76 PolarHBondContact O-N 3.42Å; Y73-K77 PolarHBondContact O-N 3.18Å
74	L	83	Confident	71.1	Confident	19 Å²	19	105.9 Å²	105.9	10%	0.099	53%	0.53	C	S	.	.	H	α-helix	trans	-62.8	-42.4	175.7	-69.7	170.6	0	0	0	111.7	F25 E26 L29 L70 K76 K77 D78	F25-L74 HydrophobicContact CB-CD2 4.06Å; F25-L74 HydrophobicContact CB-CG 4.36Å; E26-L74 HydrophobicContact CG-CD1 3.94Å; E26-L74 HydrophobicContact CG-CD2 3.85Å; L29-L74 HydrophobicContact CD2-CD1 3.98Å; L70-L74 WeakPolarHBondContact O-CG 3.4Å; L70-L74 PolarHBondContact O-N 3.22Å; L74-K76 VanDerWaalsContact C-N 3.26Å; L74-K76 PolarHBondContact O-N 2.95Å; L74-K77 WeakPolarHBondContact O-CB 3.21Å; L74-K77 PolarHBondContact O-N 2.8Å; L74-D78 PolarHBondContact O-N 3.23Å
75	K	82.1	Confident	68.9	Low	143 Å²	143	107.8 Å²	107.8	62%	0.622	55%	0.547	S	S	*	.	H	α-helix	trans	-64.9	-26.8	176.8	-164.3	177.7	-175.4	-177.7	0	113.4	K71 E72 K79	K71-K75 VanDerWaalsContact O-CB 3.3Å; K71-K75 WeakPolarHBondContact O-CB 3.44Å; K71-K75 PolarHBondContact O-N 2.93Å; E72-K75 PolarHBondContact O-N 3.27Å; K75-K79 WeakPolarHBondContact O-CG 3.47Å
76	K	80.4	Confident	66.1	Low	152 Å²	152	110 Å²	110	66%	0.661	56%	0.563	S	S	*	*	H	α-helix	trans	-78.9	-35.7	171.6	-74.5	176.4	-177.9	175.1	0	111.7	E72 Y73 L74 K79	E72-K76 WeakPolarHBondContact O-CG 2.98Å; E72-K76 PolarHBondContact O-N 2.88Å; Y73-K76 PolarHBondContact O-N 3.42Å; L74-K76 VanDerWaalsContact C-N 3.26Å; L74-K76 PolarHBondContact O-N 2.95Å; K76-K79 PolarHBondContact O-N 2.83Å
77	K	72.4	Confident	63.1	Low	130 Å²	130	114.2 Å²	114.2	57%	0.565	58%	0.584	S	S	*	*	H	α-helix	trans	-66.3	-39.8	176.5	-167.1	-179.1	176.6	-173	0	112.3	Y73 L74 K79 A80	Y73-K77 PolarHBondContact O-N 3.18Å; L74-K77 WeakPolarHBondContact O-CB 3.21Å; L74-K77 PolarHBondContact O-N 2.8Å; K77-K79 PolarHBondContact O-N 3.2Å; K77-A80 PolarHBondContact O-N 3.08Å
78	D	64	Low	60.3	Low	133 Å²	133	122.6 Å²	122.6	71%	0.711	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-12.6	176.7	-72.8	-25.7	0	0	0	114.1	L74	L74-D78 PolarHBondContact O-N 3.23Å
79	K	60.7	Low	57.4	Low	167 Å²	167	122.7 Å²	122.7	73%	0.726	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	2.5	176.9	-74.6	-175	175.8	-167.6	0	113.9	K75 K76 K77	K75-K79 WeakPolarHBondContact O-CG 3.47Å; K76-K79 PolarHBondContact O-N 2.83Å; K77-K79 PolarHBondContact O-N 3.2Å
80	A	45.5	Very low	54.4	Low	70 Å²	70	126.4 Å²	126.4	58%	0.579	66%	0.656	S	S	*	*	S	Bend	trans	-86.2	128.1	173	0	0	0	0	0	110.7	K77	K77-A80 PolarHBondContact O-N 3.08Å
81	P	42.7	Very low	51.6	Low	116 Å²	116	131.8 Å²	131.8	75%	0.753	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-72.2	152.1	179.5	5.1	5.7	0	0	0	112.1
82	P	38	Very low	48.6	Very low	128 Å²	128	133.4 Å²	133.4	83%	0.831	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-71.9	132.7	173.3	30.2	-31	0	0	0	110
83	A	36.8	Very low	45.7	Very low	99 Å²	99	134.6 Å²	134.6	82%	0.818	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-64.2	135	-179.2	0	0	0	0	0	112.5
84	K	29.9	Very low	43.2	Very low	206 Å²	206	138.2 Å²	138.2	90%	0.896	74%	0.737	S	S	*	*			trans	-133.1	152.5	151	-90.8	-169.2	-179.5	179.2	0	110.4
85	P	39.3	Very low	40.4	Very low	113 Å²	113	141 Å²	141	73%	0.734	77%	0.77	S	S	*	*			trans	-98.3	167.6	-152.4	35.3	-27.4	0	0	0	113.1
86	V	27.3	Very low	37.9	Very low	124 Å²	124	142.2 Å²	142.2	75%	0.752	78%	0.784	S	S	*	*			trans	134.7	114.3	143.1	176.3	0	0	0	0	113.7
87	K	25.5	Very low	35.4	Very low	188 Å²	188	143.9 Å²	143.9	82%	0.817	79%	0.794	S	S	*	*			trans	56.5	117.9	144.6	-71.6	176.6	174.2	-178	0	122
88	E	26.3	Very low	33.3	Very low	181 Å²	181	143.3 Å²	143.3	85%	0.846	81%	0.806	S	S	*	*			trans	-5.6	128.9	136.7	-65.6	171.2	149	0	0	116.7
89	S	24.1	Very low	31.9	Very low	126 Å²	126	144.2 Å²	144.2	88%	0.881	81%	0.811	S	S	*	*				-163.1	146.7	118.6	-58	0	0	0	0	110.4
90	Q	25.8	Very low	30.6	Very low	187 Å²	187	145.3 Å²	145.3	87%	0.874	82%	0.819	S	S	*	*			trans	-65.7	152.8	-177.4	-64.6	160.5	-24.5	0	0	114.4
91	S	24.7	Very low	30.2	Very low	118 Å²	118	145 Å²	145	83%	0.825	82%	0.823	S	S	*	*				176.6	144	116.3	37.7	0	0	0	0	112.4
92	D	24.8	Very low	30.3	Very low	161 Å²	161	145 Å²	145	86%	0.861	82%	0.816	S	S	*	*			trans	-59.8	150	-179.9	-58.2	-68.1	0	0	0	114.5
93	D	24.3	Very low	30.9	Very low	145 Å²	145	142.3 Å²	142.3	78%	0.775	80%	0.795	S	S	*	*				172.7	155	101.3	-162.1	18.2	0	0	0	111.8
94	K	28.6	Very low	31.7	Very low	196 Å²	196	142.4 Å²	142.4	85%	0.852	79%	0.787	S	S	*	*			trans	-55.6	145	-168.9	-67	158.4	175.1	168.1	0	116.5
95	G	24.7	Very low	32.7	Very low	77 Å²	77	139.5 Å²	139.5	79%	0.794	78%	0.776	S	S	*	*			trans	-154.9	113.3	157.4	0	0	0	0	0	110
96	N	29	Very low	33.3	Very low	169 Å²	169	141 Å²	141	90%	0.904	77%	0.771	S	S	*	*			trans	-74.7	117.6	-172.3	-148.9	18.2	0	0	0	110.3
97	E	28.5	Very low	34.6	Very low	188 Å²	188	139.7 Å²	139.7	88%	0.879	76%	0.756	S	S	*	*			trans	-130.4	121.3	160.7	-89.8	-174.2	172	0	0	110	D99	E97-D99 PolarHBondContact O-N 3.25Å
98	S	29.5	Very low	35.9	Very low	117 Å²	117	138.1 Å²	138.1	82%	0.818	75%	0.749	S	S	*	*			trans	-59.5	123.8	178.5	42.6	0	0	0	0	111.6	E100	S98-E100 PolarHBondContact O-N 3.04Å
99	D	33.3	Very low	37	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	72%	0.716	S	S	*	*			trans	-54.9	107.1	164.3	-159.5	10.7	0	0	0	110.8	E97	E97-D99 PolarHBondContact O-N 3.25Å
100	E	34.1	Very low	38.2	Very low	190 Å²	190	129.8 Å²	129.8	89%	0.888	70%	0.695	S	S	*	*			trans	-111.6	104	154.1	-89.1	-163.8	170.3	0	0	108.4	S98 D102	S98-E100 PolarHBondContact O-N 3.04Å; E100-D102 PolarHBondContact O-N 3.31Å
101	G	35.9	Very low	39.7	Very low	64 Å²	64	126.3 Å²	126.3	66%	0.66	68%	0.683	S	S	*	*			trans	-51.8	123.8	-176.1	0	0	0	0	0	113.4	D103	G101-D103 VanDerWaalsContact C-N 3.32Å; G101-D103 PolarHBondContact O-N 2.78Å
102	D	45.9	Very low	41.1	Very low	116 Å²	116	125.3 Å²	125.3	62%	0.62	67%	0.665	S	S	*	*			trans	-70.4	85.3	173.5	-151	-8.4	0	0	0	108.9	E100 P104 K107	E100-D102 PolarHBondContact O-N 3.31Å; D102-P104 VanDerWaalsContact O-CD 3.31Å; D102-P104 WeakPolarHBondContact O-CD 3.5Å; D102-K107 VanDerWaalsContact OD1-CE 3.23Å; D102-K107 WeakPolarHBondContact OD1-CE 3.43Å; D102-K107 IonicContact OD1-NZ 2.76Å; D102-K107 PolarHBondContact OD1-NZ 3.22Å; D102-K107 WeakPolarHBondContact OD2-CE 3.42Å; D102-K107 IonicContact OD2-NZ 3.68Å; D102-K107 PolarHBondContact OD2-NZ 2.88Å
103	D	51	Low	42.4	Very low	70 Å²	70	118 Å²	118	37%	0.374	63%	0.626	S	S	.	*			trans	-57.7	114.9	-173.6	-177.5	9.4	0	0	0	111.5	G101 E105 K106 K107	G101-D103 VanDerWaalsContact C-N 3.32Å; G101-D103 PolarHBondContact O-N 2.78Å; D103-E105 PolarHBondContact O-N 3.49Å; D103-E105 VanDerWaalsContact O-N 3.14Å; D103-E105 PolarHBondContact OD1-N 2.67Å; D103-E105 VanDerWaalsContact OD1-N 3.11Å; D103-K106 HydrophobicContact CB-CB 4.37Å; D103-K106 WeakPolarHBondContact O-CB 3.44Å; D103-K106 PolarHBondContact O-N 2.84Å; D103-K107 PolarHBondContact O-N 3.47Å
104	P	53.7	Low	43.9	Very low	101 Å²	101	114.8 Å²	114.8	66%	0.656	62%	0.615	S	S	*	*	H	α-helix	trans	-61.4	-21.5	179.5	22.9	-31.9	0	0	0	113.2	D102 K108	D102-P104 VanDerWaalsContact O-CD 3.31Å; D102-P104 WeakPolarHBondContact O-CD 3.5Å; P104-K108 WeakPolarHBondContact O-CB 3.26Å; P104-K108 PolarHBondContact O-N 3.02Å; P104-K108 VanDerWaalsContact O-N 3.12Å
105	E	50.8	Low	45.5	Very low	145 Å²	145	108.4 Å²	108.4	68%	0.678	61%	0.605	S	S	*	*	H	α-helix	trans	-69.2	-40.1	172.4	-67.9	-163.9	156.9	0	0	112.1	D103 K107 K108 F109	D103-E105 PolarHBondContact O-N 3.49Å; D103-E105 VanDerWaalsContact O-N 3.14Å; D103-E105 PolarHBondContact OD1-N 2.67Å; D103-E105 VanDerWaalsContact OD1-N 3.11Å; E105-K107 VanDerWaalsContact C-N 3.34Å; E105-K107 PolarHBondContact O-N 3.16Å; E105-K108 PolarHBondContact O-N 3.39Å; E105-F109 VanDerWaalsContact O-CB 3.23Å; E105-F109 WeakPolarHBondContact O-CB 3.48Å; E105-F109 PolarHBondContact O-N 3.29Å
106	K	51	Low	47.3	Very low	144 Å²	144	105 Å²	105	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-59.6	-43	174.9	-92.5	-177.8	176.1	176.7	0	111.8	D103 F109 Q110	D103-K106 HydrophobicContact CB-CB 4.37Å; D103-K106 WeakPolarHBondContact O-CB 3.44Å; D103-K106 PolarHBondContact O-N 2.84Å; K106-F109 PolarHBondContact O-N 2.77Å; K106-Q110 VanDerWaalsContact O-CB 3.29Å; K106-Q110 WeakPolarHBondContact O-CB 3.48Å; K106-Q110 VanDerWaalsContact O-CG 3.24Å; K106-Q110 WeakPolarHBondContact O-CG 3.38Å; K106-Q110 PolarHBondContact O-N 3.48Å
107	K	55	Low	49.3	Very low	98 Å²	98	97.1 Å²	97.1	43%	0.426	53%	0.527	S	S	.	.	H	α-helix	trans	-69.4	-41.1	178.8	-80.5	178.5	-179.6	167.2	0	113	D102 D103 E105 F109 Q110 N111	D102-K107 VanDerWaalsContact OD1-CE 3.23Å; D102-K107 WeakPolarHBondContact OD1-CE 3.43Å; D102-K107 IonicContact OD1-NZ 2.76Å; D102-K107 PolarHBondContact OD1-NZ 3.22Å; D102-K107 WeakPolarHBondContact OD2-CE 3.42Å; D102-K107 IonicContact OD2-NZ 3.68Å; D102-K107 PolarHBondContact OD2-NZ 2.88Å; D103-K107 PolarHBondContact O-N 3.47Å; E105-K107 VanDerWaalsContact C-N 3.34Å; E105-K107 PolarHBondContact O-N 3.16Å; K107-F109 VanDerWaalsContact C-N 3.32Å; K107-Q110 PolarHBondContact O-N 2.88Å; K107-N111 PolarHBondContact O-N 3.46Å
108	K	52.6	Low	51.7	Low	155 Å²	155	92.1 Å²	92.1	67%	0.674	51%	0.509	S	S	*	.	H	α-helix	trans	-65.4	-38.9	176.5	-163.4	176.3	-176.6	-178.5	0	111.3	P104 E105 N111 Q112	P104-K108 WeakPolarHBondContact O-CB 3.26Å; P104-K108 PolarHBondContact O-N 3.02Å; P104-K108 VanDerWaalsContact O-N 3.12Å; E105-K108 PolarHBondContact O-N 3.39Å; K108-N111 PolarHBondContact O-N 3.39Å; K108-Q112 PolarHBondContact O-N 2.88Å
109	F	48.8	Very low	54.2	Low	35 Å²	35	91.8 Å²	91.8	15%	0.154	50%	0.496	C	S	.	.	H	α-helix	trans	-73.1	-39.3	176.3	-154.4	-96.2	0	0	0	111.7	E105 K106 K107 N111 Q112 L113 K207 N211	E105-F109 VanDerWaalsContact O-CB 3.23Å; E105-F109 WeakPolarHBondContact O-CB 3.48Å; E105-F109 PolarHBondContact O-N 3.29Å; K106-F109 PolarHBondContact O-N 2.77Å; K107-F109 VanDerWaalsContact C-N 3.32Å; F109-N111 VanDerWaalsContact C-N 3.26Å; F109-N111 PolarHBondContact O-N 3.19Å; F109-Q112 CarbonylContact O-C 3.44Å; F109-Q112 WeakPolarHBondContact O-CA 3.46Å; F109-Q112 WeakPolarHBondContact O-CB 3.4Å; F109-Q112 PolarHBondContact O-N 3.33Å; F109-L113 HydrophobicContact CD1-CD1 4.07Å; F109-L113 HydrophobicContact CD1-CD2 4.06Å; F109-L113 HydrophobicContact CD1-CG 3.87Å; F109-L113 HydrophobicContact CE1-CD2 3.76Å; F109-L113 HydrophobicContact CE1-CG 4.11Å; F109-L113 VanDerWaalsContact O-CG 3.25Å; F109-L113 WeakPolarHBondContact O-CG 3.4Å; F109-L113 PolarHBondContact O-N 3.38Å; F109-K207 HydrophobicContact CE1-CB 4.01Å; F109-K207 HydrophobicContact CE2-CD 4.43Å; F109-K207 HydrophobicContact CZ-CB 3.63Å; F109-K207 HydrophobicContact CZ-CD 4.29Å; F109-N211 WeakPolarHBondContact CD1-ND2 3.43Å; F109-N211 WeakPolarHBondContact CE1-ND2 3.23Å
110	Q	51	Low	56.5	Low	96 Å²	96	86.7 Å²	86.7	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-56.4	-38.7	171	-82.7	176.3	-9.2	0	0	112.5	K106 K107 L113 S114	K106-Q110 VanDerWaalsContact O-CB 3.29Å; K106-Q110 WeakPolarHBondContact O-CB 3.48Å; K106-Q110 VanDerWaalsContact O-CG 3.24Å; K106-Q110 WeakPolarHBondContact O-CG 3.38Å; K106-Q110 PolarHBondContact O-N 3.48Å; K107-Q110 PolarHBondContact O-N 2.88Å; Q110-L113 HydrophobicContact CG-CD1 4.46Å; Q110-L113 WeakPolarHBondContact O-CB 3.34Å; Q110-L113 PolarHBondContact O-N 3Å; Q110-S114 PolarHBondContact O-N 3.46Å
111	N	56.4	Low	58.7	Low	115 Å²	115	84.9 Å²	84.9	62%	0.615	46%	0.457	S	S	*	.	H	α-helix	trans	-67.5	-36.1	173.1	-71.1	-17.5	0	0	0	112.2	K107 K108 F109 S114	K107-N111 PolarHBondContact O-N 3.46Å; K108-N111 PolarHBondContact O-N 3.39Å; F109-N111 VanDerWaalsContact C-N 3.26Å; F109-N111 PolarHBondContact O-N 3.19Å; N111-S114 PolarHBondContact O-N 2.89Å; N111-S114 PolarHBondContact O-OG 3.45Å
112	Q	53.3	Low	60.9	Low	96 Å²	96	82.5 Å²	82.5	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-69.6	-35.4	172	-72.3	175.9	-46.5	0	0	112.9	K108 F109 S114 G115	K108-Q112 PolarHBondContact O-N 2.88Å; F109-Q112 CarbonylContact O-C 3.44Å; F109-Q112 WeakPolarHBondContact O-CA 3.46Å; F109-Q112 WeakPolarHBondContact O-CB 3.4Å; F109-Q112 PolarHBondContact O-N 3.33Å; Q112-S114 VanDerWaalsContact C-N 3.32Å; Q112-S114 PolarHBondContact O-N 3.43Å; Q112-G115 PolarHBondContact O-N 3.5Å
113	L	53.4	Low	62.8	Low	8 Å²	8	83.1 Å²	83.1	4%	0.042	43%	0.432	C	S	.	.	H	α-helix	trans	-61.1	-40.2	174.6	-68.5	175.4	0	0	0	111.2	F109 Q110 G115 A116 I117 L208 N211 L215	F109-L113 HydrophobicContact CD1-CD1 4.07Å; F109-L113 HydrophobicContact CD1-CD2 4.06Å; F109-L113 HydrophobicContact CD1-CG 3.87Å; F109-L113 HydrophobicContact CE1-CD2 3.76Å; F109-L113 HydrophobicContact CE1-CG 4.11Å; F109-L113 VanDerWaalsContact O-CG 3.25Å; F109-L113 WeakPolarHBondContact O-CG 3.4Å; F109-L113 PolarHBondContact O-N 3.38Å; Q110-L113 HydrophobicContact CG-CD1 4.46Å; Q110-L113 WeakPolarHBondContact O-CB 3.34Å; Q110-L113 PolarHBondContact O-N 3Å; L113-G115 PolarHBondContact O-N 3.04Å; L113-G115 VanDerWaalsContact O-N 3.12Å; L113-A116 PolarHBondContact O-N 3.35Å; L113-A116 VanDerWaalsContact O-N 3.09Å; L113-I117 HydrophobicContact CB-CD1 4.45Å; L113-I117 HydrophobicContact CD2-CD1 4.03Å; L113-I117 PolarHBondContact O-N 3.03Å; L113-L208 HydrophobicContact CD2-CD1 3.28Å; L113-N211 HydrophobicContact CD1-CB 3.64Å; L113-N211 HydrophobicContact CD2-CB 3.87Å; L113-N211 HydrophobicContact CG-CB 4.43Å; L113-L215 HydrophobicContact CD1-CD1 4.04Å
114	S	56.1	Low	64.5	Low	78 Å²	78	80.8 Å²	80.8	55%	0.545	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.6	179.8	72.3	0	0	0	0	114.2	Q110 N111 Q112	Q110-S114 PolarHBondContact O-N 3.46Å; N111-S114 PolarHBondContact O-N 2.89Å; N111-S114 PolarHBondContact O-OG 3.45Å; Q112-S114 VanDerWaalsContact C-N 3.32Å; Q112-S114 PolarHBondContact O-N 3.43Å
115	G	61	Low	66.1	Low	62 Å²	62	81.3 Å²	81.3	64%	0.639	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-12.6	176.4	0	0	0	0	0	115.3	Q112 L113	Q112-G115 PolarHBondContact O-N 3.5Å; L113-G115 PolarHBondContact O-N 3.04Å; L113-G115 VanDerWaalsContact O-N 3.12Å
116	A	63.3	Low	67.9	Low	5 Å²	5	75.4 Å²	75.4	4%	0.041	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-31.6	-178.9	0	0	0	0	0	113	L113 L208	L113-A116 PolarHBondContact O-N 3.35Å; L113-A116 VanDerWaalsContact O-N 3.09Å; A116-L208 HydrophobicContact CB-CD1 4.33Å; A116-L208 HydrophobicContact CB-CD2 4.24Å
117	I	71.5	Confident	69.6	Low	4 Å²	4	74.8 Å²	74.8	2%	0.021	39%	0.387	C	S	.	.	S	Bend	trans	-100.5	112.5	178	-60.3	168.9	0	0	0	107.4	L113 M119 F190 I192 L208 L212	L113-I117 HydrophobicContact CB-CD1 4.45Å; L113-I117 HydrophobicContact CD2-CD1 4.03Å; L113-I117 PolarHBondContact O-N 3.03Å; I117-M119 HydrophobicContact CG2-CG 4.36Å; I117-M119 PolarHBondContact O-N 3.14Å; I117-F190 HydrophobicContact CG2-CB 4.32Å; I117-F190 HydrophobicContact CG2-CD1 3.75Å; I117-I192 HydrophobicContact CG1-CD1 4.14Å; I117-L208 HydrophobicContact CD1-CD1 3.86Å; I117-L208 HydrophobicContact CG1-CD1 4.07Å; I117-L212 HydrophobicContact CD1-CB 3.89Å; I117-L212 HydrophobicContact CD1-CD1 3.91Å; I117-L212 HydrophobicContact CD1-CG 4.48Å; I117-L212 HydrophobicContact CG1-CD1 4.2Å; I117-L212 HydrophobicContact CG2-CD1 3.87Å
118	V	77.3	Confident	71	Confident	82 Å²	82	72.9 Å²	72.9	50%	0.497	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	108.4	173.8	-178.3	0	0	0	0	107.7	E120 S191	V118-E120 HydrophobicContact CG1-CB 4.45Å; V118-E120 HydrophobicContact CG1-CG 4.44Å; V118-S191 PolarHBondContact N-O 2.92Å; V118-S191 PolarHBondContact O-N 3.28Å
119	M	83.1	Confident	72.6	Confident	110 Å²	110	66 Å²	66	54%	0.542	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	114	168	-66.4	-173.4	-68.1	0	0	108.5	I117 F189 F190	I117-M119 HydrophobicContact CG2-CG 4.36Å; I117-M119 PolarHBondContact O-N 3.14Å; M119-F189 WeakPolarHBondContact CA-O 3.38Å; M119-F190 HydrophobicContact CG-CD1 3.65Å; M119-F190 HydrophobicContact CG-CE1 3.55Å; M119-F190 HydrophobicContact SD-CD1 4.24Å; M119-F190 HydrophobicContact SD-CE1 3.53Å; M119-F190 VanDerWaalsContact SD-CE1 3.53Å; M119-F190 HydrophobicContact SD-CZ 4.31Å
120	E	80.6	Confident	74.4	Confident	47 Å²	47	64.8 Å²	64.8	22%	0.22	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154.1	178.1	56.4	178.3	-166.8	0	0	111.5	V118 P122 K178 F189	V118-E120 HydrophobicContact CG1-CB 4.45Å; V118-E120 HydrophobicContact CG1-CG 4.44Å; E120-P122 WeakPolarHBondContact O-CD 3.2Å; E120-K178 VanDerWaalsContact CD-NZ 3.29Å; E120-K178 WeakPolarHBondContact OE1-CE 3.1Å; E120-K178 IonicContact OE1-NZ 3.35Å; E120-K178 PolarHBondContact OE1-NZ 2.78Å; E120-K178 IonicContact OE2-NZ 3.23Å; E120-K178 PolarHBondContact OE2-NZ 2.98Å; E120-F189 HydrophobicContact CG-CB 4.22Å; E120-F189 HydrophobicContact CG-CD1 3.59Å; E120-F189 HydrophobicContact CG-CE1 4.46Å; E120-F189 HydrophobicContact CG-CG 4.37Å; E120-F189 PolarHBondContact N-O 3.48Å; E120-F189 WeakPolarHBondContact O-CB 3.27Å; E120-F189 PolarHBondContact O-N 3.26Å; E120-F189 VanDerWaalsContact OE1-CD1 3.22Å; E120-F189 WeakPolarHBondContact OE1-CD1 3.22Å; E120-F189 VanDerWaalsContact OE1-CE1 3.29Å; E120-F189 WeakPolarHBondContact OE1-CE1 3.39Å
121	K	81.6	Confident	76.1	Confident	152 Å²	152	61.3 Å²	61.3	66%	0.661	34%	0.339	S	S	*	.			trans	-111.1	89.3	162.5	-73.6	-172.4	175.4	-174.4	0	106.4
122	P	80.6	Confident	77.6	Confident	13 Å²	13	57.2 Å²	57.2	8%	0.084	32%	0.317	C	S	.	.			trans	-62.6	153.4	-178.9	25.3	-30.8	0	0	0	110	E120 K178 A181 T182 F189	E120-P122 WeakPolarHBondContact O-CD 3.2Å; P122-K178 HydrophobicContact CB-CB 3.86Å; P122-K178 HydrophobicContact CB-CG 4.31Å; P122-K178 HydrophobicContact CG-CB 4.12Å; P122-K178 VanDerWaalsContact CG-O 3.3Å; P122-K178 WeakPolarHBondContact CG-O 3.5Å; P122-A181 HydrophobicContact CG-CB 3.79Å; P122-T182 PolarHBondContact O-OG1 3.11Å; P122-F189 HydrophobicContact CG-CB 4.37Å
123	N	85.6	Confident	79.3	Confident	129 Å²	129	57.8 Å²	57.8	69%	0.69	32%	0.319	S	S	*	.			trans	-124.4	55.8	174.4	-173.2	33.7	0	0	0	109.4	T182	N123-T182 PolarHBondContact N-OG1 3.31Å
124	I	86.8	Confident	81	Confident	22 Å²	22	60 Å²	60	11%	0.113	34%	0.344	C	S	.	.			trans	-111.3	124.4	178.4	-64.4	168.4	0	0	0	106.7	D128 V129 Y175 K178 A179 T182	I124-D128 HydrophobicContact CG2-CB 4.1Å; I124-V129 HydrophobicContact CG2-CG2 4.41Å; I124-Y175 HydrophobicContact CD1-CD2 3.8Å; I124-Y175 HydrophobicContact CD1-CE2 3.47Å; I124-Y175 VanDerWaalsContact CD1-CE2 3.47Å; I124-Y175 HydrophobicContact CG1-CE2 4.18Å; I124-Y175 HydrophobicContact CG2-CD1 4.22Å; I124-Y175 HydrophobicContact CG2-CE1 3.61Å; I124-Y175 HydrophobicContact CG2-CE2 4.33Å; I124-K178 HydrophobicContact CD1-CB 3.7Å; I124-K178 HydrophobicContact CD1-CD 3.88Å; I124-K178 HydrophobicContact CD1-CG 4.45Å; I124-A179 HydrophobicContact CB-CB 4.44Å; I124-A179 HydrophobicContact CG2-CB 3.86Å; I124-A179 WeakPolarHBondContact O-CA 3.41Å; I124-T182 PolarHBondContact N-OG1 3.32Å; I124-T182 VanDerWaalsContact N-OG1 3.08Å; I124-T182 WeakPolarHBondContact O-CB 3.24Å; I124-T182 WeakPolarHBondContact O-CG2 3.38Å; I124-T182 PolarHBondContact O-OG1 3.27Å
125	K	88.3	Confident	82.6	Confident	112 Å²	112	56.6 Å²	56.6	49%	0.487	32%	0.321	S	S	.	.			trans	-94	165.8	-179.3	-62.6	-178.3	179.1	-178.8	0	111.2	D127 D128	K125-D127 PolarHBondContact O-N 3.26Å; K125-D128 PolarHBondContact N-OD2 3.37Å; K125-D128 WeakPolarHBondContact O-CB 3.3Å; K125-D128 PolarHBondContact O-N 3.02Å; K125-D128 VanDerWaalsContact O-N 3.13Å
126	W	88.4	Confident	84.1	Confident	20 Å²	20	54.1 Å²	54.1	8%	0.076	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-57	-33	172.2	-68.6	118.6	0	0	0	113.7	D128 V129 K136 L139 K140 I144 L176 A179 V180 E183	W126-D128 VanDerWaalsContact C-N 3.28Å; W126-D128 PolarHBondContact O-N 2.94Å; W126-V129 PolarHBondContact O-N 3.39Å; W126-K136 HydrophobicContact CE3-CB 4.28Å; W126-K136 HydrophobicContact CE3-CD 4.21Å; W126-K136 HydrophobicContact CE3-CG 3.81Å; W126-K136 HydrophobicContact CZ3-CB 4.26Å; W126-K136 HydrophobicContact CZ3-CG 3.95Å; W126-K136 WeakPolarHBondContact O-CE 3.29Å; W126-K136 PolarHBondContact O-NZ 2.79Å; W126-L139 HydrophobicContact CH2-CB 4.08Å; W126-K140 HydrophobicContact CZ2-CG 4.01Å; W126-I144 HydrophobicContact CZ2-CG1 4.46Å; W126-L176 HydrophobicContact CZ3-CD1 3.77Å; W126-A179 HydrophobicContact CE3-CB 4.4Å; W126-A179 HydrophobicContact CZ3-CB 4.46Å; W126-V180 HydrophobicContact CH2-CB 4.4Å; W126-V180 HydrophobicContact CH2-CG2 3.56Å; W126-V180 HydrophobicContact CZ2-CG2 4.37Å; W126-V180 HydrophobicContact CZ3-CG2 4.27Å; W126-E183 VanDerWaalsContact CD1-CG 3.43Å; W126-E183 HydrophobicContact CD2-CG 4.2Å; W126-E183 HydrophobicContact CG-CG 4.08Å; W126-E183 HydrophobicContact CZ2-CB 4.11Å; W126-E183 HydrophobicContact CZ2-CG 4.32Å; W126-E183 PolarHBondContact N-OE1 3.25Å; W126-E183 VanDerWaalsContact NE1-CD 3.3Å; W126-E183 PolarHBondContact NE1-OE2 2.87Å
127	D	86.4	Confident	85.5	Confident	132 Å²	132	60.3 Å²	60.3	71%	0.706	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-72.6	-22.7	-179	-61.1	-24.1	0	0	0	112.5	K125 V129	K125-D127 PolarHBondContact O-N 3.26Å; D127-V129 PolarHBondContact O-N 2.75Å
128	D	84.1	Confident	86.4	Confident	57 Å²	57	61.1 Å²	61.1	31%	0.305	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-77.4	-15.6	175.1	-56.8	-40.1	0	0	0	111.5	I124 K125 W126 Y175	I124-D128 HydrophobicContact CG2-CB 4.1Å; K125-D128 PolarHBondContact N-OD2 3.37Å; K125-D128 WeakPolarHBondContact O-CB 3.3Å; K125-D128 PolarHBondContact O-N 3.02Å; K125-D128 VanDerWaalsContact O-N 3.13Å; W126-D128 VanDerWaalsContact C-N 3.28Å; W126-D128 PolarHBondContact O-N 2.94Å; D128-Y175 HydrophobicContact CB-CE1 4.42Å
129	V	86.9	Confident	87.1	Confident	11 Å²	11	57.2 Å²	57.2	7%	0.067	30%	0.304	C	S	.	.	S	Bend	trans	-94.5	110.4	177.7	-173.8	0	0	0	0	109.7	I124 W126 D127 G131 L132 K136 Y175 L176 A179	I124-V129 HydrophobicContact CG2-CG2 4.41Å; W126-V129 PolarHBondContact O-N 3.39Å; D127-V129 PolarHBondContact O-N 2.75Å; V129-G131 PolarHBondContact O-N 3.38Å; V129-L132 HydrophobicContact CG1-CD1 4.28Å; V129-K136 WeakPolarHBondContact O-CE 3.22Å; V129-K136 PolarHBondContact O-NZ 3.39Å; V129-Y175 HydrophobicContact CG2-CD1 3.96Å; V129-Y175 HydrophobicContact CG2-CE1 4.1Å; V129-L176 HydrophobicContact CG1-CD1 4.12Å; V129-A179 HydrophobicContact CG2-CB 3.74Å
130	A	86.5	Confident	87.6	Confident	10 Å²	10	55.9 Å²	55.9	8%	0.083	30%	0.295	C	S	.	.			trans	-72.3	124.1	-179.3	0	0	0	0	0	112.7	F301 M302	A130-F301 HydrophobicContact CB-CD1 3.55Å; A130-F301 HydrophobicContact CB-CE1 4.16Å; A130-M302 HydrophobicContact CB-CE 3.79Å; A130-M302 HydrophobicContact CB-CG 3.63Å
131	G	87.1	Confident	88	Confident	23 Å²	23	59.4 Å²	59.4	24%	0.237	31%	0.312	C	S	.	.	S	Bend	trans	67.8	-144.6	177	0	0	0	0	0	113.3	V129 E133 K136	V129-G131 PolarHBondContact O-N 3.38Å; G131-E133 VanDerWaalsContact C-N 3.26Å; G131-E133 PolarHBondContact O-N 2.94Å; G131-K136 WeakPolarHBondContact O-CE 3.33Å; G131-K136 PolarHBondContact O-NZ 3.19Å
132	L	87.4	Confident	88.4	Confident	28 Å²	28	52.4 Å²	52.4	15%	0.147	28%	0.282	C	S	.	.			trans	58.9	30.8	179.7	-59.4	177.4	0	0	0	114.1	V129 G134 A135 K136 L176 I291 P292	V129-L132 HydrophobicContact CG1-CD1 4.28Å; L132-G134 VanDerWaalsContact C-N 3.32Å; L132-G134 PolarHBondContact O-N 3.44Å; L132-A135 HydrophobicContact CB-CB 4.26Å; L132-A135 CarbonylContact O-C 3.6Å; L132-A135 WeakPolarHBondContact O-CA 3.32Å; L132-A135 PolarHBondContact O-N 3.38Å; L132-K136 WeakPolarHBondContact O-CG 3.5Å; L132-K136 PolarHBondContact O-N 3.49Å; L132-L176 HydrophobicContact CD1-CD2 4.45Å; L132-I291 HydrophobicContact CD1-CG2 3.94Å; L132-I291 HydrophobicContact CD2-CG2 3.83Å; L132-P292 HydrophobicContact CD2-CG 4.04Å
133	E	88.9	Confident	88.8	Confident	108 Å²	108	52.2 Å²	52.2	51%	0.505	28%	0.281	S	S	.	.	H	α-helix	trans	-56.7	-42.3	-172.8	-61.6	-51.4	137.9	0	0	113.1	G131 A135 K136 E137	G131-E133 VanDerWaalsContact C-N 3.26Å; G131-E133 PolarHBondContact O-N 2.94Å; E133-A135 PolarHBondContact O-N 2.88Å; E133-K136 PolarHBondContact O-N 2.64Å; E133-K136 IonicContact OE1-NZ 3.79Å; E133-K136 PolarHBondContact OE1-NZ 3.04Å; E133-K136 IonicContact OE2-NZ 2.66Å; E133-E137 PolarHBondContact O-N 3.32Å
134	G	88.6	Confident	89	Confident	54 Å²	54	47.7 Å²	47.7	56%	0.557	26%	0.256	S	S	*	.	H	α-helix	trans	-63	-38.2	174.7	0	0	0	0	0	113.6	L132 A138	L132-G134 VanDerWaalsContact C-N 3.32Å; L132-G134 PolarHBondContact O-N 3.44Å; G134-A138 WeakPolarHBondContact O-CB 3.28Å; G134-A138 PolarHBondContact O-N 2.87Å
135	A	91.1	Very high	89.1	Confident	8 Å²	8	49.6 Å²	49.6	7%	0.066	27%	0.266	C	S	.	.	H	α-helix	trans	-72.8	-36.3	176.3	0	0	0	0	0	112	L132 E133 A138 L139 L176 I289 I291	L132-A135 HydrophobicContact CB-CB 4.26Å; L132-A135 CarbonylContact O-C 3.6Å; L132-A135 WeakPolarHBondContact O-CA 3.32Å; L132-A135 PolarHBondContact O-N 3.38Å; E133-A135 PolarHBondContact O-N 2.88Å; A135-A138 PolarHBondContact O-N 3.48Å; A135-L139 WeakPolarHBondContact O-CB 3.42Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 2.8Å; A135-L176 HydrophobicContact CB-CD2 4.44Å; A135-I289 HydrophobicContact CB-CG2 3.72Å; A135-I291 HydrophobicContact CB-CD1 3.57Å
136	K	91.9	Very high	89.1	Confident	10 Å²	10	45 Å²	45	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-45.4	173.1	-70.2	176.3	179	168.6	0	111	W126 V129 G131 L132 E133 L139 K140 L176	W126-K136 HydrophobicContact CE3-CB 4.28Å; W126-K136 HydrophobicContact CE3-CD 4.21Å; W126-K136 HydrophobicContact CE3-CG 3.81Å; W126-K136 HydrophobicContact CZ3-CB 4.26Å; W126-K136 HydrophobicContact CZ3-CG 3.95Å; W126-K136 WeakPolarHBondContact O-CE 3.29Å; W126-K136 PolarHBondContact O-NZ 2.79Å; V129-K136 WeakPolarHBondContact O-CE 3.22Å; V129-K136 PolarHBondContact O-NZ 3.39Å; G131-K136 WeakPolarHBondContact O-CE 3.33Å; G131-K136 PolarHBondContact O-NZ 3.19Å; L132-K136 WeakPolarHBondContact O-CG 3.5Å; L132-K136 PolarHBondContact O-N 3.49Å; E133-K136 PolarHBondContact O-N 2.64Å; E133-K136 IonicContact OE1-NZ 3.79Å; E133-K136 PolarHBondContact OE1-NZ 3.04Å; E133-K136 IonicContact OE2-NZ 2.66Å; K136-L139 PolarHBondContact O-N 3.01Å; K136-K140 WeakPolarHBondContact O-CB 3.5Å; K136-K140 VanDerWaalsContact O-CG 3.25Å; K136-K140 WeakPolarHBondContact O-CG 3.39Å; K136-K140 PolarHBondContact O-N 3.4Å; K136-L176 HydrophobicContact CG-CD1 4.34Å
137	E	92.3	Very high	89	Confident	135 Å²	135	46.9 Å²	46.9	63%	0.631	26%	0.259	S	S	*	.	H	α-helix	trans	-61.1	-47.8	175.2	-84.2	-173.6	149.3	0	0	111.5	E133 L139 K140 E141	E133-E137 PolarHBondContact O-N 3.32Å; E137-L139 VanDerWaalsContact C-N 3.27Å; E137-L139 PolarHBondContact O-N 3.39Å; E137-K140 PolarHBondContact O-N 3.04Å; E137-K140 VanDerWaalsContact O-N 3.14Å; E137-E141 WeakPolarHBondContact O-CB 3.34Å; E137-E141 PolarHBondContact O-N 3.33Å
138	A	91.7	Very high	89	Confident	20 Å²	20	47.4 Å²	47.4	17%	0.165	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-38.3	177.1	0	0	0	0	0	112.4	G134 A135 A142 I289	G134-A138 WeakPolarHBondContact O-CB 3.28Å; G134-A138 PolarHBondContact O-N 2.87Å; A135-A138 PolarHBondContact O-N 3.48Å; A138-A142 WeakPolarHBondContact O-CB 3.4Å; A138-A142 PolarHBondContact O-N 3.04Å; A138-I289 HydrophobicContact CB-CD1 3.84Å; A138-I289 HydrophobicContact CB-CG1 4.26Å; A138-I289 HydrophobicContact CB-CG2 4.49Å
139	L	92.1	Very high	89.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-73.7	-37.8	175.5	-76.7	165.5	0	0	0	113.1	W126 A135 K136 E137 E141 A142 V143 I163 L165 L176 V180 I289	W126-L139 HydrophobicContact CH2-CB 4.08Å; A135-L139 WeakPolarHBondContact O-CB 3.42Å; A135-L139 WeakPolarHBondContact O-CG 3.36Å; A135-L139 PolarHBondContact O-N 2.8Å; K136-L139 PolarHBondContact O-N 3.01Å; E137-L139 VanDerWaalsContact C-N 3.27Å; E137-L139 PolarHBondContact O-N 3.39Å; L139-E141 VanDerWaalsContact C-N 3.3Å; L139-E141 PolarHBondContact O-N 3.47Å; L139-A142 PolarHBondContact O-N 2.89Å; L139-V143 HydrophobicContact CD2-CG2 4.32Å; L139-V143 WeakPolarHBondContact O-CB 3.49Å; L139-V143 PolarHBondContact O-N 3.02Å; L139-I163 HydrophobicContact CD2-CD1 4.38Å; L139-I163 HydrophobicContact CD2-CG2 4.42Å; L139-L165 HydrophobicContact CD1-CD2 4.43Å; L139-L165 HydrophobicContact CD2-CD2 4.3Å; L139-L176 HydrophobicContact CD1-CD1 3.94Å; L139-L176 HydrophobicContact CD1-CD2 3.5Å; L139-L176 VanDerWaalsContact CD1-CD2 3.5Å; L139-L176 HydrophobicContact CD1-CG 3.54Å; L139-V180 HydrophobicContact CB-CG2 4.05Å; L139-V180 HydrophobicContact CD1-CG2 3.66Å; L139-V180 HydrophobicContact CD2-CG2 3.97Å; L139-V180 HydrophobicContact CG-CG2 4.11Å; L139-I289 HydrophobicContact CD2-CD1 3.75Å; L139-I289 HydrophobicContact CG-CD1 3.71Å
140	K	92	Very high	89.3	Confident	82 Å²	82	52 Å²	52	36%	0.357	28%	0.28	S	S	.	.	I	π-helix	trans	-60.6	-43.4	173.3	-76.4	170.8	-178.1	175.7	0	110.6	W126 K136 E137 I144 L145	W126-K140 HydrophobicContact CZ2-CG 4.01Å; K136-K140 WeakPolarHBondContact O-CB 3.5Å; K136-K140 VanDerWaalsContact O-CG 3.25Å; K136-K140 WeakPolarHBondContact O-CG 3.39Å; K136-K140 PolarHBondContact O-N 3.4Å; E137-K140 PolarHBondContact O-N 3.04Å; E137-K140 VanDerWaalsContact O-N 3.14Å; K140-I144 HydrophobicContact CG-CG1 4.43Å; K140-I144 CarbonylContact O-C 3.59Å; K140-I144 WeakPolarHBondContact O-CA 3.33Å; K140-I144 WeakPolarHBondContact O-CB 2.95Å; K140-I144 PolarHBondContact O-N 3.11Å; K140-L145 PolarHBondContact O-N 3.04Å
141	E	90.9	Very high	89.4	Confident	122 Å²	122	57.3 Å²	57.3	57%	0.57	30%	0.303	S	S	*	.	I	π-helix	trans	-67.2	-45.6	175.8	-170.5	-172.4	169.2	0	0	112	E137 L139 L145 P146	E137-E141 WeakPolarHBondContact O-CB 3.34Å; E137-E141 PolarHBondContact O-N 3.33Å; L139-E141 VanDerWaalsContact C-N 3.3Å; L139-E141 PolarHBondContact O-N 3.47Å; E141-L145 HydrophobicContact CG-CD2 4.28Å; E141-L145 WeakPolarHBondContact O-CB 3.09Å; E141-P146 WeakPolarHBondContact O-CD 3.31Å
142	A	88.6	Confident	89.6	Confident	5 Å²	5	59.7 Å²	59.7	4%	0.041	31%	0.31	C	S	.	.	I	π-helix	trans	-75.9	-30.4	-174.3	0	0	0	0	0	113.8	A138 L139 I163	A138-A142 WeakPolarHBondContact O-CB 3.4Å; A138-A142 PolarHBondContact O-N 3.04Å; L139-A142 PolarHBondContact O-N 2.89Å; A142-I163 HydrophobicContact CB-CD1 3.57Å
143	V	89.2	Confident	89.7	Confident	8 Å²	8	61 Å²	61	5%	0.048	31%	0.314	C	S	.	.	I	π-helix	trans	-116.5	-48.8	-171.3	-173.7	0	0	0	0	112.6	L139 P146 I147 I163 V180 A184 I223 L266	L139-V143 HydrophobicContact CD2-CG2 4.32Å; L139-V143 WeakPolarHBondContact O-CB 3.49Å; L139-V143 PolarHBondContact O-N 3.02Å; V143-P146 WeakPolarHBondContact O-CD 3.39Å; V143-I147 HydrophobicContact CG1-CD1 4.29Å; V143-I147 VanDerWaalsContact O-CD1 3.31Å; V143-I147 WeakPolarHBondContact O-CD1 3.28Å; V143-I147 VanDerWaalsContact O-CG1 3.31Å; V143-I147 WeakPolarHBondContact O-CG1 3Å; V143-I163 HydrophobicContact CG2-CD1 3.55Å; V143-V180 HydrophobicContact CB-CG1 4.03Å; V143-V180 HydrophobicContact CG1-CG1 3.72Å; V143-V180 HydrophobicContact CG2-CG1 4.01Å; V143-A184 HydrophobicContact CG1-CB 4.24Å; V143-I223 HydrophobicContact CG1-CD1 4.43Å; V143-L266 HydrophobicContact CB-CD2 4.16Å; V143-L266 HydrophobicContact CG1-CD2 3.68Å; V143-L266 HydrophobicContact CG2-CD2 3.42Å; V143-L266 VanDerWaalsContact CG2-CD2 3.42Å
144	I	89.1	Confident	89.5	Confident	35 Å²	35	59.2 Å²	59.2	18%	0.179	31%	0.311	C	S	.	.	I	π-helix	trans	-79.8	-40.1	-172.2	-51	-58.4	0	0	0	111.1	W126 K140 I147 K148 E183 A184	W126-I144 HydrophobicContact CZ2-CG1 4.46Å; K140-I144 HydrophobicContact CG-CG1 4.43Å; K140-I144 CarbonylContact O-C 3.59Å; K140-I144 WeakPolarHBondContact O-CA 3.33Å; K140-I144 WeakPolarHBondContact O-CB 2.95Å; K140-I144 PolarHBondContact O-N 3.11Å; I144-I147 PolarHBondContact O-N 2.85Å; I144-K148 WeakPolarHBondContact O-CB 2.96Å; I144-K148 PolarHBondContact O-N 3.17Å; I144-E183 HydrophobicContact CD1-CB 4.15Å; I144-A184 HydrophobicContact CD1-CB 3.9Å
145	L	90.6	Very high	89.5	Confident	61 Å²	61	60.3 Å²	60.3	32%	0.319	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-44.3	-178.3	-167	75.3	0	0	0	113	K140 E141 I147 K148 F149 F153	K140-L145 PolarHBondContact O-N 3.04Å; E141-L145 HydrophobicContact CG-CD2 4.28Å; E141-L145 WeakPolarHBondContact O-CB 3.09Å; L145-I147 VanDerWaalsContact C-N 3.35Å; L145-I147 PolarHBondContact O-N 3.48Å; L145-K148 PolarHBondContact O-N 3.13Å; L145-F149 HydrophobicContact CD1-CD2 3.69Å; L145-F149 HydrophobicContact CD1-CE2 4.14Å; L145-F149 PolarHBondContact O-N 3Å; L145-F153 HydrophobicContact CB-CE2 4.46Å; L145-F153 HydrophobicContact CB-CZ 4.47Å; L145-F153 HydrophobicContact CD2-CE2 4.3Å; L145-F153 HydrophobicContact CD2-CZ 4.09Å; L145-F153 HydrophobicContact CG-CE2 4.12Å; L145-F153 HydrophobicContact CG-CZ 4.3Å
146	P	87.8	Confident	89.3	Confident	16 Å²	16	70 Å²	70	10%	0.104	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-37.7	174.8	-19.1	28.8	0	0	0	114.3	E141 V143 P150 F153 P159	E141-P146 WeakPolarHBondContact O-CD 3.31Å; V143-P146 WeakPolarHBondContact O-CD 3.39Å; P146-P150 WeakPolarHBondContact O-CA 3.29Å; P146-F153 VanDerWaalsContact CA-CD2 3.49Å; P146-F153 HydrophobicContact CB-CD1 4.38Å; P146-F153 HydrophobicContact CB-CD2 3.86Å; P146-F153 HydrophobicContact CB-CE1 4.38Å; P146-F153 HydrophobicContact CB-CE2 3.86Å; P146-F153 HydrophobicContact CB-CG 4.13Å; P146-F153 HydrophobicContact CB-CZ 4.12Å; P146-F153 HydrophobicContact CG-CD1 4.29Å; P146-F153 HydrophobicContact CG-CD2 4.25Å; P146-F153 HydrophobicContact CG-CE1 3.84Å; P146-F153 HydrophobicContact CG-CE2 3.81Å; P146-F153 HydrophobicContact CG-CG 4.47Å; P146-F153 HydrophobicContact CG-CZ 3.58Å; P146-P159 HydrophobicContact CB-CB 3.78Å; P146-P159 HydrophobicContact CG-CB 3.81Å
147	I	85.6	Confident	89.1	Confident	59 Å²	59	76.9 Å²	76.9	30%	0.303	39%	0.388	S	S	.	.	H	α-helix	trans	-69	-42.3	179	-65.1	171.7	0	0	0	110.2	V143 I144 L145 A184 N185	V143-I147 HydrophobicContact CG1-CD1 4.29Å; V143-I147 VanDerWaalsContact O-CD1 3.31Å; V143-I147 WeakPolarHBondContact O-CD1 3.28Å; V143-I147 VanDerWaalsContact O-CG1 3.31Å; V143-I147 WeakPolarHBondContact O-CG1 3Å; I144-I147 PolarHBondContact O-N 2.85Å; L145-I147 VanDerWaalsContact C-N 3.35Å; L145-I147 PolarHBondContact O-N 3.48Å; I147-A184 HydrophobicContact CD1-CB 3.79Å; I147-N185 WeakPolarHBondContact CG2-ND2 3.04Å
148	K	87.1	Confident	88.8	Confident	144 Å²	144	74.9 Å²	74.9	63%	0.626	39%	0.386	S	S	*	.	H	α-helix	trans	-75.2	-37.3	-177.4	-170.2	171.9	-177.5	173.6	0	112.8	I144 L145	I144-K148 WeakPolarHBondContact O-CB 2.96Å; I144-K148 PolarHBondContact O-N 3.17Å; L145-K148 PolarHBondContact O-N 3.13Å
149	F	89.6	Confident	88.7	Confident	79 Å²	79	76.5 Å²	76.5	35%	0.346	39%	0.394	S	S	.	.			trans	-131.4	67	-175.4	-56.5	-63	0	0	0	111.9	L145 H151 L152	L145-F149 HydrophobicContact CD1-CD2 3.69Å; L145-F149 HydrophobicContact CD1-CE2 4.14Å; L145-F149 PolarHBondContact O-N 3Å; F149-H151 AromaticContact CD1-CE1 3.87Å; F149-H151 PolarHBondContact O-N 2.72Å; F149-H151 VanDerWaalsContact O-N 3.09Å; F149-L152 HydrophobicContact CB-CD1 3.71Å; F149-L152 HydrophobicContact CB-CG 3.96Å; F149-L152 HydrophobicContact CD2-CD1 4.43Å; F149-L152 HydrophobicContact CG-CD1 4.31Å; F149-L152 WeakPolarHBondContact O-CB 3.24Å; F149-L152 PolarHBondContact O-N 2.97Å
150	P	87.6	Confident	88.5	Confident	84 Å²	84	81.9 Å²	81.9	55%	0.545	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-60	-27.3	-176.1	22.9	-34.2	0	0	0	113.2	P146 L152 F153	P146-P150 WeakPolarHBondContact O-CA 3.29Å; P150-L152 PolarHBondContact O-N 3.29Å; P150-F153 CarbonylContact O-C 3.54Å; P150-F153 PolarHBondContact O-N 3.43Å
151	H	89.2	Confident	88.3	Confident	123 Å²	123	82.9 Å²	82.9	57%	0.569	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-62.1	-25.6	177.4	68	-87.8	0	0	0	113.9	F149 F153 T154	F149-H151 AromaticContact CD1-CE1 3.87Å; F149-H151 PolarHBondContact O-N 2.72Å; F149-H151 VanDerWaalsContact O-N 3.09Å; H151-F153 VanDerWaalsContact C-N 3.25Å; H151-T154 WeakPolarHBondContact O-CG2 3.44Å; H151-T154 PolarHBondContact O-OG1 2.92Å
152	L	91.2	Very high	88.4	Confident	72 Å²	72	77.1 Å²	77.1	38%	0.377	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-70.7	-25.9	174.4	-63.3	179.6	0	0	0	111.9	F149 P150 T154 R157	F149-L152 HydrophobicContact CB-CD1 3.71Å; F149-L152 HydrophobicContact CB-CG 3.96Å; F149-L152 HydrophobicContact CD2-CD1 4.43Å; F149-L152 HydrophobicContact CG-CD1 4.31Å; F149-L152 WeakPolarHBondContact O-CB 3.24Å; F149-L152 PolarHBondContact O-N 2.97Å; P150-L152 PolarHBondContact O-N 3.29Å; L152-T154 PolarHBondContact O-N 2.87Å; L152-R157 PolarHBondContact O-NE 3.43Å
153	F	88.2	Confident	88.7	Confident	55 Å²	55	76.9 Å²	76.9	24%	0.241	39%	0.387	C	S	.	.	S	Bend	trans	-102.9	56.5	-176.5	-62.8	-92.6	0	0	0	110.9	L145 P146 P150 H151 R157 P159	L145-F153 HydrophobicContact CB-CE2 4.46Å; L145-F153 HydrophobicContact CB-CZ 4.47Å; L145-F153 HydrophobicContact CD2-CE2 4.3Å; L145-F153 HydrophobicContact CD2-CZ 4.09Å; L145-F153 HydrophobicContact CG-CE2 4.12Å; L145-F153 HydrophobicContact CG-CZ 4.3Å; P146-F153 VanDerWaalsContact CA-CD2 3.49Å; P146-F153 HydrophobicContact CB-CD1 4.38Å; P146-F153 HydrophobicContact CB-CD2 3.86Å; P146-F153 HydrophobicContact CB-CE1 4.38Å; P146-F153 HydrophobicContact CB-CE2 3.86Å; P146-F153 HydrophobicContact CB-CG 4.13Å; P146-F153 HydrophobicContact CB-CZ 4.12Å; P146-F153 HydrophobicContact CG-CD1 4.29Å; P146-F153 HydrophobicContact CG-CD2 4.25Å; P146-F153 HydrophobicContact CG-CE1 3.84Å; P146-F153 HydrophobicContact CG-CE2 3.81Å; P146-F153 HydrophobicContact CG-CG 4.47Å; P146-F153 HydrophobicContact CG-CZ 3.58Å; P150-F153 CarbonylContact O-C 3.54Å; P150-F153 PolarHBondContact O-N 3.43Å; H151-F153 VanDerWaalsContact C-N 3.25Å; F153-R157 CarbonylContact C-O 2.89Å; F153-R157 WeakPolarHBondContact CA-O 3.31Å; F153-P159 HydrophobicContact CD1-CB 4.41Å
154	T	85.8	Confident	89	Confident	72 Å²	72	76.5 Å²	76.5	44%	0.442	39%	0.385	S	S	.	.			trans	-117	153.1	177.6	53.3	0	0	0	0	111.6	H151 L152 K156 R157	H151-T154 WeakPolarHBondContact O-CG2 3.44Å; H151-T154 PolarHBondContact O-OG1 2.92Å; L152-T154 PolarHBondContact O-N 2.87Å; T154-K156 PolarHBondContact O-N 3.2Å; T154-R157 PolarHBondContact N-O 2.95Å; T154-R157 PolarHBondContact O-N 3.44Å
155	G	88.3	Confident	89.3	Confident	76 Å²	76	74.8 Å²	74.8	78%	0.784	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	-120.9	-178.2	0	0	0	0	0	111.7
156	K	86.3	Confident	89.5	Confident	211 Å²	211	71.9 Å²	71.9	92%	0.917	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.9	178.9	-67.8	-172.9	177.5	-178.1	0	114	T154 T158	T154-K156 PolarHBondContact O-N 3.2Å; K156-T158 PolarHBondContact O-N 2.99Å
157	R	87.8	Confident	89.9	Confident	155 Å²	155	71.1 Å²	71.1	59%	0.585	36%	0.356	S	S	*	.			trans	-86.2	100.2	176.8	-67.7	168.1	-66.1	-176.2	3.9	107.2	L152 F153 T154	L152-R157 PolarHBondContact O-NE 3.43Å; F153-R157 CarbonylContact C-O 2.89Å; F153-R157 WeakPolarHBondContact CA-O 3.31Å; T154-R157 PolarHBondContact N-O 2.95Å; T154-R157 PolarHBondContact O-N 3.44Å
158	T	86.3	Confident	90.3	Very high	94 Å²	94	68.4 Å²	68.4	58%	0.577	34%	0.342	S	S	*	.			trans	-112.5	146.1	177.4	52.4	0	0	0	0	109.6	K156	K156-T158 PolarHBondContact O-N 2.99Å
159	P	88.8	Confident	90.6	Very high	54 Å²	54	64 Å²	64	35%	0.351	33%	0.329	S	S	.	.			trans	-62.5	151.6	172.9	27.9	-33.8	0	0	0	110.7	P146 F153	P146-P159 HydrophobicContact CB-CB 3.78Å; P146-P159 HydrophobicContact CG-CB 3.81Å; F153-P159 HydrophobicContact CD1-CB 4.41Å
160	W	89.1	Confident	90.7	Very high	113 Å²	113	61.7 Å²	61.7	43%	0.428	33%	0.326	S	S	.	.			trans	-64.6	133.6	174.2	-56.8	111.7	0	0	0	110.2	I163 L266 E286 K287	W160-I163 HydrophobicContact CB-CG1 4.45Å; W160-L266 WeakPolarHBondContact O-CD1 3.03Å; W160-E286 WeakPolarHBondContact CA-OE2 3.44Å; W160-E286 HydrophobicContact CD2-CB 4.33Å; W160-E286 HydrophobicContact CE3-CB 3.32Å; W160-E286 HydrophobicContact CE3-CG 4.2Å; W160-E286 HydrophobicContact CZ3-CB 3.64Å; W160-E286 HydrophobicContact CZ3-CG 4.49Å; W160-K287 HydrophobicContact CD2-CB 4.43Å; W160-K287 HydrophobicContact CG-CB 4.25Å
161	R	88.3	Confident	90.9	Very high	103 Å²	103	58.1 Å²	58.1	39%	0.389	30%	0.303	S	S	.	.	S	Bend	trans	-92.5	-25.2	-179.5	-66.4	-174.2	173.6	-150.5	-6.1	112.8	V267 E286	R161-V267 PolarHBondContact O-N 3.47Å; R161-E286 PolarHBondContact N-OE2 2.97Å
162	G	92.7	Very high	91	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	123.1	-179.7	0	0	0	0	0	111.6	V267 F285 E286 K287	G162-V267 WeakPolarHBondContact CA-O 3.44Å; G162-F285 CarbonylContact O-C 3.57Å; G162-E286 PolarHBondContact O-N 2.77Å; G162-E286 VanDerWaalsContact O-N 3.07Å; G162-K287 PolarHBondContact O-N 3.17Å
163	I	94.4	Very high	91.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.1	172.8	-51.8	170.4	0	0	0	109	L139 A142 V143 W160 L165 L266 V267 L268 G269 F285 K287 I289	L139-I163 HydrophobicContact CD2-CD1 4.38Å; L139-I163 HydrophobicContact CD2-CG2 4.42Å; A142-I163 HydrophobicContact CB-CD1 3.57Å; V143-I163 HydrophobicContact CG2-CD1 3.55Å; W160-I163 HydrophobicContact CB-CG1 4.45Å; I163-L165 HydrophobicContact CG2-CD2 4.37Å; I163-L266 HydrophobicContact CD1-CD1 4Å; I163-L266 HydrophobicContact CD1-CD2 4.31Å; I163-L266 HydrophobicContact CG1-CD1 4.11Å; I163-V267 PolarHBondContact N-O 3.32Å; I163-L268 HydrophobicContact CB-CD2 3.65Å; I163-L268 HydrophobicContact CD1-CD2 4.02Å; I163-L268 HydrophobicContact CG1-CD2 4.24Å; I163-L268 HydrophobicContact CG2-CD2 4.28Å; I163-L268 WeakPolarHBondContact O-CA 3.48Å; I163-G269 PolarHBondContact O-N 3.06Å; I163-F285 VanDerWaalsContact C-CD1 3.46Å; I163-F285 WeakPolarHBondContact O-CD1 3.32Å; I163-K287 CarbonylContact C-O 3.51Å; I163-K287 WeakPolarHBondContact CA-O 3.3Å; I163-K287 HydrophobicContact CG1-CB 4.2Å; I163-K287 HydrophobicContact CG2-CB 4.36Å; I163-I289 HydrophobicContact CG2-CD1 3.69Å; I163-I289 HydrophobicContact CG2-CG1 4.01Å
164	L	95.1	Very high	91.2	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	118.5	175.6	-177.2	68.2	0	0	0	110	I229 T271 L277 F285 K287 R288 I289	L164-I229 HydrophobicContact CD1-CG2 3.97Å; L164-T271 HydrophobicContact CD1-CG2 3.98Å; L164-T271 HydrophobicContact CD2-CG2 4.39Å; L164-T271 HydrophobicContact CG-CG2 4.38Å; L164-L277 HydrophobicContact CD2-CD2 3.91Å; L164-F285 HydrophobicContact CB-CB 3.69Å; L164-F285 HydrophobicContact CB-CD1 3.94Å; L164-F285 HydrophobicContact CB-CD2 4.46Å; L164-F285 HydrophobicContact CB-CG 3.77Å; L164-F285 HydrophobicContact CD1-CD2 4.46Å; L164-F285 HydrophobicContact CD1-CG 4.5Å; L164-K287 PolarHBondContact N-O 3.4Å; L164-R288 HydrophobicContact CB-CG 4.4Å; L164-R288 CarbonylContact O-C 3.43Å; L164-R288 WeakPolarHBondContact O-CA 3.38Å; L164-I289 PolarHBondContact O-N 2.97Å
165	L	95.9	Very high	91.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	119.7	167.3	-53.5	-176.2	0	0	0	108.5	L139 I163 K173 A177 G269 A270 T271 I289 I291	L139-L165 HydrophobicContact CD1-CD2 4.43Å; L139-L165 HydrophobicContact CD2-CD2 4.3Å; I163-L165 HydrophobicContact CG2-CD2 4.37Å; L165-K173 HydrophobicContact CB-CB 4.48Å; L165-K173 HydrophobicContact CB-CD 4.29Å; L165-K173 HydrophobicContact CB-CG 4.26Å; L165-A177 HydrophobicContact CD1-CB 4.38Å; L165-G269 PolarHBondContact N-O 2.92Å; L165-A270 VanDerWaalsContact O-CA 3.32Å; L165-A270 WeakPolarHBondContact O-CA 3.42Å; L165-T271 PolarHBondContact O-N 3.35Å; L165-I289 HydrophobicContact CD2-CB 3.96Å; L165-I289 HydrophobicContact CD2-CD1 4.29Å; L165-I289 HydrophobicContact CD2-CG2 4.49Å; L165-I291 HydrophobicContact CB-CG1 4.39Å; L165-I291 HydrophobicContact CD2-CD1 4.47Å
166	F	95.3	Very high	91.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150	178.7	75.2	-83.6	0	0	0	111.6	T271 P274 R288 I289 Y290 I291 L426 F429 T430	F166-T271 WeakPolarHBondContact CA-O 3.48Å; F166-T271 HydrophobicContact CB-CG2 3.86Å; F166-P274 HydrophobicContact CB-CB 4.09Å; F166-P274 HydrophobicContact CB-CG 4.19Å; F166-P274 HydrophobicContact CD2-CB 4.35Å; F166-P274 HydrophobicContact CD2-CG 3.79Å; F166-P274 HydrophobicContact CG-CB 4.35Å; F166-P274 HydrophobicContact CG-CG 4.26Å; F166-R288 HydrophobicContact CD1-CB 4.32Å; F166-R288 HydrophobicContact CE1-CB 3.94Å; F166-I289 WeakPolarHBondContact CD1-O 3.49Å; F166-I289 PolarHBondContact N-O 3.33Å; F166-Y290 AromaticContact CD2-CD2 3.88Å; F166-Y290 HydrophobicContact CD2-CD2 3.88Å; F166-Y290 AromaticContact CE2-CD2 3.52Å; F166-Y290 HydrophobicContact CE2-CD2 3.52Å; F166-Y290 HydrophobicContact CE2-CE2 4.4Å; F166-Y290 HydrophobicContact CE2-CG 4.19Å; F166-Y290 HydrophobicContact CZ-CD2 4.05Å; F166-Y290 HydrophobicContact CZ-CG 4.28Å; F166-Y290 CarbonylContact O-C 3.59Å; F166-Y290 WeakPolarHBondContact O-CA 3.37Å; F166-I291 PolarHBondContact O-N 3.11Å; F166-L426 HydrophobicContact CD2-CD2 4.11Å; F166-F429 HydrophobicContact CD2-CD1 4.19Å; F166-F429 HydrophobicContact CD2-CE1 4.41Å; F166-F429 AromaticContact CE2-CD1 3.8Å; F166-F429 HydrophobicContact CE2-CD1 3.8Å; F166-F429 HydrophobicContact CE2-CE1 4.22Å; F166-F429 HydrophobicContact CZ-CD1 4.15Å; F166-F429 HydrophobicContact CZ-CE1 4.27Å; F166-T430 WeakPolarHBondContact CE2-OG1 2.84Å
167	G	94.9	Very high	91.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.194	C	C	.	.			trans	156.8	-179.5	-178.9	0	0	0	0	0	111.9	K173 T271 N272	G167-K173 PolarHBondContact O-NZ 3.48Å; G167-T271 PolarHBondContact N-O 3.13Å; G167-N272 WeakPolarHBondContact O-CA 3.34Å; G167-N272 PolarHBondContact O-OD1 2.89Å
168	P	94.8	Very high	92	Very high	1 Å²	1	33 Å²	33	1%	0.006	18%	0.178	C	C	.	.	S	Bend	trans	-58.8	154.4	-177.4	4.3	3.7	0	0	0	111.9	T171 K173 I291 L293 V418 L423 L426	P168-T171 HydrophobicContact CB-CG2 4.17Å; P168-T171 HydrophobicContact CG-CG2 3.85Å; P168-T171 WeakPolarHBondContact O-CG2 3.47Å; P168-T171 PolarHBondContact O-OG1 3.45Å; P168-K173 PolarHBondContact O-NZ 3.31Å; P168-I291 WeakPolarHBondContact CD-O 3.36Å; P168-L293 HydrophobicContact CB-CD2 4.22Å; P168-L293 HydrophobicContact CG-CD2 3.97Å; P168-L293 HydrophobicContact CG-CG 3.91Å; P168-V418 HydrophobicContact CB-CB 4.45Å; P168-V418 HydrophobicContact CB-CG1 3.84Å; P168-V418 HydrophobicContact CB-CG2 3.76Å; P168-L423 HydrophobicContact CG-CD2 4.07Å; P168-L426 HydrophobicContact CB-CD1 4.27Å; P168-L426 HydrophobicContact CG-CD1 4.05Å
169	P	93.1	Very high	92.2	Very high	53 Å²	53	28.6 Å²	28.6	34%	0.344	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	154	174.3	28.2	-35.2	0	0	0	111.4	T171 N272 V418	P169-T171 VanDerWaalsContact C-N 3.28Å; P169-T171 PolarHBondContact O-N 3.35Å; P169-N272 WeakPolarHBondContact CA-OD1 3.35Å; P169-V418 HydrophobicContact CG-CG2 4.21Å
170	G	90.9	Very high	92.3	Very high	29 Å²	29	26 Å²	26	30%	0.299	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.3	9.9	174.9	0	0	0	0	0	116.1	G331 A332	G170-G331 WeakPolarHBondContact O-CA 3.45Å; G170-G331 PolarHBondContact O-N 3.42Å; G170-A332 PolarHBondContact O-N 3.42Å
171	T	92.6	Very high	92.3	Very high	10 Å²	10	20.6 Å²	20.6	6%	0.061	11%	0.113	C	C	.	.	S	Bend	trans	-88.6	2	178.8	50.7	0	0	0	0	114.5	P168 P169 P292 L293	P168-T171 HydrophobicContact CB-CG2 4.17Å; P168-T171 HydrophobicContact CG-CG2 3.85Å; P168-T171 WeakPolarHBondContact O-CG2 3.47Å; P168-T171 PolarHBondContact O-OG1 3.45Å; P169-T171 VanDerWaalsContact C-N 3.28Å; P169-T171 PolarHBondContact O-N 3.35Å; T171-P292 WeakPolarHBondContact CG2-O 3.4Å; T171-L293 HydrophobicContact CG2-CD2 4.03Å
172	G	90.5	Very high	92.3	Very high	31 Å²	31	16.4 Å²	16.4	32%	0.32	10%	0.099	S	C	.	.			trans	85.6	22.9	174.5	0	0	0	0	0	115.6	S174 Y175 L176	G172-S174 VanDerWaalsContact C-N 3.34Å; G172-S174 PolarHBondContact O-N 3.39Å; G172-Y175 CarbonylContact O-C 3.25Å; G172-Y175 WeakPolarHBondContact O-CA 3.36Å; G172-Y175 WeakPolarHBondContact O-CB 3.24Å; G172-Y175 PolarHBondContact O-N 3.5Å; G172-L176 WeakPolarHBondContact O-CB 3.43Å; G172-L176 PolarHBondContact O-N 3.09Å
173	K	94	Very high	92	Very high	10 Å²	10	19.6 Å²	19.6	4%	0.043	11%	0.113	C	C	.	.	H	α-helix	trans	-48.8	-50.4	174.8	-70.4	-177.9	-71.5	-76	0	113.2	L165 G167 P168 Y175 L176 A177 A270 T271 N272 I291	L165-K173 HydrophobicContact CB-CB 4.48Å; L165-K173 HydrophobicContact CB-CD 4.29Å; L165-K173 HydrophobicContact CB-CG 4.26Å; G167-K173 PolarHBondContact O-NZ 3.48Å; P168-K173 PolarHBondContact O-NZ 3.31Å; K173-Y175 VanDerWaalsContact C-N 3.32Å; K173-Y175 PolarHBondContact O-N 3.05Å; K173-L176 PolarHBondContact O-N 3.12Å; K173-A177 PolarHBondContact O-N 3.46Å; K173-A270 HydrophobicContact CB-CB 4.15Å; K173-A270 HydrophobicContact CD-CB 4.31Å; K173-T271 WeakPolarHBondContact CE-O 3.48Å; K173-N272 WeakPolarHBondContact CE-OD1 3.37Å; K173-N272 PolarHBondContact NZ-OD1 3.42Å; K173-I291 HydrophobicContact CG-CB 4.2Å; K173-I291 HydrophobicContact CG-CG1 3.95Å; K173-I291 HydrophobicContact CG-CG2 4.39Å
174	S	90.6	Very high	91.4	Very high	38 Å²	38	19.6 Å²	19.6	27%	0.266	11%	0.114	S	C	.	.	H	α-helix	trans	-68.8	-31.7	179.2	-28.8	0	0	0	0	112.1	G172 K178 D227	G172-S174 VanDerWaalsContact C-N 3.34Å; G172-S174 PolarHBondContact O-N 3.39Å; S174-K178 WeakPolarHBondContact O-CG 3.37Å; S174-K178 PolarHBondContact O-N 3.05Å; S174-D227 PolarHBondContact OG-OD2 2.73Å
175	Y	90.2	Very high	90.5	Very high	101 Å²	101	25.1 Å²	25.1	40%	0.396	14%	0.143	S	C	.	.	H	α-helix	trans	-70.7	-41.8	175.7	-160.6	-103.4	0	0	0	111.7	I124 D128 V129 G172 K173 K178 A179	I124-Y175 HydrophobicContact CD1-CD2 3.8Å; I124-Y175 HydrophobicContact CD1-CE2 3.47Å; I124-Y175 VanDerWaalsContact CD1-CE2 3.47Å; I124-Y175 HydrophobicContact CG1-CE2 4.18Å; I124-Y175 HydrophobicContact CG2-CD1 4.22Å; I124-Y175 HydrophobicContact CG2-CE1 3.61Å; I124-Y175 HydrophobicContact CG2-CE2 4.33Å; D128-Y175 HydrophobicContact CB-CE1 4.42Å; V129-Y175 HydrophobicContact CG2-CD1 3.96Å; V129-Y175 HydrophobicContact CG2-CE1 4.1Å; G172-Y175 CarbonylContact O-C 3.25Å; G172-Y175 WeakPolarHBondContact O-CA 3.36Å; G172-Y175 WeakPolarHBondContact O-CB 3.24Å; G172-Y175 PolarHBondContact O-N 3.5Å; K173-Y175 VanDerWaalsContact C-N 3.32Å; K173-Y175 PolarHBondContact O-N 3.05Å; Y175-K178 PolarHBondContact O-N 3.31Å; Y175-A179 PolarHBondContact O-N 3.17Å
176	L	92.6	Very high	89.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.3	-41.7	174.4	-176.4	67.1	0	0	0	111.6	W126 V129 L132 A135 K136 L139 G172 K173 K178 A179 V180 I291	W126-L176 HydrophobicContact CZ3-CD1 3.77Å; V129-L176 HydrophobicContact CG1-CD1 4.12Å; L132-L176 HydrophobicContact CD1-CD2 4.45Å; A135-L176 HydrophobicContact CB-CD2 4.44Å; K136-L176 HydrophobicContact CG-CD1 4.34Å; L139-L176 HydrophobicContact CD1-CD1 3.94Å; L139-L176 HydrophobicContact CD1-CD2 3.5Å; L139-L176 VanDerWaalsContact CD1-CD2 3.5Å; L139-L176 HydrophobicContact CD1-CG 3.54Å; G172-L176 WeakPolarHBondContact O-CB 3.43Å; G172-L176 PolarHBondContact O-N 3.09Å; K173-L176 PolarHBondContact O-N 3.12Å; L176-K178 VanDerWaalsContact C-N 3.32Å; L176-K178 PolarHBondContact O-N 2.93Å; L176-A179 WeakPolarHBondContact O-CB 3.42Å; L176-A179 PolarHBondContact O-N 3.25Å; L176-V180 VanDerWaalsContact O-CG2 3.32Å; L176-V180 WeakPolarHBondContact O-CG2 3.38Å; L176-V180 PolarHBondContact O-N 2.66Å; L176-I291 HydrophobicContact CD2-CD1 3.62Å
177	A	91.5	Very high	88.9	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.5	-39.6	175.8	0	0	0	0	0	112.5	L165 K173 V180 A181 F189 F225 L268	L165-A177 HydrophobicContact CD1-CB 4.38Å; K173-A177 PolarHBondContact O-N 3.46Å; A177-V180 WeakPolarHBondContact O-CB 3.32Å; A177-V180 PolarHBondContact O-N 3.42Å; A177-A181 PolarHBondContact O-N 2.88Å; A177-A181 VanDerWaalsContact O-N 3.17Å; A177-F189 HydrophobicContact CB-CE2 4.27Å; A177-F189 HydrophobicContact CB-CZ 4.15Å; A177-F225 HydrophobicContact CB-CD2 3.39Å; A177-F225 HydrophobicContact CB-CE2 3.44Å; A177-F225 VanDerWaalsContact CB-CE2 3.44Å; A177-F225 HydrophobicContact CB-CG 4.05Å; A177-F225 HydrophobicContact CB-CZ 4.14Å; A177-L268 HydrophobicContact CB-CD1 4.07Å
178	K	90.3	Very high	88.6	Confident	57 Å²	57	31 Å²	31	25%	0.248	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-40	173.5	-69	176.1	-173	-117.6	0	112	E120 P122 I124 S174 Y175 L176 V180 A181 T182 F189	E120-K178 VanDerWaalsContact CD-NZ 3.29Å; E120-K178 WeakPolarHBondContact OE1-CE 3.1Å; E120-K178 IonicContact OE1-NZ 3.35Å; E120-K178 PolarHBondContact OE1-NZ 2.78Å; E120-K178 IonicContact OE2-NZ 3.23Å; E120-K178 PolarHBondContact OE2-NZ 2.98Å; P122-K178 HydrophobicContact CB-CB 3.86Å; P122-K178 HydrophobicContact CB-CG 4.31Å; P122-K178 HydrophobicContact CG-CB 4.12Å; P122-K178 VanDerWaalsContact CG-O 3.3Å; P122-K178 WeakPolarHBondContact CG-O 3.5Å; I124-K178 HydrophobicContact CD1-CB 3.7Å; I124-K178 HydrophobicContact CD1-CD 3.88Å; I124-K178 HydrophobicContact CD1-CG 4.45Å; S174-K178 WeakPolarHBondContact O-CG 3.37Å; S174-K178 PolarHBondContact O-N 3.05Å; Y175-K178 PolarHBondContact O-N 3.31Å; L176-K178 VanDerWaalsContact C-N 3.32Å; L176-K178 PolarHBondContact O-N 2.93Å; K178-V180 VanDerWaalsContact C-N 3.34Å; K178-V180 PolarHBondContact O-N 2.79Å; K178-A181 PolarHBondContact O-N 3.12Å; K178-A181 VanDerWaalsContact O-N 3.16Å; K178-T182 PolarHBondContact O-N 3.28Å; K178-T182 PolarHBondContact O-OG1 3.34Å; K178-F189 HydrophobicContact CG-CE1 3.94Å; K178-F189 HydrophobicContact CG-CZ 4.08Å
179	A	90.9	Very high	88.4	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-43.2	175.8	0	0	0	0	0	111.9	I124 W126 V129 Y175 L176 A181 T182 E183	I124-A179 HydrophobicContact CB-CB 4.44Å; I124-A179 HydrophobicContact CG2-CB 3.86Å; I124-A179 WeakPolarHBondContact O-CA 3.41Å; W126-A179 HydrophobicContact CE3-CB 4.4Å; W126-A179 HydrophobicContact CZ3-CB 4.46Å; V129-A179 HydrophobicContact CG2-CB 3.74Å; Y175-A179 PolarHBondContact O-N 3.17Å; L176-A179 WeakPolarHBondContact O-CB 3.42Å; L176-A179 PolarHBondContact O-N 3.25Å; A179-A181 VanDerWaalsContact C-N 3.27Å; A179-A181 PolarHBondContact O-N 3.38Å; A179-T182 PolarHBondContact O-N 3.23Å; A179-E183 WeakPolarHBondContact O-CB 3.44Å; A179-E183 WeakPolarHBondContact O-CG 3.49Å; A179-E183 PolarHBondContact O-N 2.98Å
180	V	91.1	Very high	88.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.1	-43.6	173.4	174.4	0	0	0	0	111.1	W126 L139 V143 L176 A177 K178 E183 A184 I223 L268	W126-V180 HydrophobicContact CH2-CB 4.4Å; W126-V180 HydrophobicContact CH2-CG2 3.56Å; W126-V180 HydrophobicContact CZ2-CG2 4.37Å; W126-V180 HydrophobicContact CZ3-CG2 4.27Å; L139-V180 HydrophobicContact CB-CG2 4.05Å; L139-V180 HydrophobicContact CD1-CG2 3.66Å; L139-V180 HydrophobicContact CD2-CG2 3.97Å; L139-V180 HydrophobicContact CG-CG2 4.11Å; V143-V180 HydrophobicContact CB-CG1 4.03Å; V143-V180 HydrophobicContact CG1-CG1 3.72Å; V143-V180 HydrophobicContact CG2-CG1 4.01Å; L176-V180 VanDerWaalsContact O-CG2 3.32Å; L176-V180 WeakPolarHBondContact O-CG2 3.38Å; L176-V180 PolarHBondContact O-N 2.66Å; A177-V180 WeakPolarHBondContact O-CB 3.32Å; A177-V180 PolarHBondContact O-N 3.42Å; K178-V180 VanDerWaalsContact C-N 3.34Å; K178-V180 PolarHBondContact O-N 2.79Å; V180-E183 PolarHBondContact O-N 3.01Å; V180-A184 WeakPolarHBondContact O-CB 3.32Å; V180-A184 PolarHBondContact O-N 2.96Å; V180-I223 HydrophobicContact CG1-CD1 4Å; V180-L268 HydrophobicContact CG1-CD1 4.42Å
181	A	88	Confident	88.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.6	-37.3	-178.1	0	0	0	0	0	113.5	P122 A177 K178 A179 E183 S187 F189 I223	P122-A181 HydrophobicContact CG-CB 3.79Å; A177-A181 PolarHBondContact O-N 2.88Å; A177-A181 VanDerWaalsContact O-N 3.17Å; K178-A181 PolarHBondContact O-N 3.12Å; K178-A181 VanDerWaalsContact O-N 3.16Å; A179-A181 VanDerWaalsContact C-N 3.27Å; A179-A181 PolarHBondContact O-N 3.38Å; A181-E183 VanDerWaalsContact C-N 3.34Å; A181-S187 PolarHBondContact O-N 2.95Å; A181-F189 HydrophobicContact CB-CB 3.9Å; A181-F189 HydrophobicContact CB-CD2 3.35Å; A181-F189 HydrophobicContact CB-CE2 4.05Å; A181-F189 HydrophobicContact CB-CG 3.9Å; A181-I223 HydrophobicContact CB-CD1 4.08Å
182	T	87.9	Confident	88.1	Confident	14 Å²	14	27.9 Å²	27.9	9%	0.086	15%	0.151	C	C	.	.	H	α-helix	trans	-61.3	-45.6	172.1	-58.6	0	0	0	0	110.9	P122 N123 I124 K178 A179 N186	P122-T182 PolarHBondContact O-OG1 3.11Å; N123-T182 PolarHBondContact N-OG1 3.31Å; I124-T182 PolarHBondContact N-OG1 3.32Å; I124-T182 VanDerWaalsContact N-OG1 3.08Å; I124-T182 WeakPolarHBondContact O-CB 3.24Å; I124-T182 WeakPolarHBondContact O-CG2 3.38Å; I124-T182 PolarHBondContact O-OG1 3.27Å; K178-T182 PolarHBondContact O-N 3.28Å; K178-T182 PolarHBondContact O-OG1 3.34Å; A179-T182 PolarHBondContact O-N 3.23Å; T182-N186 PolarHBondContact O-N 2.97Å
183	E	86.5	Confident	87.7	Confident	67 Å²	67	28 Å²	28	31%	0.313	15%	0.147	S	C	.	.	H	α-helix	trans	-80	-21.6	-172.7	-65.3	-82.5	173.1	0	0	112.9	W126 I144 A179 V180 A181 N185	W126-E183 VanDerWaalsContact CD1-CG 3.43Å; W126-E183 HydrophobicContact CD2-CG 4.2Å; W126-E183 HydrophobicContact CG-CG 4.08Å; W126-E183 HydrophobicContact CZ2-CB 4.11Å; W126-E183 HydrophobicContact CZ2-CG 4.32Å; W126-E183 PolarHBondContact N-OE1 3.25Å; W126-E183 VanDerWaalsContact NE1-CD 3.3Å; W126-E183 PolarHBondContact NE1-OE2 2.87Å; I144-E183 HydrophobicContact CD1-CB 4.15Å; A179-E183 WeakPolarHBondContact O-CB 3.44Å; A179-E183 WeakPolarHBondContact O-CG 3.49Å; A179-E183 PolarHBondContact O-N 2.98Å; V180-E183 PolarHBondContact O-N 3.01Å; A181-E183 VanDerWaalsContact C-N 3.34Å; E183-N185 PolarHBondContact O-N 3.38Å
184	A	82.9	Confident	86.8	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.008	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	56.7	173.2	0	0	0	0	0	111.9	V143 I144 I147 V180 N186 S187 I223	V143-A184 HydrophobicContact CG1-CB 4.24Å; I144-A184 HydrophobicContact CD1-CB 3.9Å; I147-A184 HydrophobicContact CD1-CB 3.79Å; V180-A184 WeakPolarHBondContact O-CB 3.32Å; V180-A184 PolarHBondContact O-N 2.96Å; A184-N186 VanDerWaalsContact C-N 3.27Å; A184-N186 PolarHBondContact O-N 2.81Å; A184-S187 VanDerWaalsContact O-CB 3.29Å; A184-S187 WeakPolarHBondContact O-CB 3.48Å; A184-S187 PolarHBondContact O-N 3.49Å; A184-S187 PolarHBondContact O-OG 3.07Å; A184-I223 HydrophobicContact CB-CD1 4.17Å
185	N	76.9	Confident	85.9	Confident	116 Å²	116	28.7 Å²	28.7	62%	0.62	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	37.1	179.5	-66.3	-15.3	0	0	0	114.3	I147 E183 S187	I147-N185 WeakPolarHBondContact CG2-ND2 3.04Å; E183-N185 PolarHBondContact O-N 3.38Å; N185-S187 PolarHBondContact O-N 3.25Å
186	N	77.1	Confident	85	Confident	95 Å²	95	27 Å²	27	51%	0.508	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	39.7	-174.2	-60.9	95.4	0	0	0	113.1	T182 A184	T182-N186 PolarHBondContact O-N 2.97Å; A184-N186 VanDerWaalsContact C-N 3.27Å; A184-N186 PolarHBondContact O-N 2.81Å
187	S	80.5	Confident	83.8	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.021	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-52.9	149.2	175	-73.1	0	0	0	0	111.4	A181 A184 N185 F189 P221	A181-S187 PolarHBondContact O-N 2.95Å; A184-S187 VanDerWaalsContact O-CB 3.29Å; A184-S187 WeakPolarHBondContact O-CB 3.48Å; A184-S187 PolarHBondContact O-N 3.49Å; A184-S187 PolarHBondContact O-OG 3.07Å; N185-S187 PolarHBondContact O-N 3.25Å; S187-F189 PolarHBondContact O-N 3.39Å; S187-P221 WeakPolarHBondContact CA-O 3.48Å; S187-P221 WeakPolarHBondContact CB-O 3.39Å; S187-P221 WeakPolarHBondContact OG-CB 3.22Å; S187-P221 WeakPolarHBondContact OG-CG 3.4Å
188	T	87.2	Confident	82.6	Confident	26 Å²	26	30.9 Å²	30.9	16%	0.16	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	121.5	177.8	-51.3	0	0	0	0	109.5	F190 N219 P221 S222 I223	T188-F190 HydrophobicContact CG2-CD2 4.15Å; T188-F190 HydrophobicContact CG2-CE1 4.4Å; T188-F190 HydrophobicContact CG2-CE2 3.48Å; T188-F190 VanDerWaalsContact CG2-CE2 3.48Å; T188-F190 HydrophobicContact CG2-CZ 3.64Å; T188-N219 HydrophobicContact CG2-CB 4.22Å; T188-N219 PolarHBondContact OG1-O 3.3Å; T188-P221 PolarHBondContact N-O 3.41Å; T188-P221 VanDerWaalsContact N-O 3.11Å; T188-S222 WeakPolarHBondContact O-CA 3.47Å; T188-I223 PolarHBondContact O-N 3.07Å
189	F	90.9	Very high	81	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	116.5	179.4	-169.3	-106	0	0	0	110.4	M119 E120 P122 A177 K178 A181 S187 I223 F225	M119-F189 WeakPolarHBondContact CA-O 3.38Å; E120-F189 HydrophobicContact CG-CB 4.22Å; E120-F189 HydrophobicContact CG-CD1 3.59Å; E120-F189 HydrophobicContact CG-CE1 4.46Å; E120-F189 HydrophobicContact CG-CG 4.37Å; E120-F189 PolarHBondContact N-O 3.48Å; E120-F189 WeakPolarHBondContact O-CB 3.27Å; E120-F189 PolarHBondContact O-N 3.26Å; E120-F189 VanDerWaalsContact OE1-CD1 3.22Å; E120-F189 WeakPolarHBondContact OE1-CD1 3.22Å; E120-F189 VanDerWaalsContact OE1-CE1 3.29Å; E120-F189 WeakPolarHBondContact OE1-CE1 3.39Å; P122-F189 HydrophobicContact CG-CB 4.37Å; A177-F189 HydrophobicContact CB-CE2 4.27Å; A177-F189 HydrophobicContact CB-CZ 4.15Å; K178-F189 HydrophobicContact CG-CE1 3.94Å; K178-F189 HydrophobicContact CG-CZ 4.08Å; A181-F189 HydrophobicContact CB-CB 3.9Å; A181-F189 HydrophobicContact CB-CD2 3.35Å; A181-F189 HydrophobicContact CB-CE2 4.05Å; A181-F189 HydrophobicContact CB-CG 3.9Å; S187-F189 PolarHBondContact O-N 3.39Å; F189-I223 HydrophobicContact CD2-CB 4.13Å; F189-I223 HydrophobicContact CD2-CG2 4.06Å; F189-I223 HydrophobicContact CE2-CG2 4.15Å; F189-F225 HydrophobicContact CD2-CB 4.43Å; F189-F225 HydrophobicContact CE1-CB 3.98Å; F189-F225 HydrophobicContact CE1-CD1 4.34Å; F189-F225 HydrophobicContact CE1-CG 4.4Å; F189-F225 HydrophobicContact CE2-CB 3.49Å; F189-F225 VanDerWaalsContact CE2-CB 3.49Å; F189-F225 HydrophobicContact CE2-CG 4.15Å; F189-F225 HydrophobicContact CZ-CB 3.23Å; F189-F225 AromaticContact CZ-CD1 3.85Å; F189-F225 HydrophobicContact CZ-CD1 3.85Å; F189-F225 HydrophobicContact CZ-CD2 4.37Å; F189-F225 AromaticContact CZ-CG 3.56Å; F189-F225 HydrophobicContact CZ-CG 3.56Å
190	F	91.7	Very high	79.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	108.1	173.5	-63.7	-88.6	0	0	0	108.4	I117 M119 T188 L212 L215 A216 N219 I223 I224 F225	I117-F190 HydrophobicContact CG2-CB 4.32Å; I117-F190 HydrophobicContact CG2-CD1 3.75Å; M119-F190 HydrophobicContact CG-CD1 3.65Å; M119-F190 HydrophobicContact CG-CE1 3.55Å; M119-F190 HydrophobicContact SD-CD1 4.24Å; M119-F190 HydrophobicContact SD-CE1 3.53Å; M119-F190 VanDerWaalsContact SD-CE1 3.53Å; M119-F190 HydrophobicContact SD-CZ 4.31Å; T188-F190 HydrophobicContact CG2-CD2 4.15Å; T188-F190 HydrophobicContact CG2-CE1 4.4Å; T188-F190 HydrophobicContact CG2-CE2 3.48Å; T188-F190 VanDerWaalsContact CG2-CE2 3.48Å; T188-F190 HydrophobicContact CG2-CZ 3.64Å; F190-L212 HydrophobicContact CB-CD1 3.83Å; F190-L212 HydrophobicContact CD1-CD1 4.26Å; F190-L212 HydrophobicContact CG-CD1 4.26Å; F190-L215 HydrophobicContact CE1-CB 3.94Å; F190-L215 HydrophobicContact CZ-CB 4.21Å; F190-A216 HydrophobicContact CD2-CB 4.16Å; F190-A216 HydrophobicContact CE2-CB 4.07Å; F190-N219 HydrophobicContact CE2-CB 4.23Å; F190-N219 HydrophobicContact CZ-CB 3.98Å; F190-I223 PolarHBondContact N-O 3.05Å; F190-I224 CarbonylContact O-C 3.46Å; F190-F225 PolarHBondContact O-N 2.6Å
191	S	89.9	Confident	77.3	Confident	25 Å²	25	46.8 Å²	46.8	18%	0.175	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.4	176.3	-172.6	0	0	0	0	110.4	V118	V118-S191 PolarHBondContact N-O 2.92Å; V118-S191 PolarHBondContact O-N 3.28Å
192	I	88.1	Confident	75.6	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.01	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	134.4	173.2	-168.5	157.7	0	0	0	110.4	I117 L197 L208 L212 F225 I226 D227	I117-I192 HydrophobicContact CG1-CD1 4.14Å; I192-L197 HydrophobicContact CD1-CD1 3.71Å; I192-L197 HydrophobicContact CD1-CD2 3.56Å; I192-L197 HydrophobicContact CD1-CG 3.43Å; I192-L197 VanDerWaalsContact CD1-CG 3.43Å; I192-L197 HydrophobicContact CG1-CD1 3.93Å; I192-L197 HydrophobicContact CG1-CG 3.89Å; I192-L197 HydrophobicContact CG2-CD1 4.25Å; I192-L208 HydrophobicContact CD1-CD2 4.39Å; I192-L208 HydrophobicContact CD1-CG 4.48Å; I192-L212 HydrophobicContact CD1-CD2 4.39Å; I192-L212 HydrophobicContact CG2-CD2 3.98Å; I192-F225 PolarHBondContact N-O 3.01Å; I192-I226 HydrophobicContact CG2-CB 4.5Å; I192-I226 HydrophobicContact CG2-CG1 3.89Å; I192-I226 WeakPolarHBondContact O-CA 3.23Å; I192-D227 PolarHBondContact O-N 2.96Å; I192-D227 VanDerWaalsContact O-N 3.17Å
193	S	82.2	Confident	74.4	Confident	32 Å²	32	55.6 Å²	55.6	22%	0.224	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	139.5	166.6	178.6	0	0	0	0	109.3	S195 D196 L197	S193-S195 PolarHBondContact O-N 3.43Å; S193-S195 PolarHBondContact OG-N 2.98Å; S193-D196 WeakPolarHBondContact CB-OD2 3.49Å; S193-D196 WeakPolarHBondContact O-CB 3.5Å; S193-D196 PolarHBondContact O-N 3.01Å; S193-L197 PolarHBondContact O-N 3.34Å
194	S	75.7	Confident	73.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-56.5	-29.4	173.2	-70.1	0	0	0	0	113.6	L197 D227 E228 I229 S231 L232	S194-L197 PolarHBondContact O-N 3.21Å; S194-D227 WeakPolarHBondContact CB-O 3.45Å; S194-D227 PolarHBondContact N-O 3.42Å; S194-D227 PolarHBondContact OG-O 2.7Å; S194-E228 VanDerWaalsContact CB-O 3.26Å; S194-E228 WeakPolarHBondContact CB-O 3.4Å; S194-E228 PolarHBondContact OG-O 3.42Å; S194-E228 VanDerWaalsContact OG-O 3.04Å; S194-I229 WeakPolarHBondContact OG-CA 3.41Å; S194-S231 WeakPolarHBondContact CB-OG 3.32Å; S194-L232 VanDerWaalsContact OG-CD1 3.28Å; S194-L232 WeakPolarHBondContact OG-CD1 3.45Å
195	S	71.5	Confident	73.2	Confident	64 Å²	64	56.4 Å²	56.4	45%	0.448	31%	0.309	S	S	.	.	H	α-helix	trans	-69.1	-31.8	174.7	-67	0	0	0	0	113.4	S193 L197 V198 S199	S193-S195 PolarHBondContact O-N 3.43Å; S193-S195 PolarHBondContact OG-N 2.98Å; S195-L197 VanDerWaalsContact C-N 3.26Å; S195-L197 PolarHBondContact O-N 2.81Å; S195-V198 PolarHBondContact O-N 3.28Å; S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 3.08Å; S195-S199 PolarHBondContact O-OG 3.4Å
196	D	71.5	Confident	73.4	Confident	64 Å²	64	53.4 Å²	53.4	34%	0.342	29%	0.291	S	S	.	.	H	α-helix	trans	-70.1	-28.1	177.8	-65	-39.2	0	0	0	111.7	S193	S193-D196 WeakPolarHBondContact CB-OD2 3.49Å; S193-D196 WeakPolarHBondContact O-CB 3.5Å; S193-D196 PolarHBondContact O-N 3.01Å
197	L	68.4	Low	73.6	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-74.9	-32.4	178	-78.7	163	0	0	0	112.8	I192 S193 S194 S195 S205 L208 V209 L232	I192-L197 HydrophobicContact CD1-CD1 3.71Å; I192-L197 HydrophobicContact CD1-CD2 3.56Å; I192-L197 HydrophobicContact CD1-CG 3.43Å; I192-L197 VanDerWaalsContact CD1-CG 3.43Å; I192-L197 HydrophobicContact CG1-CD1 3.93Å; I192-L197 HydrophobicContact CG1-CG 3.89Å; I192-L197 HydrophobicContact CG2-CD1 4.25Å; S193-L197 PolarHBondContact O-N 3.34Å; S194-L197 PolarHBondContact O-N 3.21Å; S195-L197 VanDerWaalsContact C-N 3.26Å; S195-L197 PolarHBondContact O-N 2.81Å; L197-S205 WeakPolarHBondContact O-CB 3.19Å; L197-S205 PolarHBondContact O-OG 3.33Å; L197-L208 HydrophobicContact CD2-CB 4.3Å; L197-L208 HydrophobicContact CD2-CD2 3.61Å; L197-L208 HydrophobicContact CD2-CG 3.77Å; L197-L208 HydrophobicContact CG-CD2 4.42Å; L197-V209 HydrophobicContact CD2-CG2 3.77Å; L197-L232 HydrophobicContact CB-CD1 4.44Å; L197-L232 HydrophobicContact CB-CD2 3.87Å; L197-L232 HydrophobicContact CD1-CD1 3.47Å; L197-L232 VanDerWaalsContact CD1-CD1 3.47Å; L197-L232 HydrophobicContact CD1-CD2 4.38Å; L197-L232 HydrophobicContact CD1-CG 4.49Å
198	V	64.8	Low	73.7	Confident	77 Å²	77	55.2 Å²	55.2	47%	0.467	30%	0.295	S	S	.	.	H	α-helix	trans	-91.4	-25.1	-173.7	-178.5	0	0	0	0	113	S195 L232	S195-V198 PolarHBondContact O-N 3.28Å; V198-L232 HydrophobicContact CG2-CD2 3.58Å
199	S	57.6	Low	73.7	Confident	85 Å²	85	54.1 Å²	54.1	59%	0.594	29%	0.287	S	S	*	.	S	Bend	trans	-83.9	-15.3	-166.2	58.2	0	0	0	0	116.3	S195	S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 3.08Å; S195-S199 PolarHBondContact O-OG 3.4Å
200	K	55.1	Low	73.5	Confident	85 Å²	85	58.7 Å²	58.7	37%	0.37	31%	0.307	S	S	.	.	S	Bend	trans	-106.2	102.8	-175.6	-66	179.6	-177.6	172.5	0	110.6	S205	K200-S205 PolarHBondContact O-OG 3.49Å
201	W	49.3	Very low	73.2	Confident	221 Å²	221	61 Å²	61	84%	0.837	32%	0.32	S	S	*	.			trans	39.5	116.1	163.4	-74.2	77.2	0	0	0	117.5	G203 E204	W201-G203 PolarHBondContact O-N 2.84Å; W201-E204 PolarHBondContact O-N 3.29Å
202	L	52.3	Low	73.2	Confident	157 Å²	157	60 Å²	60	82%	0.822	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43	100.5	175.9	-65.2	161.1	0	0	0	112.1	A243	L202-A243 HydrophobicContact CD2-CB 3.36Å
203	G	61.6	Low	73.3	Confident	43 Å²	43	59.9 Å²	59.9	44%	0.443	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	124.8	-27.2	178.3	0	0	0	0	0	115.6	W201	W201-G203 PolarHBondContact O-N 2.84Å
204	E	70.6	Confident	73.6	Confident	77 Å²	77	60.4 Å²	60.4	36%	0.36	32%	0.315	S	S	.	.	H	α-helix	trans	-76.9	-28.9	176.6	-71.1	-171.3	166.1	0	0	112.3	W201 E206 K207 L208	W201-E204 PolarHBondContact O-N 3.29Å; E204-E206 PolarHBondContact O-N 3.06Å; E204-K207 PolarHBondContact O-N 3.5Å; E204-L208 PolarHBondContact O-N 3.45Å
205	S	74.9	Confident	74.2	Confident	8 Å²	8	61.6 Å²	61.6	6%	0.056	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-37.5	-179	-52.5	0	0	0	0	114.5	L197 K200 L208 V209	L197-S205 WeakPolarHBondContact O-CB 3.19Å; L197-S205 PolarHBondContact O-OG 3.33Å; K200-S205 PolarHBondContact O-OG 3.49Å; S205-L208 WeakPolarHBondContact O-CB 3.09Å; S205-L208 PolarHBondContact O-N 2.87Å; S205-V209 PolarHBondContact O-N 3.18Å; S205-V209 VanDerWaalsContact O-N 3.13Å
206	E	80.3	Confident	75.1	Confident	53 Å²	53	58.6 Å²	58.6	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-67.1	-42.8	177.1	-68.7	173.5	-148.9	0	0	111.1	E204 L208 V209 K210 R246 I247	E204-E206 PolarHBondContact O-N 3.06Å; E206-L208 VanDerWaalsContact C-N 3.28Å; E206-L208 PolarHBondContact O-N 3.09Å; E206-V209 PolarHBondContact O-N 2.78Å; E206-K210 PolarHBondContact O-N 3.33Å; E206-R246 HydrophobicContact CG-CB 4.33Å; E206-R246 WeakPolarHBondContact OE1-CB 3.25Å; E206-R246 WeakPolarHBondContact OE1-CD 3.44Å; E206-I247 HydrophobicContact CG-CG1 4.45Å
207	K	82.4	Confident	76	Confident	122 Å²	122	57.5 Å²	57.5	53%	0.53	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-37.1	175.3	-66.4	-176.5	179.8	-177.3	0	111.1	F109 E204 K210 N211	F109-K207 HydrophobicContact CE1-CB 4.01Å; F109-K207 HydrophobicContact CE2-CD 4.43Å; F109-K207 HydrophobicContact CZ-CB 3.63Å; F109-K207 HydrophobicContact CZ-CD 4.29Å; E204-K207 PolarHBondContact O-N 3.5Å; K207-K210 PolarHBondContact O-N 3.05Å; K207-N211 VanDerWaalsContact O-CB 3.28Å; K207-N211 WeakPolarHBondContact O-CB 3.43Å; K207-N211 PolarHBondContact O-N 3.24Å; K207-N211 PolarHBondContact O-ND2 2.9Å
208	L	82.6	Confident	76.9	Confident	14 Å²	14	63 Å²	63	7%	0.073	32%	0.317	C	S	.	.	H	α-helix	trans	-60.8	-45.3	175.9	-177	60.5	0	0	0	111.4	L113 A116 I117 I192 L197 E204 S205 E206 N211 L212	L113-L208 HydrophobicContact CD2-CD1 3.28Å; A116-L208 HydrophobicContact CB-CD1 4.33Å; A116-L208 HydrophobicContact CB-CD2 4.24Å; I117-L208 HydrophobicContact CD1-CD1 3.86Å; I117-L208 HydrophobicContact CG1-CD1 4.07Å; I192-L208 HydrophobicContact CD1-CD2 4.39Å; I192-L208 HydrophobicContact CD1-CG 4.48Å; L197-L208 HydrophobicContact CD2-CB 4.3Å; L197-L208 HydrophobicContact CD2-CD2 3.61Å; L197-L208 HydrophobicContact CD2-CG 3.77Å; L197-L208 HydrophobicContact CG-CD2 4.42Å; E204-L208 PolarHBondContact O-N 3.45Å; S205-L208 WeakPolarHBondContact O-CB 3.09Å; S205-L208 PolarHBondContact O-N 2.87Å; E206-L208 VanDerWaalsContact C-N 3.28Å; E206-L208 PolarHBondContact O-N 3.09Å; L208-N211 PolarHBondContact O-N 3.35Å; L208-L212 WeakPolarHBondContact O-CB 3.45Å; L208-L212 PolarHBondContact O-N 3.49Å
209	V	86.6	Confident	78	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-47.7	174.9	176.4	0	0	0	0	111.3	L197 S205 E206 N211 L212 F213 I247 E250 F251 Q254	L197-V209 HydrophobicContact CD2-CG2 3.77Å; S205-V209 PolarHBondContact O-N 3.18Å; S205-V209 VanDerWaalsContact O-N 3.13Å; E206-V209 PolarHBondContact O-N 2.78Å; V209-N211 VanDerWaalsContact C-N 3.29Å; V209-N211 PolarHBondContact O-N 3.38Å; V209-L212 PolarHBondContact O-N 2.84Å; V209-F213 HydrophobicContact CG1-CD2 4.2Å; V209-F213 HydrophobicContact CG1-CE2 4.23Å; V209-F213 WeakPolarHBondContact O-CD2 3.3Å; V209-F213 PolarHBondContact O-N 3.15Å; V209-I247 HydrophobicContact CG2-CG2 4.15Å; V209-E250 HydrophobicContact CB-CG 4.26Å; V209-E250 HydrophobicContact CG1-CG 4.14Å; V209-F251 HydrophobicContact CG1-CB 4.25Å; V209-F251 HydrophobicContact CG1-CD2 4.19Å; V209-Q254 HydrophobicContact CG1-CG 4.17Å
210	K	86.8	Confident	79.4	Confident	96 Å²	96	62.1 Å²	62.1	42%	0.417	30%	0.299	S	S	.	.	H	α-helix	trans	-55.4	-46.6	176.6	-75.5	-177.2	-179.1	179.1	0	112	E206 K207 F213 S214 E250	E206-K210 PolarHBondContact O-N 3.33Å; K207-K210 PolarHBondContact O-N 3.05Å; K210-F213 PolarHBondContact O-N 3.11Å; K210-S214 PolarHBondContact O-N 3.34Å; K210-E250 WeakPolarHBondContact CE-OE1 3.39Å; K210-E250 WeakPolarHBondContact CE-OE2 3.28Å; K210-E250 HydrophobicContact CG-CG 4.06Å; K210-E250 WeakPolarHBondContact CG-OE1 3.26Å; K210-E250 IonicContact NZ-OE2 3.26Å
211	N	85.8	Confident	80.9	Confident	49 Å²	49	61 Å²	61	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-73.4	-34.4	-176.3	-69.6	-8.3	0	0	0	112.5	F109 L113 K207 L208 V209 F213 S214 L215	F109-N211 WeakPolarHBondContact CD1-ND2 3.43Å; F109-N211 WeakPolarHBondContact CE1-ND2 3.23Å; L113-N211 HydrophobicContact CD1-CB 3.64Å; L113-N211 HydrophobicContact CD2-CB 3.87Å; L113-N211 HydrophobicContact CG-CB 4.43Å; K207-N211 VanDerWaalsContact O-CB 3.28Å; K207-N211 WeakPolarHBondContact O-CB 3.43Å; K207-N211 PolarHBondContact O-N 3.24Å; K207-N211 PolarHBondContact O-ND2 2.9Å; L208-N211 PolarHBondContact O-N 3.35Å; V209-N211 VanDerWaalsContact C-N 3.29Å; V209-N211 PolarHBondContact O-N 3.38Å; N211-F213 VanDerWaalsContact C-N 3.32Å; N211-F213 PolarHBondContact O-N 3.35Å; N211-S214 PolarHBondContact O-N 2.93Å; N211-L215 WeakPolarHBondContact O-CB 3.39Å; N211-L215 VanDerWaalsContact O-CG 3.31Å; N211-L215 WeakPolarHBondContact O-CG 3.45Å; N211-L215 PolarHBondContact O-N 2.99Å
212	L	89.3	Confident	82.8	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-55.4	-49.1	171	173	63.7	0	0	0	110.9	I117 F190 I192 L208 V209 A216 I224	I117-L212 HydrophobicContact CD1-CB 3.89Å; I117-L212 HydrophobicContact CD1-CD1 3.91Å; I117-L212 HydrophobicContact CD1-CG 4.48Å; I117-L212 HydrophobicContact CG1-CD1 4.2Å; I117-L212 HydrophobicContact CG2-CD1 3.87Å; F190-L212 HydrophobicContact CB-CD1 3.83Å; F190-L212 HydrophobicContact CD1-CD1 4.26Å; F190-L212 HydrophobicContact CG-CD1 4.26Å; I192-L212 HydrophobicContact CD1-CD2 4.39Å; I192-L212 HydrophobicContact CG2-CD2 3.98Å; L208-L212 WeakPolarHBondContact O-CB 3.45Å; L208-L212 PolarHBondContact O-N 3.49Å; V209-L212 PolarHBondContact O-N 2.84Å; L212-A216 WeakPolarHBondContact O-CB 3.39Å; L212-A216 PolarHBondContact O-N 3.04Å; L212-I224 HydrophobicContact CD1-CG2 4.39Å; L212-I224 HydrophobicContact CD2-CG2 3.85Å; L212-I224 HydrophobicContact CG-CD1 4.39Å; L212-I224 HydrophobicContact CG-CG2 4.24Å
213	F	90.4	Very high	84.7	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-69.7	-34.7	177.6	-82.1	-96.9	0	0	0	112.7	V209 K210 N211 A216 R217 I224 F251 Q254 M255 V267	V209-F213 HydrophobicContact CG1-CD2 4.2Å; V209-F213 HydrophobicContact CG1-CE2 4.23Å; V209-F213 WeakPolarHBondContact O-CD2 3.3Å; V209-F213 PolarHBondContact O-N 3.15Å; K210-F213 PolarHBondContact O-N 3.11Å; N211-F213 VanDerWaalsContact C-N 3.32Å; N211-F213 PolarHBondContact O-N 3.35Å; F213-A216 PolarHBondContact O-N 2.77Å; F213-R217 VanDerWaalsContact O-CG 3.29Å; F213-R217 WeakPolarHBondContact O-CG 3.43Å; F213-R217 PolarHBondContact O-N 2.66Å; F213-I224 HydrophobicContact CD1-CD1 3.78Å; F213-I224 HydrophobicContact CD2-CD1 4.21Å; F213-I224 HydrophobicContact CE1-CD1 3.79Å; F213-I224 HydrophobicContact CE2-CD1 4.22Å; F213-I224 HydrophobicContact CG-CD1 4.01Å; F213-I224 HydrophobicContact CZ-CD1 4.02Å; F213-F251 AromaticContact CE2-CD2 3.81Å; F213-F251 HydrophobicContact CE2-CD2 3.81Å; F213-F251 AromaticContact CE2-CE2 3.73Å; F213-F251 HydrophobicContact CE2-CE2 3.73Å; F213-F251 HydrophobicContact CZ-CD2 4.15Å; F213-F251 AromaticContact CZ-CE2 3.75Å; F213-F251 HydrophobicContact CZ-CE2 3.75Å; F213-Q254 HydrophobicContact CB-CB 4.27Å; F213-Q254 HydrophobicContact CB-CG 4.33Å; F213-Q254 HydrophobicContact CD1-CB 3.86Å; F213-Q254 HydrophobicContact CD2-CB 3.59Å; F213-Q254 HydrophobicContact CD2-CG 3.98Å; F213-Q254 HydrophobicContact CE1-CB 4.01Å; F213-Q254 HydrophobicContact CE2-CB 3.76Å; F213-Q254 HydrophobicContact CE2-CG 4.49Å; F213-Q254 HydrophobicContact CG-CB 3.64Å; F213-Q254 HydrophobicContact CG-CG 4.13Å; F213-Q254 HydrophobicContact CZ-CB 3.96Å; F213-M255 HydrophobicContact CZ-CG 4.15Å; F213-V267 HydrophobicContact CE1-CG2 3.97Å; F213-V267 HydrophobicContact CZ-CG2 4.08Å
214	S	89.1	Confident	86.2	Confident	42 Å²	42	41.2 Å²	41.2	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-60.8	-51.6	172.9	-162	0	0	0	0	111.4	K210 N211 A216 R217 E218	K210-S214 PolarHBondContact O-N 3.34Å; N211-S214 PolarHBondContact O-N 2.93Å; S214-A216 VanDerWaalsContact C-N 3.3Å; S214-A216 PolarHBondContact O-N 3.3Å; S214-R217 WeakPolarHBondContact O-CB 3.43Å; S214-R217 PolarHBondContact O-N 3.34Å; S214-R217 VanDerWaalsContact O-N 3.09Å; S214-E218 WeakPolarHBondContact O-CG 3.37Å; S214-E218 PolarHBondContact O-N 2.91Å; S214-E218 PolarHBondContact OG-OE1 2.99Å
215	L	88.3	Confident	87.4	Confident	26 Å²	26	37.7 Å²	37.7	14%	0.136	19%	0.186	C	C	.	.	H	α-helix	trans	-60.2	-40.5	177.8	-71.9	173.5	0	0	0	111.6	L113 F190 N211 R217 E218 N219	L113-L215 HydrophobicContact CD1-CD1 4.04Å; F190-L215 HydrophobicContact CE1-CB 3.94Å; F190-L215 HydrophobicContact CZ-CB 4.21Å; N211-L215 WeakPolarHBondContact O-CB 3.39Å; N211-L215 VanDerWaalsContact O-CG 3.31Å; N211-L215 WeakPolarHBondContact O-CG 3.45Å; N211-L215 PolarHBondContact O-N 2.99Å; L215-R217 VanDerWaalsContact C-N 3.34Å; L215-R217 PolarHBondContact O-N 2.98Å; L215-E218 PolarHBondContact O-N 3.03Å; L215-N219 WeakPolarHBondContact O-CB 3.45Å; L215-N219 PolarHBondContact O-N 3.11Å; L215-N219 PolarHBondContact O-ND2 3.47Å
216	A	89.9	Confident	88.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.5	-40.5	175.6	0	0	0	0	0	112.2	F190 L212 F213 S214 N219 K220 S222 I224 V265	F190-A216 HydrophobicContact CD2-CB 4.16Å; F190-A216 HydrophobicContact CE2-CB 4.07Å; L212-A216 WeakPolarHBondContact O-CB 3.39Å; L212-A216 PolarHBondContact O-N 3.04Å; F213-A216 PolarHBondContact O-N 2.77Å; S214-A216 VanDerWaalsContact C-N 3.3Å; S214-A216 PolarHBondContact O-N 3.3Å; A216-N219 CarbonylContact O-C 3.34Å; A216-N219 PolarHBondContact O-N 2.81Å; A216-K220 PolarHBondContact O-N 3.23Å; A216-S222 WeakPolarHBondContact O-CB 3.31Å; A216-S222 PolarHBondContact O-OG 3.39Å; A216-I224 HydrophobicContact CB-CD1 3.64Å; A216-I224 HydrophobicContact CB-CG1 3.76Å; A216-V265 HydrophobicContact CB-CG1 3.98Å; A216-V265 HydrophobicContact CB-CG2 4.49Å
217	R	89	Confident	88.7	Confident	41 Å²	41	37 Å²	37	16%	0.155	18%	0.183	C	C	.	.	H	α-helix	trans	-68.1	-34.7	175.5	-70.8	177.3	-156.8	123.6	5.8	112.9	F213 S214 L215 N219 K220 N260 N262 V265	F213-R217 VanDerWaalsContact O-CG 3.29Å; F213-R217 WeakPolarHBondContact O-CG 3.43Å; F213-R217 PolarHBondContact O-N 2.66Å; S214-R217 WeakPolarHBondContact O-CB 3.43Å; S214-R217 PolarHBondContact O-N 3.34Å; S214-R217 VanDerWaalsContact O-N 3.09Å; L215-R217 VanDerWaalsContact C-N 3.34Å; L215-R217 PolarHBondContact O-N 2.98Å; R217-N219 VanDerWaalsContact C-N 3.3Å; R217-K220 WeakPolarHBondContact O-CD 3.38Å; R217-K220 WeakPolarHBondContact O-CE 3.47Å; R217-K220 VanDerWaalsContact O-CG 3.3Å; R217-K220 WeakPolarHBondContact O-CG 3.45Å; R217-N260 PolarHBondContact NH1-ND2 2.79Å; R217-N262 PolarHBondContact NE-OD1 2.89Å; R217-N262 PolarHBondContact NH2-OD1 2.93Å; R217-V265 HydrophobicContact CG-CG2 4.07Å
218	E	88.6	Confident	89	Confident	122 Å²	122	35.1 Å²	35.1	57%	0.57	18%	0.176	S	C	*	.	H	α-helix	trans	-70.4	-27.3	176.3	-71.2	162.5	-147	0	0	112	S214 L215	S214-E218 WeakPolarHBondContact O-CG 3.37Å; S214-E218 PolarHBondContact O-N 2.91Å; S214-E218 PolarHBondContact OG-OE1 2.99Å; L215-E218 PolarHBondContact O-N 3.03Å
219	N	87.2	Confident	89.4	Confident	66 Å²	66	34.4 Å²	34.4	35%	0.353	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	33.8	-175.6	-66.8	-86.1	0	0	0	113.5	T188 F190 L215 A216 R217 P221	T188-N219 HydrophobicContact CG2-CB 4.22Å; T188-N219 PolarHBondContact OG1-O 3.3Å; F190-N219 HydrophobicContact CE2-CB 4.23Å; F190-N219 HydrophobicContact CZ-CB 3.98Å; L215-N219 WeakPolarHBondContact O-CB 3.45Å; L215-N219 PolarHBondContact O-N 3.11Å; L215-N219 PolarHBondContact O-ND2 3.47Å; A216-N219 CarbonylContact O-C 3.34Å; A216-N219 PolarHBondContact O-N 2.81Å; R217-N219 VanDerWaalsContact C-N 3.3Å; N219-P221 CarbonylContact O-C 3.52Å
220	K	86.9	Confident	89.4	Confident	76 Å²	76	35.6 Å²	35.6	33%	0.33	18%	0.179	S	C	.	.			trans	-61.2	141.7	176.7	-70.1	169.4	-175.8	-161.1	0	111.4	A216 R217 D261 E263 V265	A216-K220 PolarHBondContact O-N 3.23Å; R217-K220 WeakPolarHBondContact O-CD 3.38Å; R217-K220 WeakPolarHBondContact O-CE 3.47Å; R217-K220 VanDerWaalsContact O-CG 3.3Å; R217-K220 WeakPolarHBondContact O-CG 3.45Å; K220-D261 PolarHBondContact NZ-O 3.14Å; K220-D261 IonicContact NZ-OD2 3.93Å; K220-D261 PolarHBondContact NZ-OD2 3.43Å; K220-E263 WeakPolarHBondContact CD-O 3.43Å; K220-E263 WeakPolarHBondContact CE-O 3.11Å; K220-E263 PolarHBondContact NZ-O 2.95Å; K220-V265 HydrophobicContact CG-CG2 4.04Å
221	P	86.8	Confident	89.2	Confident	62 Å²	62	33.9 Å²	33.9	40%	0.403	18%	0.179	S	C	.	.	S	Bend	cis	-72.6	136.8	-6	31.6	-35	0	0	0	111.6	S187 T188 N219	S187-P221 WeakPolarHBondContact CA-O 3.48Å; S187-P221 WeakPolarHBondContact CB-O 3.39Å; S187-P221 WeakPolarHBondContact OG-CB 3.22Å; S187-P221 WeakPolarHBondContact OG-CG 3.4Å; T188-P221 PolarHBondContact N-O 3.41Å; T188-P221 VanDerWaalsContact N-O 3.11Å; N219-P221 CarbonylContact O-C 3.52Å
222	S	89.4	Confident	88.8	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	150.5	-175.7	61.5	0	0	0	0	113.1	T188 A216 G264 L266	T188-S222 WeakPolarHBondContact O-CA 3.47Å; A216-S222 WeakPolarHBondContact O-CB 3.31Å; A216-S222 PolarHBondContact O-OG 3.39Å; S222-G264 PolarHBondContact N-O 3.22Å; S222-G264 VanDerWaalsContact N-O 3.14Å; S222-L266 PolarHBondContact O-N 3.39Å
223	I	91.8	Very high	87.9	Confident	3 Å²	3	32 Å²	32	2%	0.015	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.8	176.8	-57.7	-176.3	0	0	0	108.2	V143 V180 A181 A184 T188 F189 F190 L266 L268	V143-I223 HydrophobicContact CG1-CD1 4.43Å; V180-I223 HydrophobicContact CG1-CD1 4Å; A181-I223 HydrophobicContact CB-CD1 4.08Å; A184-I223 HydrophobicContact CB-CD1 4.17Å; T188-I223 PolarHBondContact O-N 3.07Å; F189-I223 HydrophobicContact CD2-CB 4.13Å; F189-I223 HydrophobicContact CD2-CG2 4.06Å; F189-I223 HydrophobicContact CE2-CG2 4.15Å; F190-I223 PolarHBondContact N-O 3.05Å; I223-L266 WeakPolarHBondContact CA-O 3.48Å; I223-L266 HydrophobicContact CD1-CD2 4.4Å; I223-L266 HydrophobicContact CG1-CB 4.42Å; I223-L266 HydrophobicContact CG1-CD2 4.41Å; I223-L268 HydrophobicContact CG2-CB 4.42Å; I223-L268 HydrophobicContact CG2-CD1 3.65Å; I223-L268 HydrophobicContact CG2-CG 3.78Å
224	I	93.8	Very high	86.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	114.3	170.9	-58.4	173.4	0	0	0	107.5	F190 L212 F213 A216 I226 V265 L266 V267 L268	F190-I224 CarbonylContact O-C 3.46Å; L212-I224 HydrophobicContact CD1-CG2 4.39Å; L212-I224 HydrophobicContact CD2-CG2 3.85Å; L212-I224 HydrophobicContact CG-CD1 4.39Å; L212-I224 HydrophobicContact CG-CG2 4.24Å; F213-I224 HydrophobicContact CD1-CD1 3.78Å; F213-I224 HydrophobicContact CD2-CD1 4.21Å; F213-I224 HydrophobicContact CE1-CD1 3.79Å; F213-I224 HydrophobicContact CE2-CD1 4.22Å; F213-I224 HydrophobicContact CG-CD1 4.01Å; F213-I224 HydrophobicContact CZ-CD1 4.02Å; A216-I224 HydrophobicContact CB-CD1 3.64Å; A216-I224 HydrophobicContact CB-CG1 3.76Å; I224-I226 HydrophobicContact CG2-CD1 4.35Å; I224-I226 HydrophobicContact CG2-CG1 4.07Å; I224-V265 HydrophobicContact CD1-CG1 3.89Å; I224-V265 HydrophobicContact CG1-CG1 4.25Å; I224-L266 PolarHBondContact N-O 2.96Å; I224-V267 CarbonylContact O-C 3.56Å; I224-V267 WeakPolarHBondContact O-CA 3.34Å; I224-L268 PolarHBondContact O-N 3.48Å
225	F	94.7	Very high	85.6	Confident	3 Å²	3	34.1 Å²	34.1	1%	0.013	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	125.4	174.1	179.7	-107.5	0	0	0	111.1	A177 F189 F190 I192 D227 L268 A270	A177-F225 HydrophobicContact CB-CD2 3.39Å; A177-F225 HydrophobicContact CB-CE2 3.44Å; A177-F225 VanDerWaalsContact CB-CE2 3.44Å; A177-F225 HydrophobicContact CB-CG 4.05Å; A177-F225 HydrophobicContact CB-CZ 4.14Å; F189-F225 HydrophobicContact CD2-CB 4.43Å; F189-F225 HydrophobicContact CE1-CB 3.98Å; F189-F225 HydrophobicContact CE1-CD1 4.34Å; F189-F225 HydrophobicContact CE1-CG 4.4Å; F189-F225 HydrophobicContact CE2-CB 3.49Å; F189-F225 VanDerWaalsContact CE2-CB 3.49Å; F189-F225 HydrophobicContact CE2-CG 4.15Å; F189-F225 HydrophobicContact CZ-CB 3.23Å; F189-F225 AromaticContact CZ-CD1 3.85Å; F189-F225 HydrophobicContact CZ-CD1 3.85Å; F189-F225 HydrophobicContact CZ-CD2 4.37Å; F189-F225 AromaticContact CZ-CG 3.56Å; F189-F225 HydrophobicContact CZ-CG 3.56Å; F190-F225 PolarHBondContact O-N 2.6Å; I192-F225 PolarHBondContact N-O 3.01Å; F225-D227 HydrophobicContact CE1-CB 3.77Å; F225-D227 HydrophobicContact CZ-CB 4.16Å; F225-L268 CarbonylContact C-O 3.44Å; F225-L268 VanDerWaalsContact CA-O 3.32Å; F225-L268 WeakPolarHBondContact CA-O 3.36Å; F225-L268 HydrophobicContact CD2-CB 3.87Å; F225-A270 HydrophobicContact CE2-CB 3.74Å; F225-A270 HydrophobicContact CZ-CB 3.69Å
226	I	92.6	Very high	84.3	Confident	2 Å²	2	42 Å²	42	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	107.5	179.7	-54.8	173.9	0	0	0	108	I192 I224 I229 L232 F251 V267 L268 A270	I192-I226 HydrophobicContact CG2-CB 4.5Å; I192-I226 HydrophobicContact CG2-CG1 3.89Å; I192-I226 WeakPolarHBondContact O-CA 3.23Å; I224-I226 HydrophobicContact CG2-CD1 4.35Å; I224-I226 HydrophobicContact CG2-CG1 4.07Å; I226-I229 HydrophobicContact CG2-CB 4.09Å; I226-I229 HydrophobicContact CG2-CD1 4.37Å; I226-I229 HydrophobicContact CG2-CG1 4.12Å; I226-L232 HydrophobicContact CG2-CD1 4.25Å; I226-F251 HydrophobicContact CD1-CD2 4.28Å; I226-F251 HydrophobicContact CD1-CE1 4.39Å; I226-F251 HydrophobicContact CD1-CE2 3.22Å; I226-F251 HydrophobicContact CD1-CZ 3.29Å; I226-V267 HydrophobicContact CD1-CG1 4.25Å; I226-L268 PolarHBondContact N-O 3.07Å; I226-A270 PolarHBondContact O-N 2.7Å
227	D	91.1	Very high	82.9	Confident	43 Å²	43	45.2 Å²	45.2	23%	0.23	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	149.8	174.6	-144.3	-16.7	0	0	0	110.8	S174 I192 S194 F225 I229	S174-D227 PolarHBondContact OG-OD2 2.73Å; I192-D227 PolarHBondContact O-N 2.96Å; I192-D227 VanDerWaalsContact O-N 3.17Å; S194-D227 WeakPolarHBondContact CB-O 3.45Å; S194-D227 PolarHBondContact N-O 3.42Å; S194-D227 PolarHBondContact OG-O 2.7Å; F225-D227 HydrophobicContact CE1-CB 3.77Å; F225-D227 HydrophobicContact CZ-CB 4.16Å; D227-I229 VanDerWaalsContact C-N 3.28Å; D227-I229 PolarHBondContact O-N 2.73Å
228	E	89.4	Confident	81.4	Confident	83 Å²	83	52.4 Å²	52.4	39%	0.388	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	44.8	-179.5	-57.6	-179.1	153.7	0	0	113.2	S194 D230 S231 A270	S194-E228 VanDerWaalsContact CB-O 3.26Å; S194-E228 WeakPolarHBondContact CB-O 3.4Å; S194-E228 PolarHBondContact OG-O 3.42Å; S194-E228 VanDerWaalsContact OG-O 3.04Å; E228-D230 PolarHBondContact O-N 3.27Å; E228-S231 PolarHBondContact O-N 2.71Å; E228-S231 PolarHBondContact O-OG 2.81Å; E228-A270 WeakPolarHBondContact CA-O 3.37Å; E228-A270 PolarHBondContact N-O 3.19Å; E228-A270 VanDerWaalsContact N-O 3.11Å
229	I	90.3	Very high	80.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.1	-173.6	-168.4	165.4	0	0	0	113.4	L164 S194 I226 D227 S231 L232 C233 F251 A270 L277 I281 F285	L164-I229 HydrophobicContact CD1-CG2 3.97Å; S194-I229 WeakPolarHBondContact OG-CA 3.41Å; I226-I229 HydrophobicContact CG2-CB 4.09Å; I226-I229 HydrophobicContact CG2-CD1 4.37Å; I226-I229 HydrophobicContact CG2-CG1 4.12Å; D227-I229 VanDerWaalsContact C-N 3.28Å; D227-I229 PolarHBondContact O-N 2.73Å; I229-S231 PolarHBondContact O-N 2.92Å; I229-L232 PolarHBondContact O-N 3.28Å; I229-C233 HydrophobicContact CG1-CB 4.34Å; I229-C233 VanDerWaalsContact O-CB 3.27Å; I229-C233 WeakPolarHBondContact O-CB 3.37Å; I229-C233 PolarHBondContact O-N 2.93Å; I229-F251 HydrophobicContact CD1-CE1 4.2Å; I229-F251 HydrophobicContact CD1-CZ 4.4Å; I229-A270 PolarHBondContact N-O 3.16Å; I229-L277 HydrophobicContact CG2-CD1 4.12Å; I229-I281 HydrophobicContact CD1-CG2 4.47Å; I229-F285 HydrophobicContact CD1-CE2 3.37Å; I229-F285 HydrophobicContact CD1-CZ 3.3Å
230	D	86.9	Confident	79.4	Confident	26 Å²	26	52.5 Å²	52.5	14%	0.139	28%	0.276	C	S	.	.	H	α-helix	trans	-58.7	-28.7	173.4	50	-82.2	0	0	0	113.7	E228 C233 G234 T271 I273	E228-D230 PolarHBondContact O-N 3.27Å; D230-C233 PolarHBondContact O-N 3.04Å; D230-G234 WeakPolarHBondContact O-CA 3.34Å; D230-G234 PolarHBondContact O-N 3.19Å; D230-T271 VanDerWaalsContact CG-OG1 3.31Å; D230-T271 VanDerWaalsContact OD1-CB 3.3Å; D230-T271 WeakPolarHBondContact OD1-CB 3.45Å; D230-T271 PolarHBondContact OD1-OG1 3.19Å; D230-I273 HydrophobicContact CB-CD1 4.18Å; D230-I273 HydrophobicContact CB-CG1 3.79Å; D230-I273 VanDerWaalsContact CG-CG1 3.48Å; D230-I273 VanDerWaalsContact OD2-CD1 3.32Å; D230-I273 WeakPolarHBondContact OD2-CD1 3.42Å; D230-I273 WeakPolarHBondContact OD2-CG1 3.08Å
231	S	82.3	Confident	78.8	Confident	60 Å²	60	52.2 Å²	52.2	42%	0.42	28%	0.284	S	S	.	.	H	α-helix	trans	-73.2	-25.9	177.8	62.6	0	0	0	0	113.5	S194 E228 I229	S194-S231 WeakPolarHBondContact CB-OG 3.32Å; E228-S231 PolarHBondContact O-N 2.71Å; E228-S231 PolarHBondContact O-OG 2.81Å; I229-S231 PolarHBondContact O-N 2.92Å
232	L	76.6	Confident	78.4	Confident	12 Å²	12	55.1 Å²	55.1	6%	0.063	29%	0.292	C	S	.	.	H	α-helix	trans	-85.6	-35.3	169	-74.3	167.4	0	0	0	112.8	S194 L197 V198 I226 I229 I247 K248	S194-L232 VanDerWaalsContact OG-CD1 3.28Å; S194-L232 WeakPolarHBondContact OG-CD1 3.45Å; L197-L232 HydrophobicContact CB-CD1 4.44Å; L197-L232 HydrophobicContact CB-CD2 3.87Å; L197-L232 HydrophobicContact CD1-CD1 3.47Å; L197-L232 VanDerWaalsContact CD1-CD1 3.47Å; L197-L232 HydrophobicContact CD1-CD2 4.38Å; L197-L232 HydrophobicContact CD1-CG 4.49Å; V198-L232 HydrophobicContact CG2-CD2 3.58Å; I226-L232 HydrophobicContact CG2-CD1 4.25Å; I229-L232 PolarHBondContact O-N 3.28Å; L232-I247 HydrophobicContact CD2-CG2 3.99Å; L232-K248 WeakPolarHBondContact O-CE 3.3Å
233	C	72	Confident	77.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-115.8	24.3	-162	-64.3	0	0	0	0	113.1	I229 D230 L277 D278 I281	I229-C233 HydrophobicContact CG1-CB 4.34Å; I229-C233 VanDerWaalsContact O-CB 3.27Å; I229-C233 WeakPolarHBondContact O-CB 3.37Å; I229-C233 PolarHBondContact O-N 2.93Å; D230-C233 PolarHBondContact O-N 3.04Å; C233-L277 HydrophobicContact CB-CD1 3.48Å; C233-L277 VanDerWaalsContact CB-CD1 3.48Å; C233-D278 WeakPolarHBondContact O-CB 3.32Å; C233-D278 PolarHBondContact O-N 3.47Å; C233-I281 HydrophobicContact CB-CB 4.18Å; C233-I281 HydrophobicContact CB-CD1 4.38Å; C233-I281 HydrophobicContact CB-CG1 3.85Å; C233-I281 HydrophobicContact CB-CG2 3.91Å; C233-I281 VanDerWaalsContact SG-CD1 3.57Å
234	G	68.1	Low	77.2	Confident	20 Å²	20	57.1 Å²	57.1	21%	0.206	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-57.3	151.9	176.7	0	0	0	0	0	112.9	D230 R236 K248 T276	D230-G234 WeakPolarHBondContact O-CA 3.34Å; D230-G234 PolarHBondContact O-N 3.19Å; G234-R236 PolarHBondContact O-N 3.28Å; G234-K248 PolarHBondContact O-NZ 2.65Å; G234-T276 CarbonylContact C-O 3.59Å; G234-T276 WeakPolarHBondContact CA-O 3.45Å
235	S	61.5	Low	76.6	Confident	69 Å²	69	62.1 Å²	62.1	48%	0.483	33%	0.328	S	S	.	.			trans	-56.9	132.7	175.3	32.4	0	0	0	0	109.7	S237 T276	S235-S237 PolarHBondContact O-N 3.45Å; S235-T276 PolarHBondContact N-O 3.06Å; S235-T276 PolarHBondContact OG-O 3.02Å
236	R	61.2	Low	76.1	Confident	192 Å²	192	68.1 Å²	68.1	73%	0.725	35%	0.35	S	S	*	.			trans	-50.5	107.2	-177	-66.7	-179.4	-179	-167.1	-3.7	110	G234	G234-R236 PolarHBondContact O-N 3.28Å
237	S	60.6	Low	75.6	Confident	66 Å²	66	68.4 Å²	68.4	46%	0.462	35%	0.352	S	S	.	.			trans	-97.8	153.2	169.4	62.5	0	0	0	0	108.9	S235 N239 E240 R245	S235-S237 PolarHBondContact O-N 3.45Å; S237-N239 PolarHBondContact O-N 2.99Å; S237-N239 VanDerWaalsContact O-N 3.14Å; S237-E240 WeakPolarHBondContact O-CB 3.28Å; S237-E240 PolarHBondContact O-N 3.05Å; S237-R245 PolarHBondContact O-NH2 3.32Å
238	E	57.5	Low	75.4	Confident	193 Å²	193	66.9 Å²	66.9	90%	0.902	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.2	177.3	-70.5	-174.5	155	0	0	112.2
239	N	63.3	Low	75.3	Confident	160 Å²	160	66.8 Å²	66.8	86%	0.856	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	9.9	178.1	-68	-21.3	0	0	0	114.3	S237 S241	S237-N239 PolarHBondContact O-N 2.99Å; S237-N239 VanDerWaalsContact O-N 3.14Å; N239-S241 PolarHBondContact O-N 3.19Å
240	E	71	Confident	75.2	Confident	30 Å²	30	67.9 Å²	67.9	14%	0.14	35%	0.354	C	S	.	.			trans	-69.7	124.7	178.6	-170.9	179.5	-156.7	0	0	111.1	S237 A244 R245 K248	S237-E240 WeakPolarHBondContact O-CB 3.28Å; S237-E240 PolarHBondContact O-N 3.05Å; E240-A244 HydrophobicContact CG-CB 4.12Å; E240-R245 HydrophobicContact CG-CG 4.06Å; E240-R245 WeakPolarHBondContact OE2-CG 3.37Å; E240-R245 IonicContact OE2-NE 3.52Å; E240-R245 PolarHBondContact OE2-NE 3.3Å; E240-K248 VanDerWaalsContact OE1-CE 3.3Å; E240-K248 WeakPolarHBondContact OE1-CE 3.43Å; E240-K248 IonicContact OE1-NZ 2.9Å; E240-K248 PolarHBondContact OE1-NZ 2.99Å; E240-K248 IonicContact OE2-NZ 3.54Å
241	S	74.5	Confident	75.3	Confident	69 Å²	69	67 Å²	67	48%	0.483	35%	0.349	S	S	.	.			trans	-56.2	137.7	176.7	176.4	0	0	0	0	111.5	N239 A243 A244 R245	N239-S241 PolarHBondContact O-N 3.19Å; S241-A243 PolarHBondContact O-N 3.38Å; S241-A243 PolarHBondContact OG-N 3.01Å; S241-A244 WeakPolarHBondContact O-CB 3.43Å; S241-A244 PolarHBondContact O-N 3.02Å; S241-R245 PolarHBondContact O-N 3.4Å
242	E	78.3	Confident	75.6	Confident	124 Å²	124	65.8 Å²	65.8	58%	0.579	34%	0.337	S	S	*	.	H	α-helix	trans	-56	-34.6	176.2	-157	-164	157.7	0	0	111.6	R245 R246	E242-R245 WeakPolarHBondContact O-CB 3.17Å; E242-R245 PolarHBondContact O-N 3.08Å; E242-R246 WeakPolarHBondContact O-CG 3.39Å; E242-R246 PolarHBondContact O-N 3.2Å; E242-R246 VanDerWaalsContact O-N 3.08Å; E242-R246 IonicContact OE1-CZ 3Å; E242-R246 IonicContact OE1-NE 2.64Å; E242-R246 PolarHBondContact OE1-NE 2.66Å; E242-R246 IonicContact OE1-NH2 2.72Å; E242-R246 PolarHBondContact OE1-NH2 3.43Å; E242-R246 IonicContact OE2-NH2 3.78Å
243	A	76.9	Confident	76.2	Confident	23 Å²	23	68 Å²	68	19%	0.19	35%	0.351	C	S	.	.	H	α-helix	trans	-65	-41.4	176	0	0	0	0	0	112.8	L202 S241 R245 R246 I247	L202-A243 HydrophobicContact CD2-CB 3.36Å; S241-A243 PolarHBondContact O-N 3.38Å; S241-A243 PolarHBondContact OG-N 3.01Å; A243-R245 VanDerWaalsContact C-N 3.28Å; A243-R245 PolarHBondContact O-N 3.5Å; A243-R246 PolarHBondContact O-N 3.5Å; A243-I247 VanDerWaalsContact O-CG1 3.27Å; A243-I247 WeakPolarHBondContact O-CG1 3.43Å; A243-I247 PolarHBondContact O-N 3.43Å
244	A	78.2	Confident	77	Confident	24 Å²	24	68.9 Å²	68.9	20%	0.198	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-38.7	176.2	0	0	0	0	0	111.2	E240 S241 R246 I247 K248	E240-A244 HydrophobicContact CG-CB 4.12Å; S241-A244 WeakPolarHBondContact O-CB 3.43Å; S241-A244 PolarHBondContact O-N 3.02Å; A244-R246 PolarHBondContact O-N 3.22Å; A244-I247 PolarHBondContact O-N 2.72Å; A244-K248 WeakPolarHBondContact O-CB 3.49Å; A244-K248 PolarHBondContact O-N 3.28Å
245	R	81	Confident	77.9	Confident	106 Å²	106	68.7 Å²	68.7	40%	0.4	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-41.6	175	-67.1	-178.2	179.4	167.9	6.6	112.5	S237 E240 S241 E242 A243 T249	S237-R245 PolarHBondContact O-NH2 3.32Å; E240-R245 HydrophobicContact CG-CG 4.06Å; E240-R245 WeakPolarHBondContact OE2-CG 3.37Å; E240-R245 IonicContact OE2-NE 3.52Å; E240-R245 PolarHBondContact OE2-NE 3.3Å; S241-R245 PolarHBondContact O-N 3.4Å; E242-R245 WeakPolarHBondContact O-CB 3.17Å; E242-R245 PolarHBondContact O-N 3.08Å; A243-R245 VanDerWaalsContact C-N 3.28Å; A243-R245 PolarHBondContact O-N 3.5Å; R245-T249 WeakPolarHBondContact O-CB 3.32Å; R245-T249 PolarHBondContact O-N 3.46Å; R245-T249 PolarHBondContact O-OG1 2.93Å
246	R	84.1	Confident	78.9	Confident	128 Å²	128	70.6 Å²	70.6	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-67	-43.9	177.5	-65.2	178.5	-171.9	-172	2.2	111.8	E206 E242 A243 A244 K248 T249 E250	E206-R246 HydrophobicContact CG-CB 4.33Å; E206-R246 WeakPolarHBondContact OE1-CB 3.25Å; E206-R246 WeakPolarHBondContact OE1-CD 3.44Å; E242-R246 WeakPolarHBondContact O-CG 3.39Å; E242-R246 PolarHBondContact O-N 3.2Å; E242-R246 VanDerWaalsContact O-N 3.08Å; E242-R246 IonicContact OE1-CZ 3Å; E242-R246 IonicContact OE1-NE 2.64Å; E242-R246 PolarHBondContact OE1-NE 2.66Å; E242-R246 IonicContact OE1-NH2 2.72Å; E242-R246 PolarHBondContact OE1-NH2 3.43Å; E242-R246 IonicContact OE2-NH2 3.78Å; A243-R246 PolarHBondContact O-N 3.5Å; A244-R246 PolarHBondContact O-N 3.22Å; R246-K248 PolarHBondContact O-N 3.03Å; R246-T249 WeakPolarHBondContact O-CB 3.4Å; R246-T249 PolarHBondContact O-N 2.92Å; R246-E250 WeakPolarHBondContact O-CB 3.44Å; R246-E250 PolarHBondContact O-N 2.93Å
247	I	83.9	Confident	79.6	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.046	32%	0.322	C	S	.	.	H	α-helix	trans	-58.5	-46.6	174.9	-64.7	162.5	0	0	0	111	E206 V209 L232 A243 A244 T249 E250 F251	E206-I247 HydrophobicContact CG-CG1 4.45Å; V209-I247 HydrophobicContact CG2-CG2 4.15Å; L232-I247 HydrophobicContact CD2-CG2 3.99Å; A243-I247 VanDerWaalsContact O-CG1 3.27Å; A243-I247 WeakPolarHBondContact O-CG1 3.43Å; A243-I247 PolarHBondContact O-N 3.43Å; A244-I247 PolarHBondContact O-N 2.72Å; I247-T249 VanDerWaalsContact C-N 3.32Å; I247-T249 PolarHBondContact O-N 3.2Å; I247-E250 PolarHBondContact O-N 3.42Å; I247-F251 WeakPolarHBondContact O-CB 3.3Å; I247-F251 PolarHBondContact O-N 3.3Å
248	K	85.8	Confident	79.6	Confident	11 Å²	11	63.4 Å²	63.4	5%	0.048	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-41.8	177.3	-170.6	-176.2	-50.7	179.9	0	112.1	L232 G234 E240 A244 R246 F251 L252 I281	L232-K248 WeakPolarHBondContact O-CE 3.3Å; G234-K248 PolarHBondContact O-NZ 2.65Å; E240-K248 VanDerWaalsContact OE1-CE 3.3Å; E240-K248 WeakPolarHBondContact OE1-CE 3.43Å; E240-K248 IonicContact OE1-NZ 2.9Å; E240-K248 PolarHBondContact OE1-NZ 2.99Å; E240-K248 IonicContact OE2-NZ 3.54Å; A244-K248 WeakPolarHBondContact O-CB 3.49Å; A244-K248 PolarHBondContact O-N 3.28Å; R246-K248 PolarHBondContact O-N 3.03Å; K248-F251 PolarHBondContact O-N 2.88Å; K248-L252 WeakPolarHBondContact O-CG 3.36Å; K248-L252 PolarHBondContact O-N 3.28Å; K248-I281 HydrophobicContact CD-CG1 4.49Å; K248-I281 HydrophobicContact CG-CD1 4.1Å; K248-I281 HydrophobicContact CG-CG1 4.2Å
249	T	87.8	Confident	79.4	Confident	81 Å²	81	57.9 Å²	57.9	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-64.3	-46.3	177.3	-56.4	0	0	0	0	110.8	R245 R246 I247 F251 L252 V253	R245-T249 WeakPolarHBondContact O-CB 3.32Å; R245-T249 PolarHBondContact O-N 3.46Å; R245-T249 PolarHBondContact O-OG1 2.93Å; R246-T249 WeakPolarHBondContact O-CB 3.4Å; R246-T249 PolarHBondContact O-N 2.92Å; I247-T249 VanDerWaalsContact C-N 3.32Å; I247-T249 PolarHBondContact O-N 3.2Å; T249-F251 PolarHBondContact O-N 3.45Å; T249-L252 PolarHBondContact O-N 2.85Å; T249-V253 WeakPolarHBondContact O-CG2 2.85Å; T249-V253 PolarHBondContact O-N 3.05Å
250	E	88.1	Confident	79.7	Confident	23 Å²	23	54.2 Å²	54.2	11%	0.107	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-45.2	177.4	-176.1	55.7	-139.4	0	0	111.5	V209 K210 R246 I247 L252 V253 Q254	V209-E250 HydrophobicContact CB-CG 4.26Å; V209-E250 HydrophobicContact CG1-CG 4.14Å; K210-E250 WeakPolarHBondContact CE-OE1 3.39Å; K210-E250 WeakPolarHBondContact CE-OE2 3.28Å; K210-E250 HydrophobicContact CG-CG 4.06Å; K210-E250 WeakPolarHBondContact CG-OE1 3.26Å; K210-E250 IonicContact NZ-OE2 3.26Å; R246-E250 WeakPolarHBondContact O-CB 3.44Å; R246-E250 PolarHBondContact O-N 2.93Å; I247-E250 PolarHBondContact O-N 3.42Å; E250-L252 VanDerWaalsContact C-N 3.34Å; E250-L252 PolarHBondContact O-N 3.41Å; E250-V253 WeakPolarHBondContact O-CB 3.47Å; E250-V253 PolarHBondContact O-N 3.14Å; E250-V253 VanDerWaalsContact O-N 3.16Å; E250-Q254 WeakPolarHBondContact O-CG 3.46Å; E250-Q254 PolarHBondContact O-N 3.32Å; E250-Q254 PolarHBondContact OE1-NE2 3.04Å
251	F	89.3	Confident	79.8	Confident	8 Å²	8	57 Å²	57	4%	0.035	32%	0.319	C	S	.	.	H	α-helix	trans	-58.5	-43.9	176.6	-176.7	-109.2	0	0	0	112.5	V209 F213 I226 I229 I247 K248 T249 V253 Q254 M255 V267 I281	V209-F251 HydrophobicContact CG1-CB 4.25Å; V209-F251 HydrophobicContact CG1-CD2 4.19Å; F213-F251 AromaticContact CE2-CD2 3.81Å; F213-F251 HydrophobicContact CE2-CD2 3.81Å; F213-F251 AromaticContact CE2-CE2 3.73Å; F213-F251 HydrophobicContact CE2-CE2 3.73Å; F213-F251 HydrophobicContact CZ-CD2 4.15Å; F213-F251 AromaticContact CZ-CE2 3.75Å; F213-F251 HydrophobicContact CZ-CE2 3.75Å; I226-F251 HydrophobicContact CD1-CD2 4.28Å; I226-F251 HydrophobicContact CD1-CE1 4.39Å; I226-F251 HydrophobicContact CD1-CE2 3.22Å; I226-F251 HydrophobicContact CD1-CZ 3.29Å; I229-F251 HydrophobicContact CD1-CE1 4.2Å; I229-F251 HydrophobicContact CD1-CZ 4.4Å; I247-F251 WeakPolarHBondContact O-CB 3.3Å; I247-F251 PolarHBondContact O-N 3.3Å; K248-F251 PolarHBondContact O-N 2.88Å; T249-F251 PolarHBondContact O-N 3.45Å; F251-V253 PolarHBondContact O-N 2.97Å; F251-Q254 PolarHBondContact O-N 3.01Å; F251-M255 HydrophobicContact CD1-CG 4.43Å; F251-M255 HydrophobicContact CD1-SD 3.98Å; F251-M255 HydrophobicContact CE1-CG 4.02Å; F251-M255 HydrophobicContact CE1-SD 3.28Å; F251-M255 WeakPolarHBondContact CE1-SD 3.37Å; F251-M255 HydrophobicContact CE2-CG 4.24Å; F251-M255 HydrophobicContact CE2-SD 4.44Å; F251-M255 HydrophobicContact CZ-CG 3.9Å; F251-M255 HydrophobicContact CZ-SD 3.54Å; F251-M255 VanDerWaalsContact CZ-SD 3.54Å; F251-M255 WeakPolarHBondContact O-CG 3.41Å; F251-M255 PolarHBondContact O-N 3.14Å; F251-V267 HydrophobicContact CZ-CG1 4.16Å; F251-I281 HydrophobicContact CD1-CD1 3.73Å; F251-I281 HydrophobicContact CE1-CD1 4.19Å
252	L	88.3	Confident	79.9	Confident	33 Å²	33	54.1 Å²	54.1	17%	0.173	30%	0.298	C	S	.	.	H	α-helix	trans	-61.4	-41.8	175	-76.7	169.4	0	0	0	112.7	K248 T249 E250 M255 Q256 A280 I281 R284	K248-L252 WeakPolarHBondContact O-CG 3.36Å; K248-L252 PolarHBondContact O-N 3.28Å; T249-L252 PolarHBondContact O-N 2.85Å; E250-L252 VanDerWaalsContact C-N 3.34Å; E250-L252 PolarHBondContact O-N 3.41Å; L252-M255 PolarHBondContact O-N 3.22Å; L252-Q256 WeakPolarHBondContact O-CB 3.42Å; L252-Q256 PolarHBondContact O-N 3.41Å; L252-Q256 VanDerWaalsContact O-N 3.09Å; L252-A280 HydrophobicContact CD1-CB 4.06Å; L252-A280 HydrophobicContact CD2-CB 4.37Å; L252-I281 HydrophobicContact CD1-CD1 4.22Å; L252-I281 HydrophobicContact CD2-CD1 3.46Å; L252-I281 VanDerWaalsContact CD2-CD1 3.46Å; L252-I281 HydrophobicContact CD2-CG1 4.1Å; L252-I281 HydrophobicContact CG-CD1 3.58Å; L252-I281 HydrophobicContact CG-CG1 4.4Å; L252-R284 HydrophobicContact CD2-CG 3.71Å
253	V	89.4	Confident	79.9	Confident	59 Å²	59	54.9 Å²	54.9	36%	0.358	30%	0.301	S	S	.	.	H	α-helix	trans	-62.7	-44.5	177	170.7	0	0	0	0	110.4	T249 E250 F251 Q256 G257	T249-V253 WeakPolarHBondContact O-CG2 2.85Å; T249-V253 PolarHBondContact O-N 3.05Å; E250-V253 WeakPolarHBondContact O-CB 3.47Å; E250-V253 PolarHBondContact O-N 3.14Å; E250-V253 VanDerWaalsContact O-N 3.16Å; F251-V253 PolarHBondContact O-N 2.97Å; V253-Q256 PolarHBondContact O-N 3.43Å; V253-G257 PolarHBondContact O-N 3.49Å
254	Q	89.3	Confident	80.1	Confident	18 Å²	18	55.9 Å²	55.9	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-42.2	178.5	-66.8	-56	-34.6	0	0	112.6	V209 F213 E250 F251 Q256 G257 N262	V209-Q254 HydrophobicContact CG1-CG 4.17Å; F213-Q254 HydrophobicContact CB-CB 4.27Å; F213-Q254 HydrophobicContact CB-CG 4.33Å; F213-Q254 HydrophobicContact CD1-CB 3.86Å; F213-Q254 HydrophobicContact CD2-CB 3.59Å; F213-Q254 HydrophobicContact CD2-CG 3.98Å; F213-Q254 HydrophobicContact CE1-CB 4.01Å; F213-Q254 HydrophobicContact CE2-CB 3.76Å; F213-Q254 HydrophobicContact CE2-CG 4.49Å; F213-Q254 HydrophobicContact CG-CB 3.64Å; F213-Q254 HydrophobicContact CG-CG 4.13Å; F213-Q254 HydrophobicContact CZ-CB 3.96Å; E250-Q254 WeakPolarHBondContact O-CG 3.46Å; E250-Q254 PolarHBondContact O-N 3.32Å; E250-Q254 PolarHBondContact OE1-NE2 3.04Å; F251-Q254 PolarHBondContact O-N 3.01Å; Q254-Q256 VanDerWaalsContact C-N 3.28Å; Q254-Q256 PolarHBondContact O-N 2.88Å; Q254-G257 PolarHBondContact O-N 3.13Å; Q254-G257 VanDerWaalsContact O-N 3.14Å; Q254-N262 PolarHBondContact O-ND2 2.67Å
255	M	87	Confident	80.7	Confident	16 Å²	16	55.3 Å²	55.3	8%	0.079	31%	0.308	C	S	.	.	H	α-helix	trans	-61.7	-36.7	175.4	-73.4	-171	83.1	0	0	112.4	F213 F251 L252 G257 V267 R284 F285	F213-M255 HydrophobicContact CZ-CG 4.15Å; F251-M255 HydrophobicContact CD1-CG 4.43Å; F251-M255 HydrophobicContact CD1-SD 3.98Å; F251-M255 HydrophobicContact CE1-CG 4.02Å; F251-M255 HydrophobicContact CE1-SD 3.28Å; F251-M255 WeakPolarHBondContact CE1-SD 3.37Å; F251-M255 HydrophobicContact CE2-CG 4.24Å; F251-M255 HydrophobicContact CE2-SD 4.44Å; F251-M255 HydrophobicContact CZ-CG 3.9Å; F251-M255 HydrophobicContact CZ-SD 3.54Å; F251-M255 VanDerWaalsContact CZ-SD 3.54Å; F251-M255 WeakPolarHBondContact O-CG 3.41Å; F251-M255 PolarHBondContact O-N 3.14Å; L252-M255 PolarHBondContact O-N 3.22Å; M255-G257 VanDerWaalsContact C-N 3.25Å; M255-G257 PolarHBondContact O-N 3.13Å; M255-V267 HydrophobicContact CE-CB 4.27Å; M255-V267 HydrophobicContact CE-CG1 4.24Å; M255-R284 HydrophobicContact CE-CB 3.6Å; M255-R284 HydrophobicContact SD-CB 3.74Å; M255-R284 HydrophobicContact SD-CG 4.39Å; M255-F285 HydrophobicContact CE-CD1 4.49Å; M255-F285 HydrophobicContact CE-CE1 4.15Å; M255-F285 HydrophobicContact CE-CE2 4.36Å; M255-F285 HydrophobicContact CE-CZ 4.06Å
256	Q	81.1	Confident	81.2	Confident	110 Å²	110	51 Å²	51	51%	0.514	29%	0.293	S	S	.	.	H	α-helix	trans	-71.5	-22.2	178.6	-170	160.1	-4.7	0	0	112.6	L252 V253 Q254 V258	L252-Q256 WeakPolarHBondContact O-CB 3.42Å; L252-Q256 PolarHBondContact O-N 3.41Å; L252-Q256 VanDerWaalsContact O-N 3.09Å; V253-Q256 PolarHBondContact O-N 3.43Å; Q254-Q256 VanDerWaalsContact C-N 3.28Å; Q254-Q256 PolarHBondContact O-N 2.88Å; Q256-V258 VanDerWaalsContact C-N 3.34Å; Q256-V258 HydrophobicContact CB-CG2 4.1Å; Q256-V258 HydrophobicContact CG-CG2 3.86Å
257	G	75.5	Confident	81.7	Confident	13 Å²	13	45.2 Å²	45.2	13%	0.134	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	31.7	180	0	0	0	0	0	112.7	V253 Q254 M255 G259 N260 N262	V253-G257 PolarHBondContact O-N 3.49Å; Q254-G257 PolarHBondContact O-N 3.13Å; Q254-G257 VanDerWaalsContact O-N 3.14Å; M255-G257 VanDerWaalsContact C-N 3.25Å; M255-G257 PolarHBondContact O-N 3.13Å; G257-G259 PolarHBondContact O-N 3.41Å; G257-N260 PolarHBondContact O-N 3.36Å; G257-N260 VanDerWaalsContact O-N 3.09Å; G257-N262 VanDerWaalsContact CA-ND2 3.29Å; G257-N262 WeakPolarHBondContact CA-ND2 3.44Å; G257-N262 PolarHBondContact N-ND2 2.82Å
258	V	60.7	Low	82.2	Confident	93 Å²	93	44.8 Å²	44.8	56%	0.564	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	113.8	177.5	-177.9	0	0	0	0	108.7	Q256 N260	Q256-V258 VanDerWaalsContact C-N 3.34Å; Q256-V258 HydrophobicContact CB-CG2 4.1Å; Q256-V258 HydrophobicContact CG-CG2 3.86Å; V258-N260 VanDerWaalsContact C-N 3.34Å; V258-N260 PolarHBondContact O-N 3.36Å
259	G	53.8	Low	82.6	Confident	78 Å²	78	44.3 Å²	44.3	80%	0.804	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	4.6	-179.7	0	0	0	0	0	116	G257	G257-G259 PolarHBondContact O-N 3.41Å
260	N	68.9	Low	83	Confident	82 Å²	82	40.4 Å²	40.4	44%	0.439	24%	0.244	S	C	.	.	S	Bend	trans	-140.4	141.6	-179.3	-70.1	-60.6	0	0	0	112.2	R217 G257 V258 N262	R217-N260 PolarHBondContact NH1-ND2 2.79Å; G257-N260 PolarHBondContact O-N 3.36Å; G257-N260 VanDerWaalsContact O-N 3.09Å; V258-N260 VanDerWaalsContact C-N 3.34Å; V258-N260 PolarHBondContact O-N 3.36Å; N260-N262 PolarHBondContact O-N 3.03Å
261	D	73.5	Confident	83.3	Confident	89 Å²	89	39.4 Å²	39.4	48%	0.476	24%	0.239	S	C	.	.			trans	-78.9	108.4	173.1	175.7	36.8	0	0	0	111.6	K220 E263	K220-D261 PolarHBondContact NZ-O 3.14Å; K220-D261 IonicContact NZ-OD2 3.93Å; K220-D261 PolarHBondContact NZ-OD2 3.43Å; D261-E263 VanDerWaalsContact C-N 3.33Å; D261-E263 WeakPolarHBondContact OD1-CB 3.27Å; D261-E263 PolarHBondContact OD1-N 3.02Å; D261-E263 WeakPolarHBondContact OD2-CB 3.48Å
262	N	76.3	Confident	83.5	Confident	8 Å²	8	41.2 Å²	41.2	4%	0.043	25%	0.249	C	C	.	.			trans	-89.5	10	174.3	-72.1	-11.9	0	0	0	112.9	R217 Q254 G257 N260 G264 V265	R217-N262 PolarHBondContact NE-OD1 2.89Å; R217-N262 PolarHBondContact NH2-OD1 2.93Å; Q254-N262 PolarHBondContact O-ND2 2.67Å; G257-N262 VanDerWaalsContact CA-ND2 3.29Å; G257-N262 WeakPolarHBondContact CA-ND2 3.44Å; G257-N262 PolarHBondContact N-ND2 2.82Å; N260-N262 PolarHBondContact O-N 3.03Å; N262-G264 PolarHBondContact O-N 3.45Å; N262-V265 PolarHBondContact O-N 3.29Å; N262-V265 VanDerWaalsContact O-N 3.09Å
263	E	79.6	Confident	83.7	Confident	140 Å²	140	42.5 Å²	42.5	65%	0.654	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	131	174.1	-170.6	169.7	-167.5	0	0	110.4	K220 D261	K220-E263 WeakPolarHBondContact CD-O 3.43Å; K220-E263 WeakPolarHBondContact CE-O 3.11Å; K220-E263 PolarHBondContact NZ-O 2.95Å; D261-E263 VanDerWaalsContact C-N 3.33Å; D261-E263 WeakPolarHBondContact OD1-CB 3.27Å; D261-E263 PolarHBondContact OD1-N 3.02Å; D261-E263 WeakPolarHBondContact OD2-CB 3.48Å
264	G	81.6	Confident	83.9	Confident	45 Å²	45	39.7 Å²	39.7	46%	0.464	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	6.9	-176.3	0	0	0	0	0	116	S222 N262	S222-G264 PolarHBondContact N-O 3.22Å; S222-G264 VanDerWaalsContact N-O 3.14Å; N262-G264 PolarHBondContact O-N 3.45Å
265	V	89.9	Confident	83.9	Confident	11 Å²	11	43.2 Å²	43.2	7%	0.067	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.4	170.2	-175.7	0	0	0	0	109.7	A216 R217 K220 I224 N262	A216-V265 HydrophobicContact CB-CG1 3.98Å; A216-V265 HydrophobicContact CB-CG2 4.49Å; R217-V265 HydrophobicContact CG-CG2 4.07Å; K220-V265 HydrophobicContact CG-CG2 4.04Å; I224-V265 HydrophobicContact CD1-CG1 3.89Å; I224-V265 HydrophobicContact CG1-CG1 4.25Å; N262-V265 PolarHBondContact O-N 3.29Å; N262-V265 VanDerWaalsContact O-N 3.09Å
266	L	91.5	Very high	84.1	Confident	17 Å²	17	44.1 Å²	44.1	9%	0.089	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.1	176.2	175.9	68.3	0	0	0	110.7	V143 W160 I163 S222 I223 I224 L268	V143-L266 HydrophobicContact CB-CD2 4.16Å; V143-L266 HydrophobicContact CG1-CD2 3.68Å; V143-L266 HydrophobicContact CG2-CD2 3.42Å; V143-L266 VanDerWaalsContact CG2-CD2 3.42Å; W160-L266 WeakPolarHBondContact O-CD1 3.03Å; I163-L266 HydrophobicContact CD1-CD1 4Å; I163-L266 HydrophobicContact CD1-CD2 4.31Å; I163-L266 HydrophobicContact CG1-CD1 4.11Å; S222-L266 PolarHBondContact O-N 3.39Å; I223-L266 WeakPolarHBondContact CA-O 3.48Å; I223-L266 HydrophobicContact CD1-CD2 4.4Å; I223-L266 HydrophobicContact CG1-CB 4.42Å; I223-L266 HydrophobicContact CG1-CD2 4.41Å; I224-L266 PolarHBondContact N-O 2.96Å; L266-L268 HydrophobicContact CD2-CD2 3.94Å; L266-L268 HydrophobicContact CD2-CG 4.18Å; L266-L268 HydrophobicContact CG-CD2 4.25Å; L266-L268 HydrophobicContact CG-CG 4.4Å
267	V	94	Very high	84.5	Confident	6 Å²	6	39 Å²	39	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	118.6	172.4	-173.7	0	0	0	0	110.2	R161 G162 I163 F213 I224 I226 F251 M255 F285	R161-V267 PolarHBondContact O-N 3.47Å; G162-V267 WeakPolarHBondContact CA-O 3.44Å; I163-V267 PolarHBondContact N-O 3.32Å; F213-V267 HydrophobicContact CE1-CG2 3.97Å; F213-V267 HydrophobicContact CZ-CG2 4.08Å; I224-V267 CarbonylContact O-C 3.56Å; I224-V267 WeakPolarHBondContact O-CA 3.34Å; I226-V267 HydrophobicContact CD1-CG1 4.25Å; F251-V267 HydrophobicContact CZ-CG1 4.16Å; M255-V267 HydrophobicContact CE-CB 4.27Å; M255-V267 HydrophobicContact CE-CG1 4.24Å; V267-F285 HydrophobicContact CG1-CE1 4.08Å; V267-F285 HydrophobicContact CG1-CZ 4.24Å
268	L	94.9	Very high	85	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.1	171.1	-66.1	-174.6	0	0	0	109.6	I163 A177 V180 I223 I224 F225 I226 L266	I163-L268 HydrophobicContact CB-CD2 3.65Å; I163-L268 HydrophobicContact CD1-CD2 4.02Å; I163-L268 HydrophobicContact CG1-CD2 4.24Å; I163-L268 HydrophobicContact CG2-CD2 4.28Å; I163-L268 WeakPolarHBondContact O-CA 3.48Å; A177-L268 HydrophobicContact CB-CD1 4.07Å; V180-L268 HydrophobicContact CG1-CD1 4.42Å; I223-L268 HydrophobicContact CG2-CB 4.42Å; I223-L268 HydrophobicContact CG2-CD1 3.65Å; I223-L268 HydrophobicContact CG2-CG 3.78Å; I224-L268 PolarHBondContact O-N 3.48Å; F225-L268 CarbonylContact C-O 3.44Å; F225-L268 VanDerWaalsContact CA-O 3.32Å; F225-L268 WeakPolarHBondContact CA-O 3.36Å; F225-L268 HydrophobicContact CD2-CB 3.87Å; I226-L268 PolarHBondContact N-O 3.07Å; L266-L268 HydrophobicContact CD2-CD2 3.94Å; L266-L268 HydrophobicContact CD2-CG 4.18Å; L266-L268 HydrophobicContact CG-CD2 4.25Å; L266-L268 HydrophobicContact CG-CG 4.4Å
269	G	95.1	Very high	86.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.5	171.1	0	0	0	0	0	111	I163 L165	I163-G269 PolarHBondContact O-N 3.06Å; L165-G269 PolarHBondContact N-O 2.92Å
270	A	95.1	Very high	87.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	136.6	168.7	0	0	0	0	0	111.4	L165 K173 F225 I226 E228 I229	L165-A270 VanDerWaalsContact O-CA 3.32Å; L165-A270 WeakPolarHBondContact O-CA 3.42Å; K173-A270 HydrophobicContact CB-CB 4.15Å; K173-A270 HydrophobicContact CD-CB 4.31Å; F225-A270 HydrophobicContact CE2-CB 3.74Å; F225-A270 HydrophobicContact CZ-CB 3.69Å; I226-A270 PolarHBondContact O-N 2.7Å; E228-A270 WeakPolarHBondContact CA-O 3.37Å; E228-A270 PolarHBondContact N-O 3.19Å; E228-A270 VanDerWaalsContact N-O 3.11Å; I229-A270 PolarHBondContact N-O 3.16Å
271	T	94.2	Very high	88.7	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.8	174.6	-176.5	0	0	0	0	112.2	L164 L165 F166 G167 K173 D230 I273 P274	L164-T271 HydrophobicContact CD1-CG2 3.98Å; L164-T271 HydrophobicContact CD2-CG2 4.39Å; L164-T271 HydrophobicContact CG-CG2 4.38Å; L165-T271 PolarHBondContact O-N 3.35Å; F166-T271 WeakPolarHBondContact CA-O 3.48Å; F166-T271 HydrophobicContact CB-CG2 3.86Å; G167-T271 PolarHBondContact N-O 3.13Å; K173-T271 WeakPolarHBondContact CE-O 3.48Å; D230-T271 VanDerWaalsContact CG-OG1 3.31Å; D230-T271 VanDerWaalsContact OD1-CB 3.3Å; D230-T271 WeakPolarHBondContact OD1-CB 3.45Å; D230-T271 PolarHBondContact OD1-OG1 3.19Å; T271-I273 PolarHBondContact OG1-N 2.9Å; T271-I273 VanDerWaalsContact OG1-N 3.11Å; T271-P274 HydrophobicContact CG2-CB 3.89Å
272	N	94.2	Very high	89.5	Confident	47 Å²	47	28.9 Å²	28.9	25%	0.251	16%	0.161	S	C	.	.	S	Bend	trans	-96.5	-17.9	170.6	-59.4	-46	0	0	0	112.8	G167 P169 K173	G167-N272 WeakPolarHBondContact O-CA 3.34Å; G167-N272 PolarHBondContact O-OD1 2.89Å; P169-N272 WeakPolarHBondContact CA-OD1 3.35Å; K173-N272 WeakPolarHBondContact CE-OD1 3.37Å; K173-N272 PolarHBondContact NZ-OD1 3.42Å
273	I	92.8	Very high	90	Very high	60 Å²	60	36.7 Å²	36.7	31%	0.308	19%	0.19	S	C	.	.			trans	-131.2	61.1	-169.4	54.4	171.4	0	0	0	111.2	D230 T271 W275 T276	D230-I273 HydrophobicContact CB-CD1 4.18Å; D230-I273 HydrophobicContact CB-CG1 3.79Å; D230-I273 VanDerWaalsContact CG-CG1 3.48Å; D230-I273 VanDerWaalsContact OD2-CD1 3.32Å; D230-I273 WeakPolarHBondContact OD2-CD1 3.42Å; D230-I273 WeakPolarHBondContact OD2-CG1 3.08Å; T271-I273 PolarHBondContact OG1-N 2.9Å; T271-I273 VanDerWaalsContact OG1-N 3.11Å; I273-W275 HydrophobicContact CB-CH2 4.35Å; I273-W275 HydrophobicContact CB-CZ2 3.82Å; I273-W275 HydrophobicContact CG2-CH2 4.03Å; I273-W275 HydrophobicContact CG2-CZ2 3.54Å; I273-W275 PolarHBondContact O-N 3.24Å; I273-T276 HydrophobicContact CB-CG2 4.37Å; I273-T276 HydrophobicContact CD1-CG2 3.93Å; I273-T276 HydrophobicContact CG1-CG2 4.35Å; I273-T276 PolarHBondContact O-N 2.97Å; I273-T276 PolarHBondContact O-OG1 3.01Å
274	P	92.6	Very high	90.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-62.3	-20.2	-168.2	29.9	-40.3	0	0	0	114.6	F166 T271 T276 L277 L426 F429	F166-P274 HydrophobicContact CB-CB 4.09Å; F166-P274 HydrophobicContact CB-CG 4.19Å; F166-P274 HydrophobicContact CD2-CB 4.35Å; F166-P274 HydrophobicContact CD2-CG 3.79Å; F166-P274 HydrophobicContact CG-CB 4.35Å; F166-P274 HydrophobicContact CG-CG 4.26Å; T271-P274 HydrophobicContact CG2-CB 3.89Å; P274-T276 VanDerWaalsContact C-N 3.27Å; P274-T276 PolarHBondContact O-N 2.91Å; P274-L277 VanDerWaalsContact O-CB 3.24Å; P274-L277 WeakPolarHBondContact O-CB 3.34Å; P274-L277 PolarHBondContact O-N 3.14Å; P274-L426 HydrophobicContact CG-CD2 4Å; P274-F429 HydrophobicContact CB-CD1 3.91Å; P274-F429 HydrophobicContact CB-CD2 4.07Å; P274-F429 HydrophobicContact CB-CE1 3.64Å; P274-F429 HydrophobicContact CB-CE2 3.8Å; P274-F429 HydrophobicContact CB-CG 4.13Å; P274-F429 HydrophobicContact CB-CZ 3.6Å; P274-F429 HydrophobicContact CG-CB 4.34Å; P274-F429 HydrophobicContact CG-CD1 3.66Å; P274-F429 HydrophobicContact CG-CD2 4.04Å; P274-F429 HydrophobicContact CG-CE1 3.95Å; P274-F429 HydrophobicContact CG-CE2 4.29Å; P274-F429 HydrophobicContact CG-CG 3.73Å; P274-F429 HydrophobicContact CG-CZ 4.26Å; P274-F429 WeakPolarHBondContact O-CE2 3.5Å
275	W	90.4	Very high	91	Very high	92 Å²	92	32 Å²	32	35%	0.348	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-68.3	-21.1	176	54.1	82.1	0	0	0	114	I273 L277 K425 L426 F429	I273-W275 HydrophobicContact CB-CH2 4.35Å; I273-W275 HydrophobicContact CB-CZ2 3.82Å; I273-W275 HydrophobicContact CG2-CH2 4.03Å; I273-W275 HydrophobicContact CG2-CZ2 3.54Å; I273-W275 PolarHBondContact O-N 3.24Å; W275-L277 VanDerWaalsContact C-N 3.25Å; W275-K425 HydrophobicContact CE3-CB 3.95Å; W275-K425 HydrophobicContact CH2-CB 3.72Å; W275-K425 HydrophobicContact CH2-CD 4.02Å; W275-K425 HydrophobicContact CZ2-CB 4.28Å; W275-K425 HydrophobicContact CZ2-CD 3.88Å; W275-K425 HydrophobicContact CZ3-CB 3.53Å; W275-L426 HydrophobicContact CZ3-CD2 3.94Å; W275-L426 HydrophobicContact CZ3-CG 4.03Å; W275-F429 HydrophobicContact CB-CD2 4.22Å
276	T	90	Very high	90.9	Very high	34 Å²	34	34.8 Å²	34.8	21%	0.209	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-81.3	-8	174.6	65	0	0	0	0	112.1	G234 S235 I273 P274	G234-T276 CarbonylContact C-O 3.59Å; G234-T276 WeakPolarHBondContact CA-O 3.45Å; S235-T276 PolarHBondContact N-O 3.06Å; S235-T276 PolarHBondContact OG-O 3.02Å; I273-T276 HydrophobicContact CB-CG2 4.37Å; I273-T276 HydrophobicContact CD1-CG2 3.93Å; I273-T276 HydrophobicContact CG1-CG2 4.35Å; I273-T276 PolarHBondContact O-N 2.97Å; I273-T276 PolarHBondContact O-OG1 3.01Å; P274-T276 VanDerWaalsContact C-N 3.27Å; P274-T276 PolarHBondContact O-N 2.91Å
277	L	89.1	Confident	90.9	Very high	3 Å²	3	35 Å²	35	2%	0.016	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-73.7	130.6	-174.8	-158.5	70.1	0	0	0	111.6	L164 I229 C233 P274 W275 S279 I281 R282	L164-L277 HydrophobicContact CD2-CD2 3.91Å; I229-L277 HydrophobicContact CG2-CD1 4.12Å; C233-L277 HydrophobicContact CB-CD1 3.48Å; C233-L277 VanDerWaalsContact CB-CD1 3.48Å; P274-L277 VanDerWaalsContact O-CB 3.24Å; P274-L277 WeakPolarHBondContact O-CB 3.34Å; P274-L277 PolarHBondContact O-N 3.14Å; W275-L277 VanDerWaalsContact C-N 3.25Å; L277-S279 PolarHBondContact O-N 2.85Å; L277-I281 HydrophobicContact CD1-CG2 4.08Å; L277-I281 HydrophobicContact CD2-CG2 4.11Å; L277-I281 HydrophobicContact CG-CB 4.4Å; L277-I281 HydrophobicContact CG-CG2 4.08Å; L277-R282 HydrophobicContact CD2-CB 4.1Å
278	D	86.8	Confident	90.9	Very high	19 Å²	19	35.2 Å²	35.2	10%	0.102	17%	0.165	C	C	.	.			trans	-55.6	139.1	176.3	-175.5	-86.3	0	0	0	111.4	C233 A280 I281 R282	C233-D278 WeakPolarHBondContact O-CB 3.32Å; C233-D278 PolarHBondContact O-N 3.47Å; D278-A280 PolarHBondContact O-N 3.46Å; D278-A280 WeakPolarHBondContact OD1-CB 3.5Å; D278-A280 PolarHBondContact OD1-N 3.02Å; D278-I281 HydrophobicContact CB-CG1 4.36Å; D278-I281 PolarHBondContact O-N 3.44Å; D278-R282 WeakPolarHBondContact O-CB 3.35Å; D278-R282 PolarHBondContact O-N 3.31Å
279	S	86.8	Confident	90.8	Very high	54 Å²	54	35.6 Å²	35.6	38%	0.378	17%	0.167	S	C	.	.	H	α-helix	trans	-59.4	-32	-177.2	68.7	0	0	0	0	113.7	L277 R283	L277-S279 PolarHBondContact O-N 2.85Å; S279-R283 VanDerWaalsContact O-CG 3.26Å; S279-R283 WeakPolarHBondContact O-CG 3.33Å; S279-R283 PolarHBondContact O-N 3.39Å; S279-R283 VanDerWaalsContact O-N 3.16Å
280	A	87	Confident	90.7	Very high	34 Å²	34	38.2 Å²	38.2	28%	0.281	18%	0.177	S	C	.	.	H	α-helix	trans	-69.8	-41.8	178.4	0	0	0	0	0	111.4	L252 D278 R283 R284	L252-A280 HydrophobicContact CD1-CB 4.06Å; L252-A280 HydrophobicContact CD2-CB 4.37Å; D278-A280 PolarHBondContact O-N 3.46Å; D278-A280 WeakPolarHBondContact OD1-CB 3.5Å; D278-A280 PolarHBondContact OD1-N 3.02Å; A280-R283 PolarHBondContact O-N 3.17Å; A280-R284 WeakPolarHBondContact O-CG 3.39Å; A280-R284 PolarHBondContact O-N 3.27Å
281	I	88.1	Confident	90.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.1	-46.6	177.7	-63.3	-77.6	0	0	0	110.1	I229 C233 K248 F251 L252 L277 D278 R283 R284 F285	I229-I281 HydrophobicContact CD1-CG2 4.47Å; C233-I281 HydrophobicContact CB-CB 4.18Å; C233-I281 HydrophobicContact CB-CD1 4.38Å; C233-I281 HydrophobicContact CB-CG1 3.85Å; C233-I281 HydrophobicContact CB-CG2 3.91Å; C233-I281 VanDerWaalsContact SG-CD1 3.57Å; K248-I281 HydrophobicContact CD-CG1 4.49Å; K248-I281 HydrophobicContact CG-CD1 4.1Å; K248-I281 HydrophobicContact CG-CG1 4.2Å; F251-I281 HydrophobicContact CD1-CD1 3.73Å; F251-I281 HydrophobicContact CE1-CD1 4.19Å; L252-I281 HydrophobicContact CD1-CD1 4.22Å; L252-I281 HydrophobicContact CD2-CD1 3.46Å; L252-I281 VanDerWaalsContact CD2-CD1 3.46Å; L252-I281 HydrophobicContact CD2-CG1 4.1Å; L252-I281 HydrophobicContact CG-CD1 3.58Å; L252-I281 HydrophobicContact CG-CG1 4.4Å; L277-I281 HydrophobicContact CD1-CG2 4.08Å; L277-I281 HydrophobicContact CD2-CG2 4.11Å; L277-I281 HydrophobicContact CG-CB 4.4Å; L277-I281 HydrophobicContact CG-CG2 4.08Å; D278-I281 HydrophobicContact CB-CG1 4.36Å; D278-I281 PolarHBondContact O-N 3.44Å; I281-R283 PolarHBondContact O-N 2.94Å; I281-R284 WeakPolarHBondContact O-CA 3.31Å; I281-R284 WeakPolarHBondContact O-CB 3.5Å; I281-R284 PolarHBondContact O-N 3.47Å; I281-F285 HydrophobicContact CG2-CD2 3.98Å; I281-F285 HydrophobicContact CG2-CE2 3.65Å; I281-F285 WeakPolarHBondContact O-CD2 3.34Å; I281-F285 PolarHBondContact O-N 3.44Å
282	R	88.9	Confident	90.7	Very high	36 Å²	36	40.5 Å²	40.5	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-58.3	-32	177.9	-179.7	168	35.1	159.1	-5.7	113.5	L277 D278 R284 F285 R288	L277-R282 HydrophobicContact CD2-CB 4.1Å; D278-R282 WeakPolarHBondContact O-CB 3.35Å; D278-R282 PolarHBondContact O-N 3.31Å; R282-R284 VanDerWaalsContact C-N 3.34Å; R282-F285 PolarHBondContact O-N 3.44Å; R282-F285 VanDerWaalsContact O-O 3.09Å; R282-R288 PolarHBondContact O-NH2 3.01Å
283	R	87.5	Confident	90.7	Very high	171 Å²	171	39.7 Å²	39.7	65%	0.645	19%	0.187	S	C	*	.	H	α-helix	trans	-73.1	-21.5	173	-76	171.8	177.8	148.8	-1.3	113.9	S279 A280 I281	S279-R283 VanDerWaalsContact O-CG 3.26Å; S279-R283 WeakPolarHBondContact O-CG 3.33Å; S279-R283 PolarHBondContact O-N 3.39Å; S279-R283 VanDerWaalsContact O-N 3.16Å; A280-R283 PolarHBondContact O-N 3.17Å; I281-R283 PolarHBondContact O-N 2.94Å
284	R	90	Very high	90.7	Very high	87 Å²	87	37.4 Å²	37.4	33%	0.328	18%	0.177	S	C	.	.	H	α-helix	trans	-83	-16.8	174.5	-65.3	-69.6	180	-99.6	4.1	112.5	L252 M255 A280 I281 R282 E286	L252-R284 HydrophobicContact CD2-CG 3.71Å; M255-R284 HydrophobicContact CE-CB 3.6Å; M255-R284 HydrophobicContact SD-CB 3.74Å; M255-R284 HydrophobicContact SD-CG 4.39Å; A280-R284 WeakPolarHBondContact O-CG 3.39Å; A280-R284 PolarHBondContact O-N 3.27Å; I281-R284 WeakPolarHBondContact O-CA 3.31Å; I281-R284 WeakPolarHBondContact O-CB 3.5Å; I281-R284 PolarHBondContact O-N 3.47Å; R282-R284 VanDerWaalsContact C-N 3.34Å; R284-E286 PolarHBondContact O-N 3.38Å
285	F	91.9	Very high	90.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.211	C	C	.	.			trans	-91.6	88.2	165.8	-68.5	-72.9	0	0	0	109.7	G162 I163 L164 I229 M255 V267 I281 R282 K287 R288	G162-F285 CarbonylContact O-C 3.57Å; I163-F285 VanDerWaalsContact C-CD1 3.46Å; I163-F285 WeakPolarHBondContact O-CD1 3.32Å; L164-F285 HydrophobicContact CB-CB 3.69Å; L164-F285 HydrophobicContact CB-CD1 3.94Å; L164-F285 HydrophobicContact CB-CD2 4.46Å; L164-F285 HydrophobicContact CB-CG 3.77Å; L164-F285 HydrophobicContact CD1-CD2 4.46Å; L164-F285 HydrophobicContact CD1-CG 4.5Å; I229-F285 HydrophobicContact CD1-CE2 3.37Å; I229-F285 HydrophobicContact CD1-CZ 3.3Å; M255-F285 HydrophobicContact CE-CD1 4.49Å; M255-F285 HydrophobicContact CE-CE1 4.15Å; M255-F285 HydrophobicContact CE-CE2 4.36Å; M255-F285 HydrophobicContact CE-CZ 4.06Å; V267-F285 HydrophobicContact CG1-CE1 4.08Å; V267-F285 HydrophobicContact CG1-CZ 4.24Å; I281-F285 HydrophobicContact CG2-CD2 3.98Å; I281-F285 HydrophobicContact CG2-CE2 3.65Å; I281-F285 WeakPolarHBondContact O-CD2 3.34Å; I281-F285 PolarHBondContact O-N 3.44Å; R282-F285 PolarHBondContact O-N 3.44Å; R282-F285 VanDerWaalsContact O-O 3.09Å; F285-K287 VanDerWaalsContact C-N 3.34Å; F285-R288 PolarHBondContact O-NE 2.91Å
286	E	88.7	Confident	91	Very high	69 Å²	69	44.9 Å²	44.9	32%	0.322	22%	0.216	S	C	.	.			trans	-68.4	-33.3	-174.3	-58.2	163.8	154.4	0	0	111.9	W160 R161 G162 R284 G437	W160-E286 WeakPolarHBondContact CA-OE2 3.44Å; W160-E286 HydrophobicContact CD2-CB 4.33Å; W160-E286 HydrophobicContact CE3-CB 3.32Å; W160-E286 HydrophobicContact CE3-CG 4.2Å; W160-E286 HydrophobicContact CZ3-CB 3.64Å; W160-E286 HydrophobicContact CZ3-CG 4.49Å; R161-E286 PolarHBondContact N-OE2 2.97Å; G162-E286 PolarHBondContact O-N 2.77Å; G162-E286 VanDerWaalsContact O-N 3.07Å; R284-E286 PolarHBondContact O-N 3.38Å; E286-G437 WeakPolarHBondContact O-CA 3.36Å; E286-G437 PolarHBondContact O-N 3.1Å
287	K	91.1	Very high	91.1	Very high	23 Å²	23	50.6 Å²	50.6	10%	0.1	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.5	172.8	-167	69.4	173.1	-177.8	0	110	W160 G162 I163 L164 F285 I289 E436	W160-K287 HydrophobicContact CD2-CB 4.43Å; W160-K287 HydrophobicContact CG-CB 4.25Å; G162-K287 PolarHBondContact O-N 3.17Å; I163-K287 CarbonylContact C-O 3.51Å; I163-K287 WeakPolarHBondContact CA-O 3.3Å; I163-K287 HydrophobicContact CG1-CB 4.2Å; I163-K287 HydrophobicContact CG2-CB 4.36Å; L164-K287 PolarHBondContact N-O 3.4Å; F285-K287 VanDerWaalsContact C-N 3.34Å; K287-I289 HydrophobicContact CG-CG1 4.25Å; K287-E436 IonicContact NZ-OE1 3.74Å; K287-E436 PolarHBondContact NZ-OE1 2.99Å
288	R	93.2	Very high	91.3	Very high	10 Å²	10	50.8 Å²	50.8	4%	0.038	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	114.7	-178.5	-57.7	176.5	-168.4	131.2	15	109.1	L164 F166 R282 F285 F433 Q435 G437	L164-R288 HydrophobicContact CB-CG 4.4Å; L164-R288 CarbonylContact O-C 3.43Å; L164-R288 WeakPolarHBondContact O-CA 3.38Å; F166-R288 HydrophobicContact CD1-CB 4.32Å; F166-R288 HydrophobicContact CE1-CB 3.94Å; R282-R288 PolarHBondContact O-NH2 3.01Å; F285-R288 PolarHBondContact O-NE 2.91Å; R288-F433 PolarHBondContact NH1-O 3.24Å; R288-Q435 PolarHBondContact N-O 2.89Å; R288-Q435 CarbonylContact O-C 3.57Å; R288-Q435 VanDerWaalsContact O-CA 3.31Å; R288-Q435 WeakPolarHBondContact O-CA 3.25Å; R288-G437 VanDerWaalsContact CZ-OXT 3.25Å; R288-G437 PolarHBondContact NH1-OXT 3.04Å; R288-G437 VanDerWaalsContact NH1-OXT 3.1Å; R288-G437 PolarHBondContact NH2-OXT 3.43Å
289	I	93.6	Very high	91.7	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.036	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	117.1	-174.7	-55.2	177.8	0	0	0	108.4	A135 A138 L139 I163 L164 L165 F166 K287 I291	A135-I289 HydrophobicContact CB-CG2 3.72Å; A138-I289 HydrophobicContact CB-CD1 3.84Å; A138-I289 HydrophobicContact CB-CG1 4.26Å; A138-I289 HydrophobicContact CB-CG2 4.49Å; L139-I289 HydrophobicContact CD2-CD1 3.75Å; L139-I289 HydrophobicContact CG-CD1 3.71Å; I163-I289 HydrophobicContact CG2-CD1 3.69Å; I163-I289 HydrophobicContact CG2-CG1 4.01Å; L164-I289 PolarHBondContact O-N 2.97Å; L165-I289 HydrophobicContact CD2-CB 3.96Å; L165-I289 HydrophobicContact CD2-CD1 4.29Å; L165-I289 HydrophobicContact CD2-CG2 4.49Å; F166-I289 WeakPolarHBondContact CD1-O 3.49Å; F166-I289 PolarHBondContact N-O 3.33Å; K287-I289 HydrophobicContact CG-CG1 4.25Å; I289-I291 HydrophobicContact CG2-CD1 3.9Å
290	Y	93.6	Very high	92.1	Very high	55 Å²	55	48.7 Å²	48.7	22%	0.216	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	127.7	173.5	179.2	-120.3	0	0	0	110	F166 P292 L426	F166-Y290 AromaticContact CD2-CD2 3.88Å; F166-Y290 HydrophobicContact CD2-CD2 3.88Å; F166-Y290 AromaticContact CE2-CD2 3.52Å; F166-Y290 HydrophobicContact CE2-CD2 3.52Å; F166-Y290 HydrophobicContact CE2-CE2 4.4Å; F166-Y290 HydrophobicContact CE2-CG 4.19Å; F166-Y290 HydrophobicContact CZ-CD2 4.05Å; F166-Y290 HydrophobicContact CZ-CG 4.28Å; F166-Y290 CarbonylContact O-C 3.59Å; F166-Y290 WeakPolarHBondContact O-CA 3.37Å; Y290-P292 HydrophobicContact CD1-CB 4.28Å; Y290-P292 HydrophobicContact CE1-CB 3.7Å; Y290-P292 WeakPolarHBondContact O-CD 3.33Å; Y290-L426 HydrophobicContact CE2-CB 4.19Å; Y290-L426 HydrophobicContact CE2-CD1 4.33Å
291	I	94.6	Very high	92.4	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.23	C	C	.	.			trans	-105.9	101.5	175.7	-53.1	-53.6	0	0	0	107.7	L132 A135 L165 F166 P168 K173 L176 I289	L132-I291 HydrophobicContact CD1-CG2 3.94Å; L132-I291 HydrophobicContact CD2-CG2 3.83Å; A135-I291 HydrophobicContact CB-CD1 3.57Å; L165-I291 HydrophobicContact CB-CG1 4.39Å; L165-I291 HydrophobicContact CD2-CD1 4.47Å; F166-I291 PolarHBondContact O-N 3.11Å; P168-I291 WeakPolarHBondContact CD-O 3.36Å; K173-I291 HydrophobicContact CG-CB 4.2Å; K173-I291 HydrophobicContact CG-CG1 3.95Å; K173-I291 HydrophobicContact CG-CG2 4.39Å; L176-I291 HydrophobicContact CD2-CD1 3.62Å; I289-I291 HydrophobicContact CG2-CD1 3.9Å
292	P	93.3	Very high	92.7	Very high	49 Å²	49	52.3 Å²	52.3	32%	0.318	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-73.5	172.3	-178.1	30.8	-36.9	0	0	0	112.6	L132 T171 Y290	L132-P292 HydrophobicContact CD2-CG 4.04Å; T171-P292 WeakPolarHBondContact CG2-O 3.4Å; Y290-P292 HydrophobicContact CD1-CB 4.28Å; Y290-P292 HydrophobicContact CE1-CB 3.7Å; Y290-P292 WeakPolarHBondContact O-CD 3.33Å
293	L	94.6	Very high	93	Very high	30 Å²	30	50.6 Å²	50.6	16%	0.157	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-62.7	148.2	161.7	-71	174.1	0	0	0	110.2	P168 T171 V418 L423	P168-L293 HydrophobicContact CB-CD2 4.22Å; P168-L293 HydrophobicContact CG-CD2 3.97Å; P168-L293 HydrophobicContact CG-CG 3.91Å; T171-L293 HydrophobicContact CG2-CD2 4.03Å; L293-V418 HydrophobicContact CD1-CB 4.5Å; L293-V418 HydrophobicContact CD1-CG1 4.34Å; L293-V418 HydrophobicContact CD2-CB 4.44Å; L293-V418 HydrophobicContact CD2-CG2 4.15Å; L293-L423 HydrophobicContact CD1-CD1 4.08Å; L293-L423 HydrophobicContact CD1-CD2 4.04Å; L293-L423 HydrophobicContact CG-CD2 4.43Å
294	P	94	Very high	93.3	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.078	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-67.1	138.3	-178.7	27.7	-34.9	0	0	0	112.2	A298 R299 M302 Y329	P294-A298 HydrophobicContact CB-CB 3.99Å; P294-R299 HydrophobicContact CB-CG 3.82Å; P294-R299 HydrophobicContact CG-CG 3.68Å; P294-R299 PolarHBondContact O-NH1 3.48Å; P294-M302 HydrophobicContact CB-CE 3.74Å; P294-M302 HydrophobicContact CB-SD 4.11Å; P294-M302 HydrophobicContact CG-CE 4.2Å; P294-M302 HydrophobicContact CG-SD 4.15Å; P294-Y329 WeakPolarHBondContact CD-O 3.49Å; P294-Y329 WeakPolarHBondContact CG-O 3.46Å
295	E	92.9	Very high	93.4	Very high	155 Å²	155	46 Å²	46	72%	0.724	22%	0.221	S	C	*	.	P	Polyproline II helix	trans	-70.1	165.6	171.9	-63.6	-178.7	-174.1	0	0	112.1	H297 A298 R299	E295-H297 PolarHBondContact O-N 2.97Å; E295-A298 WeakPolarHBondContact O-CA 3.15Å; E295-A298 WeakPolarHBondContact O-CB 3.3Å; E295-A298 PolarHBondContact O-N 2.7Å; E295-R299 WeakPolarHBondContact O-CG 3.33Å; E295-R299 PolarHBondContact O-N 2.93Å
296	E	94.6	Very high	93.4	Very high	95 Å²	95	48.9 Å²	48.9	44%	0.444	24%	0.236	S	C	.	.	H	α-helix	trans	-48.3	-51.8	-177.3	-177.4	175	160.7	0	0	113.2	A298 R299 S300	E296-A298 VanDerWaalsContact C-N 3.35Å; E296-A298 PolarHBondContact O-N 3.08Å; E296-R299 PolarHBondContact O-N 2.66Å; E296-S300 PolarHBondContact O-N 3.4Å; E296-S300 PolarHBondContact O-OG 3.32Å
297	H	92.8	Very high	93.6	Very high	154 Å²	154	45.7 Å²	45.7	71%	0.713	22%	0.221	S	C	*	.	H	α-helix	trans	-62.9	-40.4	179.6	-179.5	-85.4	0	0	0	112.3	E295 R299 S300 F301	E295-H297 PolarHBondContact O-N 2.97Å; H297-R299 VanDerWaalsContact C-N 3.34Å; H297-R299 PolarHBondContact O-N 2.76Å; H297-S300 PolarHBondContact O-N 3Å; H297-F301 PolarHBondContact O-N 3.19Å
298	A	93.8	Very high	93.6	Very high	7 Å²	7	47.1 Å²	47.1	6%	0.058	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-40.5	176.7	0	0	0	0	0	111.1	P294 E295 E296 F301 M302	P294-A298 HydrophobicContact CB-CB 3.99Å; E295-A298 WeakPolarHBondContact O-CA 3.15Å; E295-A298 WeakPolarHBondContact O-CB 3.3Å; E295-A298 PolarHBondContact O-N 2.7Å; E296-A298 VanDerWaalsContact C-N 3.35Å; E296-A298 PolarHBondContact O-N 3.08Å; A298-F301 PolarHBondContact O-N 2.86Å; A298-M302 VanDerWaalsContact O-CG 3.24Å; A298-M302 WeakPolarHBondContact O-CG 3.41Å; A298-M302 PolarHBondContact O-N 3.11Å
299	R	95.6	Very high	93.4	Very high	12 Å²	12	52.7 Å²	52.7	5%	0.045	28%	0.283	C	S	.	.	H	α-helix	trans	-64	-43.6	176	-64.4	-171.8	-57.7	-112.1	11.2	112.1	P294 E295 E296 H297 F301 M302 F303 G323 T326 D327 I334	P294-R299 HydrophobicContact CB-CG 3.82Å; P294-R299 HydrophobicContact CG-CG 3.68Å; P294-R299 PolarHBondContact O-NH1 3.48Å; E295-R299 WeakPolarHBondContact O-CG 3.33Å; E295-R299 PolarHBondContact O-N 2.93Å; E296-R299 PolarHBondContact O-N 2.66Å; H297-R299 VanDerWaalsContact C-N 3.34Å; H297-R299 PolarHBondContact O-N 2.76Å; R299-F301 VanDerWaalsContact C-N 3.32Å; R299-F301 PolarHBondContact O-N 3.28Å; R299-M302 PolarHBondContact O-N 3.24Å; R299-F303 VanDerWaalsContact O-CD2 3.23Å; R299-F303 WeakPolarHBondContact O-CD2 3.41Å; R299-F303 PolarHBondContact O-N 3.19Å; R299-G323 PolarHBondContact NE-O 2.93Å; R299-G323 PolarHBondContact NH2-O 3.48Å; R299-T326 WeakPolarHBondContact CD-O 3.31Å; R299-T326 WeakPolarHBondContact CD-OG1 3.33Å; R299-T326 PolarHBondContact NE-O 3.35Å; R299-T326 VanDerWaalsContact NE-O 3.08Å; R299-T326 PolarHBondContact NE-OG1 3.13Å; R299-D327 IonicContact CZ-OD1 3.97Å; R299-D327 IonicContact NH1-OD1 3.31Å; R299-D327 PolarHBondContact NH1-OD1 3.15Å; R299-D327 IonicContact NH2-OD1 2.6Å; R299-I334 HydrophobicContact CB-CD1 3.7Å; R299-I334 HydrophobicContact CG-CD1 3.66Å
300	S	95.2	Very high	93.4	Very high	17 Å²	17	54.9 Å²	54.9	12%	0.119	30%	0.297	C	S	.	.	H	α-helix	trans	-57.1	-45.6	173.9	-67.7	0	0	0	0	111.9	E296 H297 F303 K304 F319 A320 G323	E296-S300 PolarHBondContact O-N 3.4Å; E296-S300 PolarHBondContact O-OG 3.32Å; H297-S300 PolarHBondContact O-N 3Å; S300-F303 PolarHBondContact O-N 2.9Å; S300-K304 PolarHBondContact O-N 3.31Å; S300-F319 VanDerWaalsContact CB-O 3.31Å; S300-F319 WeakPolarHBondContact CB-O 3.36Å; S300-F319 PolarHBondContact OG-O 3.48Å; S300-A320 WeakPolarHBondContact OG-CA 3.31Å; S300-G323 WeakPolarHBondContact OG-CA 3.42Å
301	F	93.1	Very high	93.2	Very high	81 Å²	81	56.3 Å²	56.3	36%	0.355	31%	0.312	S	S	.	.	H	α-helix	trans	-65.6	-40.9	176.7	-176.7	-95.5	0	0	0	112.4	A130 H297 A298 R299 F303 K304 L305	A130-F301 HydrophobicContact CB-CD1 3.55Å; A130-F301 HydrophobicContact CB-CE1 4.16Å; H297-F301 PolarHBondContact O-N 3.19Å; A298-F301 PolarHBondContact O-N 2.86Å; R299-F301 VanDerWaalsContact C-N 3.32Å; R299-F301 PolarHBondContact O-N 3.28Å; F301-F303 VanDerWaalsContact C-N 3.3Å; F301-F303 PolarHBondContact O-N 3.4Å; F301-K304 PolarHBondContact O-N 3.1Å; F301-K304 VanDerWaalsContact O-N 3.15Å; F301-L305 HydrophobicContact CE1-CB 4.41Å; F301-L305 HydrophobicContact CE1-CD2 4.33Å; F301-L305 WeakPolarHBondContact O-CB 3.36Å; F301-L305 PolarHBondContact O-N 2.99Å
302	M	94	Very high	93.2	Very high	28 Å²	28	59 Å²	59	14%	0.138	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-37.5	176.2	-73.6	176	-176.3	0	0	112.5	A130 P294 A298 R299 L305 N306 I334	A130-M302 HydrophobicContact CB-CE 3.79Å; A130-M302 HydrophobicContact CB-CG 3.63Å; P294-M302 HydrophobicContact CB-CE 3.74Å; P294-M302 HydrophobicContact CB-SD 4.11Å; P294-M302 HydrophobicContact CG-CE 4.2Å; P294-M302 HydrophobicContact CG-SD 4.15Å; A298-M302 VanDerWaalsContact O-CG 3.24Å; A298-M302 WeakPolarHBondContact O-CG 3.41Å; A298-M302 PolarHBondContact O-N 3.11Å; R299-M302 PolarHBondContact O-N 3.24Å; M302-L305 PolarHBondContact O-N 3.19Å; M302-N306 VanDerWaalsContact O-CB 3.28Å; M302-N306 WeakPolarHBondContact O-CB 3.39Å; M302-N306 VanDerWaalsContact O-CG 3.26Å; M302-N306 PolarHBondContact O-N 3.48Å; M302-N306 PolarHBondContact O-ND2 2.64Å; M302-I334 HydrophobicContact CB-CD1 4.3Å; M302-I334 HydrophobicContact CB-CG2 4.08Å; M302-I334 HydrophobicContact SD-CD1 4.09Å
303	F	95.8	Very high	93.2	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61	-46.8	173.8	-86.3	-69	0	0	0	111.9	R299 S300 F301 L307 F319 L322 T326 I334 I337 V338 M407	R299-F303 VanDerWaalsContact O-CD2 3.23Å; R299-F303 WeakPolarHBondContact O-CD2 3.41Å; R299-F303 PolarHBondContact O-N 3.19Å; S300-F303 PolarHBondContact O-N 2.9Å; F301-F303 VanDerWaalsContact C-N 3.3Å; F301-F303 PolarHBondContact O-N 3.4Å; F303-L307 WeakPolarHBondContact O-CB 3.46Å; F303-L307 PolarHBondContact O-N 2.88Å; F303-L307 VanDerWaalsContact O-N 3.11Å; F303-F319 HydrophobicContact CB-CD1 3.84Å; F303-F319 HydrophobicContact CB-CE1 4.3Å; F303-L322 HydrophobicContact CD1-CD1 4.13Å; F303-L322 HydrophobicContact CD2-CB 3.72Å; F303-L322 HydrophobicContact CD2-CD1 4.48Å; F303-L322 HydrophobicContact CE1-CD1 4.43Å; F303-L322 HydrophobicContact CE2-CB 3.71Å; F303-L322 HydrophobicContact CG-CB 4.23Å; F303-L322 HydrophobicContact CG-CD1 4.16Å; F303-L322 HydrophobicContact CZ-CB 4.2Å; F303-T326 HydrophobicContact CE2-CG2 3.69Å; F303-T326 HydrophobicContact CZ-CG2 3.68Å; F303-I334 HydrophobicContact CD1-CG2 3.85Å; F303-I334 HydrophobicContact CD2-CG2 4.08Å; F303-I334 HydrophobicContact CE1-CG2 3.88Å; F303-I334 HydrophobicContact CE2-CD1 4.42Å; F303-I334 HydrophobicContact CE2-CG1 4.24Å; F303-I334 HydrophobicContact CE2-CG2 4.1Å; F303-I334 HydrophobicContact CG-CG2 3.96Å; F303-I334 HydrophobicContact CZ-CG1 4.3Å; F303-I334 HydrophobicContact CZ-CG2 4.01Å; F303-I337 HydrophobicContact CE1-CB 4.39Å; F303-I337 HydrophobicContact CE1-CG2 3.92Å; F303-I337 HydrophobicContact CZ-CG2 4.4Å; F303-V338 HydrophobicContact CD1-CG2 3.49Å; F303-V338 VanDerWaalsContact CD1-CG2 3.49Å; F303-V338 HydrophobicContact CE1-CG2 3.92Å; F303-M407 HydrophobicContact CD1-CE 3.33Å; F303-M407 HydrophobicContact CE1-CE 3.6Å; F303-M407 HydrophobicContact CG-CE 4.38Å
304	K	93.4	Very high	93.3	Very high	91 Å²	91	59.2 Å²	59.2	40%	0.396	33%	0.33	S	S	.	.	H	α-helix	trans	-64.2	-44.4	178.3	-174.2	173.3	179.1	173.1	0	111.7	S300 F301 L307 G308 E316 F319	S300-K304 PolarHBondContact O-N 3.31Å; F301-K304 PolarHBondContact O-N 3.1Å; F301-K304 VanDerWaalsContact O-N 3.15Å; K304-L307 PolarHBondContact O-N 3.11Å; K304-G308 PolarHBondContact O-N 3.31Å; K304-E316 IonicContact NZ-OE1 2.7Å; K304-E316 PolarHBondContact NZ-OE1 3.42Å; K304-E316 IonicContact NZ-OE2 3Å; K304-F319 HydrophobicContact CB-CD1 4.19Å; K304-F319 HydrophobicContact CB-CD2 4.48Å; K304-F319 HydrophobicContact CB-CE1 4.14Å; K304-F319 HydrophobicContact CB-CE2 4.45Å; K304-F319 HydrophobicContact CB-CG 4.37Å; K304-F319 HydrophobicContact CB-CZ 4.28Å; K304-F319 HydrophobicContact CG-CE2 4.31Å; K304-F319 HydrophobicContact CG-CZ 4.36Å
305	L	91.3	Very high	93.4	Very high	72 Å²	72	61.8 Å²	61.8	38%	0.377	35%	0.346	S	S	.	.	H	α-helix	trans	-60.7	-49.6	178.1	-177	68.1	0	0	0	111.7	F301 M302 L307 G308	F301-L305 HydrophobicContact CE1-CB 4.41Å; F301-L305 HydrophobicContact CE1-CD2 4.33Å; F301-L305 WeakPolarHBondContact O-CB 3.36Å; F301-L305 PolarHBondContact O-N 2.99Å; M302-L305 PolarHBondContact O-N 3.19Å; L305-L307 VanDerWaalsContact C-N 3.29Å; L305-L307 PolarHBondContact O-N 3.47Å; L305-G308 PolarHBondContact O-N 3.44Å; L305-G308 VanDerWaalsContact O-N 3.14Å
306	N	92.4	Very high	93.5	Very high	59 Å²	59	60.2 Å²	60.2	32%	0.316	34%	0.339	S	S	.	.	H	α-helix	trans	-70.2	-25	-177.4	-73.7	-21.5	0	0	0	113.2	M302 G308 S335 V338	M302-N306 VanDerWaalsContact O-CB 3.28Å; M302-N306 WeakPolarHBondContact O-CB 3.39Å; M302-N306 VanDerWaalsContact O-CG 3.26Å; M302-N306 PolarHBondContact O-N 3.48Å; M302-N306 PolarHBondContact O-ND2 2.64Å; N306-G308 VanDerWaalsContact C-N 3.32Å; N306-S335 WeakPolarHBondContact ND2-CA 3.35Å; N306-V338 HydrophobicContact CB-CB 4Å; N306-V338 HydrophobicContact CB-CG1 3.85Å; N306-V338 HydrophobicContact CB-CG2 3.92Å
307	L	93.6	Very high	93.6	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-73.7	-29.8	173.7	-165.1	68.3	0	0	0	111.5	F303 K304 L305 T310 N312 L314 F319 V338 L342 V402	F303-L307 WeakPolarHBondContact O-CB 3.46Å; F303-L307 PolarHBondContact O-N 2.88Å; F303-L307 VanDerWaalsContact O-N 3.11Å; K304-L307 PolarHBondContact O-N 3.11Å; L305-L307 VanDerWaalsContact C-N 3.29Å; L305-L307 PolarHBondContact O-N 3.47Å; L307-T310 VanDerWaalsContact O-CB 3.3Å; L307-T310 WeakPolarHBondContact O-CB 3.4Å; L307-T310 PolarHBondContact O-N 2.94Å; L307-T310 PolarHBondContact O-OG1 2.92Å; L307-N312 HydrophobicContact CD2-CB 3.78Å; L307-N312 VanDerWaalsContact CD2-ND2 3.33Å; L307-N312 WeakPolarHBondContact CD2-ND2 3.47Å; L307-N312 HydrophobicContact CG-CB 4.46Å; L307-L314 HydrophobicContact CD2-CD1 3.74Å; L307-F319 HydrophobicContact CD2-CE1 4.08Å; L307-F319 HydrophobicContact CD2-CZ 3.84Å; L307-V338 HydrophobicContact CB-CG1 4.49Å; L307-V338 HydrophobicContact CD1-CG1 4.35Å; L307-L342 HydrophobicContact CD1-CD2 3.93Å; L307-L342 HydrophobicContact CD1-CG 4.47Å; L307-V402 HydrophobicContact CD1-CG1 4.33Å
308	G	90.8	Very high	93.8	Very high	53 Å²	53	54.2 Å²	54.2	55%	0.546	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	-137.9	175.3	0	0	0	0	0	112.4	K304 L305 N306 T310	K304-G308 PolarHBondContact O-N 3.31Å; L305-G308 PolarHBondContact O-N 3.44Å; L305-G308 VanDerWaalsContact O-N 3.14Å; N306-G308 VanDerWaalsContact C-N 3.32Å; G308-T310 VanDerWaalsContact C-N 3.27Å; G308-T310 PolarHBondContact O-N 3.01Å
309	S	89.7	Confident	93.9	Very high	126 Å²	126	54.4 Å²	54.4	88%	0.881	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	10.8	177.4	62.4	0	0	0	0	113.6
310	T	92.2	Very high	94	Very high	54 Å²	54	56.1 Å²	56.1	33%	0.331	34%	0.338	S	S	.	.			trans	-66.2	128.5	-178.2	-50.1	0	0	0	0	109.7	L307 G308 N312 L342	L307-T310 VanDerWaalsContact O-CB 3.3Å; L307-T310 WeakPolarHBondContact O-CB 3.4Å; L307-T310 PolarHBondContact O-N 2.94Å; L307-T310 PolarHBondContact O-OG1 2.92Å; G308-T310 VanDerWaalsContact C-N 3.27Å; G308-T310 PolarHBondContact O-N 3.01Å; T310-N312 PolarHBondContact O-N 2.6Å; T310-N312 PolarHBondContact O-ND2 2.85Å; T310-L342 HydrophobicContact CG2-CD2 3.62Å
311	P	89	Confident	94.1	Very high	84 Å²	84	57.1 Å²	57.1	55%	0.545	35%	0.347	S	S	.	.			trans	-54.1	123.7	175.8	-27.1	35.5	0	0	0	111.7	V401 V402	P311-V401 HydrophobicContact CB-CG1 4.02Å; P311-V402 PolarHBondContact O-N 3.16Å
312	N	94.7	Very high	94.3	Very high	56 Å²	56	53.2 Å²	53.2	30%	0.299	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-147.6	164	-176.5	70.8	88.1	0	0	0	110.4	L307 T310 L314 V402	L307-N312 HydrophobicContact CD2-CB 3.78Å; L307-N312 VanDerWaalsContact CD2-ND2 3.33Å; L307-N312 WeakPolarHBondContact CD2-ND2 3.47Å; L307-N312 HydrophobicContact CG-CB 4.46Å; T310-N312 PolarHBondContact O-N 2.6Å; T310-N312 PolarHBondContact O-ND2 2.85Å; N312-L314 WeakPolarHBondContact OD1-CB 3.33Å; N312-L314 PolarHBondContact OD1-N 3.23Å; N312-V402 WeakPolarHBondContact CA-O 3.39Å; N312-V402 HydrophobicContact CB-CB 4.2Å
313	S	95	Very high	94.4	Very high	66 Å²	66	51.9 Å²	51.9	46%	0.462	32%	0.323	S	S	.	.			trans	-106.9	15.6	179	52.1	0	0	0	0	112.9	V402 S403	S313-V402 PolarHBondContact N-O 2.97Å; S313-V402 PolarHBondContact OG-O 3.19Å; S313-V402 VanDerWaalsContact OG-O 3.1Å; S313-S403 WeakPolarHBondContact OG-CA 3.39Å; S313-S403 WeakPolarHBondContact OG-CB 3.28Å
314	L	95.5	Very high	94.4	Very high	18 Å²	18	59 Å²	59	9%	0.094	35%	0.354	C	S	.	.			trans	-82	137.9	-176.4	-58.2	177	0	0	0	110.9	L307 N312 D318 F319 M404 M407	L307-L314 HydrophobicContact CD2-CD1 3.74Å; N312-L314 WeakPolarHBondContact OD1-CB 3.33Å; N312-L314 PolarHBondContact OD1-N 3.23Å; L314-D318 HydrophobicContact CB-CB 4.34Å; L314-D318 HydrophobicContact CD2-CB 4.17Å; L314-F319 HydrophobicContact CB-CE1 4.26Å; L314-F319 HydrophobicContact CB-CE2 3.98Å; L314-F319 HydrophobicContact CB-CZ 3.72Å; L314-F319 HydrophobicContact CD1-CE1 3.73Å; L314-F319 HydrophobicContact CD1-CZ 3.91Å; L314-F319 HydrophobicContact CG-CZ 4.47Å; L314-M404 VanDerWaalsContact CD2-CA 3.48Å; L314-M404 HydrophobicContact CD2-CB 3.67Å; L314-M404 HydrophobicContact CD2-CG 4.49Å; L314-M404 VanDerWaalsContact CD2-N 3.31Å; L314-M404 HydrophobicContact CD2-SD 4.21Å; L314-M407 HydrophobicContact CD1-CE 4.42Å; L314-M407 HydrophobicContact CD1-CG 3.91Å; L314-M407 HydrophobicContact CD1-SD 4.38Å; L314-M407 HydrophobicContact CD2-CG 4.28Å
315	T	96.1	Very high	94.6	Very high	66 Å²	66	60.6 Å²	60.6	41%	0.405	36%	0.361	S	S	.	.			trans	-98	166.2	174.9	64.1	0	0	0	0	111.4	S317 D318 F319	T315-S317 PolarHBondContact O-N 3.29Å; T315-S317 PolarHBondContact OG1-OG 2.81Å; T315-D318 WeakPolarHBondContact CB-OD2 3.37Å; T315-D318 PolarHBondContact N-OD2 3.22Å; T315-D318 WeakPolarHBondContact O-CB 3.41Å; T315-D318 PolarHBondContact O-N 2.66Å; T315-D318 VanDerWaalsContact OG1-CG 3.22Å; T315-D318 PolarHBondContact OG1-N 3.38Å; T315-D318 PolarHBondContact OG1-OD2 2.97Å; T315-F319 WeakPolarHBondContact O-CD2 3.49Å; T315-F319 PolarHBondContact O-N 3.41Å
316	E	94.6	Very high	94.8	Very high	123 Å²	123	57.1 Å²	57.1	58%	0.575	34%	0.343	S	S	*	.	H	α-helix	trans	-56.8	-35.6	172.9	-65.1	-60.3	151.5	0	0	112.4	K304 D318 F319 A320	K304-E316 IonicContact NZ-OE1 2.7Å; K304-E316 PolarHBondContact NZ-OE1 3.42Å; K304-E316 IonicContact NZ-OE2 3Å; E316-D318 VanDerWaalsContact C-N 3.31Å; E316-D318 PolarHBondContact O-N 3.03Å; E316-F319 PolarHBondContact O-N 2.95Å; E316-A320 PolarHBondContact O-N 3.42Å
317	S	96.3	Very high	95	Very high	83 Å²	83	60.1 Å²	60.1	58%	0.58	36%	0.359	S	S	*	.	H	α-helix	trans	-65.7	-32	173.9	41.8	0	0	0	0	113.3	T315 A320 A321	T315-S317 PolarHBondContact O-N 3.29Å; T315-S317 PolarHBondContact OG1-OG 2.81Å; S317-A320 PolarHBondContact O-N 2.7Å; S317-A321 WeakPolarHBondContact O-CB 3.46Å; S317-A321 PolarHBondContact O-N 2.95Å
318	D	97	Very high	95	Very high	39 Å²	39	61.1 Å²	61.1	21%	0.209	37%	0.37	C	S	.	.	H	α-helix	trans	-69.1	-41.7	175.8	-63.2	-50.9	0	0	0	110.8	L314 T315 E316 A320 A321 L322 M404	L314-D318 HydrophobicContact CB-CB 4.34Å; L314-D318 HydrophobicContact CD2-CB 4.17Å; T315-D318 WeakPolarHBondContact CB-OD2 3.37Å; T315-D318 PolarHBondContact N-OD2 3.22Å; T315-D318 WeakPolarHBondContact O-CB 3.41Å; T315-D318 PolarHBondContact O-N 2.66Å; T315-D318 VanDerWaalsContact OG1-CG 3.22Å; T315-D318 PolarHBondContact OG1-N 3.38Å; T315-D318 PolarHBondContact OG1-OD2 2.97Å; E316-D318 VanDerWaalsContact C-N 3.31Å; E316-D318 PolarHBondContact O-N 3.03Å; D318-A320 VanDerWaalsContact C-N 3.35Å; D318-A320 PolarHBondContact O-N 2.92Å; D318-A321 PolarHBondContact O-N 3.18Å; D318-L322 WeakPolarHBondContact O-CB 3.16Å; D318-L322 WeakPolarHBondContact O-CG 3.44Å; D318-L322 PolarHBondContact O-N 3.42Å; D318-M404 HydrophobicContact CB-SD 4.18Å
319	F	97.1	Very high	95.2	Very high	12 Å²	12	59.7 Å²	59.7	5%	0.053	35%	0.348	C	S	.	.	H	α-helix	trans	-63.4	-39.8	175.2	-66.4	-61.7	0	0	0	112.2	S300 F303 K304 L307 L314 T315 E316 L322 G323	S300-F319 VanDerWaalsContact CB-O 3.31Å; S300-F319 WeakPolarHBondContact CB-O 3.36Å; S300-F319 PolarHBondContact OG-O 3.48Å; F303-F319 HydrophobicContact CB-CD1 3.84Å; F303-F319 HydrophobicContact CB-CE1 4.3Å; K304-F319 HydrophobicContact CB-CD1 4.19Å; K304-F319 HydrophobicContact CB-CD2 4.48Å; K304-F319 HydrophobicContact CB-CE1 4.14Å; K304-F319 HydrophobicContact CB-CE2 4.45Å; K304-F319 HydrophobicContact CB-CG 4.37Å; K304-F319 HydrophobicContact CB-CZ 4.28Å; K304-F319 HydrophobicContact CG-CE2 4.31Å; K304-F319 HydrophobicContact CG-CZ 4.36Å; L307-F319 HydrophobicContact CD2-CE1 4.08Å; L307-F319 HydrophobicContact CD2-CZ 3.84Å; L314-F319 HydrophobicContact CB-CE1 4.26Å; L314-F319 HydrophobicContact CB-CE2 3.98Å; L314-F319 HydrophobicContact CB-CZ 3.72Å; L314-F319 HydrophobicContact CD1-CE1 3.73Å; L314-F319 HydrophobicContact CD1-CZ 3.91Å; L314-F319 HydrophobicContact CG-CZ 4.47Å; T315-F319 WeakPolarHBondContact O-CD2 3.49Å; T315-F319 PolarHBondContact O-N 3.41Å; E316-F319 PolarHBondContact O-N 2.95Å; F319-L322 HydrophobicContact CD1-CD1 4.47Å; F319-L322 PolarHBondContact O-N 3.09Å; F319-G323 PolarHBondContact O-N 3.37Å
320	A	96.8	Very high	95.5	Very high	48 Å²	48	53.8 Å²	53.8	40%	0.397	31%	0.307	S	S	.	.	H	α-helix	trans	-60.9	-46.9	172	0	0	0	0	0	111.4	S300 E316 S317 D318 L322 G323 K324	S300-A320 WeakPolarHBondContact OG-CA 3.31Å; E316-A320 PolarHBondContact O-N 3.42Å; S317-A320 PolarHBondContact O-N 2.7Å; D318-A320 VanDerWaalsContact C-N 3.35Å; D318-A320 PolarHBondContact O-N 2.92Å; A320-L322 VanDerWaalsContact C-N 3.33Å; A320-L322 PolarHBondContact O-N 3.34Å; A320-G323 PolarHBondContact O-N 3.18Å; A320-K324 PolarHBondContact O-N 3.11Å; A320-K324 VanDerWaalsContact O-N 3.07Å
321	A	97.3	Very high	95.6	Very high	37 Å²	37	52 Å²	52	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-37.4	178	0	0	0	0	0	112.9	S317 D318 K325 M404	S317-A321 WeakPolarHBondContact O-CB 3.46Å; S317-A321 PolarHBondContact O-N 2.95Å; D318-A321 PolarHBondContact O-N 3.18Å; A321-K325 WeakPolarHBondContact O-CG 3.16Å; A321-K325 PolarHBondContact O-N 3.43Å; A321-K325 VanDerWaalsContact O-N 3.14Å; A321-M404 HydrophobicContact CB-CE 4.39Å
322	L	97.2	Very high	95.8	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-46.6	174.5	-73.7	170.8	0	0	0	111.4	F303 D318 F319 A320 K324 K325 T326 M404 M407	F303-L322 HydrophobicContact CD1-CD1 4.13Å; F303-L322 HydrophobicContact CD2-CB 3.72Å; F303-L322 HydrophobicContact CD2-CD1 4.48Å; F303-L322 HydrophobicContact CE1-CD1 4.43Å; F303-L322 HydrophobicContact CE2-CB 3.71Å; F303-L322 HydrophobicContact CG-CB 4.23Å; F303-L322 HydrophobicContact CG-CD1 4.16Å; F303-L322 HydrophobicContact CZ-CB 4.2Å; D318-L322 WeakPolarHBondContact O-CB 3.16Å; D318-L322 WeakPolarHBondContact O-CG 3.44Å; D318-L322 PolarHBondContact O-N 3.42Å; F319-L322 HydrophobicContact CD1-CD1 4.47Å; F319-L322 PolarHBondContact O-N 3.09Å; A320-L322 VanDerWaalsContact C-N 3.33Å; A320-L322 PolarHBondContact O-N 3.34Å; L322-K324 VanDerWaalsContact C-N 3.26Å; L322-K324 PolarHBondContact O-N 3.18Å; L322-K325 PolarHBondContact O-N 3.04Å; L322-T326 WeakPolarHBondContact O-CG2 3.25Å; L322-T326 PolarHBondContact O-N 3.45Å; L322-T326 VanDerWaalsContact O-N 3.14Å; L322-T326 PolarHBondContact O-OG1 2.9Å; L322-T326 VanDerWaalsContact O-OG1 3.04Å; L322-M404 HydrophobicContact CD1-SD 4.16Å; L322-M404 HydrophobicContact CD2-CE 3.81Å; L322-M404 HydrophobicContact CD2-SD 3.92Å; L322-M404 HydrophobicContact CG-CE 3.85Å; L322-M404 HydrophobicContact CG-SD 3.95Å; L322-M407 HydrophobicContact CD1-CB 4.26Å; L322-M407 HydrophobicContact CD1-CE 3.68Å; L322-M407 HydrophobicContact CD1-CG 4.32Å; L322-M407 HydrophobicContact CD2-CB 4.04Å
323	G	96.4	Very high	95.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-37.5	177.1	0	0	0	0	0	113.1	R299 S300 F319 A320 T326	R299-G323 PolarHBondContact NE-O 2.93Å; R299-G323 PolarHBondContact NH2-O 3.48Å; S300-G323 WeakPolarHBondContact OG-CA 3.42Å; F319-G323 PolarHBondContact O-N 3.37Å; A320-G323 PolarHBondContact O-N 3.18Å; G323-T326 PolarHBondContact O-OG1 3.25Å
324	K	97	Very high	95.9	Very high	148 Å²	148	44.3 Å²	44.3	64%	0.643	25%	0.254	S	S	*	.	H	α-helix	trans	-68.2	-33.5	174.6	-171.3	170.4	-177.9	172.1	0	113.4	A320 L322	A320-K324 PolarHBondContact O-N 3.11Å; A320-K324 VanDerWaalsContact O-N 3.07Å; L322-K324 VanDerWaalsContact C-N 3.26Å; L322-K324 PolarHBondContact O-N 3.18Å
325	K	96.6	Very high	95.9	Very high	125 Å²	125	45 Å²	45	54%	0.543	26%	0.261	S	S	.	.	H	α-helix	trans	-81.8	-13.5	-179.3	-74.8	176.5	178.8	-67.7	0	113.9	A321 L322 L408 L411	A321-K325 WeakPolarHBondContact O-CG 3.16Å; A321-K325 PolarHBondContact O-N 3.43Å; A321-K325 VanDerWaalsContact O-N 3.14Å; L322-K325 PolarHBondContact O-N 3.04Å; K325-L408 HydrophobicContact CD-CD2 3.93Å; K325-L411 HydrophobicContact CB-CD2 3.88Å; K325-L411 HydrophobicContact CD-CD2 4.43Å
326	T	96.4	Very high	95.9	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.263	C	S	.	.			trans	-105.1	37.4	-176.5	52.9	0	0	0	0	113.5	R299 F303 L322 G323 G328 Y329 L411	R299-T326 WeakPolarHBondContact CD-O 3.31Å; R299-T326 WeakPolarHBondContact CD-OG1 3.33Å; R299-T326 PolarHBondContact NE-O 3.35Å; R299-T326 VanDerWaalsContact NE-O 3.08Å; R299-T326 PolarHBondContact NE-OG1 3.13Å; F303-T326 HydrophobicContact CE2-CG2 3.69Å; F303-T326 HydrophobicContact CZ-CG2 3.68Å; L322-T326 WeakPolarHBondContact O-CG2 3.25Å; L322-T326 PolarHBondContact O-N 3.45Å; L322-T326 VanDerWaalsContact O-N 3.14Å; L322-T326 PolarHBondContact O-OG1 2.9Å; L322-T326 VanDerWaalsContact O-OG1 3.04Å; G323-T326 PolarHBondContact O-OG1 3.25Å; T326-G328 PolarHBondContact O-N 3.42Å; T326-Y329 VanDerWaalsContact C-CD2 3.46Å; T326-Y329 HydrophobicContact CG2-CD1 4.48Å; T326-Y329 HydrophobicContact CG2-CD2 4.38Å; T326-Y329 HydrophobicContact CG2-CG 4.27Å; T326-Y329 WeakPolarHBondContact O-CB 3.48Å; T326-Y329 WeakPolarHBondContact O-CD2 3.16Å; T326-Y329 PolarHBondContact O-N 3.41Å; T326-Y329 VanDerWaalsContact O-N 3.13Å; T326-L411 HydrophobicContact CG2-CD1 3.68Å; T326-L411 HydrophobicContact CG2-CD2 4.41Å
327	D	95.2	Very high	96	Very high	121 Å²	121	40.2 Å²	40.2	65%	0.647	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	135	175.1	-163.4	31.5	0	0	0	112.2	R299 Y329	R299-D327 IonicContact CZ-OD1 3.97Å; R299-D327 IonicContact NH1-OD1 3.31Å; R299-D327 PolarHBondContact NH1-OD1 3.15Å; R299-D327 IonicContact NH2-OD1 2.6Å; D327-Y329 VanDerWaalsContact C-N 3.29Å; D327-Y329 WeakPolarHBondContact O-CD2 3.19Å; D327-Y329 PolarHBondContact O-N 2.7Å
328	G	93.7	Very high	96	Very high	24 Å²	24	36.3 Å²	36.3	25%	0.247	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	-0	-173.3	0	0	0	0	0	116.2	T326	T326-G328 PolarHBondContact O-N 3.42Å
329	Y	95.9	Very high	95.9	Very high	24 Å²	24	42.4 Å²	42.4	9%	0.094	23%	0.228	C	C	.	.			trans	-81.6	140.2	178.1	-74.5	-116.3	0	0	0	111.5	P294 T326 D327 D333 I337 L411 T414 P416	P294-Y329 WeakPolarHBondContact CD-O 3.49Å; P294-Y329 WeakPolarHBondContact CG-O 3.46Å; T326-Y329 VanDerWaalsContact C-CD2 3.46Å; T326-Y329 HydrophobicContact CG2-CD1 4.48Å; T326-Y329 HydrophobicContact CG2-CD2 4.38Å; T326-Y329 HydrophobicContact CG2-CG 4.27Å; T326-Y329 WeakPolarHBondContact O-CB 3.48Å; T326-Y329 WeakPolarHBondContact O-CD2 3.16Å; T326-Y329 PolarHBondContact O-N 3.41Å; T326-Y329 VanDerWaalsContact O-N 3.13Å; D327-Y329 VanDerWaalsContact C-N 3.29Å; D327-Y329 WeakPolarHBondContact O-CD2 3.19Å; D327-Y329 PolarHBondContact O-N 2.7Å; Y329-D333 HydrophobicContact CD1-CB 3.65Å; Y329-D333 HydrophobicContact CG-CB 4.35Å; Y329-I337 HydrophobicContact CD1-CD1 3.75Å; Y329-I337 HydrophobicContact CE1-CD1 3.71Å; Y329-L411 HydrophobicContact CE1-CD1 3.96Å; Y329-T414 HydrophobicContact CE1-CG2 4.47Å; Y329-T414 WeakPolarHBondContact CE1-O 3.34Å; Y329-T414 PolarHBondContact OH-O 3.45Å; Y329-P416 HydrophobicContact CD2-CB 3.99Å; Y329-P416 HydrophobicContact CD2-CG 4.49Å; Y329-P416 HydrophobicContact CE2-CB 4.04Å; Y329-P416 HydrophobicContact CE2-CG 4.12Å; Y329-P416 HydrophobicContact CG-CB 4.27Å
330	S	95.5	Very high	95.9	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.014	23%	0.234	C	C	.	.			trans	-81.3	166.2	170.9	72.1	0	0	0	0	111.9	A332 D333 I334	S330-A332 PolarHBondContact O-N 2.87Å; S330-D333 WeakPolarHBondContact CB-OD2 3.35Å; S330-D333 PolarHBondContact N-OD2 2.92Å; S330-D333 PolarHBondContact O-N 2.9Å; S330-D333 VanDerWaalsContact O-N 3.16Å; S330-D333 PolarHBondContact OG-N 3.25Å; S330-D333 PolarHBondContact OG-OD2 3.47Å; S330-I334 WeakPolarHBondContact O-CG1 3.49Å; S330-I334 PolarHBondContact O-N 2.93Å
331	G	93.6	Very high	95.9	Very high	16 Å²	16	41.1 Å²	41.1	17%	0.165	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-33	173.5	0	0	0	0	0	112.6	G170 I334 S335	G170-G331 WeakPolarHBondContact O-CA 3.45Å; G170-G331 PolarHBondContact O-N 3.42Å; G331-I334 PolarHBondContact O-N 3.48Å; G331-S335 PolarHBondContact O-N 3.49Å
332	A	93.4	Very high	95.9	Very high	42 Å²	42	41.9 Å²	41.9	35%	0.347	21%	0.214	S	C	.	.	H	α-helix	trans	-64.9	-43	172.9	0	0	0	0	0	112.1	G170 S330 I334 S335 I336	G170-A332 PolarHBondContact O-N 3.42Å; S330-A332 PolarHBondContact O-N 2.87Å; A332-I334 VanDerWaalsContact C-N 3.34Å; A332-I334 PolarHBondContact O-N 2.7Å; A332-S335 WeakPolarHBondContact O-CB 3.1Å; A332-S335 PolarHBondContact O-N 3.43Å; A332-I336 WeakPolarHBondContact O-CG1 2.98Å; A332-I336 PolarHBondContact O-N 3.18Å
333	D	96.1	Very high	95.8	Very high	3 Å²	3	46 Å²	46	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-62.3	-43.7	177	-57.2	-46.6	0	0	0	110.8	Y329 S330 S335 I336 I337 T417	Y329-D333 HydrophobicContact CD1-CB 3.65Å; Y329-D333 HydrophobicContact CG-CB 4.35Å; S330-D333 WeakPolarHBondContact CB-OD2 3.35Å; S330-D333 PolarHBondContact N-OD2 2.92Å; S330-D333 PolarHBondContact O-N 2.9Å; S330-D333 VanDerWaalsContact O-N 3.16Å; S330-D333 PolarHBondContact OG-N 3.25Å; S330-D333 PolarHBondContact OG-OD2 3.47Å; D333-S335 VanDerWaalsContact C-N 3.33Å; D333-S335 PolarHBondContact O-N 3.36Å; D333-I336 WeakPolarHBondContact O-CB 3.38Å; D333-I336 PolarHBondContact O-N 3.18Å; D333-I336 VanDerWaalsContact O-N 3.16Å; D333-I337 WeakPolarHBondContact O-CG1 3.29Å; D333-I337 PolarHBondContact O-N 3.1Å; D333-T417 VanDerWaalsContact OD1-CB 3.31Å; D333-T417 WeakPolarHBondContact OD1-CB 3.33Å; D333-T417 PolarHBondContact OD1-OG1 3.45Å; D333-T417 PolarHBondContact OD2-N 2.99Å
334	I	96.3	Very high	95.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-42	175.7	-66.4	170.9	0	0	0	111	R299 M302 F303 S330 G331 A332 I336 I337 V338	R299-I334 HydrophobicContact CB-CD1 3.7Å; R299-I334 HydrophobicContact CG-CD1 3.66Å; M302-I334 HydrophobicContact CB-CD1 4.3Å; M302-I334 HydrophobicContact CB-CG2 4.08Å; M302-I334 HydrophobicContact SD-CD1 4.09Å; F303-I334 HydrophobicContact CD1-CG2 3.85Å; F303-I334 HydrophobicContact CD2-CG2 4.08Å; F303-I334 HydrophobicContact CE1-CG2 3.88Å; F303-I334 HydrophobicContact CE2-CD1 4.42Å; F303-I334 HydrophobicContact CE2-CG1 4.24Å; F303-I334 HydrophobicContact CE2-CG2 4.1Å; F303-I334 HydrophobicContact CG-CG2 3.96Å; F303-I334 HydrophobicContact CZ-CG1 4.3Å; F303-I334 HydrophobicContact CZ-CG2 4.01Å; S330-I334 WeakPolarHBondContact O-CG1 3.49Å; S330-I334 PolarHBondContact O-N 2.93Å; G331-I334 PolarHBondContact O-N 3.48Å; A332-I334 VanDerWaalsContact C-N 3.34Å; A332-I334 PolarHBondContact O-N 2.7Å; I334-I336 VanDerWaalsContact C-N 3.28Å; I334-I336 PolarHBondContact O-N 3.27Å; I334-I337 PolarHBondContact O-N 2.92Å; I334-V338 HydrophobicContact CG2-CG2 4.35Å; I334-V338 VanDerWaalsContact O-CG2 3.31Å; I334-V338 WeakPolarHBondContact O-CG2 3.45Å; I334-V338 PolarHBondContact O-N 3.46Å
335	S	94.8	Very high	95.6	Very high	33 Å²	33	39.8 Å²	39.8	23%	0.231	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-37.5	175.7	177.8	0	0	0	0	112.4	N306 G331 A332 D333 R339	N306-S335 WeakPolarHBondContact ND2-CA 3.35Å; G331-S335 PolarHBondContact O-N 3.49Å; A332-S335 WeakPolarHBondContact O-CB 3.1Å; A332-S335 PolarHBondContact O-N 3.43Å; D333-S335 VanDerWaalsContact C-N 3.33Å; D333-S335 PolarHBondContact O-N 3.36Å; S335-R339 VanDerWaalsContact O-CB 3.25Å; S335-R339 WeakPolarHBondContact O-CB 3.47Å; S335-R339 PolarHBondContact O-N 3.34Å
336	I	95.9	Very high	95.5	Very high	87 Å²	87	37.4 Å²	37.4	45%	0.446	20%	0.204	S	C	.	.	H	α-helix	trans	-66.2	-46.2	176.7	-69	166.6	0	0	0	110.4	A332 D333 I334 V338 R339 D340 T414	A332-I336 WeakPolarHBondContact O-CG1 2.98Å; A332-I336 PolarHBondContact O-N 3.18Å; D333-I336 WeakPolarHBondContact O-CB 3.38Å; D333-I336 PolarHBondContact O-N 3.18Å; D333-I336 VanDerWaalsContact O-N 3.16Å; I334-I336 VanDerWaalsContact C-N 3.28Å; I334-I336 PolarHBondContact O-N 3.27Å; I336-V338 PolarHBondContact O-N 2.91Å; I336-R339 PolarHBondContact O-N 2.71Å; I336-D340 PolarHBondContact O-N 2.76Å; I336-T414 HydrophobicContact CG2-CG2 4.42Å
337	I	97.1	Very high	95.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-57.8	-50.3	177.5	-66.6	161.7	0	0	0	110.5	F303 Y329 D333 I334 R339 D340 A341 S410 L411 T414	F303-I337 HydrophobicContact CE1-CB 4.39Å; F303-I337 HydrophobicContact CE1-CG2 3.92Å; F303-I337 HydrophobicContact CZ-CG2 4.4Å; Y329-I337 HydrophobicContact CD1-CD1 3.75Å; Y329-I337 HydrophobicContact CE1-CD1 3.71Å; D333-I337 WeakPolarHBondContact O-CG1 3.29Å; D333-I337 PolarHBondContact O-N 3.1Å; I334-I337 PolarHBondContact O-N 2.92Å; I337-R339 VanDerWaalsContact C-N 3.34Å; I337-R339 PolarHBondContact O-N 3.23Å; I337-D340 PolarHBondContact O-N 3.21Å; I337-A341 WeakPolarHBondContact O-CB 3.28Å; I337-A341 PolarHBondContact O-N 3.21Å; I337-S410 WeakPolarHBondContact CA-OG 3.33Å; I337-S410 PolarHBondContact O-OG 2.69Å; I337-L411 HydrophobicContact CD1-CD1 3.73Å; I337-L411 HydrophobicContact CG2-CB 4.44Å; I337-T414 HydrophobicContact CD1-CG2 4.33Å; I337-T414 HydrophobicContact CG1-CG2 3.85Å
338	V	96.8	Very high	95.4	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-43.2	-179.3	176.4	0	0	0	0	110.8	F303 N306 L307 I334 I336 D340 A341 L342 M407	F303-V338 HydrophobicContact CD1-CG2 3.49Å; F303-V338 VanDerWaalsContact CD1-CG2 3.49Å; F303-V338 HydrophobicContact CE1-CG2 3.92Å; N306-V338 HydrophobicContact CB-CB 4Å; N306-V338 HydrophobicContact CB-CG1 3.85Å; N306-V338 HydrophobicContact CB-CG2 3.92Å; L307-V338 HydrophobicContact CB-CG1 4.49Å; L307-V338 HydrophobicContact CD1-CG1 4.35Å; I334-V338 HydrophobicContact CG2-CG2 4.35Å; I334-V338 VanDerWaalsContact O-CG2 3.31Å; I334-V338 WeakPolarHBondContact O-CG2 3.45Å; I334-V338 PolarHBondContact O-N 3.46Å; I336-V338 PolarHBondContact O-N 2.91Å; V338-D340 VanDerWaalsContact C-N 3.33Å; V338-D340 PolarHBondContact O-N 2.95Å; V338-A341 PolarHBondContact O-N 3.36Å; V338-L342 HydrophobicContact CG1-CD1 3.95Å; V338-L342 HydrophobicContact CG1-CG 4.22Å; V338-L342 WeakPolarHBondContact O-CB 3.33Å; V338-L342 VanDerWaalsContact O-CG 3.25Å; V338-L342 WeakPolarHBondContact O-CG 3.49Å; V338-L342 PolarHBondContact O-N 3.33Å; V338-M407 HydrophobicContact CG2-CE 4.04Å
339	R	96	Very high	95.4	Very high	166 Å²	166	39.4 Å²	39.4	63%	0.626	20%	0.198	S	C	*	.	H	α-helix	trans	-61.4	-40.4	178.5	-172.6	-178.7	-61.4	164.6	4.3	112.3	S335 I336 I337 M343	S335-R339 VanDerWaalsContact O-CB 3.25Å; S335-R339 WeakPolarHBondContact O-CB 3.47Å; S335-R339 PolarHBondContact O-N 3.34Å; I336-R339 PolarHBondContact O-N 2.71Å; I337-R339 VanDerWaalsContact C-N 3.34Å; I337-R339 PolarHBondContact O-N 3.23Å; R339-M343 WeakPolarHBondContact O-CG 3.4Å; R339-M343 PolarHBondContact O-N 3.04Å
340	D	96.1	Very high	95.4	Very high	34 Å²	34	44.4 Å²	44.4	18%	0.182	22%	0.223	C	C	.	.	H	α-helix	trans	-72	-35.4	176.8	175.1	70	0	0	0	112.3	I336 I337 V338 M343 R347 S410	I336-D340 PolarHBondContact O-N 2.76Å; I337-D340 PolarHBondContact O-N 3.21Å; V338-D340 VanDerWaalsContact C-N 3.33Å; V338-D340 PolarHBondContact O-N 2.95Å; D340-M343 PolarHBondContact O-N 3.25Å; D340-R347 IonicContact OD1-CZ 3.23Å; D340-R347 VanDerWaalsContact OD1-CZ 3.23Å; D340-R347 IonicContact OD1-NH1 2.7Å; D340-R347 PolarHBondContact OD1-NH1 2.82Å; D340-R347 IonicContact OD1-NH2 2.81Å; D340-R347 PolarHBondContact OD1-NH2 2.88Å; D340-R347 IonicContact OD2-NH1 3.87Å; D340-S410 VanDerWaalsContact CB-OG 3.29Å; D340-S410 WeakPolarHBondContact CB-OG 3.12Å; D340-S410 VanDerWaalsContact OD2-CB 3.26Å; D340-S410 WeakPolarHBondContact OD2-CB 3.44Å; D340-S410 PolarHBondContact OD2-OG 3.49Å
341	A	96.6	Very high	95.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-40.1	172.6	0	0	0	0	0	112.7	I337 V338 M343 Q344 V402 M407	I337-A341 WeakPolarHBondContact O-CB 3.28Å; I337-A341 PolarHBondContact O-N 3.21Å; V338-A341 PolarHBondContact O-N 3.36Å; A341-M343 PolarHBondContact O-N 3.24Å; A341-Q344 VanDerWaalsContact O-CB 3.31Å; A341-Q344 WeakPolarHBondContact O-CB 3.27Å; A341-Q344 WeakPolarHBondContact O-CG 3.42Å; A341-Q344 PolarHBondContact O-N 3.03Å; A341-V402 HydrophobicContact CB-CG1 4.43Å; A341-M407 HydrophobicContact CB-CG 4.43Å; A341-M407 HydrophobicContact CB-SD 3.37Å; A341-M407 WeakPolarHBondContact CB-SD 3.35Å
342	L	96.5	Very high	95.5	Very high	52 Å²	52	48.6 Å²	48.6	27%	0.272	25%	0.251	S	S	.	.	H	α-helix	trans	-59.4	-25.5	174.1	-75.7	169.3	0	0	0	112.6	L307 T310 V338 V402	L307-L342 HydrophobicContact CD1-CD2 3.93Å; L307-L342 HydrophobicContact CD1-CG 4.47Å; T310-L342 HydrophobicContact CG2-CD2 3.62Å; V338-L342 HydrophobicContact CG1-CD1 3.95Å; V338-L342 HydrophobicContact CG1-CG 4.22Å; V338-L342 WeakPolarHBondContact O-CB 3.33Å; V338-L342 VanDerWaalsContact O-CG 3.25Å; V338-L342 WeakPolarHBondContact O-CG 3.49Å; V338-L342 PolarHBondContact O-N 3.33Å; L342-V402 HydrophobicContact CD2-CG2 4.2Å
343	M	95.5	Very high	95.6	Very high	86 Å²	86	50.3 Å²	50.3	42%	0.424	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-7.8	176	-67.5	-57.2	-59.7	0	0	113.8	R339 D340 A341 V346 R347	R339-M343 WeakPolarHBondContact O-CG 3.4Å; R339-M343 PolarHBondContact O-N 3.04Å; D340-M343 PolarHBondContact O-N 3.25Å; A341-M343 PolarHBondContact O-N 3.24Å; M343-V346 HydrophobicContact CE-CB 4.02Å; M343-V346 HydrophobicContact CE-CG1 4.05Å; M343-V346 HydrophobicContact CE-CG2 4.14Å; M343-V346 PolarHBondContact O-N 2.81Å; M343-V346 HydrophobicContact SD-CG2 4.49Å; M343-R347 WeakPolarHBondContact O-CG 3.29Å; M343-R347 PolarHBondContact O-N 2.7Å
344	Q	94.6	Very high	95.6	Very high	7 Å²	7	51.5 Å²	51.5	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-44.1	-179.6	-64.1	-68.8	-35.4	0	0	113	A341 V346 R347 K348 D406	A341-Q344 VanDerWaalsContact O-CB 3.31Å; A341-Q344 WeakPolarHBondContact O-CB 3.27Å; A341-Q344 WeakPolarHBondContact O-CG 3.42Å; A341-Q344 PolarHBondContact O-N 3.03Å; Q344-V346 VanDerWaalsContact C-N 3.3Å; Q344-V346 PolarHBondContact O-N 2.76Å; Q344-R347 PolarHBondContact O-N 3.13Å; Q344-K348 VanDerWaalsContact O-CG 3.31Å; Q344-K348 WeakPolarHBondContact O-CG 3.24Å; Q344-K348 PolarHBondContact O-N 2.86Å; Q344-D406 HydrophobicContact CB-CB 3.9Å; Q344-D406 WeakPolarHBondContact CB-OD1 3.34Å; Q344-D406 HydrophobicContact CG-CB 3.81Å
345	P	95.1	Very high	95.6	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.071	26%	0.262	C	S	.	.	H	α-helix	trans	-53.6	-45	172.3	-31.8	39.5	0	0	0	113.6	R347 K348 V349 P400 V402	P345-R347 PolarHBondContact O-N 3.3Å; P345-K348 PolarHBondContact O-N 3.28Å; P345-V349 WeakPolarHBondContact O-CG2 3.47Å; P345-V349 PolarHBondContact O-N 2.75Å; P345-P400 WeakPolarHBondContact CB-O 3.42Å; P345-P400 WeakPolarHBondContact CG-O 3.41Å; P345-V402 HydrophobicContact CG-CG2 3.85Å
346	V	95	Very high	95.6	Very high	76 Å²	76	53 Å²	53	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-46.7	179.1	-178.3	0	0	0	0	110.7	M343 Q344 K348 V349 Q350	M343-V346 HydrophobicContact CE-CB 4.02Å; M343-V346 HydrophobicContact CE-CG1 4.05Å; M343-V346 HydrophobicContact CE-CG2 4.14Å; M343-V346 PolarHBondContact O-N 2.81Å; M343-V346 HydrophobicContact SD-CG2 4.49Å; Q344-V346 VanDerWaalsContact C-N 3.3Å; Q344-V346 PolarHBondContact O-N 2.76Å; V346-K348 VanDerWaalsContact C-N 3.34Å; V346-K348 PolarHBondContact O-N 2.91Å; V346-V349 PolarHBondContact O-N 3.17Å; V346-Q350 WeakPolarHBondContact O-CB 3.35Å; V346-Q350 PolarHBondContact O-N 3.27Å
347	R	94.5	Very high	95.5	Very high	105 Å²	105	57.5 Å²	57.5	40%	0.396	28%	0.276	S	S	.	.	H	α-helix	trans	-62.7	-39.3	177.1	-68.8	170.1	-176.8	159.9	-0.1	112	D340 M343 Q344 P345 Q350 S351	D340-R347 IonicContact OD1-CZ 3.23Å; D340-R347 VanDerWaalsContact OD1-CZ 3.23Å; D340-R347 IonicContact OD1-NH1 2.7Å; D340-R347 PolarHBondContact OD1-NH1 2.82Å; D340-R347 IonicContact OD1-NH2 2.81Å; D340-R347 PolarHBondContact OD1-NH2 2.88Å; D340-R347 IonicContact OD2-NH1 3.87Å; M343-R347 WeakPolarHBondContact O-CG 3.29Å; M343-R347 PolarHBondContact O-N 2.7Å; Q344-R347 PolarHBondContact O-N 3.13Å; P345-R347 PolarHBondContact O-N 3.3Å; R347-Q350 PolarHBondContact O-N 2.95Å; R347-S351 WeakPolarHBondContact O-CB 3.29Å; R347-S351 PolarHBondContact O-N 3.5Å; R347-S351 PolarHBondContact O-OG 2.66Å
348	K	93.9	Very high	95.2	Very high	68 Å²	68	58.5 Å²	58.5	30%	0.296	28%	0.284	S	S	.	.	H	α-helix	trans	-62.8	-45.4	175.9	-73	171.5	-172.9	171.5	0	111.2	Q344 P345 V346 A352 P400 D406	Q344-K348 VanDerWaalsContact O-CG 3.31Å; Q344-K348 WeakPolarHBondContact O-CG 3.24Å; Q344-K348 PolarHBondContact O-N 2.86Å; P345-K348 PolarHBondContact O-N 3.28Å; V346-K348 VanDerWaalsContact C-N 3.34Å; V346-K348 PolarHBondContact O-N 2.91Å; K348-A352 WeakPolarHBondContact O-CB 3.26Å; K348-A352 PolarHBondContact O-N 3.43Å; K348-P400 HydrophobicContact CB-CG 4.42Å; K348-P400 HydrophobicContact CD-CB 4.45Å; K348-P400 HydrophobicContact CD-CG 4.36Å; K348-D406 VanDerWaalsContact CE-OD1 3.24Å; K348-D406 WeakPolarHBondContact CE-OD1 3.32Å; K348-D406 IonicContact NZ-OD1 2.71Å; K348-D406 PolarHBondContact NZ-OD1 3.37Å; K348-D406 IonicContact NZ-OD2 2.91Å; K348-D406 PolarHBondContact NZ-OD2 3.45Å
349	V	95.1	Very high	94.9	Very high	13 Å²	13	66.6 Å²	66.6	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-46.4	176	172.4	0	0	0	0	111.2	P345 V346 S351 A352 F355 P376 W389 L397	P345-V349 WeakPolarHBondContact O-CG2 3.47Å; P345-V349 PolarHBondContact O-N 2.75Å; V346-V349 PolarHBondContact O-N 3.17Å; V349-S351 VanDerWaalsContact C-N 3.33Å; V349-S351 PolarHBondContact O-N 3.46Å; V349-A352 WeakPolarHBondContact O-CB 3.31Å; V349-A352 PolarHBondContact O-N 2.91Å; V349-F355 HydrophobicContact CG1-CZ 4.33Å; V349-P376 HydrophobicContact CB-CG 4.28Å; V349-P376 HydrophobicContact CG2-CG 3.64Å; V349-W389 HydrophobicContact CG1-CB 3.97Å; V349-L397 HydrophobicContact CG1-CD1 3.9Å; V349-L397 HydrophobicContact CG1-CD2 4.08Å; V349-L397 HydrophobicContact CG2-CD1 4.23Å
350	Q	94.9	Very high	94.4	Very high	129 Å²	129	59.2 Å²	59.2	60%	0.603	29%	0.29	S	S	*	.	H	α-helix	trans	-65.6	-35.3	-176.8	-170.6	-179.2	16.8	0	0	113.1	V346 R347	V346-Q350 WeakPolarHBondContact O-CB 3.35Å; V346-Q350 PolarHBondContact O-N 3.27Å; R347-Q350 PolarHBondContact O-N 2.95Å
351	S	95	Very high	93.9	Very high	93 Å²	93	63.9 Å²	63.9	65%	0.65	31%	0.31	S	S	*	.	H	α-helix	trans	-92.9	0.2	179.4	59.1	0	0	0	0	114.1	R347 V349	R347-S351 WeakPolarHBondContact O-CB 3.29Å; R347-S351 PolarHBondContact O-N 3.5Å; R347-S351 PolarHBondContact O-OG 2.66Å; V349-S351 VanDerWaalsContact C-N 3.33Å; V349-S351 PolarHBondContact O-N 3.46Å
352	A	95.4	Very high	93.3	Very high	14 Å²	14	64.7 Å²	64.7	12%	0.116	32%	0.316	C	S	.	.			trans	-68.9	131.7	178.9	0	0	0	0	0	111.2	K348 V349 F355 P376	K348-A352 WeakPolarHBondContact O-CB 3.26Å; K348-A352 PolarHBondContact O-N 3.43Å; V349-A352 WeakPolarHBondContact O-CB 3.31Å; V349-A352 PolarHBondContact O-N 2.91Å; A352-F355 HydrophobicContact CB-CD2 4.39Å; A352-F355 HydrophobicContact CB-CE2 3.62Å; A352-F355 HydrophobicContact CB-CZ 3.76Å; A352-P376 HydrophobicContact CB-CB 3.86Å; A352-P376 HydrophobicContact CB-CG 4.23Å
353	T	95.5	Very high	92.6	Very high	77 Å²	77	68.7 Å²	68.7	47%	0.472	33%	0.328	S	S	.	.	S	Bend	trans	-100.2	-16.6	171.3	55.5	0	0	0	0	112.5	M387	T353-M387 CarbonylContact C-O 3.59Å; T353-M387 VanDerWaalsContact C-O 3.25Å; T353-M387 PolarHBondContact O-N 3.3Å; T353-M387 VanDerWaalsContact O-N 3.1Å
354	H	96.6	Very high	92.1	Very high	29 Å²	29	70.3 Å²	70.3	13%	0.134	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.2	-177.7	-64.7	68.2	0	0	0	110.5	C377 A384 I385	H354-C377 PolarHBondContact O-N 3.07Å; H354-A384 HydrophobicContact CB-CB 4.16Å; H354-I385 CarbonylContact C-O 3.59Å; H354-I385 VanDerWaalsContact CA-O 3.27Å; H354-I385 WeakPolarHBondContact CA-O 3.23Å
355	F	96.4	Very high	91.6	Very high	0 Å²	0	73 Å²	73	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.6	174.7	-73.6	-104.4	0	0	0	109.7	V349 A352 L374 T375 P376 I385 M387 W389 V392 L397	V349-F355 HydrophobicContact CG1-CZ 4.33Å; A352-F355 HydrophobicContact CB-CD2 4.39Å; A352-F355 HydrophobicContact CB-CE2 3.62Å; A352-F355 HydrophobicContact CB-CZ 3.76Å; F355-L374 HydrophobicContact CB-CB 4.42Å; F355-L374 HydrophobicContact CB-CD2 4.36Å; F355-L374 HydrophobicContact CD1-CB 4.23Å; F355-T375 CarbonylContact C-O 3.58Å; F355-T375 WeakPolarHBondContact CA-O 3.34Å; F355-T375 VanDerWaalsContact CD1-C 3.48Å; F355-P376 HydrophobicContact CD1-CG 4.3Å; F355-P376 HydrophobicContact CE1-CB 4.47Å; F355-P376 HydrophobicContact CE1-CG 3.72Å; F355-P376 HydrophobicContact CZ-CG 4.2Å; F355-I385 PolarHBondContact N-O 3.36Å; F355-I385 WeakPolarHBondContact O-CA 3.41Å; F355-I385 WeakPolarHBondContact O-CB 3.44Å; F355-I385 PolarHBondContact O-N 3.1Å; F355-M387 HydrophobicContact CB-CG 3.96Å; F355-M387 HydrophobicContact CB-SD 4.05Å; F355-M387 HydrophobicContact CD2-CG 3.82Å; F355-M387 WeakPolarHBondContact CD2-O 3.42Å; F355-M387 HydrophobicContact CG-CG 4.23Å; F355-W389 HydrophobicContact CZ-CB 4.21Å; F355-V392 HydrophobicContact CD1-CG2 3.96Å; F355-V392 HydrophobicContact CD2-CG2 4.18Å; F355-V392 HydrophobicContact CE1-CG2 3.9Å; F355-V392 HydrophobicContact CE2-CG2 4.12Å; F355-V392 HydrophobicContact CG-CG2 4.11Å; F355-V392 HydrophobicContact CZ-CG2 3.99Å; F355-L397 HydrophobicContact CE1-CD1 3.97Å
356	K	94.9	Very high	91	Very high	65 Å²	65	76.3 Å²	76.3	28%	0.283	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.4	172.1	68.7	-178.4	173.3	-174.5	0	110.9	L374 T375 C377 D381 N383	K356-L374 WeakPolarHBondContact O-CA 3.29Å; K356-T375 HydrophobicContact CG-CG2 3.85Å; K356-T375 PolarHBondContact N-O 3.4Å; K356-T375 PolarHBondContact O-N 3.42Å; K356-C377 HydrophobicContact CB-CB 4.15Å; K356-C377 HydrophobicContact CD-CB 3.79Å; K356-C377 HydrophobicContact CG-CB 3.85Å; K356-D381 WeakPolarHBondContact CD-OD2 3.42Å; K356-D381 IonicContact NZ-OD2 2.76Å; K356-D381 PolarHBondContact NZ-OD2 3.41Å; K356-N383 HydrophobicContact CB-CB 4.41Å; K356-N383 WeakPolarHBondContact CB-O 3.41Å
357	R	93.9	Very high	90.6	Very high	180 Å²	180	79.5 Å²	79.5	68%	0.679	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.6	131.9	172	-66.1	-175.4	-177.2	-175.4	1.2	109.8	L373 L374 I385	R357-L373 CarbonylContact C-O 3.56Å; R357-L373 VanDerWaalsContact CA-O 3.23Å; R357-L373 WeakPolarHBondContact CA-O 3.28Å; R357-L374 HydrophobicContact CG-CD2 4.01Å; R357-I385 HydrophobicContact CG-CD1 4.4Å
358	A	90.3	Very high	90.3	Very high	22 Å²	22	77.9 Å²	77.9	18%	0.182	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148	-178.7	0	0	0	0	0	110	L373 T375 M398	A358-L373 PolarHBondContact N-O 3.29Å; A358-L373 WeakPolarHBondContact O-CB 3.28Å; A358-L373 PolarHBondContact O-N 3.5Å; A358-L373 VanDerWaalsContact O-N 3.13Å; A358-T375 HydrophobicContact CB-CG2 3.87Å; A358-M398 HydrophobicContact CB-SD 4Å
359	R	90.5	Very high	90	Very high	172 Å²	172	79.1 Å²	79.1	65%	0.649	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.7	172.5	-177.2	172.9	-159.1	-151.8	-4	108.9	I369 I370 D371	R359-I369 HydrophobicContact CG-CG2 3.45Å; R359-I369 VanDerWaalsContact CG-CG2 3.45Å; R359-I369 VanDerWaalsContact NE-CG2 3.33Å; R359-I370 WeakPolarHBondContact CA-O 3.33Å; R359-D371 WeakPolarHBondContact CD-OD1 3.49Å; R359-D371 WeakPolarHBondContact CG-OD1 3.33Å; R359-D371 IonicContact CZ-OD1 3.93Å; R359-D371 IonicContact NE-OD1 3.41Å; R359-D371 PolarHBondContact NE-OD1 3.05Å; R359-D371 IonicContact NH2-OD1 3.53Å
360	G	87.1	Confident	89.7	Confident	10 Å²	10	80.4 Å²	80.4	10%	0.103	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	174.8	-177.8	0	0	0	0	0	113	I369 I370	G360-I369 CarbonylContact O-C 3.57Å; G360-I369 WeakPolarHBondContact O-CA 3.41Å; G360-I370 PolarHBondContact N-O 3.44Å; G360-I370 PolarHBondContact O-N 3.03Å
361	Q	85.5	Confident	89.3	Confident	132 Å²	132	79.1 Å²	79.1	62%	0.617	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	145.1	177.1	-68	174.2	-6	0	0	110.4
362	S	83.9	Confident	89.1	Confident	18 Å²	18	77.7 Å²	77.7	13%	0.126	39%	0.392	C	S	.	.			trans	-65.1	143.6	171.3	-178.2	0	0	0	0	110.7	T364 D365 V368	S362-T364 VanDerWaalsContact C-N 3.26Å; S362-T364 PolarHBondContact O-N 3.26Å; S362-T364 PolarHBondContact OG-N 3.26Å; S362-T364 PolarHBondContact OG-OG1 3.14Å; S362-D365 WeakPolarHBondContact CB-O 3.38Å; S362-D365 CarbonylContact O-C 3.57Å; S362-V368 PolarHBondContact N-O 3.01Å
363	R	81.9	Confident	89	Confident	136 Å²	136	77.5 Å²	77.5	51%	0.513	39%	0.389	S	S	.	.	S	Bend	trans	-68.1	-27.3	173.4	-68.1	-177.8	169.5	-156.1	-5.1	112.7	L397 E399	R363-L397 PolarHBondContact NE-O 3.5Å; R363-L397 PolarHBondContact NH2-O 2.89Å; R363-E399 IonicContact CZ-OE2 3.31Å; R363-E399 IonicContact NE-OE2 3.18Å; R363-E399 IonicContact NH2-OE2 3.11Å; R363-E399 PolarHBondContact NH2-OE2 2.92Å
364	T	83.4	Confident	88.9	Confident	119 Å²	119	74.6 Å²	74.6	73%	0.73	37%	0.37	S	S	*	.	S	Bend	trans	-89.6	-31.7	-177.8	51.9	0	0	0	0	113.1	S362	S362-T364 VanDerWaalsContact C-N 3.26Å; S362-T364 PolarHBondContact O-N 3.26Å; S362-T364 PolarHBondContact OG-N 3.26Å; S362-T364 PolarHBondContact OG-OG1 3.14Å
365	D	84.1	Confident	88.8	Confident	65 Å²	65	74.2 Å²	74.2	35%	0.348	37%	0.37	S	S	.	.			trans	-142.6	107.6	177.8	-171.3	-16	0	0	0	110.5	S362 N367 V368	S362-D365 WeakPolarHBondContact CB-O 3.38Å; S362-D365 CarbonylContact O-C 3.57Å; D365-N367 PolarHBondContact O-N 3.38Å; D365-N367 WeakPolarHBondContact OD1-CB 3.35Å; D365-N367 PolarHBondContact OD1-N 3.15Å; D365-N367 PolarHBondContact OD1-ND2 3.4Å; D365-N367 VanDerWaalsContact OD1-ND2 3.13Å; D365-V368 HydrophobicContact CB-CB 4.39Å; D365-V368 HydrophobicContact CB-CG2 3.95Å; D365-V368 PolarHBondContact O-N 3.43Å
366	P	82.1	Confident	88.8	Confident	80 Å²	80	75.3 Å²	75.3	52%	0.519	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-19.2	-179.9	-25	34.3	0	0	0	114.8	V368	P366-V368 VanDerWaalsContact C-N 3.34Å
367	N	88.2	Confident	88.7	Confident	142 Å²	142	73.3 Å²	73.3	76%	0.759	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-14.8	179	-57.8	-60.4	0	0	0	113.1	D365	D365-N367 PolarHBondContact O-N 3.38Å; D365-N367 WeakPolarHBondContact OD1-CB 3.35Å; D365-N367 PolarHBondContact OD1-N 3.15Å; D365-N367 PolarHBondContact OD1-ND2 3.4Å; D365-N367 VanDerWaalsContact OD1-ND2 3.13Å
368	V	88.4	Confident	88.7	Confident	71 Å²	71	68.7 Å²	68.7	43%	0.43	37%	0.367	S	S	.	.			trans	-95	125	-179.6	179.9	0	0	0	0	109.4	S362 D365 P366	S362-V368 PolarHBondContact N-O 3.01Å; D365-V368 HydrophobicContact CB-CB 4.39Å; D365-V368 HydrophobicContact CB-CG2 3.95Å; D365-V368 PolarHBondContact O-N 3.43Å; P366-V368 VanDerWaalsContact C-N 3.34Å
369	I	87.3	Confident	88.8	Confident	94 Å²	94	71.6 Å²	71.6	48%	0.482	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.1	175.6	-57.5	173	0	0	0	108.7	R359 G360	R359-I369 HydrophobicContact CG-CG2 3.45Å; R359-I369 VanDerWaalsContact CG-CG2 3.45Å; R359-I369 VanDerWaalsContact NE-CG2 3.33Å; G360-I369 CarbonylContact O-C 3.57Å; G360-I369 WeakPolarHBondContact O-CA 3.41Å
370	I	87.9	Confident	88.9	Confident	40 Å²	40	67 Å²	67	21%	0.205	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	128.9	176.4	-59.9	179.4	0	0	0	108.3	R359 G360 D372 L373	R359-I370 WeakPolarHBondContact CA-O 3.33Å; G360-I370 PolarHBondContact N-O 3.44Å; G360-I370 PolarHBondContact O-N 3.03Å; I370-D372 WeakPolarHBondContact CG2-OD1 3.44Å; I370-L373 HydrophobicContact CB-CD1 4.38Å; I370-L373 HydrophobicContact CB-CD2 4.11Å; I370-L373 HydrophobicContact CB-CG 3.99Å; I370-L373 HydrophobicContact CD1-CD2 4.27Å; I370-L373 HydrophobicContact CG2-CD2 3.77Å; I370-L373 HydrophobicContact CG2-CG 3.85Å
371	D	87.9	Confident	89.1	Confident	103 Å²	103	68.3 Å²	68.3	55%	0.551	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	-7.4	-175.6	-65	-26.3	0	0	0	113.5	R359	R359-D371 WeakPolarHBondContact CD-OD1 3.49Å; R359-D371 WeakPolarHBondContact CG-OD1 3.33Å; R359-D371 IonicContact CZ-OD1 3.93Å; R359-D371 IonicContact NE-OD1 3.41Å; R359-D371 PolarHBondContact NE-OD1 3.05Å; R359-D371 IonicContact NH2-OD1 3.53Å
372	D	90.3	Very high	89.4	Confident	63 Å²	63	68 Å²	68	34%	0.337	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	25	-173	78.8	-30.5	0	0	0	114.7	I370 K396	I370-D372 WeakPolarHBondContact CG2-OD1 3.44Å; D372-K396 WeakPolarHBondContact OD2-CE 3.45Å; D372-K396 IonicContact OD2-NZ 2.66Å; D372-K396 PolarHBondContact OD2-NZ 3.46Å
373	L	92.9	Very high	89.8	Confident	9 Å²	9	72.5 Å²	72.5	5%	0.047	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	155.3	171.9	-58.5	177	0	0	0	110.8	R357 A358 I370 K396 M398	R357-L373 CarbonylContact C-O 3.56Å; R357-L373 VanDerWaalsContact CA-O 3.23Å; R357-L373 WeakPolarHBondContact CA-O 3.28Å; A358-L373 PolarHBondContact N-O 3.29Å; A358-L373 WeakPolarHBondContact O-CB 3.28Å; A358-L373 PolarHBondContact O-N 3.5Å; A358-L373 VanDerWaalsContact O-N 3.13Å; I370-L373 HydrophobicContact CB-CD1 4.38Å; I370-L373 HydrophobicContact CB-CD2 4.11Å; I370-L373 HydrophobicContact CB-CG 3.99Å; I370-L373 HydrophobicContact CD1-CD2 4.27Å; I370-L373 HydrophobicContact CG2-CD2 3.77Å; I370-L373 HydrophobicContact CG2-CG 3.85Å; L373-K396 CarbonylContact C-O 3.59Å; L373-K396 WeakPolarHBondContact CA-O 3.31Å; L373-M398 HydrophobicContact CB-CB 3.95Å; L373-M398 HydrophobicContact CD1-CB 4.2Å; L373-M398 HydrophobicContact CD1-CG 4.45Å; L373-M398 HydrophobicContact CD1-SD 4.13Å
374	L	94	Very high	90.5	Very high	16 Å²	16	67.5 Å²	67.5	8%	0.084	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	123.6	179.8	-70.5	169.6	0	0	0	109.8	F355 K356 R357 M387 V392 K396 M398	F355-L374 HydrophobicContact CB-CB 4.42Å; F355-L374 HydrophobicContact CB-CD2 4.36Å; F355-L374 HydrophobicContact CD1-CB 4.23Å; K356-L374 WeakPolarHBondContact O-CA 3.29Å; R357-L374 HydrophobicContact CG-CD2 4.01Å; L374-M387 HydrophobicContact CD1-SD 3.99Å; L374-M387 HydrophobicContact CD2-SD 4.5Å; L374-V392 HydrophobicContact CB-CG1 4.08Å; L374-V392 HydrophobicContact CD1-CG1 4.1Å; L374-V392 HydrophobicContact CD1-CG2 4.29Å; L374-K396 PolarHBondContact N-O 3.16Å; L374-M398 PolarHBondContact O-N 3.02Å
375	T	94.2	Very high	91	Very high	21 Å²	21	64.9 Å²	64.9	13%	0.129	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.7	176.8	-162.6	0	0	0	0	110.7	F355 K356 A358 M398	F355-T375 CarbonylContact C-O 3.58Å; F355-T375 WeakPolarHBondContact CA-O 3.34Å; F355-T375 VanDerWaalsContact CD1-C 3.48Å; K356-T375 HydrophobicContact CG-CG2 3.85Å; K356-T375 PolarHBondContact N-O 3.4Å; K356-T375 PolarHBondContact O-N 3.42Å; A358-T375 HydrophobicContact CB-CG2 3.87Å; T375-M398 WeakPolarHBondContact CA-O 3.32Å; T375-M398 VanDerWaalsContact CB-O 3.29Å; T375-M398 WeakPolarHBondContact CB-O 3.15Å; T375-M398 PolarHBondContact OG1-O 2.95Å
376	P	95.6	Very high	91.5	Very high	24 Å²	24	69.1 Å²	69.1	16%	0.156	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	139	175.4	-27.5	35.9	0	0	0	112.7	V349 A352 F355 P400	V349-P376 HydrophobicContact CB-CG 4.28Å; V349-P376 HydrophobicContact CG2-CG 3.64Å; A352-P376 HydrophobicContact CB-CB 3.86Å; A352-P376 HydrophobicContact CB-CG 4.23Å; F355-P376 HydrophobicContact CD1-CG 4.3Å; F355-P376 HydrophobicContact CE1-CB 4.47Å; F355-P376 HydrophobicContact CE1-CG 3.72Å; F355-P376 HydrophobicContact CZ-CG 4.2Å; P376-P400 HydrophobicContact CG-CG 4.19Å
377	C	93.8	Very high	92.1	Very high	22 Å²	22	67 Å²	67	15%	0.149	40%	0.397	C	S	.	.			trans	-141	167.6	176.7	69.4	0	0	0	0	112	H354 K356 D381	H354-C377 PolarHBondContact O-N 3.07Å; K356-C377 HydrophobicContact CB-CB 4.15Å; K356-C377 HydrophobicContact CD-CB 3.79Å; K356-C377 HydrophobicContact CG-CB 3.85Å; C377-D381 HydrophobicContact CB-CB 4.26Å
378	S	93.8	Very high	92.4	Very high	84 Å²	84	63 Å²	63	59%	0.587	38%	0.377	S	S	*	.			trans	-74.3	147.5	175	-59.3	0	0	0	0	110.7	G380 D381	S378-G380 PolarHBondContact O-N 3.22Å; S378-D381 VanDerWaalsContact O-CB 3.32Å; S378-D381 WeakPolarHBondContact O-CB 3.49Å; S378-D381 PolarHBondContact O-N 3.31Å
379	P	92.4	Very high	92.7	Very high	83 Å²	83	65.2 Å²	65.2	54%	0.539	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.4	178.5	-26.1	33.7	0	0	0	114.8
380	G	91.3	Very high	93.1	Very high	75 Å²	75	67.5 Å²	67.5	77%	0.773	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	3.7	177.1	0	0	0	0	0	115.2	S378	S378-G380 PolarHBondContact O-N 3.22Å
381	D	93.1	Very high	93.4	Very high	38 Å²	38	71.2 Å²	71.2	20%	0.203	41%	0.405	C	S	.	.	S	Bend	trans	-70.4	131.8	176.8	-165.8	-47.9	0	0	0	109.3	K356 C377 S378 N383 A384	K356-D381 WeakPolarHBondContact CD-OD2 3.42Å; K356-D381 IonicContact NZ-OD2 2.76Å; K356-D381 PolarHBondContact NZ-OD2 3.41Å; C377-D381 HydrophobicContact CB-CB 4.26Å; S378-D381 VanDerWaalsContact O-CB 3.32Å; S378-D381 WeakPolarHBondContact O-CB 3.49Å; S378-D381 PolarHBondContact O-N 3.31Å; D381-N383 PolarHBondContact O-N 3.45Å; D381-N383 PolarHBondContact OD1-N 2.88Å; D381-A384 HydrophobicContact CB-CB 4.15Å; D381-A384 WeakPolarHBondContact O-CB 3.4Å; D381-A384 PolarHBondContact O-N 3.49Å
382	P	91.6	Very high	93.6	Very high	124 Å²	124	67.1 Å²	67.1	81%	0.805	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.9	-177.9	-27.3	34.5	0	0	0	114.8
383	N	92.8	Very high	93.7	Very high	114 Å²	114	67.2 Å²	67.2	61%	0.61	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	17.8	179	-59.6	-59.5	0	0	0	112.6	K356 D381 I385	K356-N383 HydrophobicContact CB-CB 4.41Å; K356-N383 WeakPolarHBondContact CB-O 3.41Å; D381-N383 PolarHBondContact O-N 3.45Å; D381-N383 PolarHBondContact OD1-N 2.88Å; N383-I385 PolarHBondContact O-N 2.97Å
384	A	94.8	Very high	93.5	Very high	31 Å²	31	69.4 Å²	69.4	26%	0.256	41%	0.412	S	S	.	.			trans	-67.9	128.1	178.4	0	0	0	0	0	110.9	H354 D381	H354-A384 HydrophobicContact CB-CB 4.16Å; D381-A384 HydrophobicContact CB-CB 4.15Å; D381-A384 WeakPolarHBondContact O-CB 3.4Å; D381-A384 PolarHBondContact O-N 3.49Å
385	I	94.6	Very high	93.3	Very high	63 Å²	63	75.1 Å²	75.1	32%	0.323	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	120.4	171.2	-49.3	172.7	0	0	0	106.1	H354 F355 R357 N383 M387	H354-I385 CarbonylContact C-O 3.59Å; H354-I385 VanDerWaalsContact CA-O 3.27Å; H354-I385 WeakPolarHBondContact CA-O 3.23Å; F355-I385 PolarHBondContact N-O 3.36Å; F355-I385 WeakPolarHBondContact O-CA 3.41Å; F355-I385 WeakPolarHBondContact O-CB 3.44Å; F355-I385 PolarHBondContact O-N 3.1Å; R357-I385 HydrophobicContact CG-CD1 4.4Å; N383-I385 PolarHBondContact O-N 2.97Å; I385-M387 HydrophobicContact CB-CE 4.32Å; I385-M387 HydrophobicContact CG2-CE 3.63Å; I385-M387 PolarHBondContact O-N 3.41Å; I385-M387 VanDerWaalsContact O-N 3.17Å
386	E	95.7	Very high	93.1	Very high	155 Å²	155	77.8 Å²	77.8	72%	0.724	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	111.9	174.9	-170.7	175.4	-167.8	0	0	108.9
387	M	93.6	Very high	93	Very high	36 Å²	36	78.4 Å²	78.4	18%	0.177	45%	0.45	C	S	.	.			trans	-166.5	153.9	177	56.3	176.5	50.2	0	0	109.6	T353 F355 L374 I385 E391 V392	T353-M387 CarbonylContact C-O 3.59Å; T353-M387 VanDerWaalsContact C-O 3.25Å; T353-M387 PolarHBondContact O-N 3.3Å; T353-M387 VanDerWaalsContact O-N 3.1Å; F355-M387 HydrophobicContact CB-CG 3.96Å; F355-M387 HydrophobicContact CB-SD 4.05Å; F355-M387 HydrophobicContact CD2-CG 3.82Å; F355-M387 WeakPolarHBondContact CD2-O 3.42Å; F355-M387 HydrophobicContact CG-CG 4.23Å; L374-M387 HydrophobicContact CD1-SD 3.99Å; L374-M387 HydrophobicContact CD2-SD 4.5Å; I385-M387 HydrophobicContact CB-CE 4.32Å; I385-M387 HydrophobicContact CG2-CE 3.63Å; I385-M387 PolarHBondContact O-N 3.41Å; I385-M387 VanDerWaalsContact O-N 3.17Å; M387-E391 HydrophobicContact CB-CB 4.42Å; M387-E391 VanDerWaalsContact CB-OE2 3.25Å; M387-E391 WeakPolarHBondContact CB-OE2 3.34Å; M387-V392 HydrophobicContact SD-CG2 4.25Å
388	T	95	Very high	92.9	Very high	56 Å²	56	80.5 Å²	80.5	34%	0.344	46%	0.458	S	S	.	.			trans	-97.5	164.3	176.5	67.9	0	0	0	0	111.5	M390 E391	T388-M390 PolarHBondContact O-N 3.26Å; T388-E391 PolarHBondContact N-OE1 3.06Å; T388-E391 PolarHBondContact O-N 3.09Å; T388-E391 PolarHBondContact OG1-OE1 2.97Å; T388-E391 VanDerWaalsContact OG1-OE1 3.04Å
389	W	94.4	Very high	92.8	Very high	118 Å²	118	80.6 Å²	80.6	45%	0.447	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-22.5	176.8	70.8	-91.1	0	0	0	113.6	V349 F355 E391 V392	V349-W389 HydrophobicContact CG1-CB 3.97Å; F355-W389 HydrophobicContact CZ-CB 4.21Å; W389-E391 PolarHBondContact O-N 2.76Å; W389-V392 PolarHBondContact O-N 3.05Å
390	M	94.7	Very high	92.8	Very high	143 Å²	143	78.1 Å²	78.1	70%	0.704	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.6	177	-65.9	-172.1	177.6	0	0	112.8	T388	T388-M390 PolarHBondContact O-N 3.26Å
391	E	94.4	Very high	93	Very high	118 Å²	118	77.7 Å²	77.7	55%	0.551	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-12.8	-179.7	-65.4	155.1	-127.4	0	0	112.2	M387 T388 W389 P393	M387-E391 HydrophobicContact CB-CB 4.42Å; M387-E391 VanDerWaalsContact CB-OE2 3.25Å; M387-E391 WeakPolarHBondContact CB-OE2 3.34Å; T388-E391 PolarHBondContact N-OE1 3.06Å; T388-E391 PolarHBondContact O-N 3.09Å; T388-E391 PolarHBondContact OG1-OE1 2.97Å; T388-E391 VanDerWaalsContact OG1-OE1 3.04Å; W389-E391 PolarHBondContact O-N 2.76Å; E391-P393 WeakPolarHBondContact O-CD 3.42Å
392	V	93.3	Very high	93.1	Very high	16 Å²	16	76 Å²	76	10%	0.097	41%	0.407	C	S	.	.	S	Bend	trans	-79.8	121.1	-179.6	-179.9	0	0	0	0	109.8	F355 L374 M387 W389 G394 L397	F355-V392 HydrophobicContact CD1-CG2 3.96Å; F355-V392 HydrophobicContact CD2-CG2 4.18Å; F355-V392 HydrophobicContact CE1-CG2 3.9Å; F355-V392 HydrophobicContact CE2-CG2 4.12Å; F355-V392 HydrophobicContact CG-CG2 4.11Å; F355-V392 HydrophobicContact CZ-CG2 3.99Å; L374-V392 HydrophobicContact CB-CG1 4.08Å; L374-V392 HydrophobicContact CD1-CG1 4.1Å; L374-V392 HydrophobicContact CD1-CG2 4.29Å; M387-V392 HydrophobicContact SD-CG2 4.25Å; W389-V392 PolarHBondContact O-N 3.05Å; V392-G394 PolarHBondContact O-N 3.45Å; V392-L397 HydrophobicContact CG1-CB 3.98Å; V392-L397 HydrophobicContact CG1-CD1 4.09Å
393	P	92.1	Very high	93.3	Very high	66 Å²	66	71.2 Å²	71.2	43%	0.429	38%	0.376	S	S	.	.			trans	-61.2	137	173.7	-22.1	33.9	0	0	0	111	E391 E395 K396 L397	E391-P393 WeakPolarHBondContact O-CD 3.42Å; P393-E395 VanDerWaalsContact C-N 3.27Å; P393-E395 PolarHBondContact O-N 3.26Å; P393-K396 HydrophobicContact CB-CB 4.3Å; P393-K396 HydrophobicContact CB-CD 4.49Å; P393-K396 HydrophobicContact CB-CG 4.19Å; P393-K396 HydrophobicContact CG-CD 4.26Å; P393-K396 HydrophobicContact CG-CG 4.47Å; P393-K396 PolarHBondContact O-N 2.68Å; P393-L397 PolarHBondContact O-N 3.45Å
394	G	89.5	Confident	93.5	Very high	54 Å²	54	67.1 Å²	67.1	56%	0.557	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-55.5	-37.9	-174.8	0	0	0	0	0	114.6	V392 K396	V392-G394 PolarHBondContact O-N 3.45Å; G394-K396 VanDerWaalsContact C-N 3.28Å; G394-K396 PolarHBondContact O-N 3.01Å
395	E	88.5	Confident	93.6	Very high	137 Å²	137	69.9 Å²	69.9	64%	0.64	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-73.2	-19.3	178.3	-57.6	-56	153.3	0	0	113.7	P393	P393-E395 VanDerWaalsContact C-N 3.27Å; P393-E395 PolarHBondContact O-N 3.26Å
396	K	90.9	Very high	93.7	Very high	76 Å²	76	67.2 Å²	67.2	33%	0.33	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-97.3	-8.7	-178.4	-62.4	-164.2	-177.9	-166.4	0	112.9	D372 L373 L374 P393 G394 M398	D372-K396 WeakPolarHBondContact OD2-CE 3.45Å; D372-K396 IonicContact OD2-NZ 2.66Å; D372-K396 PolarHBondContact OD2-NZ 3.46Å; L373-K396 CarbonylContact C-O 3.59Å; L373-K396 WeakPolarHBondContact CA-O 3.31Å; L374-K396 PolarHBondContact N-O 3.16Å; P393-K396 HydrophobicContact CB-CB 4.3Å; P393-K396 HydrophobicContact CB-CD 4.49Å; P393-K396 HydrophobicContact CB-CG 4.19Å; P393-K396 HydrophobicContact CG-CD 4.26Å; P393-K396 HydrophobicContact CG-CG 4.47Å; P393-K396 PolarHBondContact O-N 2.68Å; G394-K396 VanDerWaalsContact C-N 3.28Å; G394-K396 PolarHBondContact O-N 3.01Å; K396-M398 PolarHBondContact O-N 2.91Å
397	L	93	Very high	93.7	Very high	38 Å²	38	59.8 Å²	59.8	20%	0.199	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-70	121.9	179.8	-179.9	65	0	0	0	110.4	V349 F355 R363 V392 P393	V349-L397 HydrophobicContact CG1-CD1 3.9Å; V349-L397 HydrophobicContact CG1-CD2 4.08Å; V349-L397 HydrophobicContact CG2-CD1 4.23Å; F355-L397 HydrophobicContact CE1-CD1 3.97Å; R363-L397 PolarHBondContact NE-O 3.5Å; R363-L397 PolarHBondContact NH2-O 2.89Å; V392-L397 HydrophobicContact CG1-CB 3.98Å; V392-L397 HydrophobicContact CG1-CD1 4.09Å; P393-L397 PolarHBondContact O-N 3.45Å
398	M	91.9	Very high	93.9	Very high	65 Å²	65	61.3 Å²	61.3	32%	0.32	33%	0.329	S	S	.	.			trans	-109.8	102.5	168.5	-177.3	178.7	-175	0	0	108.9	A358 L373 L374 T375 K396	A358-M398 HydrophobicContact CB-SD 4Å; L373-M398 HydrophobicContact CB-CB 3.95Å; L373-M398 HydrophobicContact CD1-CB 4.2Å; L373-M398 HydrophobicContact CD1-CG 4.45Å; L373-M398 HydrophobicContact CD1-SD 4.13Å; L374-M398 PolarHBondContact O-N 3.02Å; T375-M398 WeakPolarHBondContact CA-O 3.32Å; T375-M398 VanDerWaalsContact CB-O 3.29Å; T375-M398 WeakPolarHBondContact CB-O 3.15Å; T375-M398 PolarHBondContact OG1-O 2.95Å; K396-M398 PolarHBondContact O-N 2.91Å
399	E	91.3	Very high	93.9	Very high	87 Å²	87	65.8 Å²	65.8	41%	0.407	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-67.2	144.4	177.1	69.6	-80.4	-162.6	0	0	111.3	R363	R363-E399 IonicContact CZ-OE2 3.31Å; R363-E399 IonicContact NE-OE2 3.18Å; R363-E399 IonicContact NH2-OE2 3.11Å; R363-E399 PolarHBondContact NH2-OE2 2.92Å
400	P	92.9	Very high	94	Very high	30 Å²	30	60.1 Å²	60.1	20%	0.195	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-61.1	142.7	169	-20.5	32.6	0	0	0	110.5	P345 K348 P376	P345-P400 WeakPolarHBondContact CB-O 3.42Å; P345-P400 WeakPolarHBondContact CG-O 3.41Å; K348-P400 HydrophobicContact CB-CG 4.42Å; K348-P400 HydrophobicContact CD-CB 4.45Å; K348-P400 HydrophobicContact CD-CG 4.36Å; P376-P400 HydrophobicContact CG-CG 4.19Å
401	V	94.3	Very high	94	Very high	67 Å²	67	54.2 Å²	54.2	41%	0.406	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-72.7	155.1	172.2	-60.4	0	0	0	0	111	P311	P311-V401 HydrophobicContact CB-CG1 4.02Å
402	V	95.9	Very high	94.1	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.018	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-65.6	136.5	173	179.9	0	0	0	0	109.6	L307 P311 N312 S313 A341 L342 P345 D406 M407	L307-V402 HydrophobicContact CD1-CG1 4.33Å; P311-V402 PolarHBondContact O-N 3.16Å; N312-V402 WeakPolarHBondContact CA-O 3.39Å; N312-V402 HydrophobicContact CB-CB 4.2Å; S313-V402 PolarHBondContact N-O 2.97Å; S313-V402 PolarHBondContact OG-O 3.19Å; S313-V402 VanDerWaalsContact OG-O 3.1Å; A341-V402 HydrophobicContact CB-CG1 4.43Å; L342-V402 HydrophobicContact CD2-CG2 4.2Å; P345-V402 HydrophobicContact CG-CG2 3.85Å; V402-D406 HydrophobicContact CG1-CB 4.41Å; V402-M407 HydrophobicContact CG1-SD 4.31Å
403	S	96.1	Very high	94.1	Very high	22 Å²	22	57.8 Å²	57.8	15%	0.154	32%	0.319	C	S	.	.			trans	-128.6	163.8	-174.1	68.2	0	0	0	0	112.9	S313 P405 D406 M407	S313-S403 WeakPolarHBondContact OG-CA 3.39Å; S313-S403 WeakPolarHBondContact OG-CB 3.28Å; S403-P405 VanDerWaalsContact C-N 3.35Å; S403-P405 WeakPolarHBondContact OG-CD 3.44Å; S403-D406 PolarHBondContact N-OD2 3.29Å; S403-D406 VanDerWaalsContact N-OD2 3.11Å; S403-D406 VanDerWaalsContact O-CB 3.28Å; S403-D406 WeakPolarHBondContact O-CB 3.39Å; S403-D406 PolarHBondContact O-N 3.4Å; S403-D406 PolarHBondContact OG-OD2 2.95Å; S403-M407 PolarHBondContact O-N 3.31Å
404	M	96.7	Very high	94.1	Very high	29 Å²	29	55.8 Å²	55.8	14%	0.143	31%	0.305	C	S	.	.	H	α-helix	trans	-57.7	-39.6	178.4	-175	54.8	169.5	0	0	113.2	L314 D318 A321 L322 D406 M407 L408	L314-M404 VanDerWaalsContact CD2-CA 3.48Å; L314-M404 HydrophobicContact CD2-CB 3.67Å; L314-M404 HydrophobicContact CD2-CG 4.49Å; L314-M404 VanDerWaalsContact CD2-N 3.31Å; L314-M404 HydrophobicContact CD2-SD 4.21Å; D318-M404 HydrophobicContact CB-SD 4.18Å; A321-M404 HydrophobicContact CB-CE 4.39Å; L322-M404 HydrophobicContact CD1-SD 4.16Å; L322-M404 HydrophobicContact CD2-CE 3.81Å; L322-M404 HydrophobicContact CD2-SD 3.92Å; L322-M404 HydrophobicContact CG-CE 3.85Å; L322-M404 HydrophobicContact CG-SD 3.95Å; M404-D406 VanDerWaalsContact C-N 3.26Å; M404-D406 PolarHBondContact O-N 3.03Å; M404-M407 WeakPolarHBondContact O-CB 3.25Å; M404-M407 PolarHBondContact O-N 3.45Å; M404-M407 HydrophobicContact SD-CB 4.26Å; M404-L408 HydrophobicContact CE-CD1 4.27Å; M404-L408 HydrophobicContact CE-CD2 3.86Å; M404-L408 HydrophobicContact CE-CG 4Å; M404-L408 HydrophobicContact CG-CD1 4.22Å; M404-L408 HydrophobicContact CG-CG 4.35Å; M404-L408 WeakPolarHBondContact O-CG 3.49Å; M404-L408 PolarHBondContact O-N 2.95Å; M404-L408 HydrophobicContact SD-CG 4.21Å
405	P	96.7	Very high	94.3	Very high	89 Å²	89	61.7 Å²	61.7	58%	0.578	32%	0.315	S	S	*	.	H	α-helix	trans	-57.2	-35.7	171	-28.1	36.1	0	0	0	114.4	S403 R409	S403-P405 VanDerWaalsContact C-N 3.35Å; S403-P405 WeakPolarHBondContact OG-CD 3.44Å; P405-R409 VanDerWaalsContact O-CB 3.29Å; P405-R409 WeakPolarHBondContact O-CB 3.29Å; P405-R409 PolarHBondContact O-N 3.33Å
406	D	96.3	Very high	94.5	Very high	6 Å²	6	57.8 Å²	57.8	3%	0.032	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-42.3	177.2	-62.8	-43.3	0	0	0	110.9	Q344 K348 V402 S403 M404 R409 S410	Q344-D406 HydrophobicContact CB-CB 3.9Å; Q344-D406 WeakPolarHBondContact CB-OD1 3.34Å; Q344-D406 HydrophobicContact CG-CB 3.81Å; K348-D406 VanDerWaalsContact CE-OD1 3.24Å; K348-D406 WeakPolarHBondContact CE-OD1 3.32Å; K348-D406 IonicContact NZ-OD1 2.71Å; K348-D406 PolarHBondContact NZ-OD1 3.37Å; K348-D406 IonicContact NZ-OD2 2.91Å; K348-D406 PolarHBondContact NZ-OD2 3.45Å; V402-D406 HydrophobicContact CG1-CB 4.41Å; S403-D406 PolarHBondContact N-OD2 3.29Å; S403-D406 VanDerWaalsContact N-OD2 3.11Å; S403-D406 VanDerWaalsContact O-CB 3.28Å; S403-D406 WeakPolarHBondContact O-CB 3.39Å; S403-D406 PolarHBondContact O-N 3.4Å; S403-D406 PolarHBondContact OG-OD2 2.95Å; M404-D406 VanDerWaalsContact C-N 3.26Å; M404-D406 PolarHBondContact O-N 3.03Å; D406-R409 PolarHBondContact O-N 3.05Å; D406-S410 PolarHBondContact O-N 3.25Å
407	M	96.8	Very high	94.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-46.8	175.2	-61.5	-64.8	-76.2	0	0	111.8	F303 L314 L322 V338 A341 V402 S403 M404 R409 S410 L411	F303-M407 HydrophobicContact CD1-CE 3.33Å; F303-M407 HydrophobicContact CE1-CE 3.6Å; F303-M407 HydrophobicContact CG-CE 4.38Å; L314-M407 HydrophobicContact CD1-CE 4.42Å; L314-M407 HydrophobicContact CD1-CG 3.91Å; L314-M407 HydrophobicContact CD1-SD 4.38Å; L314-M407 HydrophobicContact CD2-CG 4.28Å; L322-M407 HydrophobicContact CD1-CB 4.26Å; L322-M407 HydrophobicContact CD1-CE 3.68Å; L322-M407 HydrophobicContact CD1-CG 4.32Å; L322-M407 HydrophobicContact CD2-CB 4.04Å; V338-M407 HydrophobicContact CG2-CE 4.04Å; A341-M407 HydrophobicContact CB-CG 4.43Å; A341-M407 HydrophobicContact CB-SD 3.37Å; A341-M407 WeakPolarHBondContact CB-SD 3.35Å; V402-M407 HydrophobicContact CG1-SD 4.31Å; S403-M407 PolarHBondContact O-N 3.31Å; M404-M407 WeakPolarHBondContact O-CB 3.25Å; M404-M407 PolarHBondContact O-N 3.45Å; M404-M407 HydrophobicContact SD-CB 4.26Å; M407-R409 VanDerWaalsContact C-N 3.34Å; M407-R409 PolarHBondContact O-N 3.31Å; M407-S410 PolarHBondContact O-N 2.98Å; M407-L411 WeakPolarHBondContact O-CB 3.46Å; M407-L411 PolarHBondContact O-N 3.33Å
408	L	96.9	Very high	94.5	Very high	67 Å²	67	57.5 Å²	57.5	35%	0.351	31%	0.308	S	S	.	.	H	α-helix	trans	-65.2	-38	179.1	-70.5	176.9	0	0	0	112.2	K325 M404 L411 S412	K325-L408 HydrophobicContact CD-CD2 3.93Å; M404-L408 HydrophobicContact CE-CD1 4.27Å; M404-L408 HydrophobicContact CE-CD2 3.86Å; M404-L408 HydrophobicContact CE-CG 4Å; M404-L408 HydrophobicContact CG-CD1 4.22Å; M404-L408 HydrophobicContact CG-CG 4.35Å; M404-L408 WeakPolarHBondContact O-CG 3.49Å; M404-L408 PolarHBondContact O-N 2.95Å; M404-L408 HydrophobicContact SD-CG 4.21Å; L408-L411 PolarHBondContact O-N 2.96Å; L408-S412 PolarHBondContact O-N 2.93Å
409	R	95.8	Very high	94.6	Very high	150 Å²	150	57.9 Å²	57.9	57%	0.566	31%	0.311	S	S	*	.	H	α-helix	trans	-61.7	-47.5	174	-172.6	-177.1	-143.2	174.5	9.4	110.8	P405 D406 M407 L411 S412 N413	P405-R409 VanDerWaalsContact O-CB 3.29Å; P405-R409 WeakPolarHBondContact O-CB 3.29Å; P405-R409 PolarHBondContact O-N 3.33Å; D406-R409 PolarHBondContact O-N 3.05Å; M407-R409 VanDerWaalsContact C-N 3.34Å; M407-R409 PolarHBondContact O-N 3.31Å; R409-L411 VanDerWaalsContact C-N 3.34Å; R409-L411 PolarHBondContact O-N 3.3Å; R409-S412 PolarHBondContact O-N 2.97Å; R409-S412 PolarHBondContact O-OG 3.44Å; R409-N413 PolarHBondContact O-N 3.48Å; R409-N413 PolarHBondContact O-ND2 2.94Å
410	S	96.2	Very high	94.6	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.2	-41.5	178.4	-168.7	0	0	0	0	112.2	I337 D340 D406 M407 S412 N413 T414	I337-S410 WeakPolarHBondContact CA-OG 3.33Å; I337-S410 PolarHBondContact O-OG 2.69Å; D340-S410 VanDerWaalsContact CB-OG 3.29Å; D340-S410 WeakPolarHBondContact CB-OG 3.12Å; D340-S410 VanDerWaalsContact OD2-CB 3.26Å; D340-S410 WeakPolarHBondContact OD2-CB 3.44Å; D340-S410 PolarHBondContact OD2-OG 3.49Å; D406-S410 PolarHBondContact O-N 3.25Å; M407-S410 PolarHBondContact O-N 2.98Å; S410-S412 PolarHBondContact O-N 3.49Å; S410-N413 PolarHBondContact O-N 3.01Å; S410-T414 PolarHBondContact O-N 3.17Å; S410-T414 PolarHBondContact O-OG1 3.47Å
411	L	95.7	Very high	94.5	Very high	19 Å²	19	65.4 Å²	65.4	10%	0.099	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-43.6	174.3	178.2	61	0	0	0	112	K325 T326 Y329 I337 M407 L408 R409 N413 T414	K325-L411 HydrophobicContact CB-CD2 3.88Å; K325-L411 HydrophobicContact CD-CD2 4.43Å; T326-L411 HydrophobicContact CG2-CD1 3.68Å; T326-L411 HydrophobicContact CG2-CD2 4.41Å; Y329-L411 HydrophobicContact CE1-CD1 3.96Å; I337-L411 HydrophobicContact CD1-CD1 3.73Å; I337-L411 HydrophobicContact CG2-CB 4.44Å; M407-L411 WeakPolarHBondContact O-CB 3.46Å; M407-L411 PolarHBondContact O-N 3.33Å; L408-L411 PolarHBondContact O-N 2.96Å; R409-L411 VanDerWaalsContact C-N 3.34Å; R409-L411 PolarHBondContact O-N 3.3Å; L411-N413 PolarHBondContact O-N 3.31Å; L411-T414 PolarHBondContact O-N 3.07Å; L411-T414 VanDerWaalsContact O-N 3.1Å
412	S	94.9	Very high	94.3	Very high	90 Å²	90	64.5 Å²	64.5	63%	0.629	34%	0.337	S	S	*	.	H	α-helix	trans	-63.2	-25.6	179.5	69.3	0	0	0	0	113.8	L408 R409 S410	L408-S412 PolarHBondContact O-N 2.93Å; R409-S412 PolarHBondContact O-N 2.97Å; R409-S412 PolarHBondContact O-OG 3.44Å; S410-S412 PolarHBondContact O-N 3.49Å
413	N	93.1	Very high	94.2	Very high	119 Å²	119	67 Å²	67	64%	0.636	35%	0.35	S	S	*	.	H	α-helix	trans	-89.9	-11.7	178.7	-66.2	-27	0	0	0	113.1	R409 S410 L411	R409-N413 PolarHBondContact O-N 3.48Å; R409-N413 PolarHBondContact O-ND2 2.94Å; S410-N413 PolarHBondContact O-N 3.01Å; L411-N413 PolarHBondContact O-N 3.31Å
414	T	93.1	Very high	94.1	Very high	24 Å²	24	71.7 Å²	71.7	15%	0.147	37%	0.37	C	S	.	.			trans	-115	115.6	-173.9	-50.9	0	0	0	0	109.8	Y329 I336 I337 S410 L411	Y329-T414 HydrophobicContact CE1-CG2 4.47Å; Y329-T414 WeakPolarHBondContact CE1-O 3.34Å; Y329-T414 PolarHBondContact OH-O 3.45Å; I336-T414 HydrophobicContact CG2-CG2 4.42Å; I337-T414 HydrophobicContact CD1-CG2 4.33Å; I337-T414 HydrophobicContact CG1-CG2 3.85Å; S410-T414 PolarHBondContact O-N 3.17Å; S410-T414 PolarHBondContact O-OG1 3.47Å; L411-T414 PolarHBondContact O-N 3.07Å; L411-T414 VanDerWaalsContact O-N 3.1Å
415	K	93.2	Very high	94	Very high	177 Å²	177	74.9 Å²	74.9	77%	0.77	38%	0.383	S	S	*	.			trans	-91.5	153.4	173.8	-68.9	-173.2	178.5	-177	0	110.5
416	P	93.6	Very high	93.8	Very high	56 Å²	56	70.8 Å²	70.8	36%	0.364	36%	0.356	S	S	.	.			trans	-63.2	137.6	175.3	27.2	-33.3	0	0	0	110.1	Y329	Y329-P416 HydrophobicContact CD2-CB 3.99Å; Y329-P416 HydrophobicContact CD2-CG 4.49Å; Y329-P416 HydrophobicContact CE2-CB 4.04Å; Y329-P416 HydrophobicContact CE2-CG 4.12Å; Y329-P416 HydrophobicContact CG-CB 4.27Å
417	T	92.2	Very high	93.6	Very high	94 Å²	94	76.8 Å²	76.8	58%	0.577	38%	0.382	S	S	*	.	S	Bend	trans	-79.8	-26.3	-177.5	-60.7	0	0	0	0	112.2	D333	D333-T417 VanDerWaalsContact OD1-CB 3.31Å; D333-T417 WeakPolarHBondContact OD1-CB 3.33Å; D333-T417 PolarHBondContact OD1-OG1 3.45Å; D333-T417 PolarHBondContact OD2-N 2.99Å
418	V	92.3	Very high	93.5	Very high	13 Å²	13	82.9 Å²	82.9	8%	0.079	41%	0.408	C	S	.	.			trans	-91.7	124.4	-177.2	-176.9	0	0	0	0	109.6	P168 P169 L293 D422 L423	P168-V418 HydrophobicContact CB-CB 4.45Å; P168-V418 HydrophobicContact CB-CG1 3.84Å; P168-V418 HydrophobicContact CB-CG2 3.76Å; P169-V418 HydrophobicContact CG-CG2 4.21Å; L293-V418 HydrophobicContact CD1-CB 4.5Å; L293-V418 HydrophobicContact CD1-CG1 4.34Å; L293-V418 HydrophobicContact CD2-CB 4.44Å; L293-V418 HydrophobicContact CD2-CG2 4.15Å; V418-D422 HydrophobicContact CG1-CB 4.45Å; V418-L423 HydrophobicContact CG1-CD2 3.92Å; V418-L423 HydrophobicContact CG1-CG 4.04Å
419	N	92.3	Very high	93.2	Very high	73 Å²	73	80 Å²	80	39%	0.39	39%	0.393	S	S	.	.			trans	-95.1	167.1	176.7	66.7	52	0	0	0	111.7	Q421 D422 L423	N419-Q421 VanDerWaalsContact C-N 3.33Å; N419-Q421 PolarHBondContact O-N 2.93Å; N419-Q421 WeakPolarHBondContact OD1-CA 3.26Å; N419-Q421 WeakPolarHBondContact OD1-CB 3.5Å; N419-Q421 PolarHBondContact OD1-N 3.04Å; N419-D422 PolarHBondContact ND2-OD2 2.78Å; N419-D422 PolarHBondContact O-N 2.96Å; N419-D422 PolarHBondContact OD1-N 3.07Å; N419-D422 PolarHBondContact OD1-OD2 2.89Å; N419-L423 PolarHBondContact O-N 2.9Å
420	E	91.1	Very high	92.9	Very high	148 Å²	148	74.1 Å²	74.1	69%	0.692	37%	0.374	S	S	*	.	H	α-helix	trans	-64.3	-34.5	179.7	-169.8	170	-162.6	0	0	112.8	D422 L423 E424	E420-D422 VanDerWaalsContact C-N 3.3Å; E420-D422 PolarHBondContact O-N 3.46Å; E420-L423 WeakPolarHBondContact O-CB 3.39Å; E420-L423 PolarHBondContact O-N 3.17Å; E420-L423 VanDerWaalsContact O-N 3.13Å; E420-E424 WeakPolarHBondContact O-CG 3.37Å; E420-E424 PolarHBondContact O-N 3Å
421	Q	91.6	Very high	92.6	Very high	127 Å²	127	80.4 Å²	80.4	59%	0.593	40%	0.403	S	S	*	.	H	α-helix	trans	-64	-35.5	179.1	-60.1	178.5	-0.9	0	0	112.3	N419 E424 K425	N419-Q421 VanDerWaalsContact C-N 3.33Å; N419-Q421 PolarHBondContact O-N 2.93Å; N419-Q421 WeakPolarHBondContact OD1-CA 3.26Å; N419-Q421 WeakPolarHBondContact OD1-CB 3.5Å; N419-Q421 PolarHBondContact OD1-N 3.04Å; Q421-E424 PolarHBondContact O-N 3.41Å; Q421-K425 WeakPolarHBondContact O-CG 3.13Å; Q421-K425 PolarHBondContact O-N 2.94Å; Q421-K425 VanDerWaalsContact O-N 3.09Å
422	D	91	Very high	92.2	Very high	49 Å²	49	84 Å²	84	26%	0.262	42%	0.422	S	S	.	.	H	α-helix	trans	-68.6	-38.9	176.2	-65.6	-34.4	0	0	0	110.4	V418 N419 E420 K425 L426	V418-D422 HydrophobicContact CG1-CB 4.45Å; N419-D422 PolarHBondContact ND2-OD2 2.78Å; N419-D422 PolarHBondContact O-N 2.96Å; N419-D422 PolarHBondContact OD1-N 3.07Å; N419-D422 PolarHBondContact OD1-OD2 2.89Å; E420-D422 VanDerWaalsContact C-N 3.3Å; E420-D422 PolarHBondContact O-N 3.46Å; D422-K425 PolarHBondContact O-N 3Å; D422-L426 WeakPolarHBondContact O-CG 3.32Å; D422-L426 PolarHBondContact O-N 3.39Å
423	L	92.7	Very high	91.8	Very high	56 Å²	56	83.5 Å²	83.5	29%	0.293	41%	0.409	S	S	.	.	H	α-helix	trans	-66.3	-40.8	174.7	-63	177.9	0	0	0	111.9	P168 L293 V418 N419 E420 K425 L426 K427	P168-L423 HydrophobicContact CG-CD2 4.07Å; L293-L423 HydrophobicContact CD1-CD1 4.08Å; L293-L423 HydrophobicContact CD1-CD2 4.04Å; L293-L423 HydrophobicContact CG-CD2 4.43Å; V418-L423 HydrophobicContact CG1-CD2 3.92Å; V418-L423 HydrophobicContact CG1-CG 4.04Å; N419-L423 PolarHBondContact O-N 2.9Å; E420-L423 WeakPolarHBondContact O-CB 3.39Å; E420-L423 PolarHBondContact O-N 3.17Å; E420-L423 VanDerWaalsContact O-N 3.13Å; L423-K425 PolarHBondContact O-N 3.33Å; L423-L426 PolarHBondContact O-N 3.06Å; L423-K427 WeakPolarHBondContact O-CB 3.27Å; L423-K427 PolarHBondContact O-N 3.38Å
424	E	94.2	Very high	91	Very high	120 Å²	120	79 Å²	79	56%	0.561	39%	0.391	S	S	*	.	H	α-helix	trans	-61.3	-43.4	175.3	-74.1	179.5	169.1	0	0	112	E420 Q421 L426 K427 K428	E420-E424 WeakPolarHBondContact O-CG 3.37Å; E420-E424 PolarHBondContact O-N 3Å; Q421-E424 PolarHBondContact O-N 3.41Å; E424-L426 PolarHBondContact O-N 3.25Å; E424-K427 PolarHBondContact O-N 3.03Å; E424-K428 WeakPolarHBondContact O-CB 3.39Å; E424-K428 PolarHBondContact O-N 3.47Å
425	K	94	Very high	89.8	Confident	96 Å²	96	82.7 Å²	82.7	42%	0.417	41%	0.407	S	S	.	.	H	α-helix	trans	-63.3	-41.2	175.8	-71.1	171	-171.3	163.7	0	112	W275 Q421 D422 L423 F429	W275-K425 HydrophobicContact CE3-CB 3.95Å; W275-K425 HydrophobicContact CH2-CB 3.72Å; W275-K425 HydrophobicContact CH2-CD 4.02Å; W275-K425 HydrophobicContact CZ2-CB 4.28Å; W275-K425 HydrophobicContact CZ2-CD 3.88Å; W275-K425 HydrophobicContact CZ3-CB 3.53Å; Q421-K425 WeakPolarHBondContact O-CG 3.13Å; Q421-K425 PolarHBondContact O-N 2.94Å; Q421-K425 VanDerWaalsContact O-N 3.09Å; D422-K425 PolarHBondContact O-N 3Å; L423-K425 PolarHBondContact O-N 3.33Å; K425-F429 WeakPolarHBondContact O-CB 3.4Å; K425-F429 PolarHBondContact O-N 2.73Å
426	L	93.6	Very high	88.2	Confident	2 Å²	2	81.5 Å²	81.5	1%	0.01	40%	0.404	C	S	.	.	H	α-helix	trans	-65.4	-41.8	176.1	-74.6	167.4	0	0	0	111.7	F166 P168 P274 W275 Y290 D422 L423 E424 F429 T430	F166-L426 HydrophobicContact CD2-CD2 4.11Å; P168-L426 HydrophobicContact CB-CD1 4.27Å; P168-L426 HydrophobicContact CG-CD1 4.05Å; P274-L426 HydrophobicContact CG-CD2 4Å; W275-L426 HydrophobicContact CZ3-CD2 3.94Å; W275-L426 HydrophobicContact CZ3-CG 4.03Å; Y290-L426 HydrophobicContact CE2-CB 4.19Å; Y290-L426 HydrophobicContact CE2-CD1 4.33Å; D422-L426 WeakPolarHBondContact O-CG 3.32Å; D422-L426 PolarHBondContact O-N 3.39Å; L423-L426 PolarHBondContact O-N 3.06Å; E424-L426 PolarHBondContact O-N 3.25Å; L426-F429 PolarHBondContact O-N 3.49Å; L426-T430 WeakPolarHBondContact O-CB 3.25Å; L426-T430 PolarHBondContact O-N 3.44Å; L426-T430 PolarHBondContact O-OG1 3.44Å
427	K	92	Very high	86.1	Confident	133 Å²	133	82.4 Å²	82.4	58%	0.578	42%	0.423	S	S	*	.	H	α-helix	trans	-61.6	-49.5	175.8	-177.1	177.5	175.2	-178	0	110.7	L423 E424 F429 T430 E431	L423-K427 WeakPolarHBondContact O-CB 3.27Å; L423-K427 PolarHBondContact O-N 3.38Å; E424-K427 PolarHBondContact O-N 3.03Å; K427-F429 VanDerWaalsContact C-N 3.33Å; K427-F429 PolarHBondContact O-N 2.86Å; K427-T430 CarbonylContact O-C 3.49Å; K427-T430 WeakPolarHBondContact O-CA 3.33Å; K427-T430 WeakPolarHBondContact O-CB 3.47Å; K427-T430 PolarHBondContact O-N 3.25Å; K427-E431 WeakPolarHBondContact CE-OE1 3.44Å; K427-E431 WeakPolarHBondContact O-CG 3.5Å; K427-E431 PolarHBondContact O-N 2.98Å
428	K	93.6	Very high	85.7	Confident	128 Å²	128	81.8 Å²	81.8	56%	0.557	42%	0.415	S	S	*	.	H	α-helix	trans	-57.3	-45.4	175.8	-176.5	174.7	-179	176.2	0	112	E424 T430 E431 D432	E424-K428 WeakPolarHBondContact O-CB 3.39Å; E424-K428 PolarHBondContact O-N 3.47Å; K428-T430 VanDerWaalsContact C-N 3.27Å; K428-T430 PolarHBondContact O-N 3.01Å; K428-E431 PolarHBondContact O-N 3.47Å; K428-D432 WeakPolarHBondContact O-CB 3.31Å; K428-D432 VanDerWaalsContact O-CG 3.24Å; K428-D432 PolarHBondContact O-N 3.36Å
429	F	91.7	Very high	85.4	Confident	5 Å²	5	85.4 Å²	85.4	2%	0.022	43%	0.433	C	S	.	.	H	α-helix	trans	-59.9	-39.7	175.2	-179.8	-87.7	0	0	0	112.1	F166 P274 W275 K425 L426 K427 F433	F166-F429 HydrophobicContact CD2-CD1 4.19Å; F166-F429 HydrophobicContact CD2-CE1 4.41Å; F166-F429 AromaticContact CE2-CD1 3.8Å; F166-F429 HydrophobicContact CE2-CD1 3.8Å; F166-F429 HydrophobicContact CE2-CE1 4.22Å; F166-F429 HydrophobicContact CZ-CD1 4.15Å; F166-F429 HydrophobicContact CZ-CE1 4.27Å; P274-F429 HydrophobicContact CB-CD1 3.91Å; P274-F429 HydrophobicContact CB-CD2 4.07Å; P274-F429 HydrophobicContact CB-CE1 3.64Å; P274-F429 HydrophobicContact CB-CE2 3.8Å; P274-F429 HydrophobicContact CB-CG 4.13Å; P274-F429 HydrophobicContact CB-CZ 3.6Å; P274-F429 HydrophobicContact CG-CB 4.34Å; P274-F429 HydrophobicContact CG-CD1 3.66Å; P274-F429 HydrophobicContact CG-CD2 4.04Å; P274-F429 HydrophobicContact CG-CE1 3.95Å; P274-F429 HydrophobicContact CG-CE2 4.29Å; P274-F429 HydrophobicContact CG-CG 3.73Å; P274-F429 HydrophobicContact CG-CZ 4.26Å; P274-F429 WeakPolarHBondContact O-CE2 3.5Å; W275-F429 HydrophobicContact CB-CD2 4.22Å; K425-F429 WeakPolarHBondContact O-CB 3.4Å; K425-F429 PolarHBondContact O-N 2.73Å; L426-F429 PolarHBondContact O-N 3.49Å; K427-F429 VanDerWaalsContact C-N 3.33Å; K427-F429 PolarHBondContact O-N 2.86Å; F429-F433 AromaticContact CD2-CD2 3.52Å; F429-F433 HydrophobicContact CD2-CD2 3.52Å; F429-F433 AromaticContact CD2-CE2 4Å; F429-F433 HydrophobicContact CD2-CE2 4Å; F429-F433 HydrophobicContact CE1-CB 4.36Å; F429-F433 AromaticContact CE2-CD2 3.52Å; F429-F433 HydrophobicContact CE2-CD2 3.52Å; F429-F433 HydrophobicContact CE2-CE2 4.11Å; F429-F433 HydrophobicContact CE2-CG 4.18Å; F429-F433 HydrophobicContact CG-CD2 4.07Å; F429-F433 HydrophobicContact CZ-CB 4.22Å; F429-F433 HydrophobicContact CZ-CD2 4.07Å; F429-F433 HydrophobicContact CZ-CG 4.34Å; F429-F433 WeakPolarHBondContact O-CB 3.44Å; F429-F433 WeakPolarHBondContact O-CD2 3.18Å; F429-F433 PolarHBondContact O-N 3.24Å
430	T	89.6	Confident	85	Confident	28 Å²	28	86.1 Å²	86.1	17%	0.172	44%	0.435	C	S	.	.	H	α-helix	trans	-68.1	-37.9	178.6	-52.4	0	0	0	0	111.8	F166 L426 K427 K428 G434 Q435	F166-T430 WeakPolarHBondContact CE2-OG1 2.84Å; L426-T430 WeakPolarHBondContact O-CB 3.25Å; L426-T430 PolarHBondContact O-N 3.44Å; L426-T430 PolarHBondContact O-OG1 3.44Å; K427-T430 CarbonylContact O-C 3.49Å; K427-T430 WeakPolarHBondContact O-CA 3.33Å; K427-T430 WeakPolarHBondContact O-CB 3.47Å; K427-T430 PolarHBondContact O-N 3.25Å; K428-T430 VanDerWaalsContact C-N 3.27Å; K428-T430 PolarHBondContact O-N 3.01Å; T430-G434 WeakPolarHBondContact O-CA 3.43Å; T430-G434 PolarHBondContact O-N 3.37Å; T430-Q435 HydrophobicContact CG2-CG 4.04Å
431	E	89.7	Confident	84.7	Confident	131 Å²	131	82.5 Å²	82.5	61%	0.612	42%	0.42	S	S	*	.	H	α-helix	trans	-68.4	-43.8	175.1	-71	170.6	177.9	0	0	111.8	K427 K428	K427-E431 WeakPolarHBondContact CE-OE1 3.44Å; K427-E431 WeakPolarHBondContact O-CG 3.5Å; K427-E431 PolarHBondContact O-N 2.98Å; K428-E431 PolarHBondContact O-N 3.47Å
432	D	87.8	Confident	84.2	Confident	95 Å²	95	79.7 Å²	79.7	51%	0.508	41%	0.41	S	S	.	.	H	α-helix	trans	-72.4	-33.6	-177	-71.1	-18	0	0	0	112.8	K428	K428-D432 WeakPolarHBondContact O-CB 3.31Å; K428-D432 VanDerWaalsContact O-CG 3.24Å; K428-D432 PolarHBondContact O-N 3.36Å
433	F	85.2	Confident	83.8	Confident	79 Å²	79	81.7 Å²	81.7	35%	0.346	42%	0.419	S	S	.	.	H	α-helix	trans	-124.2	-1.6	-169.4	-59.9	-69.6	0	0	0	115.3	R288 F429	R288-F433 PolarHBondContact NH1-O 3.24Å; F429-F433 AromaticContact CD2-CD2 3.52Å; F429-F433 HydrophobicContact CD2-CD2 3.52Å; F429-F433 AromaticContact CD2-CE2 4Å; F429-F433 HydrophobicContact CD2-CE2 4Å; F429-F433 HydrophobicContact CE1-CB 4.36Å; F429-F433 AromaticContact CE2-CD2 3.52Å; F429-F433 HydrophobicContact CE2-CD2 3.52Å; F429-F433 HydrophobicContact CE2-CE2 4.11Å; F429-F433 HydrophobicContact CE2-CG 4.18Å; F429-F433 HydrophobicContact CG-CD2 4.07Å; F429-F433 HydrophobicContact CZ-CB 4.22Å; F429-F433 HydrophobicContact CZ-CD2 4.07Å; F429-F433 HydrophobicContact CZ-CG 4.34Å; F429-F433 WeakPolarHBondContact O-CB 3.44Å; F429-F433 WeakPolarHBondContact O-CD2 3.18Å; F429-F433 PolarHBondContact O-N 3.24Å
434	G	77.4	Confident	83.1	Confident	26 Å²	26	83.6 Å²	83.6	27%	0.268	43%	0.428	S	S	.	.			trans	66.1	178.6	177	0	0	0	0	0	115.3	T430	T430-G434 WeakPolarHBondContact O-CA 3.43Å; T430-G434 PolarHBondContact O-N 3.37Å
435	Q	67.7	Low	82.3	Confident	101 Å²	101	80.8 Å²	80.8	47%	0.472	42%	0.418	S	S	.	.	S	Bend	trans	-100.7	-14.5	169.2	-63.8	-173.4	-0.2	0	0	112.4	R288 T430	R288-Q435 PolarHBondContact N-O 2.89Å; R288-Q435 CarbonylContact O-C 3.57Å; R288-Q435 VanDerWaalsContact O-CA 3.31Å; R288-Q435 WeakPolarHBondContact O-CA 3.25Å; T430-Q435 HydrophobicContact CG2-CG 4.04Å
436	E	60.1	Low	81.3	Confident	152 Å²	152	79.5 Å²	79.5	71%	0.71	42%	0.418	S	S	*	.	B	Isolated β-bridge	trans	-106.8	117	171.1	-50.3	-161.8	139.6	0	0	105.5	K287	K287-E436 IonicContact NZ-OE1 3.74Å; K287-E436 PolarHBondContact NZ-OE1 2.99Å
437	G	47.5	Very low	80.2	Confident	74 Å²	74	86.5 Å²	86.5	76%	0.763	46%	0.455	S	S	*	.			trans	-72.4	0	-157.4	0	0	0	0	0	116.7	E286 R288	E286-G437 WeakPolarHBondContact O-CA 3.36Å; E286-G437 PolarHBondContact O-N 3.1Å; R288-G437 VanDerWaalsContact CZ-OXT 3.25Å; R288-G437 PolarHBondContact NH1-OXT 3.04Å; R288-G437 VanDerWaalsContact NH1-OXT 3.1Å; R288-G437 PolarHBondContact NH2-OXT 3.43Å

Retrieved 437 of 437 residues in 297.2 ms (Link to these results)

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