A0A077Z0N6_TRITR Loading...

GDPGP1-like N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z0N6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 386 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	28.7	Very low	36.8	Very low	231 Å²	231	129.3 Å²	129.3	100%	1.138	72%	0.722	S	S	*	*				0	102.1	0	-68.5	-175.5	-170.2	0	0	105.8	N3	M1-N3 PolarHBondContact O-N 3.48Å
2	D	31.1	Very low	39.1	Very low	170 Å²	170	127.1 Å²	127.1	91%	0.909	70%	0.704	S	S	*	*			trans	-73	108.3	-177.7	-119.3	-19.7	0	0	0	108.4	G4	D2-G4 PolarHBondContact O-N 3.19Å
3	N	32.4	Very low	41.7	Very low	140 Å²	140	120.5 Å²	120.5	75%	0.749	66%	0.662	S	S	*	*			trans	-80.9	101.2	174.5	-74.6	-21.4	0	0	0	107.8	M1 H5	M1-N3 PolarHBondContact O-N 3.48Å; N3-H5 PolarHBondContact O-N 2.93Å; N3-H5 VanDerWaalsContact O-N 3.07Å
4	G	28.8	Very low	44	Very low	76 Å²	76	117.1 Å²	117.1	78%	0.784	64%	0.638	S	S	*	*			trans	-48	112.2	179.3	0	0	0	0	0	112.5	D2 S6	D2-G4 PolarHBondContact O-N 3.19Å; G4-S6 PolarHBondContact O-N 3.4Å
5	H	30.6	Very low	46.4	Very low	190 Å²	190	113.5 Å²	113.5	88%	0.88	62%	0.624	S	S	*	*			trans	-61.3	102.2	162.5	-72.5	-84.8	0	0	0	107.9	N3	N3-H5 PolarHBondContact O-N 2.93Å; N3-H5 VanDerWaalsContact O-N 3.07Å
6	S	31.5	Very low	48.4	Very low	81 Å²	81	107.1 Å²	107.1	57%	0.566	59%	0.588	S	S	*	*			trans	-61.8	138.6	166.1	59.8	0	0	0	0	108.3	G4 Q8	G4-S6 PolarHBondContact O-N 3.4Å; S6-Q8 PolarHBondContact O-N 3.16Å
7	L	32	Very low	50.3	Low	182 Å²	182	106.6 Å²	106.6	95%	0.953	59%	0.592	S	S	*	*			trans	-60.8	83.3	172.3	-77.1	152.5	0	0	0	108.9	S9	L7-S9 PolarHBondContact O-N 3.06Å
8	Q	37	Very low	51.9	Low	160 Å²	160	103.2 Å²	103.2	75%	0.748	58%	0.584	S	S	*	*			trans	-77.5	112.1	178.5	-78.3	-179.1	-25.2	0	0	109.7	S6 C10	S6-Q8 PolarHBondContact O-N 3.16Å; Q8-C10 PolarHBondContact O-N 3.03Å
9	S	45.6	Very low	53.6	Low	51 Å²	51	107.6 Å²	107.6	36%	0.357	59%	0.59	S	S	.	*			trans	54.6	44.6	153.4	73.3	0	0	0	0	120	L7	L7-S9 PolarHBondContact O-N 3.06Å
10	C	47.8	Very low	55	Low	95 Å²	95	102.5 Å²	102.5	64%	0.642	56%	0.562	S	S	*	*			trans	-82.5	117.7	164.4	-73.6	0	0	0	0	110.8	Q8 M12	Q8-C10 PolarHBondContact O-N 3.03Å; C10-M12 PolarHBondContact O-N 3.03Å
11	Q	59.6	Low	56.2	Low	46 Å²	46	98.5 Å²	98.5	22%	0.215	54%	0.544	C	S	.	.			trans	-63.9	120.4	162.6	-73.9	-176.8	-2.1	0	0	108.8	Y13	Q11-Y13 HydrophobicContact CB-CE2 4.37Å; Q11-Y13 PolarHBondContact OE1-OH 3.08Å
12	M	64.4	Low	58.6	Low	103 Å²	103	87.5 Å²	87.5	51%	0.507	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136	175.7	-65.5	-177.8	67.2	0	0	110	C10 E25 L26 F271	C10-M12 PolarHBondContact O-N 3.03Å; M12-E25 CarbonylContact O-C 3.52Å; M12-E25 WeakPolarHBondContact O-CA 3.42Å; M12-L26 HydrophobicContact CB-CB 4.1Å; M12-L26 HydrophobicContact CB-CD2 4.45Å; M12-L26 PolarHBondContact O-N 3.06Å; M12-L26 HydrophobicContact SD-CD2 4.22Å; M12-F271 HydrophobicContact CB-CE1 4.2Å; M12-F271 HydrophobicContact CB-CZ 4.32Å
13	Y	72.9	Confident	60.8	Low	42 Å²	42	79.7 Å²	79.7	17%	0.165	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.2	173.5	-62.6	-89.2	0	0	0	110.1	Q11 V23 A24 E25 P155	Q11-Y13 HydrophobicContact CB-CE2 4.37Å; Q11-Y13 PolarHBondContact OE1-OH 3.08Å; Y13-V23 HydrophobicContact CD1-CG1 3.95Å; Y13-V23 HydrophobicContact CG-CG1 4.5Å; Y13-A24 CarbonylContact C-O 3.47Å; Y13-A24 WeakPolarHBondContact CA-O 3.49Å; Y13-E25 HydrophobicContact CD1-CB 4.01Å; Y13-E25 HydrophobicContact CD1-CG 4.1Å; Y13-E25 HydrophobicContact CE1-CB 4Å; Y13-E25 HydrophobicContact CE1-CG 3.73Å; Y13-P155 HydrophobicContact CD1-CG 4.22Å; Y13-P155 HydrophobicContact CD2-CG 3.64Å; Y13-P155 HydrophobicContact CE2-CG 3.99Å; Y13-P155 HydrophobicContact CG-CG 3.76Å
14	K	74.1	Confident	62.8	Low	73 Å²	73	73.1 Å²	73.1	32%	0.317	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	117.5	176.6	-178.5	-177.6	179.5	-172.7	0	109.3	L16 V23 A24 F271	K14-L16 PolarHBondContact O-N 3.22Å; K14-V23 CarbonylContact O-C 3.44Å; K14-V23 WeakPolarHBondContact O-CA 3.43Å; K14-A24 PolarHBondContact N-O 3.04Å; K14-A24 PolarHBondContact O-N 3.27Å; K14-F271 HydrophobicContact CB-CE1 4.44Å; K14-F271 HydrophobicContact CB-CE2 4.36Å; K14-F271 HydrophobicContact CB-CZ 3.76Å
15	C	79.1	Confident	64.9	Low	63 Å²	63	70.1 Å²	70.1	43%	0.426	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	125.7	166.6	-69.4	0	0	0	0	109.2	Y156	C15-Y156 WeakPolarHBondContact SG-CD1 3.43Å; C15-Y156 WeakPolarHBondContact SG-CD2 3.2Å
16	L	79.1	Confident	66.6	Low	10 Å²	10	61.7 Å²	61.7	5%	0.052	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-80.4	132.9	174.2	-57.4	-176.1	0	0	0	108.8	K14 G18 L22 A24 V274 I280	K14-L16 PolarHBondContact O-N 3.22Å; L16-G18 PolarHBondContact O-N 3.12Å; L16-L22 HydrophobicContact CB-CB 4.36Å; L16-L22 HydrophobicContact CD1-CB 4.12Å; L16-L22 HydrophobicContact CG-CB 4.48Å; L16-L22 PolarHBondContact N-O 2.66Å; L16-A24 HydrophobicContact CD2-CB 4.03Å; L16-A24 HydrophobicContact CG-CB 4.39Å; L16-V274 HydrophobicContact CD1-CG1 4.39Å; L16-V274 HydrophobicContact CD2-CG1 3.77Å; L16-I280 HydrophobicContact CD1-CG1 3.75Å
17	P	80	Confident	67.9	Low	100 Å²	100	59.1 Å²	59.1	65%	0.649	32%	0.319	S	S	*	.	S	Bend	trans	-64.2	126	175.7	26.4	-32.8	0	0	0	109.4	E277	P17-E277 WeakPolarHBondContact O-CB 3.44Å
18	G	80	Confident	68.8	Low	44 Å²	44	53.4 Å²	53.4	45%	0.454	30%	0.298	S	S	.	.	S	Bend	trans	159.5	-179.9	179	0	0	0	0	0	114	L16 E277	L16-G18 PolarHBondContact O-N 3.12Å; G18-E277 VanDerWaalsContact CA-CD 3.44Å; G18-E277 WeakPolarHBondContact CA-OE1 3.33Å; G18-E277 VanDerWaalsContact CA-OE2 3.25Å; G18-E277 WeakPolarHBondContact CA-OE2 3.42Å
19	R	83.6	Confident	69.5	Low	188 Å²	188	51.2 Å²	51.2	71%	0.709	29%	0.287	S	S	*	.	S	Bend	trans	-81.8	-28.4	-173.4	67.3	178.7	-176.8	170.9	4	112.4	G21 K159 E277	R19-G21 VanDerWaalsContact C-N 3.33Å; R19-G21 PolarHBondContact O-N 3.15Å; R19-K159 VanDerWaalsContact O-CD 3.24Å; R19-K159 WeakPolarHBondContact O-CD 3.46Å; R19-K159 PolarHBondContact O-NZ 3.21Å; R19-E277 PolarHBondContact N-OE1 2.66Å; R19-E277 PolarHBondContact N-OE2 3.31Å
20	L	81.8	Confident	69.6	Low	5 Å²	5	53.1 Å²	53.1	3%	0.026	30%	0.298	C	S	.	.	S	Bend	trans	-79.7	-16.4	-173.5	-56	175.2	0	0	0	112.8	L22 W178 L179 E277 V281	L20-L22 HydrophobicContact CB-CD2 3.89Å; L20-L22 HydrophobicContact CB-CG 3.94Å; L20-L22 HydrophobicContact CD1-CD1 4.42Å; L20-W178 HydrophobicContact CD2-CG 4.46Å; L20-W178 PolarHBondContact O-NE1 2.78Å; L20-L179 HydrophobicContact CD1-CB 4.24Å; L20-L179 HydrophobicContact CD1-CD1 4.19Å; L20-E277 WeakPolarHBondContact CA-OE2 3.36Å; L20-E277 HydrophobicContact CB-CG 4.38Å; L20-E277 VanDerWaalsContact CB-OE2 3.3Å; L20-E277 WeakPolarHBondContact CB-OE2 3.23Å; L20-E277 HydrophobicContact CD1-CG 4.04Å; L20-E277 HydrophobicContact CG-CG 4.33Å; L20-E277 PolarHBondContact N-OE1 2.96Å; L20-E277 PolarHBondContact N-OE2 2.87Å; L20-V281 HydrophobicContact CD1-CG2 3.45Å; L20-V281 VanDerWaalsContact CD1-CG2 3.45Å
21	G	80.2	Confident	69.5	Low	18 Å²	18	50.4 Å²	50.4	19%	0.186	28%	0.28	C	S	.	.			trans	67.2	38.9	178.2	0	0	0	0	0	112.6	R19 E277	R19-G21 VanDerWaalsContact C-N 3.33Å; R19-G21 PolarHBondContact O-N 3.15Å; G21-E277 PolarHBondContact N-OE2 3.01Å
22	L	80.3	Confident	68.6	Low	1 Å²	1	55 Å²	55	1%	0.005	30%	0.301	C	S	.	.			trans	-69.5	151.2	178.8	-53.1	-175.7	0	0	0	110.8	L16 L20 L179 N262 E277 I280	L16-L22 HydrophobicContact CB-CB 4.36Å; L16-L22 HydrophobicContact CD1-CB 4.12Å; L16-L22 HydrophobicContact CG-CB 4.48Å; L16-L22 PolarHBondContact N-O 2.66Å; L20-L22 HydrophobicContact CB-CD2 3.89Å; L20-L22 HydrophobicContact CB-CG 3.94Å; L20-L22 HydrophobicContact CD1-CD1 4.42Å; L22-L179 HydrophobicContact CD1-CD1 4.27Å; L22-L179 HydrophobicContact CD2-CD2 4.17Å; L22-N262 WeakPolarHBondContact CD2-OD1 3.22Å; L22-E277 HydrophobicContact CD1-CG 3.93Å; L22-E277 HydrophobicContact CG-CG 4.31Å; L22-I280 HydrophobicContact CD1-CB 3.97Å; L22-I280 HydrophobicContact CD1-CG2 3.6Å
23	V	77	Confident	67.6	Low	6 Å²	6	61.4 Å²	61.4	4%	0.036	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.3	179.9	179.6	0	0	0	0	107.9	Y13 K14 Y156 N262	Y13-V23 HydrophobicContact CD1-CG1 3.95Å; Y13-V23 HydrophobicContact CG-CG1 4.5Å; K14-V23 CarbonylContact O-C 3.44Å; K14-V23 WeakPolarHBondContact O-CA 3.43Å; V23-Y156 HydrophobicContact CG1-CD2 3.79Å; V23-Y156 HydrophobicContact CG1-CE2 4.3Å; V23-Y156 HydrophobicContact CG2-CD2 3.88Å; V23-Y156 HydrophobicContact CG2-CG 4.24Å; V23-N262 PolarHBondContact N-ND2 2.85Å; V23-N262 WeakPolarHBondContact O-CB 3.39Å; V23-N262 VanDerWaalsContact O-CG 3.31Å; V23-N262 PolarHBondContact O-ND2 3.4Å
24	A	74	Confident	66.7	Low	2 Å²	2	63 Å²	63	2%	0.017	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	140.5	168.9	0	0	0	0	0	109.8	Y13 K14 L16 F271 V274	Y13-A24 CarbonylContact C-O 3.47Å; Y13-A24 WeakPolarHBondContact CA-O 3.49Å; K14-A24 PolarHBondContact N-O 3.04Å; K14-A24 PolarHBondContact O-N 3.27Å; L16-A24 HydrophobicContact CD2-CB 4.03Å; L16-A24 HydrophobicContact CG-CB 4.39Å; A24-F271 HydrophobicContact CB-CD2 4.45Å; A24-F271 HydrophobicContact CB-CE2 3.89Å; A24-V274 HydrophobicContact CB-CG1 4.2Å
25	E	72.3	Confident	65.9	Low	12 Å²	12	63.5 Å²	63.5	6%	0.056	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.3	174.5	-179.5	-169.9	130.8	0	0	108.6	M12 Y13 R27 K96 Q264	M12-E25 CarbonylContact O-C 3.52Å; M12-E25 WeakPolarHBondContact O-CA 3.42Å; Y13-E25 HydrophobicContact CD1-CB 4.01Å; Y13-E25 HydrophobicContact CD1-CG 4.1Å; Y13-E25 HydrophobicContact CE1-CB 4Å; Y13-E25 HydrophobicContact CE1-CG 3.73Å; E25-R27 IonicContact OE1-CZ 2.91Å; E25-R27 IonicContact OE1-NE 3.88Å; E25-R27 PolarHBondContact OE1-NE 3.27Å; E25-R27 IonicContact OE1-NH2 3.54Å; E25-R27 PolarHBondContact OE1-NH2 3.2Å; E25-R27 IonicContact OE2-NH2 3.61Å; E25-K96 WeakPolarHBondContact OE1-CE 3.4Å; E25-K96 IonicContact OE1-NZ 3.43Å; E25-K96 PolarHBondContact OE1-NZ 3.15Å; E25-K96 WeakPolarHBondContact OE2-CE 3.5Å; E25-K96 IonicContact OE2-NZ 3.77Å; E25-K96 PolarHBondContact OE2-NZ 3.17Å; E25-Q264 VanDerWaalsContact O-O 3.1Å
26	L	66.4	Low	64.8	Low	13 Å²	13	68.7 Å²	68.7	7%	0.068	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	131	172.5	177.2	58.8	0	0	0	109.7	M12 E266 F271	M12-L26 HydrophobicContact CB-CB 4.1Å; M12-L26 HydrophobicContact CB-CD2 4.45Å; M12-L26 PolarHBondContact O-N 3.06Å; M12-L26 HydrophobicContact SD-CD2 4.22Å; L26-E266 WeakPolarHBondContact CD1-O 3.44Å; L26-F271 HydrophobicContact CB-CB 4.38Å; L26-F271 HydrophobicContact CB-CD1 3.72Å; L26-F271 HydrophobicContact CB-CD2 3.57Å; L26-F271 HydrophobicContact CB-CE1 3.76Å; L26-F271 HydrophobicContact CB-CE2 3.61Å; L26-F271 HydrophobicContact CB-CG 3.62Å; L26-F271 HydrophobicContact CB-CZ 3.69Å; L26-F271 HydrophobicContact CD1-CB 3.54Å; L26-F271 HydrophobicContact CD1-CD1 4.28Å; L26-F271 HydrophobicContact CD1-CD2 4.25Å; L26-F271 HydrophobicContact CD1-CG 3.78Å; L26-F271 HydrophobicContact CD2-CB 4.48Å; L26-F271 HydrophobicContact CD2-CD1 3.83Å; L26-F271 HydrophobicContact CD2-CE1 4.26Å; L26-F271 HydrophobicContact CD2-CG 4.19Å; L26-F271 HydrophobicContact CG-CB 4.32Å; L26-F271 HydrophobicContact CG-CD1 4.14Å; L26-F271 HydrophobicContact CG-CD2 4.4Å; L26-F271 HydrophobicContact CG-CG 4.04Å
27	R	59.5	Low	64.1	Low	28 Å²	28	70 Å²	70	11%	0.106	36%	0.357	C	S	.	.			trans	-114.4	105.7	167.5	-65.9	-164.9	177.7	123.6	32.5	110	E25 E29 K96 R260 D263 E265	E25-R27 IonicContact OE1-CZ 2.91Å; E25-R27 IonicContact OE1-NE 3.88Å; E25-R27 PolarHBondContact OE1-NE 3.27Å; E25-R27 IonicContact OE1-NH2 3.54Å; E25-R27 PolarHBondContact OE1-NH2 3.2Å; E25-R27 IonicContact OE2-NH2 3.61Å; R27-E29 PolarHBondContact O-N 3.41Å; R27-K96 VanDerWaalsContact NH2-CE 3.3Å; R27-R260 VanDerWaalsContact CZ-NH1 3.28Å; R27-R260 VanDerWaalsContact NH1-NH1 3.1Å; R27-D263 IonicContact CZ-OD1 3.25Å; R27-D263 VanDerWaalsContact CZ-OD1 3.22Å; R27-D263 IonicContact CZ-OD2 2.89Å; R27-D263 VanDerWaalsContact CZ-OD2 3.25Å; R27-D263 IonicContact NH1-OD1 3.87Å; R27-D263 PolarHBondContact NH1-OD1 2.86Å; R27-D263 IonicContact NH1-OD2 3.31Å; R27-D263 PolarHBondContact NH1-OD2 3.2Å; R27-D263 IonicContact NH2-OD1 3.82Å; R27-D263 PolarHBondContact NH2-OD1 3.25Å; R27-D263 IonicContact NH2-OD2 3.1Å; R27-D263 PolarHBondContact NH2-OD2 3.09Å; R27-E265 IonicContact NH1-OE1 3.16Å
28	A	51	Low	63.6	Low	62 Å²	62	69 Å²	69	51%	0.512	34%	0.342	S	S	.	.			trans	-68.1	-18.8	177.7	0	0	0	0	0	113.1	P30	A28-P30 WeakPolarHBondContact O-CD 3.3Å
29	E	52	Low	63.7	Low	113 Å²	113	71.5 Å²	71.5	53%	0.528	34%	0.343	S	S	.	.	S	Bend	trans	-77.8	122.7	178.7	-73	-166	169.7	0	0	111.8	R27 C31 H95	R27-E29 PolarHBondContact O-N 3.41Å; E29-C31 PolarHBondContact O-N 3.13Å; E29-H95 IonicContact OE1-CD2 2.84Å; E29-H95 IonicContact OE1-NE2 3.33Å; E29-H95 IonicContact OE2-CD2 3.59Å; E29-H95 PolarHBondContact OE2-CD2 3.29Å; E29-H95 IonicContact OE2-NE2 3.22Å; E29-H95 PolarHBondContact OE2-NE2 2.78Å; E29-H95 VanDerWaalsContact OE2-NE2 3.15Å
30	P	45.8	Very low	63.9	Low	91 Å²	91	63 Å²	63	59%	0.591	31%	0.311	S	S	*	.			trans	-62.3	125.3	175.5	-14.2	26.2	0	0	0	108.9	A28 H32	A28-P30 WeakPolarHBondContact O-CD 3.3Å; P30-H32 HydrophobicContact CB-CB 4.37Å; P30-H32 WeakPolarHBondContact CB-CD2 3.48Å; P30-H32 PolarHBondContact O-N 3.28Å
31	C	46.9	Very low	64.4	Low	39 Å²	39	72.5 Å²	72.5	26%	0.264	35%	0.347	S	S	.	.	S	Bend	trans	-65.1	-0	-176.8	-135.6	0	0	0	0	112.9	E29 R33 H34	E29-C31 PolarHBondContact O-N 3.13Å; C31-R33 PolarHBondContact O-N 3.13Å; C31-H34 VanDerWaalsContact C-CD2 3.45Å; C31-H34 VanDerWaalsContact C-NE2 3.31Å; C31-H34 WeakPolarHBondContact CB-CE1 3.39Å; C31-H34 WeakPolarHBondContact CB-NE2 3.38Å; C31-H34 PolarHBondContact O-CD2 3.43Å; C31-H34 PolarHBondContact O-CE1 3.28Å; C31-H34 PolarHBondContact O-N 3.37Å; C31-H34 VanDerWaalsContact O-N 3.14Å; C31-H34 PolarHBondContact O-ND1 3.35Å; C31-H34 VanDerWaalsContact O-ND1 3.16Å; C31-H34 PolarHBondContact O-NE2 2.85Å; C31-H34 PolarHBondContact SG-CE1 3.42Å
32	H	40.7	Very low	65	Low	141 Å²	141	73 Å²	73	65%	0.653	35%	0.347	S	S	*	.			trans	-58.4	3.7	-174.1	-55.3	-27.5	0	0	0	118.2	P30 H34	P30-H32 HydrophobicContact CB-CB 4.37Å; P30-H32 WeakPolarHBondContact CB-CD2 3.48Å; P30-H32 PolarHBondContact O-N 3.28Å; H32-H34 VanDerWaalsContact C-N 3.29Å
33	R	43.8	Very low	65.7	Low	238 Å²	238	73 Å²	73	90%	0.898	35%	0.347	S	S	*	.	S	Bend	trans	-96.5	30.1	163.1	-70.9	-174.8	178.5	168.6	0.2	112.4	C31 R35	C31-R33 PolarHBondContact O-N 3.13Å; R33-R35 PolarHBondContact O-N 3.07Å; R33-R35 VanDerWaalsContact O-N 3.13Å
34	H	53.7	Low	66.5	Low	76 Å²	76	75.2 Å²	75.2	35%	0.352	36%	0.363	S	S	.	.			trans	-59.7	118	-179.6	-64.2	-69.6	0	0	0	110.9	C31 H32 F37	C31-H34 VanDerWaalsContact C-CD2 3.45Å; C31-H34 VanDerWaalsContact C-NE2 3.31Å; C31-H34 WeakPolarHBondContact CB-CE1 3.39Å; C31-H34 WeakPolarHBondContact CB-NE2 3.38Å; C31-H34 PolarHBondContact O-CD2 3.43Å; C31-H34 PolarHBondContact O-CE1 3.28Å; C31-H34 PolarHBondContact O-N 3.37Å; C31-H34 VanDerWaalsContact O-N 3.14Å; C31-H34 PolarHBondContact O-ND1 3.35Å; C31-H34 VanDerWaalsContact O-ND1 3.16Å; C31-H34 PolarHBondContact O-NE2 2.85Å; C31-H34 PolarHBondContact SG-CE1 3.42Å; H32-H34 VanDerWaalsContact C-N 3.29Å; H34-F37 HydrophobicContact CB-CE2 4.33Å; H34-F37 AromaticContact ND1-CE2 3.71Å
35	R	56.1	Low	67.4	Low	83 Å²	83	76.5 Å²	76.5	31%	0.313	37%	0.369	S	S	.	.			trans	-61.2	142.3	161.4	-63.5	175	178.8	178.2	-4.2	106.9	R33 F37 E61	R33-R35 PolarHBondContact O-N 3.07Å; R33-R35 VanDerWaalsContact O-N 3.13Å; R35-F37 VanDerWaalsContact C-N 3.27Å; R35-F37 PolarHBondContact O-N 3.21Å; R35-E61 IonicContact NH2-OE1 2.66Å; R35-E61 PolarHBondContact NH2-OE1 2.87Å; R35-E61 IonicContact NH2-OE2 2.82Å
36	N	56.3	Low	68.4	Low	172 Å²	172	86.1 Å²	86.1	92%	0.92	41%	0.405	S	S	*	.			trans	-58.8	95.3	171.5	-76.5	-20.8	0	0	0	108.2
37	F	64.9	Low	69.7	Low	37 Å²	37	87.3 Å²	87.3	16%	0.162	41%	0.409	C	S	.	.			trans	-63.8	145.7	-179.7	-65.7	-58.9	0	0	0	109.1	H34 R35 E143 P248 I249	H34-F37 HydrophobicContact CB-CE2 4.33Å; H34-F37 AromaticContact ND1-CE2 3.71Å; R35-F37 VanDerWaalsContact C-N 3.27Å; R35-F37 PolarHBondContact O-N 3.21Å; F37-E143 HydrophobicContact CD1-CB 3.63Å; F37-E143 HydrophobicContact CD1-CG 3.86Å; F37-E143 HydrophobicContact CE1-CB 3.73Å; F37-E143 HydrophobicContact CE1-CG 3.87Å; F37-E143 WeakPolarHBondContact CE1-OE2 3.4Å; F37-E143 VanDerWaalsContact CE2-OE1 3.26Å; F37-E143 WeakPolarHBondContact CE2-OE1 3.49Å; F37-E143 HydrophobicContact CG-CB 4.45Å; F37-E143 HydrophobicContact CG-CG 4.3Å; F37-E143 HydrophobicContact CZ-CG 4.3Å; F37-E143 WeakPolarHBondContact CZ-OE1 2.83Å; F37-E143 VanDerWaalsContact CZ-OE2 3.22Å; F37-E143 WeakPolarHBondContact CZ-OE2 3.31Å; F37-P248 HydrophobicContact CB-CG 4.31Å; F37-I249 HydrophobicContact CB-CG1 4.31Å; F37-I249 WeakPolarHBondContact O-CD1 3.34Å
38	Y	70.1	Confident	71.2	Confident	81 Å²	81	87.3 Å²	87.3	32%	0.318	41%	0.414	S	S	.	.			trans	-91.5	140.1	-178	-175.9	-90.9	0	0	0	110.5	F40 E45 R51	Y38-F40 PolarHBondContact O-N 2.94Å; Y38-E45 WeakPolarHBondContact CE1-OE1 3.4Å; Y38-R51 PolarHBondContact OH-NH2 3.34Å
39	I	81.3	Confident	73.2	Confident	96 Å²	96	86.4 Å²	86.4	49%	0.492	41%	0.406	S	S	.	.			trans	-84.7	105.6	172.7	-54.8	179.9	0	0	0	108.9	I249	I39-I249 HydrophobicContact CD1-CD1 3.91Å; I39-I249 HydrophobicContact CG1-CD1 3.26Å; I39-I249 HydrophobicContact CG1-CG1 4.2Å
40	F	88.9	Confident	75	Confident	8 Å²	8	91.3 Å²	91.3	4%	0.035	42%	0.422	C	S	.	.			trans	-60	148.3	169.2	-65.9	-82.3	0	0	0	111.3	Y38 E45 P138 L139 C142 N145	Y38-F40 PolarHBondContact O-N 2.94Å; F40-E45 VanDerWaalsContact CA-OE2 3.24Å; F40-E45 WeakPolarHBondContact CA-OE2 3.05Å; F40-E45 HydrophobicContact CD1-CB 4.15Å; F40-E45 HydrophobicContact CD1-CG 4.4Å; F40-P138 HydrophobicContact CB-CB 3.81Å; F40-P138 HydrophobicContact CD1-CB 3.73Å; F40-P138 HydrophobicContact CD1-CG 4.2Å; F40-P138 HydrophobicContact CD2-CB 4.14Å; F40-P138 HydrophobicContact CE1-CB 4.28Å; F40-P138 HydrophobicContact CE1-CG 4.32Å; F40-P138 HydrophobicContact CG-CB 3.63Å; F40-L139 HydrophobicContact CB-CD2 4.1Å; F40-L139 HydrophobicContact CB-CG 4.36Å; F40-L139 WeakPolarHBondContact O-CD2 3.07Å; F40-C142 HydrophobicContact CE2-CB 4.2Å; F40-C142 VanDerWaalsContact CE2-O 3.32Å; F40-C142 WeakPolarHBondContact CE2-O 3.42Å; F40-N145 HydrophobicContact CE1-CB 3.56Å; F40-N145 HydrophobicContact CZ-CB 3.84Å
41	R	90.8	Very high	76.9	Confident	206 Å²	206	89.2 Å²	89.2	78%	0.777	40%	0.402	S	S	*	.	S	Bend	trans	-104.3	-21.4	177.2	-62.8	-177.5	179	-178.5	-2.1	112.7	E45	R41-E45 PolarHBondContact N-OE2 3.05Å
42	S	93.5	Very high	78.7	Confident	27 Å²	27	89.8 Å²	89.8	19%	0.189	40%	0.4	C	S	.	.			trans	-149.7	152.8	179.8	174.7	0	0	0	0	110.8	S44 E45 P138 N210	S42-S44 PolarHBondContact O-N 2.95Å; S42-S44 PolarHBondContact OG-N 2.91Å; S42-S44 VanDerWaalsContact OG-N 3.1Å; S42-S44 PolarHBondContact OG-OG 3.38Å; S42-E45 WeakPolarHBondContact O-CB 3Å; S42-E45 PolarHBondContact O-N 3.01Å; S42-P138 VanDerWaalsContact O-CB 3.3Å; S42-P138 WeakPolarHBondContact O-CB 3.34Å; S42-N210 VanDerWaalsContact CA-OD1 3.25Å; S42-N210 WeakPolarHBondContact CA-OD1 3.39Å; S42-N210 WeakPolarHBondContact CB-OD1 3.41Å; S42-N210 PolarHBondContact OG-OD1 3.22Å
43	V	93.8	Very high	80.9	Confident	1 Å²	1	83.3 Å²	83.3	1%	0.006	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-32.7	168.4	-176.4	0	0	0	0	111.5	E45 P138 L139 V207 N210 P212 F213	V43-E45 VanDerWaalsContact C-N 3.32Å; V43-E45 PolarHBondContact O-N 2.87Å; V43-P138 WeakPolarHBondContact O-CG 3.46Å; V43-L139 HydrophobicContact CG2-CD1 4.23Å; V43-V207 HydrophobicContact CG1-CG2 4.06Å; V43-N210 PolarHBondContact N-OD1 3.25Å; V43-P212 HydrophobicContact CG2-CB 4.45Å; V43-P212 HydrophobicContact CG2-CG 4.23Å; V43-F213 HydrophobicContact CG1-CD1 4.44Å; V43-F213 HydrophobicContact CG1-CE1 4.12Å
44	S	94.4	Very high	82.8	Confident	53 Å²	53	72.1 Å²	72.1	37%	0.371	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	11.6	-177.1	70.3	0	0	0	0	114.4	S42 R46	S42-S44 PolarHBondContact O-N 2.95Å; S42-S44 PolarHBondContact OG-N 2.91Å; S42-S44 VanDerWaalsContact OG-N 3.1Å; S42-S44 PolarHBondContact OG-OG 3.38Å; S44-R46 PolarHBondContact O-N 2.78Å
45	E	92.9	Very high	84.2	Confident	29 Å²	29	71.7 Å²	71.7	14%	0.136	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-61.7	131.9	-171.1	-168.6	169.1	154.4	0	0	112.5	Y38 F40 R41 S42 V43 R51	Y38-E45 WeakPolarHBondContact CE1-OE1 3.4Å; F40-E45 VanDerWaalsContact CA-OE2 3.24Å; F40-E45 WeakPolarHBondContact CA-OE2 3.05Å; F40-E45 HydrophobicContact CD1-CB 4.15Å; F40-E45 HydrophobicContact CD1-CG 4.4Å; R41-E45 PolarHBondContact N-OE2 3.05Å; S42-E45 WeakPolarHBondContact O-CB 3Å; S42-E45 PolarHBondContact O-N 3.01Å; V43-E45 VanDerWaalsContact C-N 3.32Å; V43-E45 PolarHBondContact O-N 2.87Å; E45-R51 IonicContact OE1-CZ 3.08Å; E45-R51 IonicContact OE1-NH1 2.8Å; E45-R51 PolarHBondContact OE1-NH1 2.86Å; E45-R51 IonicContact OE1-NH2 3.08Å; E45-R51 PolarHBondContact OE1-NH2 3.31Å
46	R	93.3	Very high	85.6	Confident	214 Å²	214	72.5 Å²	72.5	81%	0.808	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-67.9	156.4	-174.2	-65.3	-176.6	179.5	165	0.3	112.1	S44 S48	S44-R46 PolarHBondContact O-N 2.78Å; R46-S48 PolarHBondContact O-N 2.81Å
47	F	93.6	Very high	86.6	Confident	38 Å²	38	65.1 Å²	65.1	17%	0.167	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-57.7	140	166.4	177.8	-88	0	0	0	110.1	A49 N53 R106 H146	F47-A49 HydrophobicContact CE1-CB 3.91Å; F47-N53 HydrophobicContact CE2-CB 3.72Å; F47-N53 HydrophobicContact CZ-CB 3.99Å; F47-R106 WeakPolarHBondContact CB-O 3.41Å; F47-R106 HydrophobicContact CD1-CB 3.69Å; F47-R106 HydrophobicContact CD1-CG 4.35Å; F47-R106 HydrophobicContact CD2-CB 4.08Å; F47-R106 HydrophobicContact CE1-CB 3.64Å; F47-R106 HydrophobicContact CE1-CG 3.79Å; F47-R106 HydrophobicContact CE2-CB 4.02Å; F47-R106 HydrophobicContact CE2-CG 4.36Å; F47-R106 HydrophobicContact CG-CB 3.91Å; F47-R106 WeakPolarHBondContact CG-O 3.23Å; F47-R106 HydrophobicContact CZ-CB 3.8Å; F47-R106 HydrophobicContact CZ-CG 3.79Å; F47-H146 HydrophobicContact CD2-CB 4.22Å; F47-H146 HydrophobicContact CE2-CB 4.04Å; F47-H146 AromaticContact CE2-CG 3.8Å; F47-H146 AromaticContact CE2-ND1 3.78Å
48	S	92.3	Very high	86.9	Confident	29 Å²	29	66.8 Å²	66.8	20%	0.203	31%	0.309	C	S	.	.			trans	-133.6	115.9	175.7	172.5	0	0	0	0	108.9	R46 Y50 R51 N145	R46-S48 PolarHBondContact O-N 2.81Å; S48-Y50 PolarHBondContact O-N 3.19Å; S48-Y50 PolarHBondContact OG-N 3.01Å; S48-R51 PolarHBondContact O-N 2.79Å; S48-N145 WeakPolarHBondContact CA-ND2 3.38Å; S48-N145 WeakPolarHBondContact CB-ND2 3.46Å; S48-N145 PolarHBondContact N-ND2 3.35Å; S48-N145 PolarHBondContact O-ND2 2.92Å
49	A	91.3	Very high	86.8	Confident	43 Å²	43	68 Å²	68	36%	0.355	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.9	177.9	0	0	0	0	0	112.5	F47 R51 K56	F47-A49 HydrophobicContact CE1-CB 3.91Å; A49-R51 VanDerWaalsContact C-N 3.32Å; A49-K56 WeakPolarHBondContact O-CE 3.29Å; A49-K56 PolarHBondContact O-NZ 3.24Å
50	Y	89.6	Confident	86	Confident	216 Å²	216	70.7 Å²	70.7	85%	0.847	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-27.6	178.6	-58.6	-74.3	0	0	0	112.3	S48 K56	S48-Y50 PolarHBondContact O-N 3.19Å; S48-Y50 PolarHBondContact OG-N 3.01Å; Y50-K56 PolarHBondContact O-NZ 3.15Å
51	R	86.6	Confident	84.7	Confident	47 Å²	47	71.8 Å²	71.8	18%	0.177	35%	0.348	C	S	.	.	S	Bend	trans	-80.6	166.8	177.2	-59.9	-168.8	-170.4	147.6	13.6	112.1	Y38 E45 S48 A49 N53 K56	Y38-R51 PolarHBondContact OH-NH2 3.34Å; E45-R51 IonicContact OE1-CZ 3.08Å; E45-R51 IonicContact OE1-NH1 2.8Å; E45-R51 PolarHBondContact OE1-NH1 2.86Å; E45-R51 IonicContact OE1-NH2 3.08Å; E45-R51 PolarHBondContact OE1-NH2 3.31Å; S48-R51 PolarHBondContact O-N 2.79Å; A49-R51 VanDerWaalsContact C-N 3.32Å; R51-N53 PolarHBondContact O-N 3.36Å; R51-N53 PolarHBondContact O-ND2 2.92Å; R51-N53 VanDerWaalsContact O-ND2 3.1Å; R51-K56 WeakPolarHBondContact O-CE 3.43Å; R51-K56 PolarHBondContact O-NZ 3.39Å
52	F	85	Confident	83.2	Confident	50 Å²	50	64.5 Å²	64.5	22%	0.219	32%	0.324	C	S	.	.			trans	-55.9	134.2	166.9	174	-102.8	0	0	0	109.2	F54 L57 L92 V144 N145	F52-F54 HydrophobicContact CE1-CD1 4.35Å; F52-F54 HydrophobicContact CE1-CE1 4.24Å; F52-F54 HydrophobicContact CZ-CD1 4.26Å; F52-L57 HydrophobicContact CE2-CD2 4.16Å; F52-L57 HydrophobicContact CZ-CD2 3.87Å; F52-L57 HydrophobicContact CZ-CG 4.38Å; F52-L92 HydrophobicContact CE1-CD2 4.22Å; F52-V144 HydrophobicContact CD1-CG1 4.06Å; F52-V144 HydrophobicContact CD1-CG2 3.75Å; F52-V144 HydrophobicContact CE1-CG1 4.22Å; F52-V144 HydrophobicContact CE1-CG2 3.97Å; F52-N145 PolarHBondContact O-OD1 2.77Å
53	N	87	Confident	81.4	Confident	5 Å²	5	67 Å²	67	3%	0.027	33%	0.332	C	S	.	.			trans	-153.8	160.3	174.6	68	81.6	0	0	0	108.1	F47 R51 L55 K56 H146	F47-N53 HydrophobicContact CE2-CB 3.72Å; F47-N53 HydrophobicContact CZ-CB 3.99Å; R51-N53 PolarHBondContact O-N 3.36Å; R51-N53 PolarHBondContact O-ND2 2.92Å; R51-N53 VanDerWaalsContact O-ND2 3.1Å; N53-L55 PolarHBondContact O-N 3.43Å; N53-L55 VanDerWaalsContact OD1-CB 3.23Å; N53-L55 WeakPolarHBondContact OD1-CB 3.1Å; N53-L55 PolarHBondContact OD1-N 2.79Å; N53-L55 VanDerWaalsContact OD1-N 3.11Å; N53-K56 WeakPolarHBondContact O-CB 3.26Å; N53-K56 PolarHBondContact O-N 2.99Å; N53-H146 HydrophobicContact CB-CB 4.13Å
54	F	83.7	Confident	79.3	Confident	3 Å²	3	68 Å²	68	1%	0.013	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-64.5	-15.4	-171.4	-57.2	-69.8	0	0	0	115.4	F52 K56 L57 T89 L92 L98 V100 M103 V144 H146 H148	F52-F54 HydrophobicContact CE1-CD1 4.35Å; F52-F54 HydrophobicContact CE1-CE1 4.24Å; F52-F54 HydrophobicContact CZ-CD1 4.26Å; F54-K56 PolarHBondContact O-N 3.32Å; F54-L57 HydrophobicContact CB-CD1 4.23Å; F54-L57 HydrophobicContact CD1-CD1 4.03Å; F54-L57 WeakPolarHBondContact O-CB 3.45Å; F54-L57 WeakPolarHBondContact O-CG 3.49Å; F54-L57 PolarHBondContact O-N 3.4Å; F54-T89 HydrophobicContact CD1-CG2 4.37Å; F54-T89 HydrophobicContact CE1-CG2 4.33Å; F54-L92 HydrophobicContact CE1-CD1 3.84Å; F54-L92 HydrophobicContact CZ-CD1 3.86Å; F54-L98 HydrophobicContact CE1-CD1 3.52Å; F54-L98 HydrophobicContact CZ-CD1 3.78Å; F54-V100 HydrophobicContact CB-CG1 4.04Å; F54-V100 HydrophobicContact CD1-CG2 3.95Å; F54-V100 HydrophobicContact CD2-CB 4.2Å; F54-V100 HydrophobicContact CD2-CG1 3.37Å; F54-V100 HydrophobicContact CD2-CG2 3.69Å; F54-V100 HydrophobicContact CE1-CG2 4.04Å; F54-V100 HydrophobicContact CE2-CG1 4.03Å; F54-V100 HydrophobicContact CE2-CG2 3.8Å; F54-V100 HydrophobicContact CG-CB 4.42Å; F54-V100 HydrophobicContact CG-CG1 3.83Å; F54-V100 HydrophobicContact CG-CG2 3.77Å; F54-V100 HydrophobicContact CZ-CG2 3.96Å; F54-M103 HydrophobicContact CB-CG 3.98Å; F54-M103 HydrophobicContact CB-SD 3.68Å; F54-V144 HydrophobicContact CE2-CG1 3.87Å; F54-V144 HydrophobicContact CZ-CB 4.45Å; F54-V144 HydrophobicContact CZ-CG1 4.03Å; F54-H146 HydrophobicContact CD2-CB 3.86Å; F54-H146 AromaticContact CD2-CG 3.79Å; F54-H146 AromaticContact CD2-ND1 3.75Å; F54-H146 HydrophobicContact CE2-CB 4.05Å; F54-H146 PolarHBondContact N-ND1 2.94Å; F54-H148 HydrophobicContact CE2-CB 3.62Å; F54-H148 AromaticContact CE2-CG 3.77Å; F54-H148 AromaticContact CE2-ND1 3.83Å; F54-H148 HydrophobicContact CZ-CB 3.81Å; F54-H148 AromaticContact CZ-CG 3.72Å
55	L	83.7	Confident	77.4	Confident	67 Å²	67	69.8 Å²	69.8	35%	0.351	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-71	-15.6	171.8	-59.6	167.2	0	0	0	112.8	N53 M103 R106	N53-L55 PolarHBondContact O-N 3.43Å; N53-L55 VanDerWaalsContact OD1-CB 3.23Å; N53-L55 WeakPolarHBondContact OD1-CB 3.1Å; N53-L55 PolarHBondContact OD1-N 2.79Å; N53-L55 VanDerWaalsContact OD1-N 3.11Å; L55-M103 HydrophobicContact CD2-CE 3.92Å; L55-M103 HydrophobicContact CD2-CG 3.7Å; L55-M103 HydrophobicContact CD2-SD 3.84Å; L55-M103 HydrophobicContact CG-CG 4.01Å; L55-M103 HydrophobicContact CG-SD 4.32Å; L55-R106 HydrophobicContact CD1-CG 3.79Å
56	K	84.9	Confident	75.5	Confident	101 Å²	101	68.8 Å²	68.8	44%	0.439	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-92.7	4	177.8	-62.1	179.9	173.4	174.4	0	113	A49 Y50 R51 N53 F54 C58	A49-K56 WeakPolarHBondContact O-CE 3.29Å; A49-K56 PolarHBondContact O-NZ 3.24Å; Y50-K56 PolarHBondContact O-NZ 3.15Å; R51-K56 WeakPolarHBondContact O-CE 3.43Å; R51-K56 PolarHBondContact O-NZ 3.39Å; N53-K56 WeakPolarHBondContact O-CB 3.26Å; N53-K56 PolarHBondContact O-N 2.99Å; F54-K56 PolarHBondContact O-N 3.32Å; K56-C58 PolarHBondContact O-N 3.06Å
57	L	76.6	Confident	73.4	Confident	17 Å²	17	62.3 Å²	62.3	9%	0.089	32%	0.316	C	S	.	.			trans	-65.7	130.7	174.6	-70.6	174.7	0	0	0	109.4	F52 F54 E61 L62 I87 T89	F52-L57 HydrophobicContact CE2-CD2 4.16Å; F52-L57 HydrophobicContact CZ-CD2 3.87Å; F52-L57 HydrophobicContact CZ-CG 4.38Å; F54-L57 HydrophobicContact CB-CD1 4.23Å; F54-L57 HydrophobicContact CD1-CD1 4.03Å; F54-L57 WeakPolarHBondContact O-CB 3.45Å; F54-L57 WeakPolarHBondContact O-CG 3.49Å; F54-L57 PolarHBondContact O-N 3.4Å; L57-E61 WeakPolarHBondContact CA-OE2 3.36Å; L57-E61 HydrophobicContact CB-CB 4.29Å; L57-E61 HydrophobicContact CD2-CB 3.98Å; L57-L62 HydrophobicContact CB-CD2 4.15Å; L57-L62 HydrophobicContact CB-CG 4.26Å; L57-L62 HydrophobicContact CD1-CD2 3.57Å; L57-L62 HydrophobicContact CD1-CG 4.46Å; L57-I87 HydrophobicContact CD1-CG2 4.33Å; L57-T89 HydrophobicContact CD1-CG2 4.04Å
58	C	71.2	Confident	71.2	Confident	71 Å²	71	61 Å²	61	48%	0.48	31%	0.311	S	S	.	.			trans	-66.1	151.8	168.6	-64	0	0	0	0	109.1	K56 N60 E61 L62	K56-C58 PolarHBondContact O-N 3.06Å; C58-N60 PolarHBondContact O-N 3.44Å; C58-N60 VanDerWaalsContact O-N 3.08Å; C58-E61 HydrophobicContact CB-CG 4.06Å; C58-E61 PolarHBondContact N-OE2 3.01Å; C58-E61 WeakPolarHBondContact O-CA 3.45Å; C58-E61 VanDerWaalsContact O-CB 3.28Å; C58-E61 WeakPolarHBondContact O-CB 3.44Å; C58-E61 PolarHBondContact O-N 2.68Å; C58-L62 PolarHBondContact O-N 2.91Å
59	P	68.5	Low	69	Low	106 Å²	106	63 Å²	63	69%	0.688	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-51.3	-36.1	176.7	-29.8	36.4	0	0	0	113.7	E61 L62	P59-E61 PolarHBondContact O-N 3.13Å; P59-L62 WeakPolarHBondContact O-CB 3.39Å; P59-L62 PolarHBondContact O-N 3.16Å
60	N	64.9	Low	67	Low	153 Å²	153	61.5 Å²	61.5	82%	0.818	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-74	-8.7	177.6	-58.9	-6.5	0	0	0	114	C58	C58-N60 PolarHBondContact O-N 3.44Å; C58-N60 VanDerWaalsContact O-N 3.08Å
61	E	60.2	Low	64.9	Low	32 Å²	32	56 Å²	56	15%	0.15	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-94.5	-10.8	174.6	-65.2	-172.1	129.9	0	0	112.5	R35 L57 C58 P59 F63 T89 K91	R35-E61 IonicContact NH2-OE1 2.66Å; R35-E61 PolarHBondContact NH2-OE1 2.87Å; R35-E61 IonicContact NH2-OE2 2.82Å; L57-E61 WeakPolarHBondContact CA-OE2 3.36Å; L57-E61 HydrophobicContact CB-CB 4.29Å; L57-E61 HydrophobicContact CD2-CB 3.98Å; C58-E61 HydrophobicContact CB-CG 4.06Å; C58-E61 PolarHBondContact N-OE2 3.01Å; C58-E61 WeakPolarHBondContact O-CA 3.45Å; C58-E61 VanDerWaalsContact O-CB 3.28Å; C58-E61 WeakPolarHBondContact O-CB 3.44Å; C58-E61 PolarHBondContact O-N 2.68Å; P59-E61 PolarHBondContact O-N 3.13Å; E61-F63 PolarHBondContact O-N 3.25Å; E61-T89 PolarHBondContact O-OG1 3.2Å; E61-K91 HydrophobicContact CB-CG 3.99Å; E61-K91 HydrophobicContact CG-CD 4.23Å; E61-K91 HydrophobicContact CG-CG 4.23Å
62	L	60	Low	63	Low	52 Å²	52	57.1 Å²	57.1	27%	0.272	30%	0.295	S	S	.	.			trans	-87.8	101.9	173	-64.1	169	0	0	0	108	L57 C58 P59 I87	L57-L62 HydrophobicContact CB-CD2 4.15Å; L57-L62 HydrophobicContact CB-CG 4.26Å; L57-L62 HydrophobicContact CD1-CD2 3.57Å; L57-L62 HydrophobicContact CD1-CG 4.46Å; C58-L62 PolarHBondContact O-N 2.91Å; P59-L62 WeakPolarHBondContact O-CB 3.39Å; P59-L62 PolarHBondContact O-N 3.16Å; L62-I87 HydrophobicContact CD2-CB 4.24Å; L62-I87 HydrophobicContact CD2-CD1 3.63Å; L62-I87 HydrophobicContact CD2-CG1 3.87Å; L62-I87 HydrophobicContact CD2-CG2 3.36Å
63	F	55.3	Low	61.1	Low	80 Å²	80	56.1 Å²	56.1	35%	0.351	29%	0.29	S	S	.	.	S	Bend	trans	-72.8	-38.5	175.1	-71.6	-89.9	0	0	0	110.8	E61 T90 K91	E61-F63 PolarHBondContact O-N 3.25Å; F63-T90 HydrophobicContact CB-CG2 4.44Å; F63-T90 HydrophobicContact CD1-CG2 4.31Å; F63-T90 HydrophobicContact CD2-CG2 3.65Å; F63-T90 WeakPolarHBondContact CD2-OG1 3.35Å; F63-T90 HydrophobicContact CE2-CG2 3.93Å; F63-T90 WeakPolarHBondContact CE2-OG1 3.2Å; F63-T90 HydrophobicContact CG-CG2 3.85Å; F63-T90 HydrophobicContact CZ-CG2 4.35Å; F63-T90 WeakPolarHBondContact CZ-OG1 3.44Å; F63-K91 HydrophobicContact CE2-CG 4.24Å
64	L	50.1	Low	59	Low	22 Å²	22	60.7 Å²	60.7	12%	0.115	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	130.8	178.6	176.6	73.1	0	0	0	110.7	I66 M88 A334 T338	L64-I66 HydrophobicContact CD2-CD1 3.71Å; L64-I66 HydrophobicContact CD2-CG1 3.64Å; L64-I66 HydrophobicContact CG-CD1 4.45Å; L64-I66 HydrophobicContact CG-CG1 3.91Å; L64-M88 HydrophobicContact CB-CB 4.19Å; L64-M88 HydrophobicContact CD2-CB 4.31Å; L64-M88 HydrophobicContact CD2-CG 4.44Å; L64-M88 HydrophobicContact CD2-SD 3.83Å; L64-M88 PolarHBondContact N-O 2.89Å; L64-M88 PolarHBondContact O-N 3.25Å; L64-M88 VanDerWaalsContact O-O 3.09Å; L64-A334 HydrophobicContact CD1-CB 3.94Å; L64-A334 HydrophobicContact CD2-CB 3.5Å; L64-A334 VanDerWaalsContact CD2-CB 3.5Å; L64-A334 HydrophobicContact CG-CB 4.24Å; L64-T338 WeakPolarHBondContact CD2-OG1 3.4Å
65	Q	54.2	Low	57.2	Low	91 Å²	91	68.1 Å²	68.1	43%	0.425	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	111.5	167.4	-172	174.6	19	0	0	108.5	I87	Q65-I87 HydrophobicContact CG-CG1 4.35Å
66	I	52.7	Low	55.4	Low	7 Å²	7	66.9 Å²	66.9	4%	0.036	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.3	171	-60.2	157.5	0	0	0	107.2	L64 M68 I86 M88 L331 A334	L64-I66 HydrophobicContact CD2-CD1 3.71Å; L64-I66 HydrophobicContact CD2-CG1 3.64Å; L64-I66 HydrophobicContact CG-CD1 4.45Å; L64-I66 HydrophobicContact CG-CG1 3.91Å; I66-M68 HydrophobicContact CG2-CG 3.8Å; I66-I86 CarbonylContact C-O 3.5Å; I66-I86 WeakPolarHBondContact CA-O 3.31Å; I66-I86 HydrophobicContact CB-CB 4.3Å; I66-I86 PolarHBondContact N-O 3.15Å; I66-I86 PolarHBondContact O-N 2.85Å; I66-M88 HydrophobicContact CD1-CE 3.55Å; I66-M88 HydrophobicContact CD1-CG 4.21Å; I66-M88 HydrophobicContact CD1-SD 3.86Å; I66-L331 HydrophobicContact CD1-CD1 3.41Å; I66-L331 VanDerWaalsContact CD1-CD1 3.41Å; I66-L331 HydrophobicContact CG1-CD1 4.39Å; I66-A334 HydrophobicContact CD1-CB 4.13Å; I66-A334 HydrophobicContact CG1-CB 3.74Å
67	L	49.2	Very low	53.5	Low	78 Å²	78	70.1 Å²	70.1	41%	0.408	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.6	165.1	-63.5	175.2	0	0	0	107.6	W83 K85	L67-W83 HydrophobicContact CB-CD2 4.44Å; L67-W83 HydrophobicContact CB-CE3 3.75Å; L67-W83 HydrophobicContact CB-CZ3 4.4Å; L67-K85 HydrophobicContact CD2-CB 4.37Å; L67-K85 HydrophobicContact CD2-CG 3.41Å; L67-K85 VanDerWaalsContact CD2-CG 3.41Å
68	M	49.2	Very low	52.2	Low	12 Å²	12	77.1 Å²	77.1	6%	0.059	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	119.3	170.6	-64.6	-155.5	-35.1	0	0	109.3	I66 I70 W83 H84 I86 T118 L327	I66-M68 HydrophobicContact CG2-CG 3.8Å; M68-I70 HydrophobicContact CB-CG1 4.25Å; M68-I70 HydrophobicContact CE-CD1 3.64Å; M68-I70 HydrophobicContact CE-CG1 4.13Å; M68-W83 CarbonylContact O-C 3.57Å; M68-W83 WeakPolarHBondContact O-CA 3.12Å; M68-H84 PolarHBondContact N-O 3.28Å; M68-H84 PolarHBondContact O-N 3.33Å; M68-I86 HydrophobicContact CE-CD1 3.14Å; M68-I86 HydrophobicContact CE-CG1 4.27Å; M68-I86 HydrophobicContact CG-CD1 3.78Å; M68-I86 HydrophobicContact CG-CG1 4.37Å; M68-I86 HydrophobicContact SD-CD1 3.42Å; M68-I86 WeakPolarHBondContact SD-CD1 3.18Å; M68-T118 HydrophobicContact CE-CG2 3.96Å; M68-L327 HydrophobicContact CG-CD2 4.38Å; M68-L327 HydrophobicContact SD-CD2 3.64Å
69	Q	45.7	Very low	51.1	Low	71 Å²	71	74.7 Å²	74.7	33%	0.332	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	121.1	163	-156.2	174.7	13.1	0	0	107.6	N71 Q81 W83	Q69-N71 WeakPolarHBondContact CG-OD1 3.31Å; Q69-Q81 PolarHBondContact NE2-O 3.22Å; Q69-W83 HydrophobicContact CB-CD2 3.89Å; Q69-W83 HydrophobicContact CB-CE3 3.57Å; Q69-W83 HydrophobicContact CB-CH2 3.84Å; Q69-W83 HydrophobicContact CB-CZ2 4.16Å; Q69-W83 HydrophobicContact CB-CZ3 3.57Å; Q69-W83 HydrophobicContact CG-CD2 4.16Å; Q69-W83 HydrophobicContact CG-CE3 4.34Å; Q69-W83 HydrophobicContact CG-CH2 4.45Å; Q69-W83 HydrophobicContact CG-CZ2 4.29Å; Q69-W83 VanDerWaalsContact N-CE3 3.27Å
70	I	49.1	Very low	49.9	Very low	10 Å²	10	74.5 Å²	74.5	5%	0.051	40%	0.401	C	S	.	.			trans	-120.2	96.5	172.2	-46.9	173.9	0	0	0	106.8	M68 E72 W73	M68-I70 HydrophobicContact CB-CG1 4.25Å; M68-I70 HydrophobicContact CE-CD1 3.64Å; M68-I70 HydrophobicContact CE-CG1 4.13Å; I70-E72 PolarHBondContact O-N 3.4Å; I70-E72 VanDerWaalsContact O-N 3.15Å; I70-W73 HydrophobicContact CB-CE3 3.73Å; I70-W73 HydrophobicContact CB-CZ3 4.31Å; I70-W73 HydrophobicContact CD1-CE3 3.62Å; I70-W73 HydrophobicContact CD1-CZ3 3.56Å; I70-W73 HydrophobicContact CG1-CE3 4.28Å; I70-W73 HydrophobicContact CG2-CE3 3.41Å; I70-W73 VanDerWaalsContact CG2-CE3 3.41Å; I70-W73 HydrophobicContact CG2-CZ3 3.74Å; I70-W73 PolarHBondContact O-N 2.92Å; I70-W73 VanDerWaalsContact O-N 3.16Å
71	N	44.6	Very low	49.1	Very low	101 Å²	101	73.6 Å²	73.6	54%	0.54	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-22.7	-173.3	-60.2	-32.7	0	0	0	113.2	Q69 W73 E323	Q69-N71 WeakPolarHBondContact CG-OD1 3.31Å; N71-W73 VanDerWaalsContact C-N 3.27Å; N71-W73 PolarHBondContact O-N 3.3Å; N71-E323 PolarHBondContact ND2-OE1 3.04Å
72	E	46.4	Very low	48.3	Very low	70 Å²	70	72.6 Å²	72.6	33%	0.327	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-4.3	-179.6	-63.2	175.3	-110.4	0	0	113.6	I70 K121 G318 T319	I70-E72 PolarHBondContact O-N 3.4Å; I70-E72 VanDerWaalsContact O-N 3.15Å; E72-K121 IonicContact OE1-NZ 2.71Å; E72-G318 VanDerWaalsContact CD-C 3.48Å; E72-G318 PolarHBondContact OE2-N 3.15Å; E72-T319 WeakPolarHBondContact OE1-CA 3.39Å; E72-T319 WeakPolarHBondContact OE1-CB 3.32Å; E72-T319 PolarHBondContact OE1-N 2.83Å; E72-T319 PolarHBondContact OE1-OG1 2.98Å
73	W	46.2	Very low	47.7	Very low	29 Å²	29	73.7 Å²	73.7	11%	0.11	39%	0.391	C	S	.	.	S	Bend	trans	-90.8	139.5	-179.6	-115.8	-71.1	0	0	0	113	I70 N71 K75 H84 Y102 E114 I117	I70-W73 HydrophobicContact CB-CE3 3.73Å; I70-W73 HydrophobicContact CB-CZ3 4.31Å; I70-W73 HydrophobicContact CD1-CE3 3.62Å; I70-W73 HydrophobicContact CD1-CZ3 3.56Å; I70-W73 HydrophobicContact CG1-CE3 4.28Å; I70-W73 HydrophobicContact CG2-CE3 3.41Å; I70-W73 VanDerWaalsContact CG2-CE3 3.41Å; I70-W73 HydrophobicContact CG2-CZ3 3.74Å; I70-W73 PolarHBondContact O-N 2.92Å; I70-W73 VanDerWaalsContact O-N 3.16Å; N71-W73 VanDerWaalsContact C-N 3.27Å; N71-W73 PolarHBondContact O-N 3.3Å; W73-K75 PolarHBondContact O-N 3.2Å; W73-H84 AromaticContact CG-NE2 3.83Å; W73-Y102 HydrophobicContact CD2-CE1 4.22Å; W73-Y102 HydrophobicContact CE3-CE1 4.49Å; W73-Y102 WeakPolarHBondContact CH2-OH 3.32Å; W73-Y102 WeakPolarHBondContact CZ2-OH 3.14Å; W73-Y102 WeakPolarHBondContact CZ3-OH 3.27Å; W73-E114 VanDerWaalsContact CE2-CG 3.47Å; W73-E114 HydrophobicContact CH2-CB 4.23Å; W73-E114 HydrophobicContact CH2-CG 4.31Å; W73-E114 HydrophobicContact CZ2-CB 3.66Å; W73-E114 HydrophobicContact CZ2-CG 3.32Å; W73-E114 PolarHBondContact NE1-OE1 2.82Å; W73-I117 HydrophobicContact CH2-CB 3.95Å; W73-I117 HydrophobicContact CH2-CD1 3.91Å; W73-I117 HydrophobicContact CH2-CG2 3.91Å; W73-I117 HydrophobicContact CZ2-CD1 4.43Å; W73-I117 HydrophobicContact CZ3-CG2 4.07Å
74	P	41.9	Very low	47.5	Very low	101 Å²	101	70.5 Å²	70.5	66%	0.656	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-51.3	119.5	161.8	8.6	-20.5	0	0	0	109.4	S76	P74-S76 PolarHBondContact O-N 2.95Å; P74-S76 VanDerWaalsContact O-N 3.12Å
75	K	47.3	Very low	47.8	Very low	160 Å²	160	73 Å²	73	70%	0.696	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-51.2	120.8	174.5	-62.3	178.6	-177.7	178.9	0	107	W73 N77	W73-K75 PolarHBondContact O-N 3.2Å; K75-N77 PolarHBondContact O-N 3.13Å
76	S	45.7	Very low	48	Very low	41 Å²	41	68.8 Å²	68.8	29%	0.287	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-61.6	140.2	164.7	53.1	0	0	0	0	107.4	P74 D78 A79	P74-S76 PolarHBondContact O-N 2.95Å; P74-S76 VanDerWaalsContact O-N 3.12Å; S76-D78 PolarHBondContact O-N 3.19Å; S76-A79 PolarHBondContact O-N 3.06Å; S76-A79 WeakPolarHBondContact OG-CB 3.5Å
77	N	45.8	Very low	48.4	Very low	168 Å²	168	68.5 Å²	68.5	90%	0.898	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-24	-179.6	-73.4	-10	0	0	0	113.1	K75	K75-N77 PolarHBondContact O-N 3.13Å
78	D	48.9	Very low	48.9	Very low	164 Å²	164	65 Å²	65	88%	0.877	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	0.9	-179.4	-60.7	-34.8	0	0	0	115.5	S76	S76-D78 PolarHBondContact O-N 3.19Å
79	A	47.8	Very low	49.3	Very low	21 Å²	21	64.4 Å²	64.4	17%	0.174	34%	0.344	C	S	.	.			trans	-113.9	87.9	177.8	0	0	0	0	0	110	S76 Q81 G82	S76-A79 PolarHBondContact O-N 3.06Å; S76-A79 WeakPolarHBondContact OG-CB 3.5Å; A79-Q81 PolarHBondContact O-N 3.3Å; A79-G82 PolarHBondContact O-N 2.68Å
80	A	43.9	Very low	49.7	Very low	101 Å²	101	61.3 Å²	61.3	84%	0.835	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-13.1	178.4	0	0	0	0	0	114.8
81	Q	46.5	Very low	50	Low	134 Å²	134	64.9 Å²	64.9	63%	0.626	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.3	8.4	-176	-67.3	-179.5	6.1	0	0	115.7	Q69 A79 W83	Q69-Q81 PolarHBondContact NE2-O 3.22Å; A79-Q81 PolarHBondContact O-N 3.3Å; Q81-W83 VanDerWaalsContact C-N 3.28Å; Q81-W83 VanDerWaalsContact CB-NE1 3.33Å; Q81-W83 PolarHBondContact O-N 3.25Å
82	G	44.6	Very low	50.4	Low	11 Å²	11	60.9 Å²	60.9	11%	0.113	32%	0.324	C	S	.	.			trans	66.8	23.3	174.5	0	0	0	0	0	115.5	A79	A79-G82 PolarHBondContact O-N 2.68Å
83	W	46.4	Very low	50.6	Low	76 Å²	76	59.3 Å²	59.3	29%	0.288	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	129.7	173.6	-58	94.6	0	0	0	110.5	L67 M68 Q69 Q81 F326	L67-W83 HydrophobicContact CB-CD2 4.44Å; L67-W83 HydrophobicContact CB-CE3 3.75Å; L67-W83 HydrophobicContact CB-CZ3 4.4Å; M68-W83 CarbonylContact O-C 3.57Å; M68-W83 WeakPolarHBondContact O-CA 3.12Å; Q69-W83 HydrophobicContact CB-CD2 3.89Å; Q69-W83 HydrophobicContact CB-CE3 3.57Å; Q69-W83 HydrophobicContact CB-CH2 3.84Å; Q69-W83 HydrophobicContact CB-CZ2 4.16Å; Q69-W83 HydrophobicContact CB-CZ3 3.57Å; Q69-W83 HydrophobicContact CG-CD2 4.16Å; Q69-W83 HydrophobicContact CG-CE3 4.34Å; Q69-W83 HydrophobicContact CG-CH2 4.45Å; Q69-W83 HydrophobicContact CG-CZ2 4.29Å; Q69-W83 VanDerWaalsContact N-CE3 3.27Å; Q81-W83 VanDerWaalsContact C-N 3.28Å; Q81-W83 VanDerWaalsContact CB-NE1 3.33Å; Q81-W83 PolarHBondContact O-N 3.25Å; W83-F326 HydrophobicContact CH2-CE1 4.38Å; W83-F326 HydrophobicContact CH2-CZ 4.36Å; W83-F326 HydrophobicContact CZ3-CE1 4.42Å
84	H	52	Low	50.9	Low	12 Å²	12	58.9 Å²	58.9	6%	0.056	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.7	168	-62.9	-57	0	0	0	109.4	M68 W73 I86 Y102	M68-H84 PolarHBondContact N-O 3.28Å; M68-H84 PolarHBondContact O-N 3.33Å; W73-H84 AromaticContact CG-NE2 3.83Å; H84-I86 PolarHBondContact O-N 3.34Å; H84-Y102 HydrophobicContact CB-CD1 4.26Å; H84-Y102 HydrophobicContact CB-CE1 4.17Å; H84-Y102 AromaticContact CD2-CE1 3.39Å; H84-Y102 WeakPolarHBondContact CD2-CE1 3.43Å; H84-Y102 AromaticContact CE1-CD1 3.67Å; H84-Y102 AromaticContact CE1-CE1 3.54Å; H84-Y102 AromaticContact CG-CD1 3.62Å; H84-Y102 AromaticContact CG-CE1 3.4Å; H84-Y102 AromaticContact ND1-CD1 3.35Å; H84-Y102 WeakPolarHBondContact ND1-CD1 3.48Å; H84-Y102 AromaticContact ND1-CE1 3.5Å; H84-Y102 WeakPolarHBondContact ND1-CE1 3.17Å; H84-Y102 AromaticContact NE2-CE1 3.47Å; H84-Y102 WeakPolarHBondContact NE2-CE1 3.48Å
85	K	55.4	Low	51.5	Low	74 Å²	74	56.9 Å²	56.9	32%	0.322	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	117.1	173.1	-72.1	169.5	-176.7	168.9	0	108.8	L67 M103 D104	L67-K85 HydrophobicContact CD2-CB 4.37Å; L67-K85 HydrophobicContact CD2-CG 3.41Å; L67-K85 VanDerWaalsContact CD2-CG 3.41Å; K85-M103 HydrophobicContact CD-CE 4.39Å; K85-D104 IonicContact NZ-OD2 2.69Å
86	I	58.7	Low	52.3	Low	3 Å²	3	50 Å²	50	2%	0.015	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.1	163.4	-69.6	-174.7	0	0	0	107.1	I66 M68 H84 L99 V100 T118	I66-I86 CarbonylContact C-O 3.5Å; I66-I86 WeakPolarHBondContact CA-O 3.31Å; I66-I86 HydrophobicContact CB-CB 4.3Å; I66-I86 PolarHBondContact N-O 3.15Å; I66-I86 PolarHBondContact O-N 2.85Å; M68-I86 HydrophobicContact CE-CD1 3.14Å; M68-I86 HydrophobicContact CE-CG1 4.27Å; M68-I86 HydrophobicContact CG-CD1 3.78Å; M68-I86 HydrophobicContact CG-CG1 4.37Å; M68-I86 HydrophobicContact SD-CD1 3.42Å; M68-I86 WeakPolarHBondContact SD-CD1 3.18Å; H84-I86 PolarHBondContact O-N 3.34Å; I86-L99 HydrophobicContact CD1-CD1 4.16Å; I86-L99 HydrophobicContact CG2-CD1 3.27Å; I86-L99 HydrophobicContact CG2-CG 4.12Å; I86-V100 WeakPolarHBondContact CA-O 3.14Å; I86-T118 HydrophobicContact CD1-CG2 3.27Å; I86-T118 HydrophobicContact CG1-CG2 4.27Å
87	I	62.1	Low	53.6	Low	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.4	176.4	-72.1	158.8	0	0	0	108.5	L57 L62 Q65 T89 V100 M103	L57-I87 HydrophobicContact CD1-CG2 4.33Å; L62-I87 HydrophobicContact CD2-CB 4.24Å; L62-I87 HydrophobicContact CD2-CD1 3.63Å; L62-I87 HydrophobicContact CD2-CG1 3.87Å; L62-I87 HydrophobicContact CD2-CG2 3.36Å; Q65-I87 HydrophobicContact CG-CG1 4.35Å; I87-T89 HydrophobicContact CG2-CG2 4.25Å; I87-V100 HydrophobicContact CB-CB 4.44Å; I87-V100 PolarHBondContact O-N 3.26Å; I87-M103 HydrophobicContact CD1-CE 3.21Å; I87-M103 HydrophobicContact CD1-SD 3.26Å; I87-M103 WeakPolarHBondContact CD1-SD 3.17Å; I87-M103 HydrophobicContact CG1-CE 4.47Å
88	M	58.8	Low	55.2	Low	4 Å²	4	40.8 Å²	40.8	2%	0.02	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	115.2	157.2	-66.7	178.8	-177	0	0	108.2	L64 I66 P97 L98 L331	L64-M88 HydrophobicContact CB-CB 4.19Å; L64-M88 HydrophobicContact CD2-CB 4.31Å; L64-M88 HydrophobicContact CD2-CG 4.44Å; L64-M88 HydrophobicContact CD2-SD 3.83Å; L64-M88 PolarHBondContact N-O 2.89Å; L64-M88 PolarHBondContact O-N 3.25Å; L64-M88 VanDerWaalsContact O-O 3.09Å; I66-M88 HydrophobicContact CD1-CE 3.55Å; I66-M88 HydrophobicContact CD1-CG 4.21Å; I66-M88 HydrophobicContact CD1-SD 3.86Å; M88-P97 HydrophobicContact CB-CB 4.34Å; M88-P97 HydrophobicContact CG-CB 4.42Å; M88-L98 WeakPolarHBondContact CA-O 3.28Å; M88-L98 WeakPolarHBondContact CG-O 3.24Å; M88-L331 HydrophobicContact CE-CD1 4.11Å
89	T	56.9	Low	56.8	Low	1 Å²	1	33 Å²	33	1%	0.006	18%	0.178	C	C	.	.			trans	-126.8	155.6	173.7	-179.9	0	0	0	0	108.5	F54 L57 E61 I87 K91 P97 L98	F54-T89 HydrophobicContact CD1-CG2 4.37Å; F54-T89 HydrophobicContact CE1-CG2 4.33Å; L57-T89 HydrophobicContact CD1-CG2 4.04Å; E61-T89 PolarHBondContact O-OG1 3.2Å; I87-T89 HydrophobicContact CG2-CG2 4.25Å; T89-K91 PolarHBondContact OG1-N 3.25Å; T89-P97 WeakPolarHBondContact O-CA 2.97Å; T89-L98 HydrophobicContact CG2-CB 4.28Å; T89-L98 HydrophobicContact CG2-CD1 3.77Å; T89-L98 HydrophobicContact CG2-CG 4.26Å; T89-L98 PolarHBondContact O-N 3.37Å
90	T	55.3	Low	58.6	Low	5 Å²	5	32 Å²	32	3%	0.031	17%	0.17	C	C	.	.			trans	-109.2	6.5	-179.5	81.4	0	0	0	0	111.9	F63 L92 H95	F63-T90 HydrophobicContact CB-CG2 4.44Å; F63-T90 HydrophobicContact CD1-CG2 4.31Å; F63-T90 HydrophobicContact CD2-CG2 3.65Å; F63-T90 WeakPolarHBondContact CD2-OG1 3.35Å; F63-T90 HydrophobicContact CE2-CG2 3.93Å; F63-T90 WeakPolarHBondContact CE2-OG1 3.2Å; F63-T90 HydrophobicContact CG-CG2 3.85Å; F63-T90 HydrophobicContact CZ-CG2 4.35Å; F63-T90 WeakPolarHBondContact CZ-OG1 3.44Å; T90-L92 VanDerWaalsContact C-N 3.34Å; T90-L92 PolarHBondContact O-N 3.05Å; T90-H95 VanDerWaalsContact CB-C 3.4Å; T90-H95 VanDerWaalsContact CB-CA 3.47Å; T90-H95 WeakPolarHBondContact CB-O 3.42Å; T90-H95 WeakPolarHBondContact CG2-O 3.1Å; T90-H95 WeakPolarHBondContact O-CA 3.42Å; T90-H95 PolarHBondContact O-N 2.99Å; T90-H95 PolarHBondContact OG1-ND1 3.3Å; T90-H95 VanDerWaalsContact OG1-ND1 3.14Å
91	K	54.8	Low	60.5	Low	86 Å²	86	27.2 Å²	27.2	37%	0.374	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.8	-166.9	-70.8	-79.6	178.6	171	0	115.8	E61 F63 T89	E61-K91 HydrophobicContact CB-CG 3.99Å; E61-K91 HydrophobicContact CG-CD 4.23Å; E61-K91 HydrophobicContact CG-CG 4.23Å; F63-K91 HydrophobicContact CE2-CG 4.24Å; T89-K91 PolarHBondContact OG1-N 3.25Å
92	L	54.1	Low	62	Low	16 Å²	16	21 Å²	21	8%	0.084	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	132.2	166.5	-63.2	174.5	0	0	0	108.5	F52 F54 T90 L98 V144	F52-L92 HydrophobicContact CE1-CD2 4.22Å; F54-L92 HydrophobicContact CE1-CD1 3.84Å; F54-L92 HydrophobicContact CZ-CD1 3.86Å; T90-L92 VanDerWaalsContact C-N 3.34Å; T90-L92 PolarHBondContact O-N 3.05Å; L92-L98 HydrophobicContact CB-CD1 4.08Å; L92-L98 HydrophobicContact CD1-CD1 3.5Å; L92-L98 VanDerWaalsContact CD1-CD1 3.5Å; L92-L98 HydrophobicContact CG-CD1 3.98Å; L92-V144 HydrophobicContact CD1-CB 4.42Å; L92-V144 HydrophobicContact CD1-CG2 3.45Å; L92-V144 VanDerWaalsContact CD1-CG2 3.45Å; L92-V144 HydrophobicContact CD2-CG2 3.99Å; L92-V144 HydrophobicContact CG-CG2 4.4Å
93	R	50.1	Low	63.7	Low	38 Å²	38	21.1 Å²	21.1	14%	0.143	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	19.8	103.9	-177.7	-70.5	-173.9	-175.2	-136.3	13.1	116.6	E143 C256 E265	R93-E143 IonicContact CZ-OE1 3.84Å; R93-E143 IonicContact NE-OE1 3.97Å; R93-E143 PolarHBondContact NE-OE1 3.45Å; R93-E143 IonicContact NE-OE2 2.93Å; R93-E143 IonicContact NH2-OE1 2.64Å; R93-E143 PolarHBondContact NH2-OE1 3.04Å; R93-C256 PolarHBondContact NH1-SG 2.77Å; R93-E265 WeakPolarHBondContact CD-OE1 3.23Å; R93-E265 IonicContact CZ-OE1 3.73Å; R93-E265 IonicContact NE-OE1 3.98Å; R93-E265 IonicContact NH1-OE1 2.65Å; R93-E265 PolarHBondContact NH1-OE1 2.89Å; R93-E265 IonicContact NH1-OE2 3.18Å; R93-E265 PolarHBondContact NH1-OE2 2.7Å
94	G	52	Low	65.3	Low	20 Å²	20	21.7 Å²	21.7	21%	0.206	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	35	159.8	0	0	0	0	0	115.3	K96	G94-K96 VanDerWaalsContact C-N 3.27Å; G94-K96 PolarHBondContact O-N 2.71Å
95	H	55.1	Low	66.9	Low	59 Å²	59	25.1 Å²	25.1	27%	0.273	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	28.7	173.5	-74.8	-95.4	0	0	0	115.8	E29 T90	E29-H95 IonicContact OE1-CD2 2.84Å; E29-H95 IonicContact OE1-NE2 3.33Å; E29-H95 IonicContact OE2-CD2 3.59Å; E29-H95 PolarHBondContact OE2-CD2 3.29Å; E29-H95 IonicContact OE2-NE2 3.22Å; E29-H95 PolarHBondContact OE2-NE2 2.78Å; E29-H95 VanDerWaalsContact OE2-NE2 3.15Å; T90-H95 VanDerWaalsContact CB-C 3.4Å; T90-H95 VanDerWaalsContact CB-CA 3.47Å; T90-H95 WeakPolarHBondContact CB-O 3.42Å; T90-H95 WeakPolarHBondContact CG2-O 3.1Å; T90-H95 WeakPolarHBondContact O-CA 3.42Å; T90-H95 PolarHBondContact O-N 2.99Å; T90-H95 PolarHBondContact OG1-ND1 3.3Å; T90-H95 VanDerWaalsContact OG1-ND1 3.14Å
96	K	64.7	Low	68.5	Low	15 Å²	15	28.1 Å²	28.1	7%	0.065	13%	0.131	C	C	.	.	P	Polyproline II helix	trans	-91.7	133.9	-175	-81.2	171.6	175.5	-171.6	0	113.4	E25 R27 G94 L98	E25-K96 WeakPolarHBondContact OE1-CE 3.4Å; E25-K96 IonicContact OE1-NZ 3.43Å; E25-K96 PolarHBondContact OE1-NZ 3.15Å; E25-K96 WeakPolarHBondContact OE2-CE 3.5Å; E25-K96 IonicContact OE2-NZ 3.77Å; E25-K96 PolarHBondContact OE2-NZ 3.17Å; R27-K96 VanDerWaalsContact NH2-CE 3.3Å; G94-K96 VanDerWaalsContact C-N 3.27Å; G94-K96 PolarHBondContact O-N 2.71Å; K96-L98 PolarHBondContact O-N 3.28Å
97	P	71.2	Confident	70	Confident	13 Å²	13	29.6 Å²	29.6	8%	0.084	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-60	127.9	176.7	-18.9	30	0	0	0	110.4	M88 T89 L151 F339	M88-P97 HydrophobicContact CB-CB 4.34Å; M88-P97 HydrophobicContact CG-CB 4.42Å; T89-P97 WeakPolarHBondContact O-CA 2.97Å; P97-L151 HydrophobicContact CB-CB 4.01Å; P97-L151 HydrophobicContact CB-CD2 4.07Å; P97-L151 HydrophobicContact CG-CD2 4.36Å; P97-L151 WeakPolarHBondContact O-CA 3.38Å; P97-L151 WeakPolarHBondContact O-CB 3.48Å; P97-L151 PolarHBondContact O-N 3.46Å; P97-F339 HydrophobicContact CG-CE1 4.05Å; P97-F339 HydrophobicContact CG-CZ 4.2Å
98	L	79.9	Confident	71.5	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	154.6	168.8	-56.1	176.2	0	0	0	110.1	F54 M88 T89 L92 K96 V100 F149 E150	F54-L98 HydrophobicContact CE1-CD1 3.52Å; F54-L98 HydrophobicContact CZ-CD1 3.78Å; M88-L98 WeakPolarHBondContact CA-O 3.28Å; M88-L98 WeakPolarHBondContact CG-O 3.24Å; T89-L98 HydrophobicContact CG2-CB 4.28Å; T89-L98 HydrophobicContact CG2-CD1 3.77Å; T89-L98 HydrophobicContact CG2-CG 4.26Å; T89-L98 PolarHBondContact O-N 3.37Å; L92-L98 HydrophobicContact CB-CD1 4.08Å; L92-L98 HydrophobicContact CD1-CD1 3.5Å; L92-L98 VanDerWaalsContact CD1-CD1 3.5Å; L92-L98 HydrophobicContact CG-CD1 3.98Å; K96-L98 PolarHBondContact O-N 3.28Å; L98-V100 HydrophobicContact CB-CG2 4.22Å; L98-F149 CarbonylContact C-O 3.53Å; L98-F149 VanDerWaalsContact CA-O 3.31Å; L98-F149 WeakPolarHBondContact CA-O 3.05Å; L98-E150 HydrophobicContact CD2-CB 4.38Å; L98-E150 HydrophobicContact CD2-CG 3.9Å
99	L	83.9	Confident	73.2	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.01	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	109.9	165.4	-172.5	80	0	0	0	107.1	I86 P101 T118 A119 T122 L133 H148 F149	I86-L99 HydrophobicContact CD1-CD1 4.16Å; I86-L99 HydrophobicContact CG2-CD1 3.27Å; I86-L99 HydrophobicContact CG2-CG 4.12Å; L99-P101 WeakPolarHBondContact O-CD 3.24Å; L99-T118 HydrophobicContact CD2-CG2 3.95Å; L99-T118 HydrophobicContact CG-CG2 4.41Å; L99-A119 HydrophobicContact CD2-CB 4.32Å; L99-T122 HydrophobicContact CD1-CG2 4.21Å; L99-L133 HydrophobicContact CB-CD2 4.31Å; L99-L133 HydrophobicContact CD2-CD2 3.57Å; L99-H148 CarbonylContact O-C 3.48Å; L99-H148 VanDerWaalsContact O-CA 3.26Å; L99-H148 WeakPolarHBondContact O-CA 3.49Å; L99-F149 HydrophobicContact CB-CB 4.15Å; L99-F149 HydrophobicContact CD2-CD2 4.27Å; L99-F149 PolarHBondContact N-O 3.43Å; L99-F149 PolarHBondContact O-N 2.8Å
100	V	85.4	Confident	75	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-108.3	91.9	-179.3	-172.8	0	0	0	0	109.6	F54 I86 I87 L98 M103 H148	F54-V100 HydrophobicContact CB-CG1 4.04Å; F54-V100 HydrophobicContact CD1-CG2 3.95Å; F54-V100 HydrophobicContact CD2-CB 4.2Å; F54-V100 HydrophobicContact CD2-CG1 3.37Å; F54-V100 HydrophobicContact CD2-CG2 3.69Å; F54-V100 HydrophobicContact CE1-CG2 4.04Å; F54-V100 HydrophobicContact CE2-CG1 4.03Å; F54-V100 HydrophobicContact CE2-CG2 3.8Å; F54-V100 HydrophobicContact CG-CB 4.42Å; F54-V100 HydrophobicContact CG-CG1 3.83Å; F54-V100 HydrophobicContact CG-CG2 3.77Å; F54-V100 HydrophobicContact CZ-CG2 3.96Å; I86-V100 WeakPolarHBondContact CA-O 3.14Å; I87-V100 HydrophobicContact CB-CB 4.44Å; I87-V100 PolarHBondContact O-N 3.26Å; L98-V100 HydrophobicContact CB-CG2 4.22Å; V100-M103 HydrophobicContact CG1-CB 3.95Å; V100-M103 HydrophobicContact CG1-CG 4.24Å; V100-H148 HydrophobicContact CG2-CB 4.09Å
101	P	82.6	Confident	76.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	138.6	-177.9	36.9	-39.6	0	0	0	110.6	L99 M103 T118 L147 F149	L99-P101 WeakPolarHBondContact O-CD 3.24Å; P101-M103 VanDerWaalsContact C-N 3.29Å; P101-M103 PolarHBondContact O-N 3.42Å; P101-T118 HydrophobicContact CB-CG2 3.82Å; P101-L147 HydrophobicContact CG-CD2 3.84Å; P101-L147 HydrophobicContact CG-CG 3.82Å; P101-F149 HydrophobicContact CG-CD2 4.37Å; P101-F149 HydrophobicContact CG-CE2 4.05Å
102	Y	78.3	Confident	78.7	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.016	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	41.7	174.3	-46.1	-95.2	0	0	0	113.9	W73 H84 D104 K105 L107 E114 T118	W73-Y102 HydrophobicContact CD2-CE1 4.22Å; W73-Y102 HydrophobicContact CE3-CE1 4.49Å; W73-Y102 WeakPolarHBondContact CH2-OH 3.32Å; W73-Y102 WeakPolarHBondContact CZ2-OH 3.14Å; W73-Y102 WeakPolarHBondContact CZ3-OH 3.27Å; H84-Y102 HydrophobicContact CB-CD1 4.26Å; H84-Y102 HydrophobicContact CB-CE1 4.17Å; H84-Y102 AromaticContact CD2-CE1 3.39Å; H84-Y102 WeakPolarHBondContact CD2-CE1 3.43Å; H84-Y102 AromaticContact CE1-CD1 3.67Å; H84-Y102 AromaticContact CE1-CE1 3.54Å; H84-Y102 AromaticContact CG-CD1 3.62Å; H84-Y102 AromaticContact CG-CE1 3.4Å; H84-Y102 AromaticContact ND1-CD1 3.35Å; H84-Y102 WeakPolarHBondContact ND1-CD1 3.48Å; H84-Y102 AromaticContact ND1-CE1 3.5Å; H84-Y102 WeakPolarHBondContact ND1-CE1 3.17Å; H84-Y102 AromaticContact NE2-CE1 3.47Å; H84-Y102 WeakPolarHBondContact NE2-CE1 3.48Å; Y102-D104 PolarHBondContact O-N 2.94Å; Y102-K105 HydrophobicContact CD1-CD 4.15Å; Y102-K105 HydrophobicContact CG-CD 4.36Å; Y102-K105 WeakPolarHBondContact O-CA 3.43Å; Y102-K105 WeakPolarHBondContact O-CB 3.43Å; Y102-K105 PolarHBondContact O-N 3.29Å; Y102-L107 HydrophobicContact CD2-CD1 4.48Å; Y102-L107 HydrophobicContact CG-CD1 4.48Å; Y102-E114 HydrophobicContact CD1-CG 4.48Å; Y102-E114 HydrophobicContact CD2-CB 3.8Å; Y102-E114 HydrophobicContact CD2-CG 4.37Å; Y102-E114 HydrophobicContact CE1-CB 4.24Å; Y102-E114 HydrophobicContact CE1-CG 4Å; Y102-E114 HydrophobicContact CE2-CB 3.39Å; Y102-E114 HydrophobicContact CE2-CG 4.07Å; Y102-T118 PolarHBondContact OH-OG1 3.28Å
103	M	80.9	Confident	80.3	Confident	12 Å²	12	31.4 Å²	31.4	6%	0.059	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-48.3	-39.1	-178.4	-178.2	-171.8	49.6	0	0	113.1	F54 L55 K85 I87 V100 P101 K105 R106 H146	F54-M103 HydrophobicContact CB-CG 3.98Å; F54-M103 HydrophobicContact CB-SD 3.68Å; L55-M103 HydrophobicContact CD2-CE 3.92Å; L55-M103 HydrophobicContact CD2-CG 3.7Å; L55-M103 HydrophobicContact CD2-SD 3.84Å; L55-M103 HydrophobicContact CG-CG 4.01Å; L55-M103 HydrophobicContact CG-SD 4.32Å; K85-M103 HydrophobicContact CD-CE 4.39Å; I87-M103 HydrophobicContact CD1-CE 3.21Å; I87-M103 HydrophobicContact CD1-SD 3.26Å; I87-M103 WeakPolarHBondContact CD1-SD 3.17Å; I87-M103 HydrophobicContact CG1-CE 4.47Å; V100-M103 HydrophobicContact CG1-CB 3.95Å; V100-M103 HydrophobicContact CG1-CG 4.24Å; P101-M103 VanDerWaalsContact C-N 3.29Å; P101-M103 PolarHBondContact O-N 3.42Å; M103-K105 PolarHBondContact O-N 3.4Å; M103-R106 PolarHBondContact O-N 3.39Å; M103-H146 WeakPolarHBondContact CA-NE2 3.26Å; M103-H146 PolarHBondContact O-CE1 3.04Å; M103-H146 PolarHBondContact O-NE2 3.43Å; M103-H146 VanDerWaalsContact O-NE2 3.11Å
104	D	80	Confident	81.9	Confident	88 Å²	88	32 Å²	32	47%	0.471	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-67.2	-24.8	-178.9	-57.3	-40.5	0	0	0	112.7	K85 Y102 R106	K85-D104 IonicContact NZ-OD2 2.69Å; Y102-D104 PolarHBondContact O-N 2.94Å; D104-R106 PolarHBondContact O-N 3.01Å
105	K	84.1	Confident	83.7	Confident	85 Å²	85	31.1 Å²	31.1	37%	0.37	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-77	-6.7	177	-66.9	-168.4	177.8	-179.6	0	113.4	Y102 M103 L107	Y102-K105 HydrophobicContact CD1-CD 4.15Å; Y102-K105 HydrophobicContact CG-CD 4.36Å; Y102-K105 WeakPolarHBondContact O-CA 3.43Å; Y102-K105 WeakPolarHBondContact O-CB 3.43Å; Y102-K105 PolarHBondContact O-N 3.29Å; M103-K105 PolarHBondContact O-N 3.4Å; K105-L107 HydrophobicContact CB-CD1 4.49Å; K105-L107 HydrophobicContact CB-CD2 4.13Å; K105-L107 HydrophobicContact CB-CG 3.92Å; K105-L107 PolarHBondContact O-N 3.46Å
106	R	89.9	Confident	85.5	Confident	136 Å²	136	28.3 Å²	28.3	51%	0.513	14%	0.137	S	C	.	.			trans	52.6	43.4	176.9	-61.6	175.8	-177.7	-174.7	2.8	112.3	F47 L55 M103 D104	F47-R106 WeakPolarHBondContact CB-O 3.41Å; F47-R106 HydrophobicContact CD1-CB 3.69Å; F47-R106 HydrophobicContact CD1-CG 4.35Å; F47-R106 HydrophobicContact CD2-CB 4.08Å; F47-R106 HydrophobicContact CE1-CB 3.64Å; F47-R106 HydrophobicContact CE1-CG 3.79Å; F47-R106 HydrophobicContact CE2-CB 4.02Å; F47-R106 HydrophobicContact CE2-CG 4.36Å; F47-R106 HydrophobicContact CG-CB 3.91Å; F47-R106 WeakPolarHBondContact CG-O 3.23Å; F47-R106 HydrophobicContact CZ-CB 3.8Å; F47-R106 HydrophobicContact CZ-CG 3.79Å; L55-R106 HydrophobicContact CD1-CG 3.79Å; M103-R106 PolarHBondContact O-N 3.39Å; D104-R106 PolarHBondContact O-N 3.01Å
107	L	90.4	Very high	86.6	Confident	35 Å²	35	28.2 Å²	28.2	18%	0.183	14%	0.138	C	C	.	.			trans	-68.7	136.1	-177.6	-63	176.3	0	0	0	109.7	Y102 K105 T112 H146 L147	Y102-L107 HydrophobicContact CD2-CD1 4.48Å; Y102-L107 HydrophobicContact CG-CD1 4.48Å; K105-L107 HydrophobicContact CB-CD1 4.49Å; K105-L107 HydrophobicContact CB-CD2 4.13Å; K105-L107 HydrophobicContact CB-CG 3.92Å; K105-L107 PolarHBondContact O-N 3.46Å; L107-T112 HydrophobicContact CD1-CG2 4.37Å; L107-H146 WeakPolarHBondContact O-CA 3.36Å; L107-H146 PolarHBondContact O-CD2 3.21Å; L107-L147 HydrophobicContact CB-CB 3.9Å; L107-L147 HydrophobicContact CB-CD2 4.18Å; L107-L147 HydrophobicContact CD1-CD2 3.86Å; L107-L147 PolarHBondContact O-N 3.46Å
108	P	93.8	Very high	87.2	Confident	26 Å²	26	27.7 Å²	27.7	17%	0.169	13%	0.134	C	C	.	.			trans	-60.7	162.9	171.7	27.2	-34.2	0	0	0	110.8	M110 L147	P108-M110 HydrophobicContact CB-CE 4.01Å; P108-M110 HydrophobicContact CG-CE 3.32Å; P108-M110 HydrophobicContact CG-CG 4.49Å; P108-M110 PolarHBondContact O-N 3.49Å; P108-L147 WeakPolarHBondContact O-CB 3.3Å
109	Q	94.9	Very high	87.7	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.133	C	C	.	.	S	Bend	trans	-70.5	70.8	173.9	-174.6	71.3	0.7	0	0	111	F135 N136 P138 H146 H148	Q109-F135 HydrophobicContact CG-CE2 4.05Å; Q109-F135 HydrophobicContact CG-CZ 3.97Å; Q109-N136 WeakPolarHBondContact CG-O 3.48Å; Q109-N136 PolarHBondContact NE2-O 3.45Å; Q109-P138 HydrophobicContact CB-CG 4.19Å; Q109-P138 VanDerWaalsContact O-CD 3.23Å; Q109-P138 WeakPolarHBondContact O-CD 3.47Å; Q109-H146 PolarHBondContact OE1-O 2.93Å; Q109-H148 PolarHBondContact NE2-O 3.2Å; Q109-H148 PolarHBondContact OE1-CE1 3.14Å; Q109-H148 PolarHBondContact OE1-ND1 3.42Å
110	M	94.5	Very high	87.9	Confident	49 Å²	49	27.5 Å²	27.5	24%	0.241	13%	0.133	C	C	.	.	S	Bend	trans	-137.1	143.9	176	-68.6	-167	-71.4	0	0	108.5	P108 T112 L147 V207	P108-M110 HydrophobicContact CB-CE 4.01Å; P108-M110 HydrophobicContact CG-CE 3.32Å; P108-M110 HydrophobicContact CG-CG 4.49Å; P108-M110 PolarHBondContact O-N 3.49Å; M110-T112 PolarHBondContact O-N 3.38Å; M110-L147 VanDerWaalsContact O-CD1 3.28Å; M110-L147 WeakPolarHBondContact O-CD1 3.44Å; M110-V207 HydrophobicContact SD-CG1 4Å; M110-V207 HydrophobicContact SD-CG2 4.3Å
111	L	95.3	Very high	87.8	Confident	12 Å²	12	28.2 Å²	28.2	6%	0.063	14%	0.136	C	C	.	.			trans	-66.6	128.9	176.8	-65.8	175.6	0	0	0	109.7	L116 F135 F149 L200 F213 M215 F240	L111-L116 HydrophobicContact CB-CD1 4.23Å; L111-L116 HydrophobicContact CB-CG 4.29Å; L111-L116 HydrophobicContact CD1-CD2 4.25Å; L111-L116 HydrophobicContact CD2-CD2 3.93Å; L111-L116 HydrophobicContact CD2-CG 4.25Å; L111-F135 HydrophobicContact CD2-CD1 4.17Å; L111-F135 HydrophobicContact CD2-CD2 3.61Å; L111-F135 HydrophobicContact CD2-CE1 4.26Å; L111-F135 HydrophobicContact CD2-CE2 3.7Å; L111-F135 HydrophobicContact CD2-CG 3.87Å; L111-F135 HydrophobicContact CD2-CZ 4.04Å; L111-F135 HydrophobicContact CG-CD1 4.29Å; L111-F135 HydrophobicContact CG-CD2 4.41Å; L111-F135 HydrophobicContact CG-CE1 4.05Å; L111-F135 HydrophobicContact CG-CE2 4.16Å; L111-F135 HydrophobicContact CG-CG 4.48Å; L111-F135 HydrophobicContact CG-CZ 3.98Å; L111-F149 HydrophobicContact CD2-CE1 3.56Å; L111-F149 HydrophobicContact CD2-CZ 3.61Å; L111-L200 HydrophobicContact CB-CD2 4.44Å; L111-F213 HydrophobicContact CD1-CE2 4.04Å; L111-F213 HydrophobicContact CD1-CZ 4.27Å; L111-M215 HydrophobicContact CD1-CE 4.36Å; L111-M215 HydrophobicContact CD1-SD 3.64Å; L111-M215 HydrophobicContact CD2-CE 4.1Å; L111-M215 HydrophobicContact CD2-SD 4.45Å; L111-F240 HydrophobicContact CD1-CE1 3.76Å; L111-F240 HydrophobicContact CD1-CZ 4.35Å
112	T	91.5	Very high	87.8	Confident	30 Å²	30	28.4 Å²	28.4	18%	0.184	14%	0.137	C	C	.	.			trans	-119.4	162.4	173	70.5	0	0	0	0	109.4	L107 M110 E114 G115 L116 L147	L107-T112 HydrophobicContact CD1-CG2 4.37Å; M110-T112 PolarHBondContact O-N 3.38Å; T112-E114 PolarHBondContact O-N 3.25Å; T112-E114 WeakPolarHBondContact OG1-CB 3.26Å; T112-G115 PolarHBondContact O-N 3.47Å; T112-G115 PolarHBondContact OG1-N 3.48Å; T112-L116 WeakPolarHBondContact O-CB 3.15Å; T112-L116 PolarHBondContact O-N 3.23Å; T112-L147 HydrophobicContact CG2-CD2 4.31Å
113	V	89	Confident	88.1	Confident	33 Å²	33	28.2 Å²	28.2	20%	0.2	14%	0.137	C	C	.	.	H	α-helix	trans	-50.6	-49.3	171.8	174.2	0	0	0	0	110	L116 I117 I196 L200 M315	V113-L116 PolarHBondContact O-N 3.02Å; V113-I117 HydrophobicContact CG1-CD1 3.78Å; V113-I117 WeakPolarHBondContact O-CB 3.5Å; V113-I117 WeakPolarHBondContact O-CG1 3.2Å; V113-I117 PolarHBondContact O-N 3.32Å; V113-I196 HydrophobicContact CG1-CG2 4.3Å; V113-L200 HydrophobicContact CB-CD1 4.29Å; V113-L200 HydrophobicContact CG2-CD1 3.36Å; V113-M315 HydrophobicContact CG1-CE 3.36Å; V113-M315 HydrophobicContact CG1-SD 4.26Å
114	E	83.1	Confident	88.2	Confident	51 Å²	51	30 Å²	30	24%	0.238	15%	0.146	C	C	.	.	H	α-helix	trans	-53.2	-54.3	176	-73.7	61.1	-152.9	0	0	114	W73 Y102 T112 T118	W73-E114 VanDerWaalsContact CE2-CG 3.47Å; W73-E114 HydrophobicContact CH2-CB 4.23Å; W73-E114 HydrophobicContact CH2-CG 4.31Å; W73-E114 HydrophobicContact CZ2-CB 3.66Å; W73-E114 HydrophobicContact CZ2-CG 3.32Å; W73-E114 PolarHBondContact NE1-OE1 2.82Å; Y102-E114 HydrophobicContact CD1-CG 4.48Å; Y102-E114 HydrophobicContact CD2-CB 3.8Å; Y102-E114 HydrophobicContact CD2-CG 4.37Å; Y102-E114 HydrophobicContact CE1-CB 4.24Å; Y102-E114 HydrophobicContact CE1-CG 4Å; Y102-E114 HydrophobicContact CE2-CB 3.39Å; Y102-E114 HydrophobicContact CE2-CG 4.07Å; T112-E114 PolarHBondContact O-N 3.25Å; T112-E114 WeakPolarHBondContact OG1-CB 3.26Å; E114-T118 VanDerWaalsContact O-CB 3.29Å; E114-T118 WeakPolarHBondContact O-CB 3.35Å; E114-T118 PolarHBondContact O-N 3.34Å; E114-T118 VanDerWaalsContact O-N 3.08Å; E114-T118 PolarHBondContact O-OG1 3.3Å
115	G	89.3	Confident	88	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.9	-42.6	-177.5	0	0	0	0	0	111.6	T112 T118 A119	T112-G115 PolarHBondContact O-N 3.47Å; T112-G115 PolarHBondContact OG1-N 3.48Å; G115-T118 WeakPolarHBondContact O-CB 3.47Å; G115-T118 PolarHBondContact O-N 3.07Å; G115-A119 WeakPolarHBondContact O-CB 3.4Å; G115-A119 PolarHBondContact O-N 3.38Å
116	L	92.3	Very high	87.6	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-68.7	-44.5	-179.9	-75.7	169.7	0	0	0	112.4	L111 T112 V113 T118 A119 V120 I196 C199 L200 M215	L111-L116 HydrophobicContact CB-CD1 4.23Å; L111-L116 HydrophobicContact CB-CG 4.29Å; L111-L116 HydrophobicContact CD1-CD2 4.25Å; L111-L116 HydrophobicContact CD2-CD2 3.93Å; L111-L116 HydrophobicContact CD2-CG 4.25Å; T112-L116 WeakPolarHBondContact O-CB 3.15Å; T112-L116 PolarHBondContact O-N 3.23Å; V113-L116 PolarHBondContact O-N 3.02Å; L116-T118 PolarHBondContact O-N 3.33Å; L116-A119 PolarHBondContact O-N 3.09Å; L116-V120 WeakPolarHBondContact O-CB 3.22Å; L116-V120 VanDerWaalsContact O-CG2 3.3Å; L116-V120 WeakPolarHBondContact O-CG2 3.39Å; L116-V120 PolarHBondContact O-N 3.16Å; L116-I196 HydrophobicContact CB-CD1 3.48Å; L116-I196 VanDerWaalsContact CB-CD1 3.48Å; L116-I196 HydrophobicContact CB-CG2 4.35Å; L116-I196 HydrophobicContact CD1-CG2 4.45Å; L116-C199 HydrophobicContact CD1-CB 3.83Å; L116-C199 HydrophobicContact CD2-CB 4.43Å; L116-L200 HydrophobicContact CD1-CD2 3.74Å; L116-L200 HydrophobicContact CD1-CG 3.75Å; L116-M215 HydrophobicContact CD2-CE 4.09Å; L116-M215 HydrophobicContact CD2-SD 4.2Å
117	I	88.1	Confident	86.8	Confident	13 Å²	13	19.3 Å²	19.3	7%	0.067	10%	0.103	C	C	.	.	H	α-helix	trans	-58.6	-43.6	175.3	-74	171.5	0	0	0	109.8	W73 V113 V120 K121 I196	W73-I117 HydrophobicContact CH2-CB 3.95Å; W73-I117 HydrophobicContact CH2-CD1 3.91Å; W73-I117 HydrophobicContact CH2-CG2 3.91Å; W73-I117 HydrophobicContact CZ2-CD1 4.43Å; W73-I117 HydrophobicContact CZ3-CG2 4.07Å; V113-I117 HydrophobicContact CG1-CD1 3.78Å; V113-I117 WeakPolarHBondContact O-CB 3.5Å; V113-I117 WeakPolarHBondContact O-CG1 3.2Å; V113-I117 PolarHBondContact O-N 3.32Å; I117-V120 PolarHBondContact O-N 2.94Å; I117-K121 HydrophobicContact CG2-CD 3.87Å; I117-K121 HydrophobicContact CG2-CG 4.33Å; I117-K121 VanDerWaalsContact O-CB 3.3Å; I117-K121 WeakPolarHBondContact O-CB 3.37Å; I117-K121 WeakPolarHBondContact O-CG 3.47Å; I117-K121 PolarHBondContact O-N 3.28Å; I117-I196 HydrophobicContact CG1-CD1 3.86Å; I117-I196 HydrophobicContact CG1-CG1 3.84Å; I117-I196 HydrophobicContact CG1-CG2 4.47Å
118	T	84.6	Confident	86.2	Confident	1 Å²	1	17.7 Å²	17.7	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-61.6	-45.4	177.6	-65.8	0	0	0	0	111.9	M68 I86 L99 P101 Y102 E114 G115 L116 T122	M68-T118 HydrophobicContact CE-CG2 3.96Å; I86-T118 HydrophobicContact CD1-CG2 3.27Å; I86-T118 HydrophobicContact CG1-CG2 4.27Å; L99-T118 HydrophobicContact CD2-CG2 3.95Å; L99-T118 HydrophobicContact CG-CG2 4.41Å; P101-T118 HydrophobicContact CB-CG2 3.82Å; Y102-T118 PolarHBondContact OH-OG1 3.28Å; E114-T118 VanDerWaalsContact O-CB 3.29Å; E114-T118 WeakPolarHBondContact O-CB 3.35Å; E114-T118 PolarHBondContact O-N 3.34Å; E114-T118 VanDerWaalsContact O-N 3.08Å; E114-T118 PolarHBondContact O-OG1 3.3Å; G115-T118 WeakPolarHBondContact O-CB 3.47Å; G115-T118 PolarHBondContact O-N 3.07Å; L116-T118 PolarHBondContact O-N 3.33Å; T118-T122 WeakPolarHBondContact O-CB 3.41Å; T118-T122 PolarHBondContact O-N 2.98Å; T118-T122 PolarHBondContact O-OG1 3.44Å
119	A	89.3	Confident	85.6	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.5	-46.5	176.8	0	0	0	0	0	112.2	L99 G115 L116 T122 L123 L133 F149 L217	L99-A119 HydrophobicContact CD2-CB 4.32Å; G115-A119 WeakPolarHBondContact O-CB 3.4Å; G115-A119 PolarHBondContact O-N 3.38Å; L116-A119 PolarHBondContact O-N 3.09Å; A119-T122 WeakPolarHBondContact O-CB 3.18Å; A119-T122 PolarHBondContact O-N 3.42Å; A119-L123 PolarHBondContact O-N 2.63Å; A119-L133 HydrophobicContact CB-CD2 4.03Å; A119-F149 HydrophobicContact CB-CD1 4.18Å; A119-F149 HydrophobicContact CB-CD2 4.33Å; A119-F149 HydrophobicContact CB-CE1 4.04Å; A119-F149 HydrophobicContact CB-CE2 4.19Å; A119-F149 HydrophobicContact CB-CG 4.34Å; A119-F149 HydrophobicContact CB-CZ 4.05Å; A119-L217 HydrophobicContact CB-CD2 3.76Å
120	V	89.3	Confident	84.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-64.4	-46.9	178.5	175.1	0	0	0	0	111.1	L116 I117 T122 L123 L124 L192 F195 I196 L217 V236	L116-V120 WeakPolarHBondContact O-CB 3.22Å; L116-V120 VanDerWaalsContact O-CG2 3.3Å; L116-V120 WeakPolarHBondContact O-CG2 3.39Å; L116-V120 PolarHBondContact O-N 3.16Å; I117-V120 PolarHBondContact O-N 2.94Å; V120-T122 VanDerWaalsContact C-N 3.28Å; V120-T122 PolarHBondContact O-N 2.87Å; V120-L123 PolarHBondContact O-N 3.39Å; V120-L124 HydrophobicContact CG1-CD1 3.85Å; V120-L124 HydrophobicContact CG1-CG 4.19Å; V120-L124 WeakPolarHBondContact O-CB 3.39Å; V120-L124 VanDerWaalsContact O-CG 3.29Å; V120-L124 WeakPolarHBondContact O-CG 3.34Å; V120-L124 PolarHBondContact O-N 3.28Å; V120-L192 HydrophobicContact CB-CD1 4.01Å; V120-L192 HydrophobicContact CG1-CD1 3.55Å; V120-L192 HydrophobicContact CG2-CD1 4.39Å; V120-F195 HydrophobicContact CG2-CD1 4.01Å; V120-F195 HydrophobicContact CG2-CE1 3.54Å; V120-I196 HydrophobicContact CG2-CD1 4.07Å; V120-L217 HydrophobicContact CG2-CD1 4.26Å; V120-L217 HydrophobicContact CG2-CD2 3.8Å; V120-V236 HydrophobicContact CG1-CG1 4.29Å; V120-V236 HydrophobicContact CG2-CG1 4.46Å
121	K	83.4	Confident	84.4	Confident	15 Å²	15	21.8 Å²	21.8	7%	0.065	11%	0.108	C	C	.	.	H	α-helix	trans	-60.3	-40.3	176	-75.1	-177.4	174.5	-178.3	0	110.9	E72 I117 L124 L125 T319	E72-K121 IonicContact OE1-NZ 2.71Å; I117-K121 HydrophobicContact CG2-CD 3.87Å; I117-K121 HydrophobicContact CG2-CG 4.33Å; I117-K121 VanDerWaalsContact O-CB 3.3Å; I117-K121 WeakPolarHBondContact O-CB 3.37Å; I117-K121 WeakPolarHBondContact O-CG 3.47Å; I117-K121 PolarHBondContact O-N 3.28Å; K121-L124 PolarHBondContact O-N 3.25Å; K121-L125 WeakPolarHBondContact O-CD1 3.3Å; K121-L125 VanDerWaalsContact O-CG 3.22Å; K121-L125 WeakPolarHBondContact O-CG 3.5Å; K121-L125 PolarHBondContact O-N 2.88Å; K121-T319 WeakPolarHBondContact CE-OG1 3.2Å; K121-T319 PolarHBondContact NZ-OG1 3.27Å
122	T	81.3	Confident	84.1	Confident	5 Å²	5	22 Å²	22	3%	0.031	11%	0.112	C	C	.	.	H	α-helix	trans	-59.2	-48	174.1	-58.4	0	0	0	0	111.7	L99 T118 A119 V120 L124 L125	L99-T122 HydrophobicContact CD1-CG2 4.21Å; T118-T122 WeakPolarHBondContact O-CB 3.41Å; T118-T122 PolarHBondContact O-N 2.98Å; T118-T122 PolarHBondContact O-OG1 3.44Å; A119-T122 WeakPolarHBondContact O-CB 3.18Å; A119-T122 PolarHBondContact O-N 3.42Å; V120-T122 VanDerWaalsContact C-N 3.28Å; V120-T122 PolarHBondContact O-N 2.87Å; T122-L124 VanDerWaalsContact C-N 3.33Å; T122-L124 PolarHBondContact O-N 2.86Å; T122-L125 WeakPolarHBondContact O-CB 3.3Å; T122-L125 PolarHBondContact O-N 3.19Å
123	L	84.7	Confident	84	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.9	-39.4	176.8	-177.1	66.2	0	0	0	112.4	A119 V120 L125 S126 L131 L133 L217 R219 V236	A119-L123 PolarHBondContact O-N 2.63Å; V120-L123 PolarHBondContact O-N 3.39Å; L123-L125 PolarHBondContact O-N 2.94Å; L123-S126 VanDerWaalsContact O-CA 3.26Å; L123-S126 WeakPolarHBondContact O-CA 3.46Å; L123-S126 PolarHBondContact O-N 3.38Å; L123-L131 HydrophobicContact CD1-CB 4.46Å; L123-L131 HydrophobicContact CD1-CD2 4.42Å; L123-L131 HydrophobicContact CD1-CG 4.27Å; L123-L131 VanDerWaalsContact CD1-O 3.27Å; L123-L131 WeakPolarHBondContact CD1-O 3.33Å; L123-L133 HydrophobicContact CB-CD1 3.79Å; L123-L133 HydrophobicContact CD1-CD1 4.29Å; L123-L217 HydrophobicContact CD2-CG 4.01Å; L123-R219 HydrophobicContact CD2-CG 4.45Å; L123-V236 HydrophobicContact CD2-CB 4.45Å; L123-V236 HydrophobicContact CD2-CG1 3.88Å; L123-V236 HydrophobicContact CD2-CG2 4.05Å
124	L	83.2	Confident	84.2	Confident	49 Å²	49	19 Å²	19	26%	0.257	9%	0.093	S	C	.	.	H	α-helix	trans	-69.5	-12.8	-179.3	-73.1	176.3	0	0	0	114.3	V120 K121 T122 S126 M187 V236	V120-L124 HydrophobicContact CG1-CD1 3.85Å; V120-L124 HydrophobicContact CG1-CG 4.19Å; V120-L124 WeakPolarHBondContact O-CB 3.39Å; V120-L124 VanDerWaalsContact O-CG 3.29Å; V120-L124 WeakPolarHBondContact O-CG 3.34Å; V120-L124 PolarHBondContact O-N 3.28Å; K121-L124 PolarHBondContact O-N 3.25Å; T122-L124 VanDerWaalsContact C-N 3.33Å; T122-L124 PolarHBondContact O-N 2.86Å; L124-S126 VanDerWaalsContact C-N 3.28Å; L124-M187 HydrophobicContact CD1-CE 4.37Å; L124-M187 HydrophobicContact CD2-CE 4.32Å; L124-V236 HydrophobicContact CD2-CG2 3.54Å; L124-V236 HydrophobicContact CG-CG2 4.15Å
125	L	75.4	Confident	84.7	Confident	9 Å²	9	16.6 Å²	16.6	5%	0.047	8%	0.082	C	C	.	.	H	α-helix	trans	-79.3	-20.5	171.5	-63.6	162.9	0	0	0	111	K121 T122 L123 L327 R328 L331 L357 F361	K121-L125 WeakPolarHBondContact O-CD1 3.3Å; K121-L125 VanDerWaalsContact O-CG 3.22Å; K121-L125 WeakPolarHBondContact O-CG 3.5Å; K121-L125 PolarHBondContact O-N 2.88Å; T122-L125 WeakPolarHBondContact O-CB 3.3Å; T122-L125 PolarHBondContact O-N 3.19Å; L123-L125 PolarHBondContact O-N 2.94Å; L125-L327 HydrophobicContact CD1-CB 4.38Å; L125-L327 HydrophobicContact CD1-CD2 4.42Å; L125-L327 HydrophobicContact CD2-CB 4.13Å; L125-R328 HydrophobicContact CD2-CB 4.19Å; L125-R328 HydrophobicContact CD2-CG 3.47Å; L125-R328 VanDerWaalsContact CD2-CG 3.47Å; L125-L331 HydrophobicContact CB-CD2 3.66Å; L125-L331 HydrophobicContact CD1-CB 4.06Å; L125-L331 HydrophobicContact CD1-CD2 3.17Å; L125-L331 HydrophobicContact CD1-CG 4.18Å; L125-L331 HydrophobicContact CG-CD2 3.96Å; L125-L357 WeakPolarHBondContact O-CD2 3.16Å; L125-F361 HydrophobicContact CB-CZ 4.29Å; L125-F361 HydrophobicContact CD2-CE1 4.42Å
126	S	76	Confident	84.9	Confident	2 Å²	2	16.9 Å²	16.9	1%	0.014	8%	0.084	C	C	.	.			trans	-75.9	134.3	161	-156.1	0	0	0	0	115.9	L123 L124 C128 R219 L357	L123-S126 VanDerWaalsContact O-CA 3.26Å; L123-S126 WeakPolarHBondContact O-CA 3.46Å; L123-S126 PolarHBondContact O-N 3.38Å; L124-S126 VanDerWaalsContact C-N 3.28Å; S126-C128 WeakPolarHBondContact OG-CB 3.39Å; S126-C128 PolarHBondContact OG-N 2.85Å; S126-R219 VanDerWaalsContact O-CZ 3.29Å; S126-R219 PolarHBondContact O-NE 3.28Å; S126-R219 VanDerWaalsContact O-NE 3.13Å; S126-R219 PolarHBondContact O-NH2 3.27Å; S126-L357 VanDerWaalsContact CB-CD2 3.42Å
127	N	74.1	Confident	85	Confident	73 Å²	73	16.9 Å²	16.9	39%	0.39	8%	0.084	S	C	.	.			trans	-107.5	11.2	142.3	-38.6	-27.7	0	0	0	112.6	R129 R360	N127-R129 PolarHBondContact O-N 2.93Å; N127-R360 VanDerWaalsContact CB-CZ 3.46Å; N127-R360 PolarHBondContact ND2-NE 2.72Å; N127-R360 VanDerWaalsContact ND2-NE 3.2Å; N127-R360 PolarHBondContact ND2-NH1 2.86Å; N127-R360 PolarHBondContact ND2-NH2 3.21Å
128	C	77.8	Confident	85.2	Confident	2 Å²	2	16.2 Å²	16.2	1%	0.014	8%	0.08	C	C	.	.			trans	-62.1	122.6	170.6	179.1	0	0	0	0	109.2	S126 Q130 L131 I353	S126-C128 WeakPolarHBondContact OG-CB 3.39Å; S126-C128 PolarHBondContact OG-N 2.85Å; C128-Q130 PolarHBondContact O-N 2.8Å; C128-Q130 PolarHBondContact SG-OE1 3.46Å; C128-L131 HydrophobicContact CB-CB 4.2Å; C128-L131 PolarHBondContact O-N 2.83Å; C128-I353 HydrophobicContact CB-CG1 4.4Å; C128-I353 HydrophobicContact CB-CG2 4.27Å; C128-I353 WeakPolarHBondContact SG-CD1 3.41Å
129	R	80.5	Confident	85.5	Confident	81 Å²	81	17.7 Å²	17.7	31%	0.306	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-26.3	178.7	-173.8	177.6	176.8	-178.5	-1.5	111.7	N127 L131 D162 L234	N127-R129 PolarHBondContact O-N 2.93Å; R129-L131 VanDerWaalsContact C-N 3.3Å; R129-D162 IonicContact CZ-OD1 3.95Å; R129-D162 IonicContact NH2-OD1 2.83Å; R129-D162 PolarHBondContact NH2-OD1 3.42Å; R129-D162 IonicContact NH2-OD2 2.77Å; R129-L234 HydrophobicContact CB-CD1 4.08Å; R129-L234 HydrophobicContact CG-CD1 4.31Å; R129-L234 HydrophobicContact CG-CD2 4.37Å
130	Q	80.8	Confident	85.6	Confident	59 Å²	59	17.7 Å²	17.7	28%	0.276	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.7	-178.7	-67.7	79.4	6.7	0	0	113.3	C128 Y153 C154 P155	C128-Q130 PolarHBondContact O-N 2.8Å; C128-Q130 PolarHBondContact SG-OE1 3.46Å; Q130-Y153 HydrophobicContact CB-CD2 3.83Å; Q130-Y153 HydrophobicContact CB-CE2 3.43Å; Q130-Y153 VanDerWaalsContact CB-CE2 3.43Å; Q130-Y153 HydrophobicContact CG-CE2 4.22Å; Q130-C154 WeakPolarHBondContact CB-O 3.4Å; Q130-C154 WeakPolarHBondContact CG-O 3.46Å; Q130-C154 PolarHBondContact O-N 3.16Å; Q130-P155 WeakPolarHBondContact CG-O 3.21Å
131	L	83.3	Confident	85.4	Confident	22 Å²	22	18.3 Å²	18.3	12%	0.115	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	127.4	174.5	-173.3	66.6	0	0	0	110	L123 C128 R129 L151	L123-L131 HydrophobicContact CD1-CB 4.46Å; L123-L131 HydrophobicContact CD1-CD2 4.42Å; L123-L131 HydrophobicContact CD1-CG 4.27Å; L123-L131 VanDerWaalsContact CD1-O 3.27Å; L123-L131 WeakPolarHBondContact CD1-O 3.33Å; C128-L131 HydrophobicContact CB-CB 4.2Å; C128-L131 PolarHBondContact O-N 2.83Å; R129-L131 VanDerWaalsContact C-N 3.3Å; L131-L151 HydrophobicContact CD1-CD1 3.65Å; L131-L151 HydrophobicContact CD1-CD2 4.28Å; L131-L151 HydrophobicContact CD1-CG 3.82Å; L131-L151 HydrophobicContact CG-CD1 4.38Å
132	A	88.6	Confident	85.5	Confident	16 Å²	16	17.7 Å²	17.7	13%	0.132	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	166.9	172.1	0	0	0	0	0	110.6	L152 I216 L217	A132-L152 HydrophobicContact CB-CB 4.25Å; A132-L152 PolarHBondContact N-O 2.87Å; A132-L152 PolarHBondContact O-N 3.04Å; A132-I216 HydrophobicContact CB-CG2 4.04Å; A132-L217 CarbonylContact C-O 3.52Å; A132-L217 WeakPolarHBondContact CA-O 3.3Å; A132-L217 WeakPolarHBondContact CB-O 3.02Å
133	L	90.9	Very high	85.5	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.7	168.6	-65.8	97.4	0	0	0	109.5	L99 A119 L123 F149 E150 L151 I216 L217	L99-L133 HydrophobicContact CB-CD2 4.31Å; L99-L133 HydrophobicContact CD2-CD2 3.57Å; A119-L133 HydrophobicContact CB-CD2 4.03Å; L123-L133 HydrophobicContact CB-CD1 3.79Å; L123-L133 HydrophobicContact CD1-CD1 4.29Å; L133-F149 HydrophobicContact CB-CB 4.31Å; L133-F149 HydrophobicContact CD2-CB 4.01Å; L133-F149 HydrophobicContact CD2-CG 4.47Å; L133-E150 CarbonylContact C-O 3.52Å; L133-E150 VanDerWaalsContact CA-O 3.26Å; L133-E150 WeakPolarHBondContact CA-O 3.46Å; L133-L151 HydrophobicContact CD2-CD1 4.39Å; L133-L151 HydrophobicContact CG-CD1 4.07Å; L133-I216 CarbonylContact O-C 3.59Å; L133-I216 WeakPolarHBondContact O-CA 3.47Å; L133-L217 HydrophobicContact CB-CB 4.31Å; L133-L217 HydrophobicContact CD1-CD2 4.38Å; L133-L217 PolarHBondContact N-O 3.36Å; L133-L217 PolarHBondContact O-N 2.77Å
134	G	92.1	Very high	85.6	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	145	172	0	0	0	0	0	111.1	F149 E150 M215	G134-F149 CarbonylContact O-C 3.52Å; G134-F149 VanDerWaalsContact O-CA 3.24Å; G134-F149 WeakPolarHBondContact O-CA 3.1Å; G134-F149 WeakPolarHBondContact O-CB 2.91Å; G134-E150 PolarHBondContact N-O 3.02Å; G134-E150 PolarHBondContact O-N 3.09Å; G134-M215 CarbonylContact C-O 3.57Å; G134-M215 WeakPolarHBondContact CA-O 3.22Å
135	F	94.2	Very high	85.8	Confident	1 Å²	1	16.5 Å²	16.5	0%	0.004	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.7	168.6	173.8	-84.6	0	0	0	108.8	Q109 L111 L147 F149 F213 N214 M215	Q109-F135 HydrophobicContact CG-CE2 4.05Å; Q109-F135 HydrophobicContact CG-CZ 3.97Å; L111-F135 HydrophobicContact CD2-CD1 4.17Å; L111-F135 HydrophobicContact CD2-CD2 3.61Å; L111-F135 HydrophobicContact CD2-CE1 4.26Å; L111-F135 HydrophobicContact CD2-CE2 3.7Å; L111-F135 HydrophobicContact CD2-CG 3.87Å; L111-F135 HydrophobicContact CD2-CZ 4.04Å; L111-F135 HydrophobicContact CG-CD1 4.29Å; L111-F135 HydrophobicContact CG-CD2 4.41Å; L111-F135 HydrophobicContact CG-CE1 4.05Å; L111-F135 HydrophobicContact CG-CE2 4.16Å; L111-F135 HydrophobicContact CG-CG 4.48Å; L111-F135 HydrophobicContact CG-CZ 3.98Å; F135-L147 HydrophobicContact CE2-CD1 3.84Å; F135-F149 HydrophobicContact CB-CD1 3.85Å; F135-F149 HydrophobicContact CB-CE1 4.05Å; F135-F149 HydrophobicContact CD2-CD1 4.1Å; F135-F149 AromaticContact CD2-CE1 3.88Å; F135-F149 HydrophobicContact CD2-CE1 3.88Å; F135-F149 HydrophobicContact CD2-CZ 4.32Å; F135-F149 HydrophobicContact CG-CD1 4.44Å; F135-F149 HydrophobicContact CG-CE1 4.3Å; F135-F213 AromaticContact CD1-CE2 3.93Å; F135-F213 HydrophobicContact CD1-CE2 3.93Å; F135-F213 HydrophobicContact CD1-CZ 4.39Å; F135-F213 AromaticContact CE1-CE2 3.81Å; F135-F213 HydrophobicContact CE1-CE2 3.81Å; F135-F213 AromaticContact CE1-CZ 3.79Å; F135-F213 HydrophobicContact CE1-CZ 3.79Å; F135-N214 CarbonylContact O-C 3.58Å; F135-N214 WeakPolarHBondContact O-CA 3.14Å; F135-M215 HydrophobicContact CB-CB 4.17Å; F135-M215 HydrophobicContact CB-CE 4.02Å; F135-M215 PolarHBondContact N-O 2.88Å; F135-M215 PolarHBondContact O-N 2.82Å
136	N	92.8	Very high	86.6	Confident	5 Å²	5	16 Å²	16	3%	0.027	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.2	175.1	-60.4	-34.4	0	0	0	107.5	Q109 A140 C142 E150 N214 A259	Q109-N136 WeakPolarHBondContact CG-O 3.48Å; Q109-N136 PolarHBondContact NE2-O 3.45Å; N136-A140 WeakPolarHBondContact CB-O 3.43Å; N136-C142 HydrophobicContact CB-CB 4.01Å; N136-C142 WeakPolarHBondContact O-CB 3.35Å; N136-E150 PolarHBondContact ND2-OE1 3.12Å; N136-N214 PolarHBondContact OD1-ND2 2.87Å; N136-A259 WeakPolarHBondContact OD1-CB 3.33Å; N136-A259 PolarHBondContact OD1-N 3.38Å
137	S	94.8	Very high	87.4	Confident	1 Å²	1	16 Å²	16	1%	0.007	8%	0.079	C	C	.	.			trans	-69.6	157.6	169.9	82.2	0	0	0	0	109.8	L139 A140 C142 F213	S137-L139 PolarHBondContact O-N 2.85Å; S137-A140 PolarHBondContact O-N 3.34Å; S137-C142 VanDerWaalsContact C-CB 3.47Å; S137-C142 WeakPolarHBondContact O-CB 3.22Å; S137-F213 VanDerWaalsContact CB-O 3.23Å; S137-F213 WeakPolarHBondContact CB-O 3.46Å; S137-F213 PolarHBondContact N-O 3.31Å; S137-F213 PolarHBondContact OG-N 3.33Å; S137-F213 PolarHBondContact OG-O 2.87Å; S137-F213 VanDerWaalsContact OG-O 3.06Å
138	P	92.2	Very high	88.2	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	144.6	161.4	-25	35.4	0	0	0	110.1	F40 S42 V43 Q109 A140	F40-P138 HydrophobicContact CB-CB 3.81Å; F40-P138 HydrophobicContact CD1-CB 3.73Å; F40-P138 HydrophobicContact CD1-CG 4.2Å; F40-P138 HydrophobicContact CD2-CB 4.14Å; F40-P138 HydrophobicContact CE1-CB 4.28Å; F40-P138 HydrophobicContact CE1-CG 4.32Å; F40-P138 HydrophobicContact CG-CB 3.63Å; S42-P138 VanDerWaalsContact O-CB 3.3Å; S42-P138 WeakPolarHBondContact O-CB 3.34Å; V43-P138 WeakPolarHBondContact O-CG 3.46Å; Q109-P138 HydrophobicContact CB-CG 4.19Å; Q109-P138 VanDerWaalsContact O-CD 3.23Å; Q109-P138 WeakPolarHBondContact O-CD 3.47Å; P138-A140 PolarHBondContact O-N 3.34Å
139	L	91.5	Very high	88.8	Confident	31 Å²	31	12.7 Å²	12.7	16%	0.162	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	-0.6	-172.1	-53.4	174.6	0	0	0	116.3	F40 V43 S137 P212 A245 V246	F40-L139 HydrophobicContact CB-CD2 4.1Å; F40-L139 HydrophobicContact CB-CG 4.36Å; F40-L139 WeakPolarHBondContact O-CD2 3.07Å; V43-L139 HydrophobicContact CG2-CD1 4.23Å; S137-L139 PolarHBondContact O-N 2.85Å; L139-P212 HydrophobicContact CB-CB 3.84Å; L139-P212 HydrophobicContact CB-CG 3.57Å; L139-P212 HydrophobicContact CD1-CG 4.18Å; L139-A245 HydrophobicContact CB-CB 4.15Å; L139-A245 CarbonylContact O-C 3.59Å; L139-A245 WeakPolarHBondContact O-CA 3.39Å; L139-V246 PolarHBondContact O-N 2.91Å
140	A	90.3	Very high	89.1	Confident	1 Å²	1	9.9 Å²	9.9	1%	0.008	5%	0.051	C	C	.	.	B	Isolated β-bridge	trans	-121	57	176.1	0	0	0	0	0	111.1	N136 S137 P138 C142 P212 F213 N214	N136-A140 WeakPolarHBondContact CB-O 3.43Å; S137-A140 PolarHBondContact O-N 3.34Å; P138-A140 PolarHBondContact O-N 3.34Å; A140-C142 PolarHBondContact O-N 3.16Å; A140-P212 HydrophobicContact CB-CB 3.94Å; A140-F213 WeakPolarHBondContact CB-O 3.42Å; A140-N214 PolarHBondContact O-ND2 3.42Å
141	M	85.2	Confident	89.1	Confident	13 Å²	13	7.8 Å²	7.8	6%	0.064	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	12.6	-176.1	-59.5	-64.8	-67.5	0	0	115.7	V246 P248 C256 P257	M141-V246 HydrophobicContact CG-CB 4.3Å; M141-V246 HydrophobicContact CG-CG1 4.31Å; M141-V246 PolarHBondContact N-O 3.15Å; M141-V246 HydrophobicContact SD-CB 4.04Å; M141-V246 HydrophobicContact SD-CG1 3.53Å; M141-V246 VanDerWaalsContact SD-CG1 3.53Å; M141-P248 HydrophobicContact CE-CB 4.5Å; M141-C256 HydrophobicContact CE-CB 3.68Å; M141-P257 HydrophobicContact CG-CG 4.25Å; M141-P257 HydrophobicContact SD-CG 4.46Å
142	C	86.3	Confident	88.9	Confident	1 Å²	1	7.7 Å²	7.7	1%	0.007	4%	0.041	C	C	.	.			trans	-68.4	139.9	171.3	178	0	0	0	0	111.6	F40 N136 S137 A140 V144	F40-C142 HydrophobicContact CE2-CB 4.2Å; F40-C142 VanDerWaalsContact CE2-O 3.32Å; F40-C142 WeakPolarHBondContact CE2-O 3.42Å; N136-C142 HydrophobicContact CB-CB 4.01Å; N136-C142 WeakPolarHBondContact O-CB 3.35Å; S137-C142 VanDerWaalsContact C-CB 3.47Å; S137-C142 WeakPolarHBondContact O-CB 3.22Å; A140-C142 PolarHBondContact O-N 3.16Å; C142-V144 PolarHBondContact SG-O 3.41Å
143	E	80.9	Confident	88.3	Confident	25 Å²	25	8.5 Å²	8.5	12%	0.117	4%	0.041	C	C	.	.			trans	-111.4	-21.2	-178	-62.4	-170.7	150	0	0	113.5	F37 R93 P248	F37-E143 HydrophobicContact CD1-CB 3.63Å; F37-E143 HydrophobicContact CD1-CG 3.86Å; F37-E143 HydrophobicContact CE1-CB 3.73Å; F37-E143 HydrophobicContact CE1-CG 3.87Å; F37-E143 WeakPolarHBondContact CE1-OE2 3.4Å; F37-E143 VanDerWaalsContact CE2-OE1 3.26Å; F37-E143 WeakPolarHBondContact CE2-OE1 3.49Å; F37-E143 HydrophobicContact CG-CB 4.45Å; F37-E143 HydrophobicContact CG-CG 4.3Å; F37-E143 HydrophobicContact CZ-CG 4.3Å; F37-E143 WeakPolarHBondContact CZ-OE1 2.83Å; F37-E143 VanDerWaalsContact CZ-OE2 3.22Å; F37-E143 WeakPolarHBondContact CZ-OE2 3.31Å; R93-E143 IonicContact CZ-OE1 3.84Å; R93-E143 IonicContact NE-OE1 3.97Å; R93-E143 PolarHBondContact NE-OE1 3.45Å; R93-E143 IonicContact NE-OE2 2.93Å; R93-E143 IonicContact NH2-OE1 2.64Å; R93-E143 PolarHBondContact NH2-OE1 3.04Å; E143-P248 HydrophobicContact CG-CB 4.29Å
144	V	86.6	Confident	87.3	Confident	2 Å²	2	10 Å²	10	1%	0.012	5%	0.051	C	C	.	.			trans	-129.7	129.4	-169.5	-176.6	0	0	0	0	110.3	F52 F54 L92 C142 H146	F52-V144 HydrophobicContact CD1-CG1 4.06Å; F52-V144 HydrophobicContact CD1-CG2 3.75Å; F52-V144 HydrophobicContact CE1-CG1 4.22Å; F52-V144 HydrophobicContact CE1-CG2 3.97Å; F54-V144 HydrophobicContact CE2-CG1 3.87Å; F54-V144 HydrophobicContact CZ-CB 4.45Å; F54-V144 HydrophobicContact CZ-CG1 4.03Å; L92-V144 HydrophobicContact CD1-CB 4.42Å; L92-V144 HydrophobicContact CD1-CG2 3.45Å; L92-V144 VanDerWaalsContact CD1-CG2 3.45Å; L92-V144 HydrophobicContact CD2-CG2 3.99Å; L92-V144 HydrophobicContact CG-CG2 4.4Å; C142-V144 PolarHBondContact SG-O 3.41Å; V144-H146 HydrophobicContact CG1-CB 3.94Å; V144-H146 PolarHBondContact O-N 3.48Å; V144-H146 VanDerWaalsContact O-N 3.15Å
145	N	88.5	Confident	86.1	Confident	2 Å²	2	10.6 Å²	10.6	1%	0.011	6%	0.055	C	C	.	.	S	Bend	trans	-83.4	19.6	-175.7	69.9	-26.7	0	0	0	113.6	F40 S48 F52	F40-N145 HydrophobicContact CE1-CB 3.56Å; F40-N145 HydrophobicContact CZ-CB 3.84Å; S48-N145 WeakPolarHBondContact CA-ND2 3.38Å; S48-N145 WeakPolarHBondContact CB-ND2 3.46Å; S48-N145 PolarHBondContact N-ND2 3.35Å; S48-N145 PolarHBondContact O-ND2 2.92Å; F52-N145 PolarHBondContact O-OD1 2.77Å
146	H	90.8	Very high	84.8	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	7%	0.074	C	C	.	.	S	Bend	trans	-121.8	128.2	-177	-165.8	167.2	0	0	0	107.9	F47 N53 F54 M103 L107 Q109 V144 H148	F47-H146 HydrophobicContact CD2-CB 4.22Å; F47-H146 HydrophobicContact CE2-CB 4.04Å; F47-H146 AromaticContact CE2-CG 3.8Å; F47-H146 AromaticContact CE2-ND1 3.78Å; N53-H146 HydrophobicContact CB-CB 4.13Å; F54-H146 HydrophobicContact CD2-CB 3.86Å; F54-H146 AromaticContact CD2-CG 3.79Å; F54-H146 AromaticContact CD2-ND1 3.75Å; F54-H146 HydrophobicContact CE2-CB 4.05Å; F54-H146 PolarHBondContact N-ND1 2.94Å; M103-H146 WeakPolarHBondContact CA-NE2 3.26Å; M103-H146 PolarHBondContact O-CE1 3.04Å; M103-H146 PolarHBondContact O-NE2 3.43Å; M103-H146 VanDerWaalsContact O-NE2 3.11Å; L107-H146 WeakPolarHBondContact O-CA 3.36Å; L107-H146 PolarHBondContact O-CD2 3.21Å; Q109-H146 PolarHBondContact OE1-O 2.93Å; V144-H146 HydrophobicContact CG1-CB 3.94Å; V144-H146 PolarHBondContact O-N 3.48Å; V144-H146 VanDerWaalsContact O-N 3.15Å; H146-H148 PolarHBondContact O-N 3.12Å; H146-H148 VanDerWaalsContact O-N 3.15Å; H146-H148 PolarHBondContact O-ND1 3.47Å
147	L	93	Very high	83.4	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.			trans	-45.8	116.8	-178.5	-175.6	53.6	0	0	0	112.9	P101 L107 P108 M110 T112 F135 F149	P101-L147 HydrophobicContact CG-CD2 3.84Å; P101-L147 HydrophobicContact CG-CG 3.82Å; L107-L147 HydrophobicContact CB-CB 3.9Å; L107-L147 HydrophobicContact CB-CD2 4.18Å; L107-L147 HydrophobicContact CD1-CD2 3.86Å; L107-L147 PolarHBondContact O-N 3.46Å; P108-L147 WeakPolarHBondContact O-CB 3.3Å; M110-L147 VanDerWaalsContact O-CD1 3.28Å; M110-L147 WeakPolarHBondContact O-CD1 3.44Å; T112-L147 HydrophobicContact CG2-CD2 4.31Å; F135-L147 HydrophobicContact CE2-CD1 3.84Å; L147-F149 HydrophobicContact CD1-CE2 4.28Å
148	H	91	Very high	82.1	Confident	6 Å²	6	20.3 Å²	20.3	3%	0.028	11%	0.109	C	C	.	.			trans	-151.5	157.1	173.1	63.6	-68.5	0	0	0	111.5	F54 L99 V100 Q109 H146	F54-H148 HydrophobicContact CE2-CB 3.62Å; F54-H148 AromaticContact CE2-CG 3.77Å; F54-H148 AromaticContact CE2-ND1 3.83Å; F54-H148 HydrophobicContact CZ-CB 3.81Å; F54-H148 AromaticContact CZ-CG 3.72Å; L99-H148 CarbonylContact O-C 3.48Å; L99-H148 VanDerWaalsContact O-CA 3.26Å; L99-H148 WeakPolarHBondContact O-CA 3.49Å; V100-H148 HydrophobicContact CG2-CB 4.09Å; Q109-H148 PolarHBondContact NE2-O 3.2Å; Q109-H148 PolarHBondContact OE1-CE1 3.14Å; Q109-H148 PolarHBondContact OE1-ND1 3.42Å; H146-H148 PolarHBondContact O-N 3.12Å; H146-H148 VanDerWaalsContact O-N 3.15Å; H146-H148 PolarHBondContact O-ND1 3.47Å
149	F	90.6	Very high	81.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.6	166.4	-55.9	-99.9	0	0	0	108.8	L98 L99 P101 L111 A119 L133 G134 F135 L147 M215	L98-F149 CarbonylContact C-O 3.53Å; L98-F149 VanDerWaalsContact CA-O 3.31Å; L98-F149 WeakPolarHBondContact CA-O 3.05Å; L99-F149 HydrophobicContact CB-CB 4.15Å; L99-F149 HydrophobicContact CD2-CD2 4.27Å; L99-F149 PolarHBondContact N-O 3.43Å; L99-F149 PolarHBondContact O-N 2.8Å; P101-F149 HydrophobicContact CG-CD2 4.37Å; P101-F149 HydrophobicContact CG-CE2 4.05Å; L111-F149 HydrophobicContact CD2-CE1 3.56Å; L111-F149 HydrophobicContact CD2-CZ 3.61Å; A119-F149 HydrophobicContact CB-CD1 4.18Å; A119-F149 HydrophobicContact CB-CD2 4.33Å; A119-F149 HydrophobicContact CB-CE1 4.04Å; A119-F149 HydrophobicContact CB-CE2 4.19Å; A119-F149 HydrophobicContact CB-CG 4.34Å; A119-F149 HydrophobicContact CB-CZ 4.05Å; L133-F149 HydrophobicContact CB-CB 4.31Å; L133-F149 HydrophobicContact CD2-CB 4.01Å; L133-F149 HydrophobicContact CD2-CG 4.47Å; G134-F149 CarbonylContact O-C 3.52Å; G134-F149 VanDerWaalsContact O-CA 3.24Å; G134-F149 WeakPolarHBondContact O-CA 3.1Å; G134-F149 WeakPolarHBondContact O-CB 2.91Å; F135-F149 HydrophobicContact CB-CD1 3.85Å; F135-F149 HydrophobicContact CB-CE1 4.05Å; F135-F149 HydrophobicContact CD2-CD1 4.1Å; F135-F149 AromaticContact CD2-CE1 3.88Å; F135-F149 HydrophobicContact CD2-CE1 3.88Å; F135-F149 HydrophobicContact CD2-CZ 4.32Å; F135-F149 HydrophobicContact CG-CD1 4.44Å; F135-F149 HydrophobicContact CG-CE1 4.3Å; L147-F149 HydrophobicContact CD1-CE2 4.28Å; F149-M215 HydrophobicContact CD1-CE 4.24Å; F149-M215 HydrophobicContact CE1-CE 3.73Å
150	E	85.9	Confident	81.1	Confident	23 Å²	23	23.3 Å²	23.3	11%	0.107	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.7	169.9	-60.5	-177.7	-173.7	0	0	108.9	L98 L133 G134 N136 L152 R260	L98-E150 HydrophobicContact CD2-CB 4.38Å; L98-E150 HydrophobicContact CD2-CG 3.9Å; L133-E150 CarbonylContact C-O 3.52Å; L133-E150 VanDerWaalsContact CA-O 3.26Å; L133-E150 WeakPolarHBondContact CA-O 3.46Å; G134-E150 PolarHBondContact N-O 3.02Å; G134-E150 PolarHBondContact O-N 3.09Å; N136-E150 PolarHBondContact ND2-OE1 3.12Å; E150-L152 HydrophobicContact CB-CD2 3.82Å; E150-L152 HydrophobicContact CB-CG 4.48Å; E150-L152 PolarHBondContact O-N 3.23Å; E150-R260 IonicContact OE2-CZ 2.71Å; E150-R260 IonicContact OE2-NE 3.15Å; E150-R260 PolarHBondContact OE2-NE 3.4Å; E150-R260 IonicContact OE2-NH2 3.67Å; E150-R260 PolarHBondContact OE2-NH2 3.02Å
151	L	81.2	Confident	80.5	Confident	15 Å²	15	23.7 Å²	23.7	8%	0.079	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	117.2	169.4	-161.9	66.5	0	0	0	108.2	P97 L131 L133 F339	P97-L151 HydrophobicContact CB-CB 4.01Å; P97-L151 HydrophobicContact CB-CD2 4.07Å; P97-L151 HydrophobicContact CG-CD2 4.36Å; P97-L151 WeakPolarHBondContact O-CA 3.38Å; P97-L151 WeakPolarHBondContact O-CB 3.48Å; P97-L151 PolarHBondContact O-N 3.46Å; L131-L151 HydrophobicContact CD1-CD1 3.65Å; L131-L151 HydrophobicContact CD1-CD2 4.28Å; L131-L151 HydrophobicContact CD1-CG 3.82Å; L131-L151 HydrophobicContact CG-CD1 4.38Å; L133-L151 HydrophobicContact CD2-CD1 4.39Å; L133-L151 HydrophobicContact CG-CD1 4.07Å; L151-F339 HydrophobicContact CD2-CZ 4.38Å
152	L	79.8	Confident	80.2	Confident	20 Å²	20	27.1 Å²	27.1	11%	0.105	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128	-177.3	-54.3	-175.6	0	0	0	108.9	A132 E150 R260	A132-L152 HydrophobicContact CB-CB 4.25Å; A132-L152 PolarHBondContact N-O 2.87Å; A132-L152 PolarHBondContact O-N 3.04Å; E150-L152 HydrophobicContact CB-CD2 3.82Å; E150-L152 HydrophobicContact CB-CG 4.48Å; E150-L152 PolarHBondContact O-N 3.23Å; L152-R260 HydrophobicContact CD1-CG 4.15Å; L152-R260 HydrophobicContact CD2-CG 3.51Å; L152-R260 HydrophobicContact CG-CG 4.48Å
153	Y	76.9	Confident	80.1	Confident	32 Å²	32	28.8 Å²	28.8	13%	0.125	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	126.2	169.3	176.8	-109.9	0	0	0	108.6	Q130 P155 F350 I353	Q130-Y153 HydrophobicContact CB-CD2 3.83Å; Q130-Y153 HydrophobicContact CB-CE2 3.43Å; Q130-Y153 VanDerWaalsContact CB-CE2 3.43Å; Q130-Y153 HydrophobicContact CG-CE2 4.22Å; Y153-P155 HydrophobicContact CE1-CB 4.37Å; Y153-F350 AromaticContact CD1-CD2 3.8Å; Y153-F350 HydrophobicContact CD1-CD2 3.8Å; Y153-F350 HydrophobicContact CD1-CE2 4.25Å; Y153-F350 HydrophobicContact CE1-CB 4.46Å; Y153-F350 AromaticContact CE1-CD2 3.7Å; Y153-F350 HydrophobicContact CE1-CD2 3.7Å; Y153-F350 HydrophobicContact CG-CD2 4.35Å; Y153-F350 HydrophobicContact CG-CE2 4.44Å; Y153-I353 HydrophobicContact CD2-CD1 3.8Å; Y153-I353 HydrophobicContact CE1-CD1 4.3Å; Y153-I353 HydrophobicContact CE2-CD1 2.88Å; Y153-I353 HydrophobicContact CE2-CG1 4.37Å; Y153-I353 WeakPolarHBondContact OH-CD1 2.91Å
154	C	69.9	Low	80.4	Confident	32 Å²	32	31.5 Å²	31.5	22%	0.216	17%	0.171	C	C	.	.			trans	-130.7	113.6	176.4	176.2	0	0	0	0	108.1	Q130 Y156	Q130-C154 WeakPolarHBondContact CB-O 3.4Å; Q130-C154 WeakPolarHBondContact CG-O 3.46Å; Q130-C154 PolarHBondContact O-N 3.16Å; C154-Y156 PolarHBondContact O-N 3.44Å; C154-Y156 PolarHBondContact SG-O 3.05Å
155	P	66.8	Low	80.6	Confident	12 Å²	12	31.5 Å²	31.5	8%	0.078	17%	0.171	C	C	.	.	S	Bend	trans	-59.1	-26.6	-173.9	22.3	-31.7	0	0	0	112.5	Y13 Q130 Y153 E349	Y13-P155 HydrophobicContact CD1-CG 4.22Å; Y13-P155 HydrophobicContact CD2-CG 3.64Å; Y13-P155 HydrophobicContact CE2-CG 3.99Å; Y13-P155 HydrophobicContact CG-CG 3.76Å; Q130-P155 WeakPolarHBondContact CG-O 3.21Å; Y153-P155 HydrophobicContact CE1-CB 4.37Å; P155-E349 WeakPolarHBondContact CB-OE2 3.33Å
156	Y	66.2	Low	80.7	Confident	104 Å²	104	36.4 Å²	36.4	41%	0.408	19%	0.194	S	C	.	.	S	Bend	trans	-91.7	142.4	176.4	-50.2	-77.2	0	0	0	112.4	C15 V23 C154 S158	C15-Y156 WeakPolarHBondContact SG-CD1 3.43Å; C15-Y156 WeakPolarHBondContact SG-CD2 3.2Å; V23-Y156 HydrophobicContact CG1-CD2 3.79Å; V23-Y156 HydrophobicContact CG1-CE2 4.3Å; V23-Y156 HydrophobicContact CG2-CD2 3.88Å; V23-Y156 HydrophobicContact CG2-CG 4.24Å; C154-Y156 PolarHBondContact O-N 3.44Å; C154-Y156 PolarHBondContact SG-O 3.05Å; Y156-S158 PolarHBondContact O-N 2.82Å
157	S	63.6	Low	80.8	Confident	63 Å²	63	41.2 Å²	41.2	44%	0.441	22%	0.215	S	C	.	.			trans	-66.3	114.6	174.5	56.5	0	0	0	0	110.5	K159	S157-K159 PolarHBondContact O-N 3.22Å
158	S	68.1	Low	80.7	Confident	45 Å²	45	42.2 Å²	42.2	32%	0.315	22%	0.22	S	C	.	.			trans	-60.6	131.4	167.2	175.7	0	0	0	0	109.9	Y156 L160	Y156-S158 PolarHBondContact O-N 2.82Å; S158-L160 PolarHBondContact O-N 3.23Å; S158-L160 WeakPolarHBondContact OG-CB 3.23Å; S158-L160 PolarHBondContact OG-N 3.45Å
159	K	78.3	Confident	80.6	Confident	85 Å²	85	42.7 Å²	42.7	37%	0.37	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-74.7	0.1	173.3	-66.8	-176	175.9	179.2	0	113.2	R19 S157 G161 D162 Q163	R19-K159 VanDerWaalsContact O-CD 3.24Å; R19-K159 WeakPolarHBondContact O-CD 3.46Å; R19-K159 PolarHBondContact O-NZ 3.21Å; S157-K159 PolarHBondContact O-N 3.22Å; K159-G161 VanDerWaalsContact C-N 3.26Å; K159-G161 PolarHBondContact O-N 3.19Å; K159-D162 PolarHBondContact O-N 3.26Å; K159-Q163 WeakPolarHBondContact O-CG 3.26Å; K159-Q163 PolarHBondContact O-N 2.68Å; K159-Q163 PolarHBondContact O-NE2 2.89Å
160	L	82.4	Confident	80.5	Confident	8 Å²	8	47.5 Å²	47.5	4%	0.042	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-50.5	-47.2	174.5	171.9	52	0	0	0	111.7	S158 D162 Q163 L175 W178 I216 Y239 F241	S158-L160 PolarHBondContact O-N 3.23Å; S158-L160 WeakPolarHBondContact OG-CB 3.23Å; S158-L160 PolarHBondContact OG-N 3.45Å; L160-D162 PolarHBondContact O-N 3.5Å; L160-Q163 PolarHBondContact O-N 3.3Å; L160-L175 HydrophobicContact CD1-CD2 3.8Å; L160-W178 HydrophobicContact CB-CD2 4.33Å; L160-W178 HydrophobicContact CB-CE3 4.39Å; L160-W178 HydrophobicContact CB-CH2 3.72Å; L160-W178 HydrophobicContact CB-CZ2 3.7Å; L160-W178 HydrophobicContact CB-CZ3 4.05Å; L160-W178 HydrophobicContact CD1-CD2 3.82Å; L160-W178 HydrophobicContact CD1-CE3 3.4Å; L160-W178 HydrophobicContact CD1-CG 4.49Å; L160-W178 HydrophobicContact CD1-CH2 4.1Å; L160-W178 HydrophobicContact CD1-CZ3 3.51Å; L160-W178 HydrophobicContact CD2-CE3 4.44Å; L160-W178 HydrophobicContact CD2-CH2 3.78Å; L160-W178 HydrophobicContact CD2-CZ3 3.67Å; L160-W178 HydrophobicContact CG-CE3 4.25Å; L160-W178 HydrophobicContact CG-CH2 4.06Å; L160-W178 HydrophobicContact CG-CZ2 4.47Å; L160-W178 HydrophobicContact CG-CZ3 3.92Å; L160-I216 HydrophobicContact CD2-CD1 4.31Å; L160-Y239 HydrophobicContact CD1-CD1 3.81Å; L160-Y239 HydrophobicContact CD1-CE1 3.93Å; L160-Y239 HydrophobicContact CD1-CG 4.26Å; L160-Y239 HydrophobicContact CD2-CD1 4.23Å; L160-Y239 HydrophobicContact CD2-CD2 3.79Å; L160-Y239 HydrophobicContact CD2-CE2 4.13Å; L160-Y239 HydrophobicContact CD2-CG 3.84Å; L160-Y239 HydrophobicContact CG-CD1 4.07Å; L160-Y239 HydrophobicContact CG-CD2 4.23Å; L160-Y239 HydrophobicContact CG-CE1 4.01Å; L160-Y239 HydrophobicContact CG-CE2 4.17Å; L160-Y239 HydrophobicContact CG-CG 4.18Å; L160-F241 HydrophobicContact CD1-CZ 4.27Å; L160-F241 HydrophobicContact CD2-CZ 3.94Å
161	G	79	Confident	80.5	Confident	9 Å²	9	46.6 Å²	46.6	9%	0.093	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-70	-12.9	-178.7	0	0	0	0	0	114.8	K159 S221 Y239	K159-G161 VanDerWaalsContact C-N 3.26Å; K159-G161 PolarHBondContact O-N 3.19Å; G161-S221 PolarHBondContact O-OG 3.08Å; G161-Y239 WeakPolarHBondContact CA-OH 3.42Å
162	D	79.2	Confident	81	Confident	85 Å²	85	46 Å²	46	46%	0.455	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-103.1	-1.7	-177.2	-49.2	-35.9	0	0	0	111.7	R129 K159 L160	R129-D162 IonicContact CZ-OD1 3.95Å; R129-D162 IonicContact NH2-OD1 2.83Å; R129-D162 PolarHBondContact NH2-OD1 3.42Å; R129-D162 IonicContact NH2-OD2 2.77Å; K159-D162 PolarHBondContact O-N 3.26Å; L160-D162 PolarHBondContact O-N 3.5Å
163	Q	84.2	Confident	81.7	Confident	36 Å²	36	45.9 Å²	45.9	17%	0.168	24%	0.242	C	C	.	.	S	Bend	trans	-71.8	146	178.3	-61.4	-55.7	-67.3	0	0	111.3	K159 L160 A165 L175 W178	K159-Q163 WeakPolarHBondContact O-CG 3.26Å; K159-Q163 PolarHBondContact O-N 2.68Å; K159-Q163 PolarHBondContact O-NE2 2.89Å; L160-Q163 PolarHBondContact O-N 3.3Å; Q163-A165 PolarHBondContact O-N 3.42Å; Q163-L175 HydrophobicContact CB-CD2 3.91Å; Q163-W178 HydrophobicContact CG-CB 4.01Å; Q163-W178 HydrophobicContact CG-CG 3.94Å
164	P	86.2	Confident	82.6	Confident	82 Å²	82	44.5 Å²	44.5	53%	0.532	24%	0.237	S	C	.	.			trans	-54.4	134.5	171	-23.3	33.4	0	0	0	110.9
165	A	90.5	Very high	83.7	Confident	3 Å²	3	43 Å²	43	3%	0.025	23%	0.227	C	C	.	.			trans	-129	121.6	-179.5	0	0	0	0	0	109.9	Q163 V174 L175 L223 P225	Q163-A165 PolarHBondContact O-N 3.42Å; A165-V174 CarbonylContact C-O 3.57Å; A165-V174 WeakPolarHBondContact CA-O 3.44Å; A165-L175 HydrophobicContact CB-CD1 4.01Å; A165-L175 HydrophobicContact CB-CG 4.13Å; A165-L223 HydrophobicContact CB-CB 4.03Å; A165-L223 HydrophobicContact CB-CD1 4.43Å; A165-L223 HydrophobicContact CB-CD2 4.1Å; A165-L223 HydrophobicContact CB-CG 4.41Å; A165-P225 WeakPolarHBondContact O-CA 3.5Å
166	E	91.5	Very high	84.8	Confident	105 Å²	105	47.5 Å²	47.5	49%	0.491	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.2	175.1	-171.9	-171	161.1	0	0	109.3	I168 Y173 V174	E166-I168 HydrophobicContact CB-CD1 4.2Å; E166-I168 VanDerWaalsContact CD-CD1 3.45Å; E166-I168 HydrophobicContact CG-CD1 3.77Å; E166-I168 PolarHBondContact O-N 2.86Å; E166-I168 WeakPolarHBondContact OE1-CD1 3.4Å; E166-Y173 CarbonylContact O-C 3.49Å; E166-Y173 WeakPolarHBondContact O-CA 3.35Å; E166-V174 PolarHBondContact N-O 2.88Å; E166-V174 PolarHBondContact O-N 2.89Å
167	K	91.8	Very high	85.6	Confident	101 Å²	101	48.8 Å²	48.8	44%	0.439	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	118.4	172.5	-174.5	179.1	-178.9	175.1	0	109.3	A169 D170 Y173	K167-A169 WeakPolarHBondContact CE-O 3.16Å; K167-A169 WeakPolarHBondContact CG-O 3.16Å; K167-D170 IonicContact NZ-OD1 3.01Å; K167-D170 PolarHBondContact NZ-OD1 3.28Å; K167-Y173 HydrophobicContact CB-CD1 4Å; K167-Y173 HydrophobicContact CB-CE1 3.95Å; K167-Y173 HydrophobicContact CD-CE1 4.45Å; K167-Y173 HydrophobicContact CG-CD1 4.36Å; K167-Y173 HydrophobicContact CG-CE1 4.06Å
168	I	91.4	Very high	86.6	Confident	21 Å²	21	46.7 Å²	46.7	11%	0.108	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	-37.9	-177.9	-56	-55.2	0	0	0	112	E166 L172 V174 V299 K303	E166-I168 HydrophobicContact CB-CD1 4.2Å; E166-I168 VanDerWaalsContact CD-CD1 3.45Å; E166-I168 HydrophobicContact CG-CD1 3.77Å; E166-I168 PolarHBondContact O-N 2.86Å; E166-I168 WeakPolarHBondContact OE1-CD1 3.4Å; I168-L172 HydrophobicContact CB-CD2 4.44Å; I168-L172 HydrophobicContact CG2-CD2 4.47Å; I168-L172 PolarHBondContact N-O 3.21Å; I168-V174 HydrophobicContact CD1-CB 4.24Å; I168-V174 HydrophobicContact CD1-CG2 4.2Å; I168-V174 HydrophobicContact CG1-CB 3.88Å; I168-V174 HydrophobicContact CG1-CG2 3.47Å; I168-V174 VanDerWaalsContact CG1-CG2 3.47Å; I168-V299 HydrophobicContact CD1-CG1 4.32Å; I168-V299 HydrophobicContact CG1-CG1 4.11Å; I168-V299 HydrophobicContact CG2-CG1 4.02Å; I168-K303 HydrophobicContact CG2-CB 3.7Å; I168-K303 HydrophobicContact CG2-CD 3.73Å; I168-K303 HydrophobicContact CG2-CG 3.72Å
169	A	90.2	Very high	87.4	Confident	16 Å²	16	45 Å²	45	13%	0.132	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	178.1	175.3	0	0	0	0	0	109.7	K167 G171 L172 F306	K167-A169 WeakPolarHBondContact CE-O 3.16Å; K167-A169 WeakPolarHBondContact CG-O 3.16Å; A169-G171 PolarHBondContact O-N 3.18Å; A169-L172 HydrophobicContact CB-CB 4.02Å; A169-L172 HydrophobicContact CB-CD2 4.28Å; A169-L172 PolarHBondContact N-O 2.79Å; A169-L172 PolarHBondContact O-N 3.04Å; A169-L172 VanDerWaalsContact O-O 3.12Å; A169-F306 HydrophobicContact CB-CB 3.7Å; A169-F306 HydrophobicContact CB-CD1 4.36Å; A169-F306 HydrophobicContact CB-CG 4.33Å
170	D	86.5	Confident	87.9	Confident	101 Å²	101	41 Å²	41	54%	0.54	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	121.1	179.2	-165.4	49.5	0	0	0	112.3	K167 L172 Q198	K167-D170 IonicContact NZ-OD1 3.01Å; K167-D170 PolarHBondContact NZ-OD1 3.28Å; D170-L172 PolarHBondContact O-N 3.31Å; D170-Q198 PolarHBondContact O-NE2 3.24Å
171	G	86.7	Confident	88.4	Confident	3 Å²	3	41.9 Å²	41.9	3%	0.031	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	6.4	-172.3	0	0	0	0	0	115.8	A169 V185	A169-G171 PolarHBondContact O-N 3.18Å; G171-V185 WeakPolarHBondContact O-CA 3.29Å
172	L	92.9	Very high	89.2	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125.9	179.3	-171	68.4	0	0	0	111.1	I168 A169 D170 V183 V185 V202 L302 F306	I168-L172 HydrophobicContact CB-CD2 4.44Å; I168-L172 HydrophobicContact CG2-CD2 4.47Å; I168-L172 PolarHBondContact N-O 3.21Å; A169-L172 HydrophobicContact CB-CB 4.02Å; A169-L172 HydrophobicContact CB-CD2 4.28Å; A169-L172 PolarHBondContact N-O 2.79Å; A169-L172 PolarHBondContact O-N 3.04Å; A169-L172 VanDerWaalsContact O-O 3.12Å; D170-L172 PolarHBondContact O-N 3.31Å; L172-V183 HydrophobicContact CD1-CG1 3.28Å; L172-V183 HydrophobicContact CG-CG1 4.25Å; L172-V185 HydrophobicContact CD1-CG2 4.28Å; L172-V202 HydrophobicContact CD1-CG2 3.97Å; L172-L302 HydrophobicContact CD2-CB 4.13Å; L172-F306 HydrophobicContact CB-CD1 3.82Å; L172-F306 HydrophobicContact CB-CE1 3.77Å; L172-F306 HydrophobicContact CB-CG 4.36Å; L172-F306 HydrophobicContact CB-CZ 4.28Å; L172-F306 HydrophobicContact CD1-CE1 4.12Å; L172-F306 HydrophobicContact CD1-CE2 4.03Å; L172-F306 HydrophobicContact CD1-CZ 3.76Å; L172-F306 HydrophobicContact CD2-CD1 4.31Å; L172-F306 HydrophobicContact CD2-CD2 3.94Å; L172-F306 HydrophobicContact CD2-CE2 4.16Å; L172-F306 HydrophobicContact CD2-CG 4.02Å; L172-F306 HydrophobicContact CD2-CZ 4.45Å; L172-F306 HydrophobicContact CG-CE1 4.36Å; L172-F306 HydrophobicContact CG-CZ 4.39Å
173	Y	94.4	Very high	90	Very high	18 Å²	18	37.5 Å²	37.5	7%	0.071	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	157.5	-177	-56.5	-98.5	0	0	0	111	E166 K167 V183 A184 Q186 L223	E166-Y173 CarbonylContact O-C 3.49Å; E166-Y173 WeakPolarHBondContact O-CA 3.35Å; K167-Y173 HydrophobicContact CB-CD1 4Å; K167-Y173 HydrophobicContact CB-CE1 3.95Å; K167-Y173 HydrophobicContact CD-CE1 4.45Å; K167-Y173 HydrophobicContact CG-CD1 4.36Å; K167-Y173 HydrophobicContact CG-CE1 4.06Å; Y173-V183 CarbonylContact O-C 3.56Å; Y173-V183 WeakPolarHBondContact O-CA 3.45Å; Y173-A184 PolarHBondContact N-O 2.82Å; Y173-A184 PolarHBondContact O-N 2.98Å; Y173-Q186 HydrophobicContact CE2-CB 4.3Å; Y173-L223 HydrophobicContact CD1-CB 3.85Å; Y173-L223 HydrophobicContact CD1-CD1 4.38Å; Y173-L223 HydrophobicContact CD2-CD1 3.9Å; Y173-L223 HydrophobicContact CE1-CB 3.93Å; Y173-L223 WeakPolarHBondContact CE1-O 3.17Å; Y173-L223 HydrophobicContact CG-CB 4.15Å; Y173-L223 HydrophobicContact CG-CD1 3.83Å
174	V	95.1	Very high	90.5	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	134.6	176.3	166.6	0	0	0	0	110.4	A165 E166 I168 K176 A182 V183 F295 V299	A165-V174 CarbonylContact C-O 3.57Å; A165-V174 WeakPolarHBondContact CA-O 3.44Å; E166-V174 PolarHBondContact N-O 2.88Å; E166-V174 PolarHBondContact O-N 2.89Å; I168-V174 HydrophobicContact CD1-CB 4.24Å; I168-V174 HydrophobicContact CD1-CG2 4.2Å; I168-V174 HydrophobicContact CG1-CB 3.88Å; I168-V174 HydrophobicContact CG1-CG2 3.47Å; I168-V174 VanDerWaalsContact CG1-CG2 3.47Å; V174-K176 HydrophobicContact CG1-CD 4.44Å; V174-K176 HydrophobicContact CG1-CG 3.7Å; V174-A182 WeakPolarHBondContact CA-O 3.23Å; V174-V183 HydrophobicContact CG2-CG2 4.36Å; V174-F295 HydrophobicContact CG1-CE1 3.7Å; V174-F295 HydrophobicContact CG1-CZ 3.94Å; V174-V299 HydrophobicContact CG1-CG2 4.41Å; V174-V299 HydrophobicContact CG2-CB 4.44Å; V174-V299 HydrophobicContact CG2-CG1 3.85Å; V174-V299 HydrophobicContact CG2-CG2 3.66Å
175	L	92.7	Very high	90.9	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	115.7	173.3	-66.5	75.7	0	0	0	107.4	L160 Q163 A165 P181 A182 A184 Y239	L160-L175 HydrophobicContact CD1-CD2 3.8Å; Q163-L175 HydrophobicContact CB-CD2 3.91Å; A165-L175 HydrophobicContact CB-CD1 4.01Å; A165-L175 HydrophobicContact CB-CG 4.13Å; L175-P181 CarbonylContact O-C 3.53Å; L175-P181 VanDerWaalsContact O-CA 3.23Å; L175-P181 WeakPolarHBondContact O-CA 3.19Å; L175-A182 HydrophobicContact CB-CB 4.34Å; L175-A182 PolarHBondContact N-O 2.84Å; L175-A182 PolarHBondContact O-N 3.17Å; L175-A184 HydrophobicContact CD1-CB 3.7Å; L175-Y239 HydrophobicContact CD1-CD1 4.28Å; L175-Y239 HydrophobicContact CD1-CE1 4.18Å; L175-Y239 HydrophobicContact CD2-CD1 4.15Å; L175-Y239 HydrophobicContact CD2-CE1 3.82Å
176	K	89.6	Confident	91	Very high	106 Å²	106	31.8 Å²	31.8	46%	0.461	15%	0.154	S	C	.	.			trans	-100.1	-24.6	-178.1	-63.9	-169.3	174.3	-168.7	0	114.1	V174 F295 D296	V174-K176 HydrophobicContact CG1-CD 4.44Å; V174-K176 HydrophobicContact CG1-CG 3.7Å; K176-F295 HydrophobicContact CG-CE1 4.39Å; K176-D296 IonicContact NZ-OD1 3.71Å; K176-D296 PolarHBondContact NZ-OD1 2.78Å
177	E	82.6	Confident	90.9	Very high	132 Å²	132	27.7 Å²	27.7	62%	0.617	14%	0.135	S	C	*	.	S	Bend	trans	-102.9	10.3	-164	-59.2	-169.4	174.2	0	0	115.4
178	W	84.8	Confident	90.2	Very high	19 Å²	19	25.5 Å²	25.5	7%	0.072	13%	0.13	C	C	.	.	S	Bend	trans	-90.5	-170.1	175.9	-160.1	48.9	0	0	0	112.3	L20 L160 Q163 L180 F241 L261	L20-W178 HydrophobicContact CD2-CG 4.46Å; L20-W178 PolarHBondContact O-NE1 2.78Å; L160-W178 HydrophobicContact CB-CD2 4.33Å; L160-W178 HydrophobicContact CB-CE3 4.39Å; L160-W178 HydrophobicContact CB-CH2 3.72Å; L160-W178 HydrophobicContact CB-CZ2 3.7Å; L160-W178 HydrophobicContact CB-CZ3 4.05Å; L160-W178 HydrophobicContact CD1-CD2 3.82Å; L160-W178 HydrophobicContact CD1-CE3 3.4Å; L160-W178 HydrophobicContact CD1-CG 4.49Å; L160-W178 HydrophobicContact CD1-CH2 4.1Å; L160-W178 HydrophobicContact CD1-CZ3 3.51Å; L160-W178 HydrophobicContact CD2-CE3 4.44Å; L160-W178 HydrophobicContact CD2-CH2 3.78Å; L160-W178 HydrophobicContact CD2-CZ3 3.67Å; L160-W178 HydrophobicContact CG-CE3 4.25Å; L160-W178 HydrophobicContact CG-CH2 4.06Å; L160-W178 HydrophobicContact CG-CZ2 4.47Å; L160-W178 HydrophobicContact CG-CZ3 3.92Å; Q163-W178 HydrophobicContact CG-CB 4.01Å; Q163-W178 HydrophobicContact CG-CG 3.94Å; W178-L180 PolarHBondContact O-N 2.92Å; W178-L180 VanDerWaalsContact O-N 3.12Å; W178-F241 AromaticContact CE3-CE1 3.76Å; W178-F241 HydrophobicContact CE3-CE1 3.76Å; W178-F241 HydrophobicContact CE3-CZ 4.19Å; W178-F241 AromaticContact CZ3-CE1 3.62Å; W178-F241 HydrophobicContact CZ3-CE1 3.62Å; W178-F241 AromaticContact CZ3-CZ 3.63Å; W178-F241 HydrophobicContact CZ3-CZ 3.63Å; W178-L261 HydrophobicContact CE3-CD1 4.27Å; W178-L261 HydrophobicContact CH2-CB 4.42Å; W178-L261 HydrophobicContact CH2-CD1 3.66Å; W178-L261 HydrophobicContact CZ3-CD1 3.25Å
179	L	85.2	Confident	89.1	Confident	8 Å²	8	28 Å²	28	4%	0.042	15%	0.154	C	C	.	.	S	Bend	trans	-51.4	-37	178.8	-178.1	64.7	0	0	0	112.7	L20 L22 L261 I280 V281 F284	L20-L179 HydrophobicContact CD1-CB 4.24Å; L20-L179 HydrophobicContact CD1-CD1 4.19Å; L22-L179 HydrophobicContact CD1-CD1 4.27Å; L22-L179 HydrophobicContact CD2-CD2 4.17Å; L179-L261 HydrophobicContact CD2-CB 4.01Å; L179-L261 VanDerWaalsContact CD2-O 3.23Å; L179-L261 WeakPolarHBondContact CD2-O 3.48Å; L179-I280 HydrophobicContact CD1-CG2 4.44Å; L179-V281 HydrophobicContact CD1-CB 4.27Å; L179-V281 HydrophobicContact CD1-CG2 3.76Å; L179-F284 HydrophobicContact CD1-CB 3.98Å; L179-F284 HydrophobicContact CD1-CD2 4.06Å; L179-F284 HydrophobicContact CD1-CG 4.06Å; L179-F284 HydrophobicContact CD2-CD1 4.06Å; L179-F284 HydrophobicContact CD2-CD2 3.75Å; L179-F284 HydrophobicContact CD2-CE1 4.16Å; L179-F284 HydrophobicContact CD2-CE2 3.79Å; L179-F284 HydrophobicContact CD2-CG 3.88Å; L179-F284 HydrophobicContact CD2-CZ 4.03Å; L179-F284 HydrophobicContact CG-CB 4.16Å; L179-F284 HydrophobicContact CG-CD1 4.27Å; L179-F284 HydrophobicContact CG-CD2 4.16Å; L179-F284 HydrophobicContact CG-CG 3.94Å
180	L	89.6	Confident	88	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.016	19%	0.186	C	C	.	.	S	Bend	trans	-139.9	148.6	172.2	-64.4	167.4	0	0	0	108.9	W178 F241 R243 L261 F284 A289	W178-L180 PolarHBondContact O-N 2.92Å; W178-L180 VanDerWaalsContact O-N 3.12Å; L180-F241 HydrophobicContact CB-CD1 3.99Å; L180-F241 HydrophobicContact CD1-CB 4.31Å; L180-F241 HydrophobicContact CD1-CD1 4.4Å; L180-R243 VanDerWaalsContact CD1-NH2 3.28Å; L180-L261 HydrophobicContact CD1-CD2 3.53Å; L180-F284 HydrophobicContact CD1-CD1 3.78Å; L180-F284 HydrophobicContact CD1-CE1 4.11Å; L180-F284 HydrophobicContact CD2-CB 4.24Å; L180-F284 HydrophobicContact CD2-CD1 4.09Å; L180-F284 HydrophobicContact CG-CD1 3.97Å; L180-A289 HydrophobicContact CD2-CB 3.74Å
181	P	92.6	Very high	87.7	Confident	26 Å²	26	35.6 Å²	35.6	17%	0.169	18%	0.183	C	C	.	.			trans	-63.7	142	170	30.2	-35.6	0	0	0	110.2	L175 F295	L175-P181 CarbonylContact O-C 3.53Å; L175-P181 VanDerWaalsContact O-CA 3.23Å; L175-P181 WeakPolarHBondContact O-CA 3.19Å; P181-F295 HydrophobicContact CB-CD1 3.8Å; P181-F295 HydrophobicContact CB-CD2 3.81Å; P181-F295 HydrophobicContact CB-CE1 3.71Å; P181-F295 HydrophobicContact CB-CE2 3.73Å; P181-F295 HydrophobicContact CB-CG 3.84Å; P181-F295 HydrophobicContact CB-CZ 3.68Å; P181-F295 HydrophobicContact CG-CB 4.45Å; P181-F295 HydrophobicContact CG-CD1 4.37Å; P181-F295 HydrophobicContact CG-CD2 3.88Å; P181-F295 HydrophobicContact CG-CE2 4.22Å; P181-F295 HydrophobicContact CG-CG 3.96Å
182	A	94.8	Very high	87.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	146.9	-175.1	0	0	0	0	0	111.9	V174 L175 F240 F241	V174-A182 WeakPolarHBondContact CA-O 3.23Å; L175-A182 HydrophobicContact CB-CB 4.34Å; L175-A182 PolarHBondContact N-O 2.84Å; L175-A182 PolarHBondContact O-N 3.17Å; A182-F240 CarbonylContact C-O 3.58Å; A182-F240 VanDerWaalsContact CA-O 3.23Å; A182-F240 WeakPolarHBondContact CA-O 3.39Å; A182-F241 HydrophobicContact CB-CD1 3.61Å; A182-F241 HydrophobicContact CB-CE1 3.43Å; A182-F241 VanDerWaalsContact CB-CE1 3.43Å; A182-F241 HydrophobicContact CB-CG 4.46Å; A182-F241 HydrophobicContact CB-CZ 4.14Å
183	V	96.2	Very high	87.4	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	128.5	164.1	176.2	0	0	0	0	107.5	L172 Y173 V174 V202 F240 F295 V299 L302	L172-V183 HydrophobicContact CD1-CG1 3.28Å; L172-V183 HydrophobicContact CG-CG1 4.25Å; Y173-V183 CarbonylContact O-C 3.56Å; Y173-V183 WeakPolarHBondContact O-CA 3.45Å; V174-V183 HydrophobicContact CG2-CG2 4.36Å; V183-V202 HydrophobicContact CG1-CG1 4.35Å; V183-V202 HydrophobicContact CG1-CG2 4.2Å; V183-F240 PolarHBondContact N-O 2.72Å; V183-F240 PolarHBondContact O-N 3.25Å; V183-F295 HydrophobicContact CG2-CE2 4.19Å; V183-F295 HydrophobicContact CG2-CZ 4.21Å; V183-V299 HydrophobicContact CG2-CG2 4.4Å; V183-L302 HydrophobicContact CB-CD1 4.49Å; V183-L302 HydrophobicContact CG1-CD1 4.12Å; V183-L302 HydrophobicContact CG2-CD1 3.9Å
184	A	95.8	Very high	87.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.3	-178.9	0	0	0	0	0	112.4	Y173 L175 L223 T237 S238 Y239	Y173-A184 PolarHBondContact N-O 2.82Å; Y173-A184 PolarHBondContact O-N 2.98Å; L175-A184 HydrophobicContact CD1-CB 3.7Å; A184-L223 HydrophobicContact CB-CD1 3.78Å; A184-T237 HydrophobicContact CB-CG2 4.38Å; A184-S238 CarbonylContact C-O 3.48Å; A184-S238 WeakPolarHBondContact CA-O 3.45Å; A184-Y239 HydrophobicContact CB-CD1 3.73Å; A184-Y239 HydrophobicContact CB-CE1 3.96Å
185	V	94.9	Very high	87	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.9	170.8	178.1	0	0	0	0	107.3	G171 L172 F195 Q198 V202 T237 S238 F240	G171-V185 WeakPolarHBondContact O-CA 3.29Å; L172-V185 HydrophobicContact CD1-CG2 4.28Å; V185-F195 HydrophobicContact CB-CE2 4.39Å; V185-F195 HydrophobicContact CG1-CD2 3.75Å; V185-F195 HydrophobicContact CG1-CE2 3.93Å; V185-F195 WeakPolarHBondContact O-CE2 3.48Å; V185-Q198 HydrophobicContact CG1-CB 3.54Å; V185-Q198 HydrophobicContact CG2-CB 4.26Å; V185-V202 HydrophobicContact CG2-CG2 4.07Å; V185-T237 CarbonylContact O-C 3.54Å; V185-T237 WeakPolarHBondContact O-CA 3.5Å; V185-T237 WeakPolarHBondContact O-CG2 3.45Å; V185-S238 PolarHBondContact N-O 2.82Å; V185-S238 PolarHBondContact O-N 2.8Å; V185-F240 HydrophobicContact CG2-CE2 4.4Å
186	Q	92.1	Very high	87.1	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.9	-177.8	-175.3	167	65.6	0	0	111.3	Y173 T188 S220 S221 L223 L235 T237	Y173-Q186 HydrophobicContact CE2-CB 4.3Å; Q186-T188 PolarHBondContact O-N 2.75Å; Q186-T188 VanDerWaalsContact O-N 3.13Å; Q186-S220 PolarHBondContact NE2-OG 3.41Å; Q186-S221 PolarHBondContact NE2-O 2.99Å; Q186-L223 HydrophobicContact CB-CD1 4.35Å; Q186-L235 HydrophobicContact CG-CB 3.93Å; Q186-L235 HydrophobicContact CG-CD1 3.98Å; Q186-T237 HydrophobicContact CB-CG2 4.18Å; Q186-T237 WeakPolarHBondContact CG-OG1 3.42Å; Q186-T237 PolarHBondContact NE2-OG1 3.18Å
187	M	88.9	Confident	87.2	Confident	19 Å²	19	39.6 Å²	39.6	9%	0.094	20%	0.203	C	C	.	.			trans	-78.3	97.2	178.6	-170.3	174.2	71.1	0	0	109.9	L124 L192 F195 V236	L124-M187 HydrophobicContact CD1-CE 4.37Å; L124-M187 HydrophobicContact CD2-CE 4.32Å; M187-L192 HydrophobicContact SD-CB 4.43Å; M187-L192 HydrophobicContact SD-CD1 4.26Å; M187-F195 HydrophobicContact CB-CB 3.98Å; M187-F195 HydrophobicContact CB-CD2 3.51Å; M187-F195 HydrophobicContact CB-CE2 4.05Å; M187-F195 HydrophobicContact CB-CG 3.75Å; M187-F195 HydrophobicContact CG-CB 3.88Å; M187-F195 HydrophobicContact CG-CD2 4.35Å; M187-F195 HydrophobicContact CG-CG 4.13Å; M187-F195 VanDerWaalsContact N-CD2 3.32Å; M187-F195 HydrophobicContact SD-CB 4.37Å; M187-F195 HydrophobicContact SD-CG 4.49Å; M187-V236 HydrophobicContact CB-CB 4.16Å; M187-V236 WeakPolarHBondContact CB-O 3.47Å; M187-V236 HydrophobicContact CE-CB 3.98Å; M187-V236 HydrophobicContact CE-CG2 3.86Å; M187-V236 PolarHBondContact N-O 2.84Å
188	T	77.4	Confident	87.8	Confident	56 Å²	56	34.1 Å²	34.1	34%	0.344	18%	0.177	S	C	.	.			trans	-90.4	154	171.3	60.8	0	0	0	0	110.4	Q186 Q190 H191 L222 L235	Q186-T188 PolarHBondContact O-N 2.75Å; Q186-T188 VanDerWaalsContact O-N 3.13Å; T188-Q190 PolarHBondContact O-N 2.83Å; T188-H191 PolarHBondContact O-N 2.87Å; T188-L222 HydrophobicContact CG2-CD1 4.46Å; T188-L235 HydrophobicContact CG2-CD1 4.46Å
189	A	68	Low	88.4	Confident	74 Å²	74	33.2 Å²	33.2	61%	0.612	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	22.3	174.7	0	0	0	0	0	117	H191	A189-H191 PolarHBondContact O-N 2.88Å
190	Q	66.4	Low	88.9	Confident	171 Å²	171	34 Å²	34	80%	0.799	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	22.8	-178.7	-54.1	-178.1	3.6	0	0	114.7	T188 L192	T188-Q190 PolarHBondContact O-N 2.83Å; Q190-L192 VanDerWaalsContact C-N 3.31Å; Q190-L192 PolarHBondContact O-N 2.86Å
191	H	81.9	Confident	89.1	Confident	104 Å²	104	35.6 Å²	35.6	48%	0.481	19%	0.186	S	C	.	.			trans	-80.7	74.8	177	-65.4	-55.8	0	0	0	112	T188 A189 N193 Q194 F195	T188-H191 PolarHBondContact O-N 2.87Å; A189-H191 PolarHBondContact O-N 2.88Å; H191-N193 VanDerWaalsContact C-N 3.3Å; H191-N193 PolarHBondContact O-N 2.8Å; H191-Q194 HydrophobicContact CB-CB 3.98Å; H191-Q194 PolarHBondContact O-N 2.86Å; H191-Q194 VanDerWaalsContact O-N 3.15Å; H191-F195 PolarHBondContact O-N 2.76Å
192	L	86.7	Confident	89.4	Confident	31 Å²	31	34.4 Å²	34.4	16%	0.162	18%	0.178	C	C	.	.	H	α-helix	trans	-50.3	-48.2	179.8	179.1	61.7	0	0	0	112.1	V120 M187 Q190 Q194 F195 I196	V120-L192 HydrophobicContact CB-CD1 4.01Å; V120-L192 HydrophobicContact CG1-CD1 3.55Å; V120-L192 HydrophobicContact CG2-CD1 4.39Å; M187-L192 HydrophobicContact SD-CB 4.43Å; M187-L192 HydrophobicContact SD-CD1 4.26Å; Q190-L192 VanDerWaalsContact C-N 3.31Å; Q190-L192 PolarHBondContact O-N 2.86Å; L192-Q194 VanDerWaalsContact C-N 3.32Å; L192-Q194 PolarHBondContact O-N 3.22Å; L192-F195 WeakPolarHBondContact O-CB 3.04Å; L192-F195 PolarHBondContact O-N 2.93Å; L192-I196 HydrophobicContact CD1-CD1 4.06Å; L192-I196 HydrophobicContact CD1-CG1 3.83Å; L192-I196 HydrophobicContact CG-CG1 4.13Å; L192-I196 WeakPolarHBondContact O-CG1 3.47Å; L192-I196 PolarHBondContact O-N 3.35Å
193	N	85.9	Confident	89.5	Confident	38 Å²	38	34.4 Å²	34.4	20%	0.203	18%	0.179	C	C	.	.	H	α-helix	trans	-63	-37.7	-176.8	-73.7	-1.3	0	0	0	113	H191 R197 M315 S317	H191-N193 VanDerWaalsContact C-N 3.3Å; H191-N193 PolarHBondContact O-N 2.8Å; N193-R197 WeakPolarHBondContact O-CB 3.47Å; N193-R197 VanDerWaalsContact O-CG 3.22Å; N193-R197 WeakPolarHBondContact O-CG 3.39Å; N193-R197 PolarHBondContact O-N 3.5Å; N193-M315 PolarHBondContact ND2-O 3.15Å; N193-S317 VanDerWaalsContact ND2-CB 3.31Å; N193-S317 WeakPolarHBondContact ND2-CB 3.27Å
194	Q	89.2	Confident	89.5	Confident	73 Å²	73	37.7 Å²	37.7	34%	0.341	20%	0.196	S	C	.	.	H	α-helix	trans	-66.7	-46.3	175.4	-178.3	178	-1.9	0	0	110.6	H191 L192 I196 R197 Q198	H191-Q194 HydrophobicContact CB-CB 3.98Å; H191-Q194 PolarHBondContact O-N 2.86Å; H191-Q194 VanDerWaalsContact O-N 3.15Å; L192-Q194 VanDerWaalsContact C-N 3.32Å; L192-Q194 PolarHBondContact O-N 3.22Å; Q194-I196 VanDerWaalsContact C-N 3.35Å; Q194-I196 PolarHBondContact O-N 3.35Å; Q194-R197 WeakPolarHBondContact O-CB 2.88Å; Q194-R197 PolarHBondContact O-N 3.39Å; Q194-Q198 HydrophobicContact CG-CG 4.49Å; Q194-Q198 WeakPolarHBondContact O-CG 3.39Å; Q194-Q198 PolarHBondContact O-N 2.95Å
195	F	92.6	Very high	89.5	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-57.5	-46.1	176.9	176.1	-97.3	0	0	0	112.4	V120 V185 M187 H191 L192 Q198 C199 L217 V236	V120-F195 HydrophobicContact CG2-CD1 4.01Å; V120-F195 HydrophobicContact CG2-CE1 3.54Å; V185-F195 HydrophobicContact CB-CE2 4.39Å; V185-F195 HydrophobicContact CG1-CD2 3.75Å; V185-F195 HydrophobicContact CG1-CE2 3.93Å; V185-F195 WeakPolarHBondContact O-CE2 3.48Å; M187-F195 HydrophobicContact CB-CB 3.98Å; M187-F195 HydrophobicContact CB-CD2 3.51Å; M187-F195 HydrophobicContact CB-CE2 4.05Å; M187-F195 HydrophobicContact CB-CG 3.75Å; M187-F195 HydrophobicContact CG-CB 3.88Å; M187-F195 HydrophobicContact CG-CD2 4.35Å; M187-F195 HydrophobicContact CG-CG 4.13Å; M187-F195 VanDerWaalsContact N-CD2 3.32Å; M187-F195 HydrophobicContact SD-CB 4.37Å; M187-F195 HydrophobicContact SD-CG 4.49Å; H191-F195 PolarHBondContact O-N 2.76Å; L192-F195 WeakPolarHBondContact O-CB 3.04Å; L192-F195 PolarHBondContact O-N 2.93Å; F195-Q198 PolarHBondContact O-N 3.46Å; F195-C199 PolarHBondContact O-N 2.89Å; F195-C199 PolarHBondContact O-SG 3.33Å; F195-L217 HydrophobicContact CE1-CD1 4.02Å; F195-L217 HydrophobicContact CZ-CD1 3.72Å; F195-V236 HydrophobicContact CE1-CG1 4.15Å; F195-V236 HydrophobicContact CE2-CG1 4.49Å; F195-V236 HydrophobicContact CZ-CG1 3.86Å
196	I	93.6	Very high	89.7	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-44.7	177.7	-63	-68.6	0	0	0	110.6	V113 L116 I117 V120 L192 Q194 Q198 C199 L200	V113-I196 HydrophobicContact CG1-CG2 4.3Å; L116-I196 HydrophobicContact CB-CD1 3.48Å; L116-I196 VanDerWaalsContact CB-CD1 3.48Å; L116-I196 HydrophobicContact CB-CG2 4.35Å; L116-I196 HydrophobicContact CD1-CG2 4.45Å; I117-I196 HydrophobicContact CG1-CD1 3.86Å; I117-I196 HydrophobicContact CG1-CG1 3.84Å; I117-I196 HydrophobicContact CG1-CG2 4.47Å; V120-I196 HydrophobicContact CG2-CD1 4.07Å; L192-I196 HydrophobicContact CD1-CD1 4.06Å; L192-I196 HydrophobicContact CD1-CG1 3.83Å; L192-I196 HydrophobicContact CG-CG1 4.13Å; L192-I196 WeakPolarHBondContact O-CG1 3.47Å; L192-I196 PolarHBondContact O-N 3.35Å; Q194-I196 VanDerWaalsContact C-N 3.35Å; Q194-I196 PolarHBondContact O-N 3.35Å; I196-Q198 PolarHBondContact O-N 2.96Å; I196-C199 PolarHBondContact O-N 3.3Å; I196-L200 HydrophobicContact CG2-CD1 4.02Å; I196-L200 WeakPolarHBondContact O-CG 3.16Å; I196-L200 PolarHBondContact O-N 2.9Å
197	R	92.2	Very high	89.8	Confident	68 Å²	68	39.1 Å²	39.1	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-59.7	-45.3	176.5	-76.7	172.2	175.4	-176	-1	112	N193 Q194 L200 L201 Q313	N193-R197 WeakPolarHBondContact O-CB 3.47Å; N193-R197 VanDerWaalsContact O-CG 3.22Å; N193-R197 WeakPolarHBondContact O-CG 3.39Å; N193-R197 PolarHBondContact O-N 3.5Å; Q194-R197 WeakPolarHBondContact O-CB 2.88Å; Q194-R197 PolarHBondContact O-N 3.39Å; R197-L200 PolarHBondContact O-N 3.28Å; R197-L201 WeakPolarHBondContact O-CG 3.5Å; R197-L201 PolarHBondContact O-N 2.96Å; R197-Q313 PolarHBondContact NH2-O 3.08Å
198	Q	94.7	Very high	90.2	Very high	17 Å²	17	44.2 Å²	44.2	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-42.1	178.7	-71.5	171	-31.5	0	0	111.8	D170 V185 Q194 F195 I196 L200 L201 V202 F306	D170-Q198 PolarHBondContact O-NE2 3.24Å; V185-Q198 HydrophobicContact CG1-CB 3.54Å; V185-Q198 HydrophobicContact CG2-CB 4.26Å; Q194-Q198 HydrophobicContact CG-CG 4.49Å; Q194-Q198 WeakPolarHBondContact O-CG 3.39Å; Q194-Q198 PolarHBondContact O-N 2.95Å; F195-Q198 PolarHBondContact O-N 3.46Å; I196-Q198 PolarHBondContact O-N 2.96Å; Q198-L200 VanDerWaalsContact C-N 3.3Å; Q198-L200 PolarHBondContact O-N 2.81Å; Q198-L201 PolarHBondContact O-N 3.41Å; Q198-V202 PolarHBondContact O-N 2.97Å; Q198-F306 HydrophobicContact CB-CE1 3.84Å; Q198-F306 HydrophobicContact CB-CZ 3.9Å; Q198-F306 HydrophobicContact CG-CE1 3.64Å; Q198-F306 HydrophobicContact CG-CZ 4.18Å
199	C	96.9	Very high	91	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.2	-41.9	173	-70.3	0	0	0	0	111.9	L116 F195 I196 V202 S203 F240	L116-C199 HydrophobicContact CD1-CB 3.83Å; L116-C199 HydrophobicContact CD2-CB 4.43Å; F195-C199 PolarHBondContact O-N 2.89Å; F195-C199 PolarHBondContact O-SG 3.33Å; I196-C199 PolarHBondContact O-N 3.3Å; C199-V202 PolarHBondContact O-N 3.21Å; C199-S203 PolarHBondContact O-N 2.99Å; C199-S203 PolarHBondContact O-OG 3.25Å; C199-F240 HydrophobicContact CB-CE2 4.42Å; C199-F240 HydrophobicContact CB-CZ 3.98Å
200	L	96.1	Very high	92.4	Very high	24 Å²	24	44.3 Å²	44.3	13%	0.126	22%	0.219	C	C	.	.	H	α-helix	trans	-68.8	-35.8	177.6	-72.9	169.5	0	0	0	113	L111 V113 L116 I196 R197 Q198 V202 S203 N204	L111-L200 HydrophobicContact CB-CD2 4.44Å; V113-L200 HydrophobicContact CB-CD1 4.29Å; V113-L200 HydrophobicContact CG2-CD1 3.36Å; L116-L200 HydrophobicContact CD1-CD2 3.74Å; L116-L200 HydrophobicContact CD1-CG 3.75Å; I196-L200 HydrophobicContact CG2-CD1 4.02Å; I196-L200 WeakPolarHBondContact O-CG 3.16Å; I196-L200 PolarHBondContact O-N 2.9Å; R197-L200 PolarHBondContact O-N 3.28Å; Q198-L200 VanDerWaalsContact C-N 3.3Å; Q198-L200 PolarHBondContact O-N 2.81Å; L200-V202 VanDerWaalsContact C-N 3.29Å; L200-V202 PolarHBondContact O-N 3.25Å; L200-S203 WeakPolarHBondContact CA-OG 3.44Å; L200-S203 PolarHBondContact O-N 3.46Å; L200-S203 PolarHBondContact O-OG 3.41Å; L200-N204 WeakPolarHBondContact O-CB 3.37Å; L200-N204 PolarHBondContact O-N 3.39Å; L200-N204 PolarHBondContact O-ND2 3.45Å; L200-N204 PolarHBondContact O-OD1 3.25Å
201	L	95.1	Very high	93.8	Very high	38 Å²	38	37.6 Å²	37.6	20%	0.199	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-44.6	173.4	-78.1	171.2	0	0	0	111.2	R197 Q198 H205 F306 Y310	R197-L201 WeakPolarHBondContact O-CG 3.5Å; R197-L201 PolarHBondContact O-N 2.96Å; Q198-L201 PolarHBondContact O-N 3.41Å; L201-H205 WeakPolarHBondContact O-CB 3.44Å; L201-H205 PolarHBondContact O-N 3.44Å; L201-F306 HydrophobicContact CB-CD2 4.39Å; L201-F306 HydrophobicContact CB-CE2 3.71Å; L201-F306 HydrophobicContact CB-CZ 4.19Å; L201-F306 HydrophobicContact CD1-CD2 4.28Å; L201-F306 HydrophobicContact CD1-CE2 4.14Å; L201-F306 HydrophobicContact CD1-CZ 4.35Å; L201-Y310 HydrophobicContact CD2-CE2 4.11Å
202	V	97.8	Very high	94.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-49.8	176.6	177.6	0	0	0	0	110.9	L172 V183 V185 Q198 C199 L200 N204 H205 F206 F240 L302 F306	L172-V202 HydrophobicContact CD1-CG2 3.97Å; V183-V202 HydrophobicContact CG1-CG1 4.35Å; V183-V202 HydrophobicContact CG1-CG2 4.2Å; V185-V202 HydrophobicContact CG2-CG2 4.07Å; Q198-V202 PolarHBondContact O-N 2.97Å; C199-V202 PolarHBondContact O-N 3.21Å; L200-V202 VanDerWaalsContact C-N 3.29Å; L200-V202 PolarHBondContact O-N 3.25Å; V202-N204 PolarHBondContact O-N 3.19Å; V202-H205 WeakPolarHBondContact O-CB 3.42Å; V202-H205 PolarHBondContact O-N 3.33Å; V202-F206 HydrophobicContact CG1-CD2 4.16Å; V202-F206 HydrophobicContact CG1-CE2 3.44Å; V202-F206 VanDerWaalsContact CG1-CE2 3.44Å; V202-F206 HydrophobicContact CG1-CZ 3.83Å; V202-F206 WeakPolarHBondContact O-CD2 3.34Å; V202-F206 PolarHBondContact O-N 3.11Å; V202-F240 HydrophobicContact CB-CD2 4.34Å; V202-F240 HydrophobicContact CB-CE2 4.23Å; V202-F240 HydrophobicContact CB-CZ 4.35Å; V202-F240 HydrophobicContact CG1-CB 4.05Å; V202-F240 HydrophobicContact CG1-CD1 3.9Å; V202-F240 HydrophobicContact CG1-CD2 3.78Å; V202-F240 HydrophobicContact CG1-CE1 4.26Å; V202-F240 HydrophobicContact CG1-CE2 4.15Å; V202-F240 HydrophobicContact CG1-CG 3.65Å; V202-F240 HydrophobicContact CG1-CZ 4.38Å; V202-L302 HydrophobicContact CB-CD2 4.48Å; V202-L302 HydrophobicContact CG1-CD1 4.41Å; V202-L302 HydrophobicContact CG2-CD2 4.32Å; V202-F306 HydrophobicContact CG2-CE2 3.9Å; V202-F306 HydrophobicContact CG2-CZ 3.95Å
203	S	97.1	Very high	94.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-67.2	-38.7	-177.4	69.7	0	0	0	0	113.4	C199 L200 H205 F206 V207	C199-S203 PolarHBondContact O-N 2.99Å; C199-S203 PolarHBondContact O-OG 3.25Å; L200-S203 WeakPolarHBondContact CA-OG 3.44Å; L200-S203 PolarHBondContact O-N 3.46Å; L200-S203 PolarHBondContact O-OG 3.41Å; S203-H205 VanDerWaalsContact C-N 3.32Å; S203-F206 PolarHBondContact O-N 3.39Å; S203-V207 VanDerWaalsContact O-CG2 3.3Å; S203-V207 WeakPolarHBondContact O-CG2 3.46Å; S203-V207 PolarHBondContact O-N 3.36Å
204	N	96.1	Very high	95.3	Very high	70 Å²	70	29.9 Å²	29.9	37%	0.374	15%	0.15	S	C	.	.	H	α-helix	trans	-66	-38.5	178.8	-71.4	-7.6	0	0	0	110.9	L200 V202 F206 V207 E208	L200-N204 WeakPolarHBondContact O-CB 3.37Å; L200-N204 PolarHBondContact O-N 3.39Å; L200-N204 PolarHBondContact O-ND2 3.45Å; L200-N204 PolarHBondContact O-OD1 3.25Å; V202-N204 PolarHBondContact O-N 3.19Å; N204-F206 VanDerWaalsContact C-N 3.32Å; N204-F206 PolarHBondContact O-N 3.33Å; N204-V207 PolarHBondContact O-N 2.82Å; N204-E208 WeakPolarHBondContact O-CB 3.48Å; N204-E208 WeakPolarHBondContact O-CG 3.31Å; N204-E208 PolarHBondContact O-N 3.2Å
205	H	96.8	Very high	95.7	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-55.5	-48.8	171.7	174.9	64.8	0	0	0	111.4	L201 V202 S203 V207 E208 T209 E301 L302 R305	L201-H205 WeakPolarHBondContact O-CB 3.44Å; L201-H205 PolarHBondContact O-N 3.44Å; V202-H205 WeakPolarHBondContact O-CB 3.42Å; V202-H205 PolarHBondContact O-N 3.33Å; S203-H205 VanDerWaalsContact C-N 3.32Å; H205-V207 PolarHBondContact O-N 3.14Å; H205-E208 PolarHBondContact O-N 2.88Å; H205-T209 WeakPolarHBondContact O-CG2 3.41Å; H205-T209 PolarHBondContact O-N 3.18Å; H205-T209 PolarHBondContact O-OG1 2.95Å; H205-E301 IonicContact CE1-OE2 3.55Å; H205-E301 PolarHBondContact CE1-OE2 3.38Å; H205-E301 IonicContact NE2-OE2 3.75Å; H205-L302 HydrophobicContact CB-CD2 3.63Å; H205-R305 VanDerWaalsContact ND1-CZ 3.31Å; H205-R305 PolarHBondContact ND1-NE 3.4Å; H205-R305 PolarHBondContact ND1-NH2 2.94Å
206	F	97.7	Very high	95.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.2	-37.5	177.4	-63.6	-31.9	0	0	0	113.9	V202 S203 N204 N210 Q211 F213 F240 P242 I298 L302	V202-F206 HydrophobicContact CG1-CD2 4.16Å; V202-F206 HydrophobicContact CG1-CE2 3.44Å; V202-F206 VanDerWaalsContact CG1-CE2 3.44Å; V202-F206 HydrophobicContact CG1-CZ 3.83Å; V202-F206 WeakPolarHBondContact O-CD2 3.34Å; V202-F206 PolarHBondContact O-N 3.11Å; S203-F206 PolarHBondContact O-N 3.39Å; N204-F206 VanDerWaalsContact C-N 3.32Å; N204-F206 PolarHBondContact O-N 3.33Å; F206-N210 CarbonylContact O-C 3.55Å; F206-N210 WeakPolarHBondContact O-CA 3.41Å; F206-N210 PolarHBondContact O-N 2.79Å; F206-Q211 HydrophobicContact CB-CB 4.24Å; F206-Q211 WeakPolarHBondContact CB-O 3.41Å; F206-Q211 HydrophobicContact CD1-CB 4.02Å; F206-Q211 HydrophobicContact CD1-CG 3.73Å; F206-Q211 HydrophobicContact CE1-CG 4.27Å; F206-Q211 HydrophobicContact CG-CB 4.49Å; F206-Q211 HydrophobicContact CG-CG 4.39Å; F206-Q211 PolarHBondContact O-N 3.12Å; F206-F213 HydrophobicContact CB-CD1 3.54Å; F206-F213 HydrophobicContact CB-CE1 3.84Å; F206-F213 HydrophobicContact CB-CG 4.33Å; F206-F213 HydrophobicContact CD2-CB 3.76Å; F206-F213 AromaticContact CD2-CD1 3.58Å; F206-F213 HydrophobicContact CD2-CD1 3.58Å; F206-F213 HydrophobicContact CD2-CD2 4.01Å; F206-F213 HydrophobicContact CD2-CE1 4.13Å; F206-F213 AromaticContact CD2-CG 3.51Å; F206-F213 HydrophobicContact CD2-CG 3.51Å; F206-F213 HydrophobicContact CE2-CB 4.09Å; F206-F213 HydrophobicContact CE2-CD2 4.48Å; F206-F213 HydrophobicContact CE2-CG 4.17Å; F206-F213 HydrophobicContact CG-CB 4.37Å; F206-F213 AromaticContact CG-CD1 3.91Å; F206-F213 HydrophobicContact CG-CD1 3.91Å; F206-F213 HydrophobicContact CG-CE1 4.48Å; F206-F213 HydrophobicContact CG-CG 4.22Å; F206-F240 HydrophobicContact CE2-CB 3.86Å; F206-F240 HydrophobicContact CE2-CD1 4.16Å; F206-F240 HydrophobicContact CE2-CG 4.3Å; F206-F240 HydrophobicContact CZ-CB 4.49Å; F206-P242 HydrophobicContact CE1-CB 3.95Å; F206-P242 HydrophobicContact CE1-CG 4.49Å; F206-P242 HydrophobicContact CZ-CB 4.03Å; F206-P242 HydrophobicContact CZ-CG 4.32Å; F206-I298 HydrophobicContact CE1-CG2 3.66Å; F206-I298 HydrophobicContact CZ-CG2 4.37Å; F206-L302 HydrophobicContact CZ-CD1 4.46Å
207	V	95.9	Very high	95.7	Very high	30 Å²	30	27.1 Å²	27.1	18%	0.182	14%	0.138	C	C	.	.	H	α-helix	trans	-65.3	-46	176.2	171.6	0	0	0	0	110.7	V43 M110 S203 N204 H205 N210	V43-V207 HydrophobicContact CG1-CG2 4.06Å; M110-V207 HydrophobicContact SD-CG1 4Å; M110-V207 HydrophobicContact SD-CG2 4.3Å; S203-V207 VanDerWaalsContact O-CG2 3.3Å; S203-V207 WeakPolarHBondContact O-CG2 3.46Å; S203-V207 PolarHBondContact O-N 3.36Å; N204-V207 PolarHBondContact O-N 2.82Å; H205-V207 PolarHBondContact O-N 3.14Å; V207-N210 PolarHBondContact O-N 3.48Å
208	E	95.6	Very high	95.6	Very high	125 Å²	125	24.2 Å²	24.2	58%	0.584	13%	0.129	S	C	*	.	H	α-helix	trans	-66	-37.4	-179.2	-72.3	163.5	-158.2	0	0	112.6	N204 H205 N210 R305	N204-E208 WeakPolarHBondContact O-CB 3.48Å; N204-E208 WeakPolarHBondContact O-CG 3.31Å; N204-E208 PolarHBondContact O-N 3.2Å; H205-E208 PolarHBondContact O-N 2.88Å; E208-N210 VanDerWaalsContact C-N 3.28Å; E208-R305 IonicContact OE1-NH1 2.78Å; E208-R305 IonicContact OE2-CZ 3.52Å; E208-R305 IonicContact OE2-NH1 3.41Å; E208-R305 PolarHBondContact OE2-NH1 3.15Å; E208-R305 IonicContact OE2-NH2 3.15Å; E208-R305 PolarHBondContact OE2-NH2 3.47Å
209	T	95.9	Very high	95.3	Very high	65 Å²	65	24.9 Å²	24.9	40%	0.399	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.8	176.2	60.1	0	0	0	0	113.2	H205 Q211	H205-T209 WeakPolarHBondContact O-CG2 3.41Å; H205-T209 PolarHBondContact O-N 3.18Å; H205-T209 PolarHBondContact O-OG1 2.95Å; T209-Q211 PolarHBondContact O-N 2.91Å; T209-Q211 WeakPolarHBondContact OG1-CB 3.25Å
210	N	95.9	Very high	94.7	Very high	67 Å²	67	25 Å²	25	36%	0.358	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.4	33.9	-175.2	-166.6	54.8	0	0	0	113.2	S42 V43 F206 V207 E208 P212	S42-N210 VanDerWaalsContact CA-OD1 3.25Å; S42-N210 WeakPolarHBondContact CA-OD1 3.39Å; S42-N210 WeakPolarHBondContact CB-OD1 3.41Å; S42-N210 PolarHBondContact OG-OD1 3.22Å; V43-N210 PolarHBondContact N-OD1 3.25Å; F206-N210 CarbonylContact O-C 3.55Å; F206-N210 WeakPolarHBondContact O-CA 3.41Å; F206-N210 PolarHBondContact O-N 2.79Å; V207-N210 PolarHBondContact O-N 3.48Å; E208-N210 VanDerWaalsContact C-N 3.28Å; N210-P212 WeakPolarHBondContact O-CD 3.3Å
211	Q	96.8	Very high	94.2	Very high	30 Å²	30	24.9 Å²	24.9	14%	0.14	13%	0.133	C	C	.	.			trans	-86.3	112.4	-179.4	176.2	51.8	65.7	0	0	110.1	F206 T209 P242 R243 I298	F206-Q211 HydrophobicContact CB-CB 4.24Å; F206-Q211 WeakPolarHBondContact CB-O 3.41Å; F206-Q211 HydrophobicContact CD1-CB 4.02Å; F206-Q211 HydrophobicContact CD1-CG 3.73Å; F206-Q211 HydrophobicContact CE1-CG 4.27Å; F206-Q211 HydrophobicContact CG-CB 4.49Å; F206-Q211 HydrophobicContact CG-CG 4.39Å; F206-Q211 PolarHBondContact O-N 3.12Å; T209-Q211 PolarHBondContact O-N 2.91Å; T209-Q211 WeakPolarHBondContact OG1-CB 3.25Å; Q211-P242 HydrophobicContact CG-CB 3.97Å; Q211-R243 VanDerWaalsContact NE2-N 3.2Å; Q211-R243 PolarHBondContact NE2-O 3.44Å; Q211-I298 HydrophobicContact CG-CD1 3.9Å
212	P	95.7	Very high	93.7	Very high	9 Å²	9	25.6 Å²	25.6	6%	0.058	14%	0.136	C	C	.	.			trans	-62.7	144.8	177.2	-20.6	33.5	0	0	0	111	V43 L139 A140 N210 P242 R243 A245	V43-P212 HydrophobicContact CG2-CB 4.45Å; V43-P212 HydrophobicContact CG2-CG 4.23Å; L139-P212 HydrophobicContact CB-CB 3.84Å; L139-P212 HydrophobicContact CB-CG 3.57Å; L139-P212 HydrophobicContact CD1-CG 4.18Å; A140-P212 HydrophobicContact CB-CB 3.94Å; N210-P212 WeakPolarHBondContact O-CD 3.3Å; P212-P242 WeakPolarHBondContact O-CA 3.35Å; P212-R243 PolarHBondContact O-N 3.44Å; P212-A245 HydrophobicContact CG-CB 4Å
213	F	96.1	Very high	93.1	Very high	3 Å²	3	26 Å²	26	1%	0.013	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	152.5	179.2	69.9	-82.9	0	0	0	113.2	V43 L111 F135 S137 A140 F206 F240 F241	V43-F213 HydrophobicContact CG1-CD1 4.44Å; V43-F213 HydrophobicContact CG1-CE1 4.12Å; L111-F213 HydrophobicContact CD1-CE2 4.04Å; L111-F213 HydrophobicContact CD1-CZ 4.27Å; F135-F213 AromaticContact CD1-CE2 3.93Å; F135-F213 HydrophobicContact CD1-CE2 3.93Å; F135-F213 HydrophobicContact CD1-CZ 4.39Å; F135-F213 AromaticContact CE1-CE2 3.81Å; F135-F213 HydrophobicContact CE1-CE2 3.81Å; F135-F213 AromaticContact CE1-CZ 3.79Å; F135-F213 HydrophobicContact CE1-CZ 3.79Å; S137-F213 VanDerWaalsContact CB-O 3.23Å; S137-F213 WeakPolarHBondContact CB-O 3.46Å; S137-F213 PolarHBondContact N-O 3.31Å; S137-F213 PolarHBondContact OG-N 3.33Å; S137-F213 PolarHBondContact OG-O 2.87Å; S137-F213 VanDerWaalsContact OG-O 3.06Å; A140-F213 WeakPolarHBondContact CB-O 3.42Å; F206-F213 HydrophobicContact CB-CD1 3.54Å; F206-F213 HydrophobicContact CB-CE1 3.84Å; F206-F213 HydrophobicContact CB-CG 4.33Å; F206-F213 HydrophobicContact CD2-CB 3.76Å; F206-F213 AromaticContact CD2-CD1 3.58Å; F206-F213 HydrophobicContact CD2-CD1 3.58Å; F206-F213 HydrophobicContact CD2-CD2 4.01Å; F206-F213 HydrophobicContact CD2-CE1 4.13Å; F206-F213 AromaticContact CD2-CG 3.51Å; F206-F213 HydrophobicContact CD2-CG 3.51Å; F206-F213 HydrophobicContact CE2-CB 4.09Å; F206-F213 HydrophobicContact CE2-CD2 4.48Å; F206-F213 HydrophobicContact CE2-CG 4.17Å; F206-F213 HydrophobicContact CG-CB 4.37Å; F206-F213 AromaticContact CG-CD1 3.91Å; F206-F213 HydrophobicContact CG-CD1 3.91Å; F206-F213 HydrophobicContact CG-CE1 4.48Å; F206-F213 HydrophobicContact CG-CG 4.22Å; F213-F240 AromaticContact CD2-CD1 3.87Å; F213-F240 HydrophobicContact CD2-CD1 3.87Å; F213-F240 AromaticContact CE2-CD1 3.94Å; F213-F240 HydrophobicContact CE2-CD1 3.94Å; F213-F240 HydrophobicContact CE2-CE1 4.13Å; F213-F241 VanDerWaalsContact CA-O 3.23Å; F213-F241 WeakPolarHBondContact CA-O 3.47Å
214	N	94.7	Very high	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	152.6	163	-57.4	102.1	0	0	0	109	F135 N136 A140 F240 F241 R243 A259	F135-N214 CarbonylContact O-C 3.58Å; F135-N214 WeakPolarHBondContact O-CA 3.14Å; N136-N214 PolarHBondContact OD1-ND2 2.87Å; A140-N214 PolarHBondContact O-ND2 3.42Å; N214-F240 CarbonylContact O-C 3.14Å; N214-F240 WeakPolarHBondContact O-CA 3.45Å; N214-F241 HydrophobicContact CB-CB 4.45Å; N214-F241 HydrophobicContact CB-CD2 4.47Å; N214-F241 PolarHBondContact N-O 2.98Å; N214-F241 PolarHBondContact O-N 3.15Å; N214-R243 WeakPolarHBondContact OD1-CG 3.36Å; N214-R243 PolarHBondContact OD1-NH1 3.14Å; N214-A259 HydrophobicContact CB-CB 4.03Å; N214-A259 PolarHBondContact ND2-N 3.1Å
215	M	95.6	Very high	90	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.2	172.1	-178.1	-164.7	79.3	0	0	110	L111 L116 G134 F135 F149 L217 S238 Y239 F240	L111-M215 HydrophobicContact CD1-CE 4.36Å; L111-M215 HydrophobicContact CD1-SD 3.64Å; L111-M215 HydrophobicContact CD2-CE 4.1Å; L111-M215 HydrophobicContact CD2-SD 4.45Å; L116-M215 HydrophobicContact CD2-CE 4.09Å; L116-M215 HydrophobicContact CD2-SD 4.2Å; G134-M215 CarbonylContact C-O 3.57Å; G134-M215 WeakPolarHBondContact CA-O 3.22Å; F135-M215 HydrophobicContact CB-CB 4.17Å; F135-M215 HydrophobicContact CB-CE 4.02Å; F135-M215 PolarHBondContact N-O 2.88Å; F135-M215 PolarHBondContact O-N 2.82Å; F149-M215 HydrophobicContact CD1-CE 4.24Å; F149-M215 HydrophobicContact CE1-CE 3.73Å; M215-L217 HydrophobicContact CE-CB 4.28Å; M215-S238 WeakPolarHBondContact CG-OG 3.24Å; M215-S238 PolarHBondContact SD-OG 2.8Å; M215-Y239 CarbonylContact C-O 3.45Å; M215-Y239 WeakPolarHBondContact CA-O 3.2Å; M215-F240 HydrophobicContact CB-CD1 3.96Å; M215-F240 HydrophobicContact CB-CE1 4.12Å; M215-F240 HydrophobicContact CG-CD1 3.91Å; M215-F240 HydrophobicContact CG-CD2 4.48Å; M215-F240 HydrophobicContact CG-CE1 3.77Å; M215-F240 HydrophobicContact CG-CE2 4.36Å; M215-F240 HydrophobicContact CG-CG 4.26Å; M215-F240 HydrophobicContact CG-CZ 4.01Å; M215-F240 HydrophobicContact SD-CD1 4.28Å; M215-F240 HydrophobicContact SD-CE1 3.53Å; M215-F240 VanDerWaalsContact SD-CE1 3.53Å; M215-F240 HydrophobicContact SD-CE2 4.3Å; M215-F240 HydrophobicContact SD-CZ 3.54Å; M215-F240 VanDerWaalsContact SD-CZ 3.54Å
216	I	93.9	Very high	88	Confident	22 Å²	22	35.4 Å²	35.4	11%	0.113	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	118.9	169.7	-60.2	174.2	0	0	0	107.8	A132 L133 L160 S238 Y239 F241 A259 L261	A132-I216 HydrophobicContact CB-CG2 4.04Å; L133-I216 CarbonylContact O-C 3.59Å; L133-I216 WeakPolarHBondContact O-CA 3.47Å; L160-I216 HydrophobicContact CD2-CD1 4.31Å; I216-S238 CarbonylContact O-C 3.6Å; I216-S238 WeakPolarHBondContact O-CA 3.47Å; I216-Y239 PolarHBondContact N-O 3.21Å; I216-Y239 PolarHBondContact O-N 3.31Å; I216-F241 HydrophobicContact CB-CE2 4.22Å; I216-F241 HydrophobicContact CD1-CE2 3.7Å; I216-F241 HydrophobicContact CD1-CZ 4.18Å; I216-F241 HydrophobicContact CG1-CE2 3.84Å; I216-A259 WeakPolarHBondContact CD1-O 3.34Å; I216-A259 HydrophobicContact CG1-CB 4.39Å; I216-A259 WeakPolarHBondContact CG1-O 3.41Å; I216-L261 HydrophobicContact CD1-CD1 3.82Å; I216-L261 HydrophobicContact CD1-CG 4.24Å
217	L	93.4	Very high	85.7	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.7	173.1	-179.2	68.6	0	0	0	108.8	A119 V120 L123 A132 L133 F195 M215 V236	A119-L217 HydrophobicContact CB-CD2 3.76Å; V120-L217 HydrophobicContact CG2-CD1 4.26Å; V120-L217 HydrophobicContact CG2-CD2 3.8Å; L123-L217 HydrophobicContact CD2-CG 4.01Å; A132-L217 CarbonylContact C-O 3.52Å; A132-L217 WeakPolarHBondContact CA-O 3.3Å; A132-L217 WeakPolarHBondContact CB-O 3.02Å; L133-L217 HydrophobicContact CB-CB 4.31Å; L133-L217 HydrophobicContact CD1-CD2 4.38Å; L133-L217 PolarHBondContact N-O 3.36Å; L133-L217 PolarHBondContact O-N 2.77Å; F195-L217 HydrophobicContact CE1-CD1 4.02Å; F195-L217 HydrophobicContact CZ-CD1 3.72Å; M215-L217 HydrophobicContact CE-CB 4.28Å; L217-V236 HydrophobicContact CD1-CG1 3.57Å; L217-V236 HydrophobicContact CG-CG1 4.37Å
218	G	90.9	Very high	83.4	Confident	7 Å²	7	44.2 Å²	44.2	7%	0.072	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	-168.3	-175.1	0	0	0	0	0	112.6	V236 T237	G218-V236 WeakPolarHBondContact O-CA 3.39Å; G218-T237 PolarHBondContact N-O 2.84Å; G218-T237 PolarHBondContact O-N 2.85Å
219	R	86.8	Confident	81.2	Confident	31 Å²	31	44.8 Å²	44.8	12%	0.117	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.1	176	-71.8	-175.5	175.9	-76.3	3.4	110.8	L123 S126 L234 L235	L123-R219 HydrophobicContact CD2-CG 4.45Å; S126-R219 VanDerWaalsContact O-CZ 3.29Å; S126-R219 PolarHBondContact O-NE 3.28Å; S126-R219 VanDerWaalsContact O-NE 3.13Å; S126-R219 PolarHBondContact O-NH2 3.27Å; R219-L234 HydrophobicContact CB-CB 4.21Å; R219-L234 PolarHBondContact NH1-O 2.81Å; R219-L235 VanDerWaalsContact CA-O 3.26Å; R219-L235 WeakPolarHBondContact CA-O 3.46Å
220	S	85.7	Confident	79.1	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	161	172.8	61.1	0	0	0	0	111.9	Q186 L235 T237 Y239	Q186-S220 PolarHBondContact NE2-OG 3.41Å; S220-L235 PolarHBondContact N-O 2.75Å; S220-L235 PolarHBondContact O-N 3.29Å; S220-T237 WeakPolarHBondContact OG-CB 3.39Å; S220-T237 PolarHBondContact OG-OG1 2.78Å; S220-Y239 WeakPolarHBondContact CB-OH 3.21Å; S220-Y239 PolarHBondContact OG-OH 2.86Å
221	S	84.1	Confident	77.1	Confident	23 Å²	23	45.2 Å²	45.2	16%	0.161	27%	0.268	C	S	.	.			trans	-59.1	161.2	166.3	38.3	0	0	0	0	110.7	G161 Q186 L223	G161-S221 PolarHBondContact O-OG 3.08Å; Q186-S221 PolarHBondContact NE2-O 2.99Å; S221-L223 PolarHBondContact O-N 3.42Å; S221-L223 VanDerWaalsContact O-N 3.16Å
222	L	85.7	Confident	75.2	Confident	52 Å²	52	53.3 Å²	53.3	27%	0.272	30%	0.303	S	S	.	.			trans	-50.3	122.4	171.9	-176.8	65.4	0	0	0	110.5	T188 K224 L235	T188-L222 HydrophobicContact CG2-CD1 4.46Å; L222-K224 HydrophobicContact CD2-CD 4.48Å; L222-K224 HydrophobicContact CD2-CG 4.15Å; L222-K224 HydrophobicContact CG-CG 4.1Å; L222-K224 PolarHBondContact O-N 2.7Å; L222-L235 HydrophobicContact CB-CD1 4.46Å; L222-L235 HydrophobicContact CD1-CD1 3.88Å
223	L	85.1	Confident	73.8	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.042	31%	0.312	C	S	.	.			trans	-71.4	113.6	175.5	-63	-179.8	0	0	0	108	A165 Y173 A184 Q186 S221 T237	A165-L223 HydrophobicContact CB-CB 4.03Å; A165-L223 HydrophobicContact CB-CD1 4.43Å; A165-L223 HydrophobicContact CB-CD2 4.1Å; A165-L223 HydrophobicContact CB-CG 4.41Å; Y173-L223 HydrophobicContact CD1-CB 3.85Å; Y173-L223 HydrophobicContact CD1-CD1 4.38Å; Y173-L223 HydrophobicContact CD2-CD1 3.9Å; Y173-L223 HydrophobicContact CE1-CB 3.93Å; Y173-L223 WeakPolarHBondContact CE1-O 3.17Å; Y173-L223 HydrophobicContact CG-CB 4.15Å; Y173-L223 HydrophobicContact CG-CD1 3.83Å; A184-L223 HydrophobicContact CB-CD1 3.78Å; Q186-L223 HydrophobicContact CB-CD1 4.35Å; S221-L223 PolarHBondContact O-N 3.42Å; S221-L223 VanDerWaalsContact O-N 3.16Å; L223-T237 HydrophobicContact CD1-CG2 3.98Å
224	K	70.3	Confident	72.8	Confident	66 Å²	66	57.4 Å²	57.4	29%	0.287	33%	0.327	S	S	.	.			trans	-121.6	146	176.8	-67.2	-173	-171.6	172.1	0	110.4	L222 D226 E228 T229	L222-K224 HydrophobicContact CD2-CD 4.48Å; L222-K224 HydrophobicContact CD2-CG 4.15Å; L222-K224 HydrophobicContact CG-CG 4.1Å; L222-K224 PolarHBondContact O-N 2.7Å; K224-D226 PolarHBondContact O-N 3.32Å; K224-E228 WeakPolarHBondContact CD-O 3.4Å; K224-E228 PolarHBondContact NZ-O 3.03Å; K224-T229 PolarHBondContact NZ-O 3.39Å
225	P	58.5	Low	72.4	Confident	75 Å²	75	59 Å²	59	49%	0.487	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-28.9	174.5	21.7	-29.3	0	0	0	113.3	A165	A165-P225 WeakPolarHBondContact O-CA 3.5Å
226	D	53.3	Low	72.1	Confident	130 Å²	130	59 Å²	59	70%	0.695	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	16.3	-163.3	-54.3	-39.5	0	0	0	115.3	K224 E228	K224-D226 PolarHBondContact O-N 3.32Å; D226-E228 PolarHBondContact O-N 3.47Å
227	G	49.9	Very low	72.1	Confident	74 Å²	74	58 Å²	58	76%	0.763	33%	0.33	S	S	*	.			trans	62.1	4.4	176.1	0	0	0	0	0	115.8	T229	G227-T229 PolarHBondContact O-N 3.27Å
228	E	48.4	Very low	72.2	Confident	141 Å²	141	58 Å²	58	66%	0.659	33%	0.33	S	S	*	.			trans	-65.2	128.3	-178.7	-76.1	-162.3	156.7	0	0	112	K224 D226 A230	K224-E228 WeakPolarHBondContact CD-O 3.4Å; K224-E228 PolarHBondContact NZ-O 3.03Å; D226-E228 PolarHBondContact O-N 3.47Å; E228-A230 PolarHBondContact O-N 2.8Å
229	T	49	Very low	72.4	Confident	137 Å²	137	58 Å²	58	84%	0.84	33%	0.328	S	S	*	.			trans	-30.2	123.9	-172.1	45	0	0	0	0	115.2	K224 G227	K224-T229 PolarHBondContact NZ-O 3.39Å; G227-T229 PolarHBondContact O-N 3.27Å
230	A	51.6	Low	72.9	Confident	51 Å²	51	56.5 Å²	56.5	42%	0.421	32%	0.322	S	S	.	.			trans	-65	134.6	-167	0	0	0	0	0	112.1	E228 K232	E228-A230 PolarHBondContact O-N 2.8Å; A230-K232 PolarHBondContact O-N 3.12Å
231	D	52.9	Low	73.3	Confident	90 Å²	90	56.4 Å²	56.4	48%	0.481	32%	0.322	S	S	.	.			trans	-50.2	117.5	143.7	178.8	3.9	0	0	0	106.5	S233	D231-S233 PolarHBondContact O-N 2.8Å; D231-S233 WeakPolarHBondContact OD1-CB 3.21Å; D231-S233 PolarHBondContact OD1-N 2.9Å; D231-S233 PolarHBondContact OD1-OG 2.82Å; D231-S233 WeakPolarHBondContact OD2-CB 3.41Å; D231-S233 PolarHBondContact OD2-OG 2.79Å
232	K	56.7	Low	73.9	Confident	199 Å²	199	55.4 Å²	55.4	87%	0.865	32%	0.315	S	S	*	.			trans	-68.5	-0.2	-179.9	-67.2	-175.4	-179.8	179.1	0	111.7	A230 L234	A230-K232 PolarHBondContact O-N 3.12Å; K232-L234 PolarHBondContact O-N 2.78Å; K232-L234 VanDerWaalsContact O-N 3.13Å
233	S	66.4	Low	74.2	Confident	38 Å²	38	53 Å²	53	27%	0.266	30%	0.302	S	S	.	.			trans	-59.2	115.8	170.1	75.1	0	0	0	0	110	D231 L235	D231-S233 PolarHBondContact O-N 2.8Å; D231-S233 WeakPolarHBondContact OD1-CB 3.21Å; D231-S233 PolarHBondContact OD1-N 2.9Å; D231-S233 PolarHBondContact OD1-OG 2.82Å; D231-S233 WeakPolarHBondContact OD2-CB 3.41Å; D231-S233 PolarHBondContact OD2-OG 2.79Å; S233-L235 PolarHBondContact O-N 2.77Å; S233-L235 VanDerWaalsContact O-N 3.13Å
234	L	74.9	Confident	74.5	Confident	60 Å²	60	56.2 Å²	56.2	31%	0.314	32%	0.317	S	S	.	.			trans	-80.9	89.7	174.3	-73.4	179.1	0	0	0	108.6	R129 R219 K232	R129-L234 HydrophobicContact CB-CD1 4.08Å; R129-L234 HydrophobicContact CG-CD1 4.31Å; R129-L234 HydrophobicContact CG-CD2 4.37Å; R219-L234 HydrophobicContact CB-CB 4.21Å; R219-L234 PolarHBondContact NH1-O 2.81Å; K232-L234 PolarHBondContact O-N 2.78Å; K232-L234 VanDerWaalsContact O-N 3.13Å
235	L	86.7	Confident	75.4	Confident	33 Å²	33	56.2 Å²	56.2	17%	0.173	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	155.7	-179.1	-58.7	-179.6	0	0	0	110.9	Q186 T188 R219 S220 L222 S233	Q186-L235 HydrophobicContact CG-CB 3.93Å; Q186-L235 HydrophobicContact CG-CD1 3.98Å; T188-L235 HydrophobicContact CG2-CD1 4.46Å; R219-L235 VanDerWaalsContact CA-O 3.26Å; R219-L235 WeakPolarHBondContact CA-O 3.46Å; S220-L235 PolarHBondContact N-O 2.75Å; S220-L235 PolarHBondContact O-N 3.29Å; L222-L235 HydrophobicContact CB-CD1 4.46Å; L222-L235 HydrophobicContact CD1-CD1 3.88Å; S233-L235 PolarHBondContact O-N 2.77Å; S233-L235 VanDerWaalsContact O-N 3.13Å
236	V	90.2	Very high	76.3	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	125.7	171.7	174.4	0	0	0	0	108.3	V120 L123 L124 M187 F195 L217 G218	V120-V236 HydrophobicContact CG1-CG1 4.29Å; V120-V236 HydrophobicContact CG2-CG1 4.46Å; L123-V236 HydrophobicContact CD2-CB 4.45Å; L123-V236 HydrophobicContact CD2-CG1 3.88Å; L123-V236 HydrophobicContact CD2-CG2 4.05Å; L124-V236 HydrophobicContact CD2-CG2 3.54Å; L124-V236 HydrophobicContact CG-CG2 4.15Å; M187-V236 HydrophobicContact CB-CB 4.16Å; M187-V236 WeakPolarHBondContact CB-O 3.47Å; M187-V236 HydrophobicContact CE-CB 3.98Å; M187-V236 HydrophobicContact CE-CG2 3.86Å; M187-V236 PolarHBondContact N-O 2.84Å; F195-V236 HydrophobicContact CE1-CG1 4.15Å; F195-V236 HydrophobicContact CE2-CG1 4.49Å; F195-V236 HydrophobicContact CZ-CG1 3.86Å; L217-V236 HydrophobicContact CD1-CG1 3.57Å; L217-V236 HydrophobicContact CG-CG1 4.37Å; G218-V236 WeakPolarHBondContact O-CA 3.39Å
237	T	93.2	Very high	77.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.8	-177.5	-50.5	0	0	0	0	109.6	A184 V185 Q186 G218 S220 L223 Y239	A184-T237 HydrophobicContact CB-CG2 4.38Å; V185-T237 CarbonylContact O-C 3.54Å; V185-T237 WeakPolarHBondContact O-CA 3.5Å; V185-T237 WeakPolarHBondContact O-CG2 3.45Å; Q186-T237 HydrophobicContact CB-CG2 4.18Å; Q186-T237 WeakPolarHBondContact CG-OG1 3.42Å; Q186-T237 PolarHBondContact NE2-OG1 3.18Å; G218-T237 PolarHBondContact N-O 2.84Å; G218-T237 PolarHBondContact O-N 2.85Å; S220-T237 WeakPolarHBondContact OG-CB 3.39Å; S220-T237 PolarHBondContact OG-OG1 2.78Å; L223-T237 HydrophobicContact CD1-CG2 3.98Å; T237-Y239 HydrophobicContact CG2-CD2 4.16Å; T237-Y239 HydrophobicContact CG2-CE1 4Å; T237-Y239 HydrophobicContact CG2-CE2 3.55Å; T237-Y239 VanDerWaalsContact CG2-CZ 3.45Å
238	S	95.5	Very high	77.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.4	171.9	-170.8	0	0	0	0	109.1	A184 V185 M215 I216 F240	A184-S238 CarbonylContact C-O 3.48Å; A184-S238 WeakPolarHBondContact CA-O 3.45Å; V185-S238 PolarHBondContact N-O 2.82Å; V185-S238 PolarHBondContact O-N 2.8Å; M215-S238 WeakPolarHBondContact CG-OG 3.24Å; M215-S238 PolarHBondContact SD-OG 2.8Å; I216-S238 CarbonylContact O-C 3.6Å; I216-S238 WeakPolarHBondContact O-CA 3.47Å; S238-F240 WeakPolarHBondContact OG-CE2 3.26Å
239	Y	95.6	Very high	78.4	Confident	6 Å²	6	43.5 Å²	43.5	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.6	174.4	-59.8	-89.8	0	0	0	108.9	L160 G161 L175 A184 M215 I216 S220 T237 F241	L160-Y239 HydrophobicContact CD1-CD1 3.81Å; L160-Y239 HydrophobicContact CD1-CE1 3.93Å; L160-Y239 HydrophobicContact CD1-CG 4.26Å; L160-Y239 HydrophobicContact CD2-CD1 4.23Å; L160-Y239 HydrophobicContact CD2-CD2 3.79Å; L160-Y239 HydrophobicContact CD2-CE2 4.13Å; L160-Y239 HydrophobicContact CD2-CG 3.84Å; L160-Y239 HydrophobicContact CG-CD1 4.07Å; L160-Y239 HydrophobicContact CG-CD2 4.23Å; L160-Y239 HydrophobicContact CG-CE1 4.01Å; L160-Y239 HydrophobicContact CG-CE2 4.17Å; L160-Y239 HydrophobicContact CG-CG 4.18Å; G161-Y239 WeakPolarHBondContact CA-OH 3.42Å; L175-Y239 HydrophobicContact CD1-CD1 4.28Å; L175-Y239 HydrophobicContact CD1-CE1 4.18Å; L175-Y239 HydrophobicContact CD2-CD1 4.15Å; L175-Y239 HydrophobicContact CD2-CE1 3.82Å; A184-Y239 HydrophobicContact CB-CD1 3.73Å; A184-Y239 HydrophobicContact CB-CE1 3.96Å; M215-Y239 CarbonylContact C-O 3.45Å; M215-Y239 WeakPolarHBondContact CA-O 3.2Å; I216-Y239 PolarHBondContact N-O 3.21Å; I216-Y239 PolarHBondContact O-N 3.31Å; S220-Y239 WeakPolarHBondContact CB-OH 3.21Å; S220-Y239 PolarHBondContact OG-OH 2.86Å; T237-Y239 HydrophobicContact CG2-CD2 4.16Å; T237-Y239 HydrophobicContact CG2-CE1 4Å; T237-Y239 HydrophobicContact CG2-CE2 3.55Å; T237-Y239 VanDerWaalsContact CG2-CZ 3.45Å; Y239-F241 HydrophobicContact CG-CZ 4.49Å; Y239-F241 WeakPolarHBondContact O-CE2 3.38Å
240	F	96.9	Very high	78.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	128.2	176.4	-63.2	-99.2	0	0	0	110.3	L111 A182 V183 V185 C199 V202 F206 F213 N214 M215 S238 P242	L111-F240 HydrophobicContact CD1-CE1 3.76Å; L111-F240 HydrophobicContact CD1-CZ 4.35Å; A182-F240 CarbonylContact C-O 3.58Å; A182-F240 VanDerWaalsContact CA-O 3.23Å; A182-F240 WeakPolarHBondContact CA-O 3.39Å; V183-F240 PolarHBondContact N-O 2.72Å; V183-F240 PolarHBondContact O-N 3.25Å; V185-F240 HydrophobicContact CG2-CE2 4.4Å; C199-F240 HydrophobicContact CB-CE2 4.42Å; C199-F240 HydrophobicContact CB-CZ 3.98Å; V202-F240 HydrophobicContact CB-CD2 4.34Å; V202-F240 HydrophobicContact CB-CE2 4.23Å; V202-F240 HydrophobicContact CB-CZ 4.35Å; V202-F240 HydrophobicContact CG1-CB 4.05Å; V202-F240 HydrophobicContact CG1-CD1 3.9Å; V202-F240 HydrophobicContact CG1-CD2 3.78Å; V202-F240 HydrophobicContact CG1-CE1 4.26Å; V202-F240 HydrophobicContact CG1-CE2 4.15Å; V202-F240 HydrophobicContact CG1-CG 3.65Å; V202-F240 HydrophobicContact CG1-CZ 4.38Å; F206-F240 HydrophobicContact CE2-CB 3.86Å; F206-F240 HydrophobicContact CE2-CD1 4.16Å; F206-F240 HydrophobicContact CE2-CG 4.3Å; F206-F240 HydrophobicContact CZ-CB 4.49Å; F213-F240 AromaticContact CD2-CD1 3.87Å; F213-F240 HydrophobicContact CD2-CD1 3.87Å; F213-F240 AromaticContact CE2-CD1 3.94Å; F213-F240 HydrophobicContact CE2-CD1 3.94Å; F213-F240 HydrophobicContact CE2-CE1 4.13Å; N214-F240 CarbonylContact O-C 3.14Å; N214-F240 WeakPolarHBondContact O-CA 3.45Å; M215-F240 HydrophobicContact CB-CD1 3.96Å; M215-F240 HydrophobicContact CB-CE1 4.12Å; M215-F240 HydrophobicContact CG-CD1 3.91Å; M215-F240 HydrophobicContact CG-CD2 4.48Å; M215-F240 HydrophobicContact CG-CE1 3.77Å; M215-F240 HydrophobicContact CG-CE2 4.36Å; M215-F240 HydrophobicContact CG-CG 4.26Å; M215-F240 HydrophobicContact CG-CZ 4.01Å; M215-F240 HydrophobicContact SD-CD1 4.28Å; M215-F240 HydrophobicContact SD-CE1 3.53Å; M215-F240 VanDerWaalsContact SD-CE1 3.53Å; M215-F240 HydrophobicContact SD-CE2 4.3Å; M215-F240 HydrophobicContact SD-CZ 3.54Å; M215-F240 VanDerWaalsContact SD-CZ 3.54Å; S238-F240 WeakPolarHBondContact OG-CE2 3.26Å; F240-P242 WeakPolarHBondContact O-CD 3.4Å
241	F	95.5	Very high	78.6	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	96.7	-179.3	-54.4	-85.8	0	0	0	108.3	L160 W178 L180 A182 F213 N214 I216 Y239 R243 L261	L160-F241 HydrophobicContact CD1-CZ 4.27Å; L160-F241 HydrophobicContact CD2-CZ 3.94Å; W178-F241 AromaticContact CE3-CE1 3.76Å; W178-F241 HydrophobicContact CE3-CE1 3.76Å; W178-F241 HydrophobicContact CE3-CZ 4.19Å; W178-F241 AromaticContact CZ3-CE1 3.62Å; W178-F241 HydrophobicContact CZ3-CE1 3.62Å; W178-F241 AromaticContact CZ3-CZ 3.63Å; W178-F241 HydrophobicContact CZ3-CZ 3.63Å; L180-F241 HydrophobicContact CB-CD1 3.99Å; L180-F241 HydrophobicContact CD1-CB 4.31Å; L180-F241 HydrophobicContact CD1-CD1 4.4Å; A182-F241 HydrophobicContact CB-CD1 3.61Å; A182-F241 HydrophobicContact CB-CE1 3.43Å; A182-F241 VanDerWaalsContact CB-CE1 3.43Å; A182-F241 HydrophobicContact CB-CG 4.46Å; A182-F241 HydrophobicContact CB-CZ 4.14Å; F213-F241 VanDerWaalsContact CA-O 3.23Å; F213-F241 WeakPolarHBondContact CA-O 3.47Å; N214-F241 HydrophobicContact CB-CB 4.45Å; N214-F241 HydrophobicContact CB-CD2 4.47Å; N214-F241 PolarHBondContact N-O 2.98Å; N214-F241 PolarHBondContact O-N 3.15Å; I216-F241 HydrophobicContact CB-CE2 4.22Å; I216-F241 HydrophobicContact CD1-CE2 3.7Å; I216-F241 HydrophobicContact CD1-CZ 4.18Å; I216-F241 HydrophobicContact CG1-CE2 3.84Å; Y239-F241 HydrophobicContact CG-CZ 4.49Å; Y239-F241 WeakPolarHBondContact O-CE2 3.38Å; F241-R243 VanDerWaalsContact O-CD 3.24Å; F241-R243 WeakPolarHBondContact O-CD 3.19Å; F241-R243 VanDerWaalsContact O-CG 3.24Å; F241-R243 WeakPolarHBondContact O-CG 3.19Å; F241-L261 HydrophobicContact CD1-CD1 4.09Å; F241-L261 HydrophobicContact CD2-CD1 4.09Å; F241-L261 HydrophobicContact CE1-CD1 3.76Å; F241-L261 HydrophobicContact CE2-CD1 3.79Å; F241-L261 HydrophobicContact CG-CD1 4.24Å; F241-L261 HydrophobicContact CZ-CD1 3.61Å
242	P	96.1	Very high	78.5	Confident	2 Å²	2	49 Å²	49	1%	0.013	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	136.6	173	31.4	-35.8	0	0	0	110	F206 Q211 P212 F240 L290 F295 I298	F206-P242 HydrophobicContact CE1-CB 3.95Å; F206-P242 HydrophobicContact CE1-CG 4.49Å; F206-P242 HydrophobicContact CZ-CB 4.03Å; F206-P242 HydrophobicContact CZ-CG 4.32Å; Q211-P242 HydrophobicContact CG-CB 3.97Å; P212-P242 WeakPolarHBondContact O-CA 3.35Å; F240-P242 WeakPolarHBondContact O-CD 3.4Å; P242-L290 HydrophobicContact CB-CD1 3.76Å; P242-L290 HydrophobicContact CG-CD1 4.04Å; P242-F295 HydrophobicContact CG-CD2 3.69Å; P242-F295 HydrophobicContact CG-CE2 3.8Å; P242-I298 HydrophobicContact CB-CD1 4.05Å; P242-I298 HydrophobicContact CG-CD1 4.37Å
243	R	91.5	Very high	77.8	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.008	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-129.8	156.6	-166.9	-48.1	-56.1	-64.1	-84.8	10.9	112.9	L180 Q211 P212 N214 F241 P257 A288	L180-R243 VanDerWaalsContact CD1-NH2 3.28Å; Q211-R243 VanDerWaalsContact NE2-N 3.2Å; Q211-R243 PolarHBondContact NE2-O 3.44Å; P212-R243 PolarHBondContact O-N 3.44Å; N214-R243 WeakPolarHBondContact OD1-CG 3.36Å; N214-R243 PolarHBondContact OD1-NH1 3.14Å; F241-R243 VanDerWaalsContact O-CD 3.24Å; F241-R243 WeakPolarHBondContact O-CD 3.19Å; F241-R243 VanDerWaalsContact O-CG 3.24Å; F241-R243 WeakPolarHBondContact O-CG 3.19Å; R243-P257 PolarHBondContact NH1-O 3.4Å; R243-A288 VanDerWaalsContact CA-O 3.3Å; R243-A288 WeakPolarHBondContact CA-O 3.3Å; R243-A288 WeakPolarHBondContact CB-O 3.46Å; R243-A288 PolarHBondContact NE-O 2.96Å
244	Q	91	Very high	77.1	Confident	75 Å²	75	43.3 Å²	43.3	35%	0.35	24%	0.243	S	C	.	.			trans	-62.4	151.1	154	-68.8	-177.8	4.8	0	0	109.8	V246 A288 A289 L290	Q244-V246 WeakPolarHBondContact O-CG2 3.43Å; Q244-V246 PolarHBondContact O-N 3.15Å; Q244-A288 PolarHBondContact N-O 3.06Å; Q244-A288 VanDerWaalsContact N-O 3.08Å; Q244-A289 VanDerWaalsContact CD-O 3.29Å; Q244-A289 WeakPolarHBondContact CG-O 3.33Å; Q244-A289 PolarHBondContact NE2-O 2.98Å; Q244-A289 VanDerWaalsContact NE2-O 3.16Å; Q244-L290 HydrophobicContact CG-CD2 4.05Å
245	A	89.1	Confident	76.3	Confident	66 Å²	66	40.9 Å²	40.9	55%	0.545	23%	0.23	S	C	.	.			trans	-63.1	121.1	177.4	0	0	0	0	0	110.2	L139 P212	L139-A245 HydrophobicContact CB-CB 4.15Å; L139-A245 CarbonylContact O-C 3.59Å; L139-A245 WeakPolarHBondContact O-CA 3.39Å; P212-A245 HydrophobicContact CG-CB 4Å
246	V	78.6	Confident	75	Confident	15 Å²	15	40 Å²	40	9%	0.091	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-118.5	118.1	176.7	-166.4	0	0	0	0	109	L139 M141 Q244 P257 K287 A288	L139-V246 PolarHBondContact O-N 2.91Å; M141-V246 HydrophobicContact CG-CB 4.3Å; M141-V246 HydrophobicContact CG-CG1 4.31Å; M141-V246 PolarHBondContact N-O 3.15Å; M141-V246 HydrophobicContact SD-CB 4.04Å; M141-V246 HydrophobicContact SD-CG1 3.53Å; M141-V246 VanDerWaalsContact SD-CG1 3.53Å; Q244-V246 WeakPolarHBondContact O-CG2 3.43Å; Q244-V246 PolarHBondContact O-N 3.15Å; V246-P257 HydrophobicContact CG1-CG 4.06Å; V246-P257 HydrophobicContact CG2-CG 4.39Å; V246-K287 WeakPolarHBondContact CG2-O 3.34Å; V246-A288 HydrophobicContact CG2-CB 3.63Å
247	S	68.8	Low	73.6	Confident	31 Å²	31	40.2 Å²	40.2	22%	0.217	23%	0.228	C	C	.	.			trans	-78.6	136.1	174.7	176.8	0	0	0	0	110.5	I249	S247-I249 PolarHBondContact O-N 3.35Å; S247-I249 VanDerWaalsContact O-N 3.14Å; S247-I249 PolarHBondContact OG-N 3.48Å
248	P	64.5	Low	72.4	Confident	20 Å²	20	40.6 Å²	40.6	13%	0.13	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-4.6	173.4	30.3	-35.2	0	0	0	113.4	F37 M141 E143	F37-P248 HydrophobicContact CB-CG 4.31Å; M141-P248 HydrophobicContact CE-CB 4.5Å; E143-P248 HydrophobicContact CG-CB 4.29Å
249	I	62.1	Low	70.5	Confident	86 Å²	86	40.7 Å²	40.7	44%	0.441	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-10	-173.7	-48.8	-173.9	0	0	0	113.1	F37 I39 S247	F37-I249 HydrophobicContact CB-CG1 4.31Å; F37-I249 WeakPolarHBondContact O-CD1 3.34Å; I39-I249 HydrophobicContact CD1-CD1 3.91Å; I39-I249 HydrophobicContact CG1-CD1 3.26Å; I39-I249 HydrophobicContact CG1-CG1 4.2Å; S247-I249 PolarHBondContact O-N 3.35Å; S247-I249 VanDerWaalsContact O-N 3.14Å; S247-I249 PolarHBondContact OG-N 3.48Å
250	L	55.7	Low	68.9	Low	123 Å²	123	41.2 Å²	41.2	64%	0.644	23%	0.233	S	C	*	.	S	Bend	trans	-65.5	149.9	-179.3	-86.1	147.8	0	0	0	112.2
251	P	49.3	Very low	66.9	Low	97 Å²	97	41.5 Å²	41.5	63%	0.63	24%	0.235	S	C	*	.			trans	-60.2	144.2	-159	23.1	-32.6	0	0	0	112.6	T253	P251-T253 PolarHBondContact O-N 2.92Å; P251-T253 PolarHBondContact O-OG1 3.22Å
252	K	50.5	Low	64.6	Low	175 Å²	175	43.2 Å²	43.2	76%	0.761	24%	0.244	S	C	*	.			trans	-47.8	61.6	-178.9	-61.4	174.8	179.6	172.7	0	114.2
253	T	42.6	Very low	62.3	Low	83 Å²	83	43.2 Å²	43.2	51%	0.509	24%	0.244	S	C	.	.			trans	-103.6	135	164.8	52.4	0	0	0	0	106.3	P251 L255 K287	P251-T253 PolarHBondContact O-N 2.92Å; P251-T253 PolarHBondContact O-OG1 3.22Å; T253-L255 VanDerWaalsContact C-N 3.27Å; T253-L255 PolarHBondContact O-N 3.25Å; T253-K287 PolarHBondContact OG1-NZ 2.94Å
254	S	51.9	Low	60	Low	34 Å²	34	43.2 Å²	43.2	24%	0.238	24%	0.244	C	C	.	.	S	Bend	trans	-70.8	4.2	-137	45.9	0	0	0	0	119.2	Q264 E265 E266	S254-Q264 CarbonylContact O-C 3.55Å; S254-Q264 VanDerWaalsContact O-CA 3.27Å; S254-Q264 WeakPolarHBondContact O-CA 3.44Å; S254-Q264 WeakPolarHBondContact O-CG 3.45Å; S254-E265 PolarHBondContact O-N 2.84Å; S254-E266 WeakPolarHBondContact CB-OE1 3.45Å; S254-E266 PolarHBondContact OG-OE1 3.25Å
255	L	57.4	Low	57.8	Low	8 Å²	8	41.9 Å²	41.9	4%	0.042	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-127.7	128.9	-171.9	-165.4	85.2	0	0	0	111.3	T253 P257 D263 Q264 I280 I283 F284	T253-L255 VanDerWaalsContact C-N 3.27Å; T253-L255 PolarHBondContact O-N 3.25Å; L255-P257 WeakPolarHBondContact O-CD 3.34Å; L255-D263 WeakPolarHBondContact CD1-O 3.22Å; L255-Q264 HydrophobicContact CB-CG 4.33Å; L255-Q264 HydrophobicContact CD1-CB 3.64Å; L255-Q264 HydrophobicContact CD1-CG 3.5Å; L255-Q264 VanDerWaalsContact CD1-CG 3.5Å; L255-I280 HydrophobicContact CD1-CD1 3.66Å; L255-I280 HydrophobicContact CD2-CD1 4.05Å; L255-I280 HydrophobicContact CD2-CG2 4.11Å; L255-I280 HydrophobicContact CG-CD1 4.48Å; L255-I283 HydrophobicContact CB-CD1 4.25Å; L255-I283 HydrophobicContact CB-CG2 4.32Å; L255-I283 HydrophobicContact CD2-CB 3.94Å; L255-I283 HydrophobicContact CD2-CD1 4.04Å; L255-I283 HydrophobicContact CD2-CG2 3.65Å; L255-F284 HydrophobicContact CD2-CD2 3.8Å; L255-F284 HydrophobicContact CD2-CE2 3.54Å; L255-F284 HydrophobicContact CG-CE2 4.37Å
256	C	60.1	Low	55.6	Low	16 Å²	16	39.4 Å²	39.4	11%	0.108	22%	0.215	C	C	.	.			trans	-106.5	106.1	179.8	-74.5	0	0	0	0	109.8	R93 M141 S258 D263	R93-C256 PolarHBondContact NH1-SG 2.77Å; M141-C256 HydrophobicContact CE-CB 3.68Å; C256-S258 PolarHBondContact O-N 3.42Å; C256-D263 PolarHBondContact N-O 2.82Å
257	P	60.1	Low	54	Low	5 Å²	5	42.3 Å²	42.3	3%	0.032	24%	0.236	C	C	.	.			trans	-78.3	52.7	-174	34.6	-37.9	0	0	0	112.5	M141 R243 V246 L255 F284 A288	M141-P257 HydrophobicContact CG-CG 4.25Å; M141-P257 HydrophobicContact SD-CG 4.46Å; R243-P257 PolarHBondContact NH1-O 3.4Å; V246-P257 HydrophobicContact CG1-CG 4.06Å; V246-P257 HydrophobicContact CG2-CG 4.39Å; L255-P257 WeakPolarHBondContact O-CD 3.34Å; P257-F284 HydrophobicContact CB-CD1 3.91Å; P257-F284 HydrophobicContact CB-CE1 3.39Å; P257-F284 HydrophobicContact CB-CE2 4.47Å; P257-F284 HydrophobicContact CB-CZ 3.72Å; P257-A288 HydrophobicContact CB-CB 4.08Å; P257-A288 HydrophobicContact CG-CB 4.09Å
258	S	67.4	Low	53.1	Low	9 Å²	9	45.3 Å²	45.3	6%	0.063	25%	0.249	C	C	.	.	S	Bend	trans	-79.2	-175.2	176.2	70.2	0	0	0	0	111.6	C256 R260 L261	C256-S258 PolarHBondContact O-N 3.42Å; S258-R260 CarbonylContact O-C 3.22Å; S258-R260 PolarHBondContact O-N 3.34Å; S258-R260 WeakPolarHBondContact OG-CB 3.45Å; S258-R260 PolarHBondContact OG-N 3.27Å; S258-R260 VanDerWaalsContact OG-N 3.15Å; S258-L261 WeakPolarHBondContact O-CD2 3.2Å; S258-L261 PolarHBondContact O-N 2.91Å
259	A	55.7	Low	52.2	Low	1 Å²	1	49.5 Å²	49.5	1%	0.008	27%	0.27	C	S	.	.	S	Bend	trans	-55.1	-18.6	168.8	0	0	0	0	0	112.5	N136 N214 I216 L261	N136-A259 WeakPolarHBondContact OD1-CB 3.33Å; N136-A259 PolarHBondContact OD1-N 3.38Å; N214-A259 HydrophobicContact CB-CB 4.03Å; N214-A259 PolarHBondContact ND2-N 3.1Å; I216-A259 WeakPolarHBondContact CD1-O 3.34Å; I216-A259 HydrophobicContact CG1-CB 4.39Å; I216-A259 WeakPolarHBondContact CG1-O 3.41Å; A259-L261 VanDerWaalsContact C-N 3.3Å; A259-L261 PolarHBondContact O-N 2.9Å
260	R	61.9	Low	51.6	Low	18 Å²	18	51 Å²	51	7%	0.068	27%	0.273	C	S	.	.	S	Bend	trans	-81.7	85.8	158.1	-59.6	172.9	-162.7	164.9	9.1	108.1	R27 E150 L152 S258 N262 D263	R27-R260 VanDerWaalsContact CZ-NH1 3.28Å; R27-R260 VanDerWaalsContact NH1-NH1 3.1Å; E150-R260 IonicContact OE2-CZ 2.71Å; E150-R260 IonicContact OE2-NE 3.15Å; E150-R260 PolarHBondContact OE2-NE 3.4Å; E150-R260 IonicContact OE2-NH2 3.67Å; E150-R260 PolarHBondContact OE2-NH2 3.02Å; L152-R260 HydrophobicContact CD1-CG 4.15Å; L152-R260 HydrophobicContact CD2-CG 3.51Å; L152-R260 HydrophobicContact CG-CG 4.48Å; S258-R260 CarbonylContact O-C 3.22Å; S258-R260 PolarHBondContact O-N 3.34Å; S258-R260 WeakPolarHBondContact OG-CB 3.45Å; S258-R260 PolarHBondContact OG-N 3.27Å; S258-R260 VanDerWaalsContact OG-N 3.15Å; R260-N262 PolarHBondContact O-N 2.71Å; R260-D263 HydrophobicContact CB-CB 3.76Å; R260-D263 VanDerWaalsContact CD-OD2 3.22Å; R260-D263 WeakPolarHBondContact CD-OD2 3.42Å; R260-D263 IonicContact CZ-OD2 3.21Å; R260-D263 IonicContact NE-OD2 2.74Å; R260-D263 IonicContact NH1-OD2 3.98Å; R260-D263 PolarHBondContact NH1-OD2 2.73Å; R260-D263 PolarHBondContact O-N 3.3Å; R260-D263 VanDerWaalsContact O-N 3.11Å
261	L	55.9	Low	51.5	Low	5 Å²	5	45.6 Å²	45.6	3%	0.026	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	16.9	177.9	-66.7	175.4	0	0	0	114.3	W178 L179 L180 I216 F241 S258 A259 F284	W178-L261 HydrophobicContact CE3-CD1 4.27Å; W178-L261 HydrophobicContact CH2-CB 4.42Å; W178-L261 HydrophobicContact CH2-CD1 3.66Å; W178-L261 HydrophobicContact CZ3-CD1 3.25Å; L179-L261 HydrophobicContact CD2-CB 4.01Å; L179-L261 VanDerWaalsContact CD2-O 3.23Å; L179-L261 WeakPolarHBondContact CD2-O 3.48Å; L180-L261 HydrophobicContact CD1-CD2 3.53Å; I216-L261 HydrophobicContact CD1-CD1 3.82Å; I216-L261 HydrophobicContact CD1-CG 4.24Å; F241-L261 HydrophobicContact CD1-CD1 4.09Å; F241-L261 HydrophobicContact CD2-CD1 4.09Å; F241-L261 HydrophobicContact CE1-CD1 3.76Å; F241-L261 HydrophobicContact CE2-CD1 3.79Å; F241-L261 HydrophobicContact CG-CD1 4.24Å; F241-L261 HydrophobicContact CZ-CD1 3.61Å; S258-L261 WeakPolarHBondContact O-CD2 3.2Å; S258-L261 PolarHBondContact O-N 2.91Å; A259-L261 VanDerWaalsContact C-N 3.3Å; A259-L261 PolarHBondContact O-N 2.9Å; L261-F284 HydrophobicContact CB-CE1 4.49Å; L261-F284 HydrophobicContact CB-CZ 4.31Å; L261-F284 HydrophobicContact CD2-CD1 4.29Å; L261-F284 HydrophobicContact CD2-CE1 3.44Å; L261-F284 VanDerWaalsContact CD2-CE1 3.44Å; L261-F284 HydrophobicContact CD2-CZ 4.04Å; L261-F284 WeakPolarHBondContact O-CE2 3.39Å; L261-F284 WeakPolarHBondContact O-CZ 3.37Å
262	N	47.5	Very low	51.6	Low	36 Å²	36	47.1 Å²	47.1	19%	0.193	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-145.9	-2.4	-163.5	-86.7	2.6	0	0	0	112.1	L22 V23 R260 Q264	L22-N262 WeakPolarHBondContact CD2-OD1 3.22Å; V23-N262 PolarHBondContact N-ND2 2.85Å; V23-N262 WeakPolarHBondContact O-CB 3.39Å; V23-N262 VanDerWaalsContact O-CG 3.31Å; V23-N262 PolarHBondContact O-ND2 3.4Å; R260-N262 PolarHBondContact O-N 2.71Å; N262-Q264 PolarHBondContact O-N 2.69Å
263	D	47.2	Very low	51.7	Low	3 Å²	3	48.3 Å²	48.3	2%	0.016	25%	0.246	C	C	.	.			trans	-81.7	107.2	-172.5	-144.5	1.8	0	0	0	111.4	R27 L255 C256 R260	R27-D263 IonicContact CZ-OD1 3.25Å; R27-D263 VanDerWaalsContact CZ-OD1 3.22Å; R27-D263 IonicContact CZ-OD2 2.89Å; R27-D263 VanDerWaalsContact CZ-OD2 3.25Å; R27-D263 IonicContact NH1-OD1 3.87Å; R27-D263 PolarHBondContact NH1-OD1 2.86Å; R27-D263 IonicContact NH1-OD2 3.31Å; R27-D263 PolarHBondContact NH1-OD2 3.2Å; R27-D263 IonicContact NH2-OD1 3.82Å; R27-D263 PolarHBondContact NH2-OD1 3.25Å; R27-D263 IonicContact NH2-OD2 3.1Å; R27-D263 PolarHBondContact NH2-OD2 3.09Å; L255-D263 WeakPolarHBondContact CD1-O 3.22Å; C256-D263 PolarHBondContact N-O 2.82Å; R260-D263 HydrophobicContact CB-CB 3.76Å; R260-D263 VanDerWaalsContact CD-OD2 3.22Å; R260-D263 WeakPolarHBondContact CD-OD2 3.42Å; R260-D263 IonicContact CZ-OD2 3.21Å; R260-D263 IonicContact NE-OD2 2.74Å; R260-D263 IonicContact NH1-OD2 3.98Å; R260-D263 PolarHBondContact NH1-OD2 2.73Å; R260-D263 PolarHBondContact O-N 3.3Å; R260-D263 VanDerWaalsContact O-N 3.11Å
264	Q	41.9	Very low	52.4	Low	2 Å²	2	44.8 Å²	44.8	1%	0.009	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-108.9	114.6	171.9	-145.1	169.4	-4.5	0	0	108.2	E25 S254 L255 N262 E266 V274	E25-Q264 VanDerWaalsContact O-O 3.1Å; S254-Q264 CarbonylContact O-C 3.55Å; S254-Q264 VanDerWaalsContact O-CA 3.27Å; S254-Q264 WeakPolarHBondContact O-CA 3.44Å; S254-Q264 WeakPolarHBondContact O-CG 3.45Å; L255-Q264 HydrophobicContact CB-CG 4.33Å; L255-Q264 HydrophobicContact CD1-CB 3.64Å; L255-Q264 HydrophobicContact CD1-CG 3.5Å; L255-Q264 VanDerWaalsContact CD1-CG 3.5Å; N262-Q264 PolarHBondContact O-N 2.69Å; Q264-E266 HydrophobicContact CG-CG 3.87Å; Q264-E266 VanDerWaalsContact NE2-CD 3.26Å; Q264-E266 PolarHBondContact NE2-OE1 3.33Å; Q264-E266 PolarHBondContact O-N 2.97Å; Q264-V274 VanDerWaalsContact OE1-CG2 3.23Å
265	E	45.6	Very low	52.8	Low	47 Å²	47	45 Å²	45	22%	0.22	23%	0.226	C	C	.	.			trans	-92.1	96	173	-76.3	176.1	-173.2	0	0	107	R27 R93 S254	R27-E265 IonicContact NH1-OE1 3.16Å; R93-E265 WeakPolarHBondContact CD-OE1 3.23Å; R93-E265 IonicContact CZ-OE1 3.73Å; R93-E265 IonicContact NE-OE1 3.98Å; R93-E265 IonicContact NH1-OE1 2.65Å; R93-E265 PolarHBondContact NH1-OE1 2.89Å; R93-E265 IonicContact NH1-OE2 3.18Å; R93-E265 PolarHBondContact NH1-OE2 2.7Å; S254-E265 PolarHBondContact O-N 2.84Å
266	E	43	Very low	53.6	Low	13 Å²	13	47.3 Å²	47.3	6%	0.061	25%	0.246	C	C	.	.			trans	-125.6	139	-177.8	-78.7	-171.3	176.3	0	0	111.7	L26 S254 Q264 F270 F271 V274	L26-E266 WeakPolarHBondContact CD1-O 3.44Å; S254-E266 WeakPolarHBondContact CB-OE1 3.45Å; S254-E266 PolarHBondContact OG-OE1 3.25Å; Q264-E266 HydrophobicContact CG-CG 3.87Å; Q264-E266 VanDerWaalsContact NE2-CD 3.26Å; Q264-E266 PolarHBondContact NE2-OE1 3.33Å; Q264-E266 PolarHBondContact O-N 2.97Å; E266-F270 HydrophobicContact CB-CB 3.56Å; E266-F270 VanDerWaalsContact CD-CB 3.48Å; E266-F270 HydrophobicContact CG-CB 3.64Å; E266-F270 HydrophobicContact CG-CG 4.44Å; E266-F270 WeakPolarHBondContact OE2-CA 3.26Å; E266-F270 WeakPolarHBondContact OE2-CB 3.47Å; E266-F271 HydrophobicContact CB-CB 4.36Å; E266-F271 PolarHBondContact OE2-N 3.14Å; E266-F271 VanDerWaalsContact OE2-N 3.15Å; E266-V274 WeakPolarHBondContact OE2-CG2 3.31Å
267	S	45.3	Very low	54.5	Low	76 Å²	76	47.2 Å²	47.2	53%	0.531	24%	0.244	S	C	.	.			trans	-56.8	151.2	161.4	53.7	0	0	0	0	109.2	I269 F270 F271	S267-I269 PolarHBondContact O-N 2.95Å; S267-F270 WeakPolarHBondContact O-CA 3.46Å; S267-F270 WeakPolarHBondContact O-CB 3.13Å; S267-F270 PolarHBondContact O-N 3.02Å; S267-F271 PolarHBondContact O-N 3.34Å; S267-F271 VanDerWaalsContact O-N 3.1Å
268	D	48.6	Very low	55.6	Low	95 Å²	95	51.5 Å²	51.5	51%	0.508	27%	0.272	S	S	.	.	H	α-helix	trans	-46.1	-37.7	-173.5	-64.5	-28.9	0	0	0	114	F270 F271 L272	D268-F270 VanDerWaalsContact C-N 3.34Å; D268-F270 PolarHBondContact O-N 3.23Å; D268-F271 PolarHBondContact O-N 3.16Å; D268-L272 WeakPolarHBondContact O-CD1 3.48Å; D268-L272 VanDerWaalsContact O-CG 3.26Å; D268-L272 WeakPolarHBondContact O-CG 3.23Å; D268-L272 PolarHBondContact O-N 3.46Å; D268-L272 VanDerWaalsContact O-N 3.13Å
269	I	46.5	Very low	56.1	Low	108 Å²	108	52.8 Å²	52.8	55%	0.554	28%	0.283	S	S	*	.	H	α-helix	trans	-64.1	-40.3	179.3	-62.4	174.1	0	0	0	111.8	S267 R273	S267-I269 PolarHBondContact O-N 2.95Å; I269-R273 WeakPolarHBondContact O-CB 3.24Å; I269-R273 VanDerWaalsContact O-CG 3.29Å; I269-R273 WeakPolarHBondContact O-CG 3.44Å; I269-R273 PolarHBondContact O-N 2.93Å
270	F	49.1	Very low	57.2	Low	118 Å²	118	52.9 Å²	52.9	52%	0.518	28%	0.283	S	S	.	.	H	α-helix	trans	-74.2	-46.8	-179.9	-99.4	-77.3	0	0	0	109.2	E266 S267 D268 L272 R273 V274	E266-F270 HydrophobicContact CB-CB 3.56Å; E266-F270 VanDerWaalsContact CD-CB 3.48Å; E266-F270 HydrophobicContact CG-CB 3.64Å; E266-F270 HydrophobicContact CG-CG 4.44Å; E266-F270 WeakPolarHBondContact OE2-CA 3.26Å; E266-F270 WeakPolarHBondContact OE2-CB 3.47Å; S267-F270 WeakPolarHBondContact O-CA 3.46Å; S267-F270 WeakPolarHBondContact O-CB 3.13Å; S267-F270 PolarHBondContact O-N 3.02Å; D268-F270 VanDerWaalsContact C-N 3.34Å; D268-F270 PolarHBondContact O-N 3.23Å; F270-L272 PolarHBondContact O-N 3.29Å; F270-L272 VanDerWaalsContact O-N 3.15Å; F270-R273 CarbonylContact O-C 3.44Å; F270-R273 VanDerWaalsContact O-C 3.22Å; F270-R273 VanDerWaalsContact O-CA 3.26Å; F270-R273 WeakPolarHBondContact O-CA 3.24Å; F270-R273 PolarHBondContact O-N 2.8Å; F270-V274 WeakPolarHBondContact O-CG2 3.35Å; F270-V274 PolarHBondContact O-N 2.77Å
271	F	53.5	Low	58.2	Low	8 Å²	8	54 Å²	54	4%	0.035	29%	0.293	C	S	.	.	H	α-helix	trans	-52.8	-40.8	175.7	-177.4	-103.4	0	0	0	113.6	M12 K14 A24 L26 E266 S267 D268 V274	M12-F271 HydrophobicContact CB-CE1 4.2Å; M12-F271 HydrophobicContact CB-CZ 4.32Å; K14-F271 HydrophobicContact CB-CE1 4.44Å; K14-F271 HydrophobicContact CB-CE2 4.36Å; K14-F271 HydrophobicContact CB-CZ 3.76Å; A24-F271 HydrophobicContact CB-CD2 4.45Å; A24-F271 HydrophobicContact CB-CE2 3.89Å; L26-F271 HydrophobicContact CB-CB 4.38Å; L26-F271 HydrophobicContact CB-CD1 3.72Å; L26-F271 HydrophobicContact CB-CD2 3.57Å; L26-F271 HydrophobicContact CB-CE1 3.76Å; L26-F271 HydrophobicContact CB-CE2 3.61Å; L26-F271 HydrophobicContact CB-CG 3.62Å; L26-F271 HydrophobicContact CB-CZ 3.69Å; L26-F271 HydrophobicContact CD1-CB 3.54Å; L26-F271 HydrophobicContact CD1-CD1 4.28Å; L26-F271 HydrophobicContact CD1-CD2 4.25Å; L26-F271 HydrophobicContact CD1-CG 3.78Å; L26-F271 HydrophobicContact CD2-CB 4.48Å; L26-F271 HydrophobicContact CD2-CD1 3.83Å; L26-F271 HydrophobicContact CD2-CE1 4.26Å; L26-F271 HydrophobicContact CD2-CG 4.19Å; L26-F271 HydrophobicContact CG-CB 4.32Å; L26-F271 HydrophobicContact CG-CD1 4.14Å; L26-F271 HydrophobicContact CG-CD2 4.4Å; L26-F271 HydrophobicContact CG-CG 4.04Å; E266-F271 HydrophobicContact CB-CB 4.36Å; E266-F271 PolarHBondContact OE2-N 3.14Å; E266-F271 VanDerWaalsContact OE2-N 3.15Å; S267-F271 PolarHBondContact O-N 3.34Å; S267-F271 VanDerWaalsContact O-N 3.1Å; D268-F271 PolarHBondContact O-N 3.16Å; F271-V274 HydrophobicContact CD2-CG2 4.45Å; F271-V274 WeakPolarHBondContact O-CB 3.33Å; F271-V274 WeakPolarHBondContact O-CG2 3.34Å; F271-V274 PolarHBondContact O-N 2.94Å
272	L	51	Low	59.5	Low	130 Å²	130	61.6 Å²	61.6	68%	0.681	32%	0.321	S	S	*	.	H	α-helix	trans	-67.2	-37.9	175	-70	169.6	0	0	0	112.1	D268 F270	D268-L272 WeakPolarHBondContact O-CD1 3.48Å; D268-L272 VanDerWaalsContact O-CG 3.26Å; D268-L272 WeakPolarHBondContact O-CG 3.23Å; D268-L272 PolarHBondContact O-N 3.46Å; D268-L272 VanDerWaalsContact O-N 3.13Å; F270-L272 PolarHBondContact O-N 3.29Å; F270-L272 VanDerWaalsContact O-N 3.15Å
273	R	53.2	Low	61.1	Low	200 Å²	200	61.5 Å²	61.5	76%	0.755	32%	0.32	S	S	*	.	H	α-helix	trans	-83.9	-8	176.3	-72.1	-179	177.8	-168.4	-0.2	114.4	I269 F270 S275	I269-R273 WeakPolarHBondContact O-CB 3.24Å; I269-R273 VanDerWaalsContact O-CG 3.29Å; I269-R273 WeakPolarHBondContact O-CG 3.44Å; I269-R273 PolarHBondContact O-N 2.93Å; F270-R273 CarbonylContact O-C 3.44Å; F270-R273 VanDerWaalsContact O-C 3.22Å; F270-R273 VanDerWaalsContact O-CA 3.26Å; F270-R273 WeakPolarHBondContact O-CA 3.24Å; F270-R273 PolarHBondContact O-N 2.8Å; R273-S275 PolarHBondContact O-N 2.83Å
274	V	56.9	Low	62.8	Low	8 Å²	8	61.3 Å²	61.3	5%	0.048	32%	0.319	C	S	.	.			trans	-45.8	101.6	-175.1	165	0	0	0	0	110.4	L16 A24 Q264 E266 F270 F271	L16-V274 HydrophobicContact CD1-CG1 4.39Å; L16-V274 HydrophobicContact CD2-CG1 3.77Å; A24-V274 HydrophobicContact CB-CG1 4.2Å; Q264-V274 VanDerWaalsContact OE1-CG2 3.23Å; E266-V274 WeakPolarHBondContact OE2-CG2 3.31Å; F270-V274 WeakPolarHBondContact O-CG2 3.35Å; F270-V274 PolarHBondContact O-N 2.77Å; F271-V274 HydrophobicContact CD2-CG2 4.45Å; F271-V274 WeakPolarHBondContact O-CB 3.33Å; F271-V274 WeakPolarHBondContact O-CG2 3.34Å; F271-V274 PolarHBondContact O-N 2.94Å
275	S	61.3	Low	64.8	Low	40 Å²	40	64.4 Å²	64.4	28%	0.28	34%	0.341	S	S	.	.				33.1	91.8	122.8	-55.8	0	0	0	0	113.4	R273	R273-S275 PolarHBondContact O-N 2.83Å
276	A	73.7	Confident	66.6	Low	56 Å²	56	67.4 Å²	67.4	46%	0.463	36%	0.355	S	S	.	.			trans	-42.6	151.8	162.8	0	0	0	0	0	110.8	P278 A279	A276-P278 WeakPolarHBondContact O-CD 3.35Å; A276-A279 PolarHBondContact O-N 3.11Å
277	E	79.4	Confident	68.5	Low	14 Å²	14	70.8 Å²	70.8	7%	0.065	37%	0.369	C	S	.	.	H	α-helix	trans	-39.3	-40.9	179.8	-178.1	178.3	98.7	0	0	114.5	P17 G18 R19 L20 G21 L22 A279 I280 V281	P17-E277 WeakPolarHBondContact O-CB 3.44Å; G18-E277 VanDerWaalsContact CA-CD 3.44Å; G18-E277 WeakPolarHBondContact CA-OE1 3.33Å; G18-E277 VanDerWaalsContact CA-OE2 3.25Å; G18-E277 WeakPolarHBondContact CA-OE2 3.42Å; R19-E277 PolarHBondContact N-OE1 2.66Å; R19-E277 PolarHBondContact N-OE2 3.31Å; L20-E277 WeakPolarHBondContact CA-OE2 3.36Å; L20-E277 HydrophobicContact CB-CG 4.38Å; L20-E277 VanDerWaalsContact CB-OE2 3.3Å; L20-E277 WeakPolarHBondContact CB-OE2 3.23Å; L20-E277 HydrophobicContact CD1-CG 4.04Å; L20-E277 HydrophobicContact CG-CG 4.33Å; L20-E277 PolarHBondContact N-OE1 2.96Å; L20-E277 PolarHBondContact N-OE2 2.87Å; G21-E277 PolarHBondContact N-OE2 3.01Å; L22-E277 HydrophobicContact CD1-CG 3.93Å; L22-E277 HydrophobicContact CG-CG 4.31Å; E277-A279 VanDerWaalsContact C-N 3.31Å; E277-A279 PolarHBondContact O-N 2.71Å; E277-I280 PolarHBondContact O-N 3.18Å; E277-I280 VanDerWaalsContact O-N 3.16Å; E277-V281 HydrophobicContact CG-CG2 4.19Å; E277-V281 WeakPolarHBondContact O-CG2 3.5Å; E277-V281 PolarHBondContact O-N 3.38Å
278	P	82.4	Confident	70.4	Confident	94 Å²	94	67.1 Å²	67.1	61%	0.61	34%	0.344	S	S	*	.	H	α-helix	trans	-57.1	-35.2	176.9	-27.6	36.9	0	0	0	115.6	A276 R282	A276-P278 WeakPolarHBondContact O-CD 3.35Å; P278-R282 WeakPolarHBondContact O-CB 3.3Å; P278-R282 PolarHBondContact O-N 3Å
279	A	79.3	Confident	72.3	Confident	36 Å²	36	63.4 Å²	63.4	30%	0.298	33%	0.326	S	S	.	.	H	α-helix	trans	-72	-37.2	179.2	0	0	0	0	0	111.5	A276 E277 R282 I283	A276-A279 PolarHBondContact O-N 3.11Å; E277-A279 VanDerWaalsContact C-N 3.31Å; E277-A279 PolarHBondContact O-N 2.71Å; A279-R282 PolarHBondContact O-N 3.15Å; A279-I283 WeakPolarHBondContact O-CG1 3.44Å; A279-I283 PolarHBondContact O-N 3.29Å; A279-I283 VanDerWaalsContact O-N 3.11Å
280	I	78.8	Confident	74.5	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-48.5	173.3	-58.6	-59.6	0	0	0	110.3	L16 L22 L179 L255 E277 R282 I283 F284	L16-I280 HydrophobicContact CD1-CG1 3.75Å; L22-I280 HydrophobicContact CD1-CB 3.97Å; L22-I280 HydrophobicContact CD1-CG2 3.6Å; L179-I280 HydrophobicContact CD1-CG2 4.44Å; L255-I280 HydrophobicContact CD1-CD1 3.66Å; L255-I280 HydrophobicContact CD2-CD1 4.05Å; L255-I280 HydrophobicContact CD2-CG2 4.11Å; L255-I280 HydrophobicContact CG-CD1 4.48Å; E277-I280 PolarHBondContact O-N 3.18Å; E277-I280 VanDerWaalsContact O-N 3.16Å; I280-R282 VanDerWaalsContact C-N 3.28Å; I280-R282 PolarHBondContact O-N 3.03Å; I280-I283 PolarHBondContact O-N 2.86Å; I280-I283 VanDerWaalsContact O-N 3.14Å; I280-F284 HydrophobicContact CG2-CD2 3.81Å; I280-F284 HydrophobicContact CG2-CE2 3.94Å; I280-F284 WeakPolarHBondContact O-CD2 3.47Å; I280-F284 PolarHBondContact O-N 3.21Å
281	V	83.1	Confident	76.6	Confident	43 Å²	43	59 Å²	59	26%	0.261	30%	0.303	S	S	.	.	H	α-helix	trans	-53.3	-48.8	175.6	172.5	0	0	0	0	110.5	L20 L179 E277 I283 F284 S285	L20-V281 HydrophobicContact CD1-CG2 3.45Å; L20-V281 VanDerWaalsContact CD1-CG2 3.45Å; L179-V281 HydrophobicContact CD1-CB 4.27Å; L179-V281 HydrophobicContact CD1-CG2 3.76Å; E277-V281 HydrophobicContact CG-CG2 4.19Å; E277-V281 WeakPolarHBondContact O-CG2 3.5Å; E277-V281 PolarHBondContact O-N 3.38Å; V281-I283 PolarHBondContact O-N 3.04Å; V281-F284 PolarHBondContact O-N 3.47Å; V281-S285 WeakPolarHBondContact O-CB 3.39Å; V281-S285 PolarHBondContact O-N 3.07Å; V281-S285 PolarHBondContact O-OG 2.92Å
282	R	82.8	Confident	78.5	Confident	163 Å²	163	63 Å²	63	62%	0.615	33%	0.333	S	S	*	.	H	α-helix	trans	-56.6	-46.5	178.1	-177.4	177.8	176.8	180	-0.1	112.6	P278 A279 I280 F284 S285 E286	P278-R282 WeakPolarHBondContact O-CB 3.3Å; P278-R282 PolarHBondContact O-N 3Å; A279-R282 PolarHBondContact O-N 3.15Å; I280-R282 VanDerWaalsContact C-N 3.28Å; I280-R282 PolarHBondContact O-N 3.03Å; R282-F284 VanDerWaalsContact C-N 3.35Å; R282-F284 PolarHBondContact O-N 2.81Å; R282-S285 PolarHBondContact O-N 2.8Å; R282-E286 HydrophobicContact CG-CG 4.29Å; R282-E286 WeakPolarHBondContact CG-OE1 3.23Å; R282-E286 IonicContact CZ-OE1 2.7Å; R282-E286 IonicContact NE-OE1 3.25Å; R282-E286 PolarHBondContact NE-OE1 3.01Å; R282-E286 IonicContact NE-OE2 2.97Å; R282-E286 IonicContact NH2-OE1 3.38Å; R282-E286 PolarHBondContact NH2-OE1 2.8Å; R282-E286 WeakPolarHBondContact O-CB 3.28Å; R282-E286 WeakPolarHBondContact O-CG 3.49Å; R282-E286 PolarHBondContact O-N 2.75Å
283	I	79.9	Confident	80.6	Confident	34 Å²	34	63.6 Å²	63.6	17%	0.174	33%	0.327	C	S	.	.	H	α-helix	trans	-61.8	-44.5	179	-67	163.1	0	0	0	110.9	L255 A279 I280 V281 E286 K287	L255-I283 HydrophobicContact CB-CD1 4.25Å; L255-I283 HydrophobicContact CB-CG2 4.32Å; L255-I283 HydrophobicContact CD2-CB 3.94Å; L255-I283 HydrophobicContact CD2-CD1 4.04Å; L255-I283 HydrophobicContact CD2-CG2 3.65Å; A279-I283 WeakPolarHBondContact O-CG1 3.44Å; A279-I283 PolarHBondContact O-N 3.29Å; A279-I283 VanDerWaalsContact O-N 3.11Å; I280-I283 PolarHBondContact O-N 2.86Å; I280-I283 VanDerWaalsContact O-N 3.14Å; V281-I283 PolarHBondContact O-N 3.04Å; I283-E286 PolarHBondContact O-N 3.26Å; I283-K287 HydrophobicContact CG2-CD 3.99Å; I283-K287 HydrophobicContact CG2-CG 4.43Å; I283-K287 WeakPolarHBondContact O-CB 3.47Å; I283-K287 PolarHBondContact O-N 2.79Å
284	F	83.4	Confident	82.6	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-43.7	178.1	-90.3	-88.8	0	0	0	112	L179 L180 L255 P257 L261 I280 V281 R282 A288 A289	L179-F284 HydrophobicContact CD1-CB 3.98Å; L179-F284 HydrophobicContact CD1-CD2 4.06Å; L179-F284 HydrophobicContact CD1-CG 4.06Å; L179-F284 HydrophobicContact CD2-CD1 4.06Å; L179-F284 HydrophobicContact CD2-CD2 3.75Å; L179-F284 HydrophobicContact CD2-CE1 4.16Å; L179-F284 HydrophobicContact CD2-CE2 3.79Å; L179-F284 HydrophobicContact CD2-CG 3.88Å; L179-F284 HydrophobicContact CD2-CZ 4.03Å; L179-F284 HydrophobicContact CG-CB 4.16Å; L179-F284 HydrophobicContact CG-CD1 4.27Å; L179-F284 HydrophobicContact CG-CD2 4.16Å; L179-F284 HydrophobicContact CG-CG 3.94Å; L180-F284 HydrophobicContact CD1-CD1 3.78Å; L180-F284 HydrophobicContact CD1-CE1 4.11Å; L180-F284 HydrophobicContact CD2-CB 4.24Å; L180-F284 HydrophobicContact CD2-CD1 4.09Å; L180-F284 HydrophobicContact CG-CD1 3.97Å; L255-F284 HydrophobicContact CD2-CD2 3.8Å; L255-F284 HydrophobicContact CD2-CE2 3.54Å; L255-F284 HydrophobicContact CG-CE2 4.37Å; P257-F284 HydrophobicContact CB-CD1 3.91Å; P257-F284 HydrophobicContact CB-CE1 3.39Å; P257-F284 HydrophobicContact CB-CE2 4.47Å; P257-F284 HydrophobicContact CB-CZ 3.72Å; L261-F284 HydrophobicContact CB-CE1 4.49Å; L261-F284 HydrophobicContact CB-CZ 4.31Å; L261-F284 HydrophobicContact CD2-CD1 4.29Å; L261-F284 HydrophobicContact CD2-CE1 3.44Å; L261-F284 VanDerWaalsContact CD2-CE1 3.44Å; L261-F284 HydrophobicContact CD2-CZ 4.04Å; L261-F284 WeakPolarHBondContact O-CE2 3.39Å; L261-F284 WeakPolarHBondContact O-CZ 3.37Å; I280-F284 HydrophobicContact CG2-CD2 3.81Å; I280-F284 HydrophobicContact CG2-CE2 3.94Å; I280-F284 WeakPolarHBondContact O-CD2 3.47Å; I280-F284 PolarHBondContact O-N 3.21Å; V281-F284 PolarHBondContact O-N 3.47Å; R282-F284 VanDerWaalsContact C-N 3.35Å; R282-F284 PolarHBondContact O-N 2.81Å; F284-A288 CarbonylContact O-C 3.54Å; F284-A288 PolarHBondContact O-N 2.97Å; F284-A289 PolarHBondContact O-N 2.93Å
285	S	84.4	Confident	84.5	Confident	66 Å²	66	56.8 Å²	56.8	46%	0.462	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-42.9	176	-61.3	0	0	0	0	112.7	V281 R282	V281-S285 WeakPolarHBondContact O-CB 3.39Å; V281-S285 PolarHBondContact O-N 3.07Å; V281-S285 PolarHBondContact O-OG 2.92Å; R282-S285 PolarHBondContact O-N 2.8Å
286	E	83.3	Confident	86.2	Confident	110 Å²	110	57.7 Å²	57.7	51%	0.514	31%	0.305	S	S	.	.	H	α-helix	trans	-77	-40.6	-176.6	-73.8	175.8	175.9	0	0	113.1	R282 I283	R282-E286 HydrophobicContact CG-CG 4.29Å; R282-E286 WeakPolarHBondContact CG-OE1 3.23Å; R282-E286 IonicContact CZ-OE1 2.7Å; R282-E286 IonicContact NE-OE1 3.25Å; R282-E286 PolarHBondContact NE-OE1 3.01Å; R282-E286 IonicContact NE-OE2 2.97Å; R282-E286 IonicContact NH2-OE1 3.38Å; R282-E286 PolarHBondContact NH2-OE1 2.8Å; R282-E286 WeakPolarHBondContact O-CB 3.28Å; R282-E286 WeakPolarHBondContact O-CG 3.49Å; R282-E286 PolarHBondContact O-N 2.75Å; I283-E286 PolarHBondContact O-N 3.26Å
287	K	81.9	Confident	87.3	Confident	84 Å²	84	61 Å²	61	37%	0.365	31%	0.309	S	S	.	.	H	α-helix	trans	-96.4	-20.7	-168.6	-65	-169.1	179.2	179.1	0	114.5	V246 T253 I283	V246-K287 WeakPolarHBondContact CG2-O 3.34Å; T253-K287 PolarHBondContact OG1-NZ 2.94Å; I283-K287 HydrophobicContact CG2-CD 3.99Å; I283-K287 HydrophobicContact CG2-CG 4.43Å; I283-K287 WeakPolarHBondContact O-CB 3.47Å; I283-K287 PolarHBondContact O-N 2.79Å
288	A	85.4	Confident	88.1	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-153.1	-13.6	-158.4	0	0	0	0	0	115.9	R243 Q244 V246 P257 F284	R243-A288 VanDerWaalsContact CA-O 3.3Å; R243-A288 WeakPolarHBondContact CA-O 3.3Å; R243-A288 WeakPolarHBondContact CB-O 3.46Å; R243-A288 PolarHBondContact NE-O 2.96Å; Q244-A288 PolarHBondContact N-O 3.06Å; Q244-A288 VanDerWaalsContact N-O 3.08Å; V246-A288 HydrophobicContact CG2-CB 3.63Å; P257-A288 HydrophobicContact CB-CB 4.08Å; P257-A288 HydrophobicContact CG-CB 4.09Å; F284-A288 CarbonylContact O-C 3.54Å; F284-A288 PolarHBondContact O-N 2.97Å
289	A	89.1	Confident	88.8	Confident	16 Å²	16	56.9 Å²	56.9	13%	0.132	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-75.1	143	171.8	0	0	0	0	0	110.8	L180 Q244 F284	L180-A289 HydrophobicContact CD2-CB 3.74Å; Q244-A289 VanDerWaalsContact CD-O 3.29Å; Q244-A289 WeakPolarHBondContact CG-O 3.33Å; Q244-A289 PolarHBondContact NE2-O 2.98Å; Q244-A289 VanDerWaalsContact NE2-O 3.16Å; F284-A289 PolarHBondContact O-N 2.93Å
290	L	93.2	Very high	89.6	Confident	19 Å²	19	59.7 Å²	59.7	10%	0.099	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-74.1	157.9	165	-66.9	179	0	0	0	110.2	P242 Q244 E294 I298	P242-L290 HydrophobicContact CB-CD1 3.76Å; P242-L290 HydrophobicContact CG-CD1 4.04Å; Q244-L290 HydrophobicContact CG-CD2 4.05Å; L290-E294 HydrophobicContact CB-CB 4.28Å; L290-I298 HydrophobicContact CD1-CD1 3.61Å
291	K	93.1	Very high	90.5	Very high	115 Å²	115	62.4 Å²	62.4	50%	0.5	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-69.5	150.7	167.5	-60.4	178.9	-171.3	169.7	0	109.3	Y293 E294 F295	K291-Y293 VanDerWaalsContact C-N 3.3Å; K291-Y293 HydrophobicContact CB-CD1 3.93Å; K291-Y293 HydrophobicContact CB-CE1 3.66Å; K291-Y293 HydrophobicContact CD-CD1 4.4Å; K291-Y293 HydrophobicContact CD-CE1 3.38Å; K291-Y293 WeakPolarHBondContact CD-OH 3.44Å; K291-Y293 HydrophobicContact CG-CE1 4.2Å; K291-Y293 PolarHBondContact NZ-OH 2.96Å; K291-Y293 PolarHBondContact O-N 2.98Å; K291-E294 HydrophobicContact CB-CG 4.16Å; K291-E294 PolarHBondContact N-OE2 3.06Å; K291-E294 WeakPolarHBondContact O-CB 3.5Å; K291-E294 PolarHBondContact O-N 2.82Å; K291-F295 PolarHBondContact O-N 3.14Å; K291-F295 VanDerWaalsContact O-N 3.14Å
292	S	92.8	Very high	91.1	Very high	93 Å²	93	60.3 Å²	60.3	65%	0.65	29%	0.292	S	S	*	.	H	α-helix	trans	-55.3	-42.8	-174.8	-50.6	0	0	0	0	113.2	E294 F295 D296	S292-E294 VanDerWaalsContact C-N 3.27Å; S292-E294 PolarHBondContact O-N 3.22Å; S292-F295 PolarHBondContact O-N 2.94Å; S292-D296 PolarHBondContact O-N 3.11Å
293	Y	95	Very high	91.7	Very high	141 Å²	141	57.2 Å²	57.2	55%	0.553	28%	0.283	S	S	*	.	H	α-helix	trans	-65.5	-28.2	178.7	72.4	-99.2	0	0	0	113.5	K291 K297	K291-Y293 VanDerWaalsContact C-N 3.3Å; K291-Y293 HydrophobicContact CB-CD1 3.93Å; K291-Y293 HydrophobicContact CB-CE1 3.66Å; K291-Y293 HydrophobicContact CD-CD1 4.4Å; K291-Y293 HydrophobicContact CD-CE1 3.38Å; K291-Y293 WeakPolarHBondContact CD-OH 3.44Å; K291-Y293 HydrophobicContact CG-CE1 4.2Å; K291-Y293 PolarHBondContact NZ-OH 2.96Å; K291-Y293 PolarHBondContact O-N 2.98Å; Y293-K297 WeakPolarHBondContact O-CB 3.48Å; Y293-K297 PolarHBondContact O-N 3.31Å; Y293-K297 VanDerWaalsContact O-N 3.15Å
294	E	96	Very high	92.3	Very high	61 Å²	61	62.3 Å²	62.3	29%	0.285	31%	0.306	S	S	.	.	H	α-helix	trans	-73.7	-41.4	176.8	-59.9	174.1	145.4	0	0	109.9	L290 K291 S292 I298	L290-E294 HydrophobicContact CB-CB 4.28Å; K291-E294 HydrophobicContact CB-CG 4.16Å; K291-E294 PolarHBondContact N-OE2 3.06Å; K291-E294 WeakPolarHBondContact O-CB 3.5Å; K291-E294 PolarHBondContact O-N 2.82Å; S292-E294 VanDerWaalsContact C-N 3.27Å; S292-E294 PolarHBondContact O-N 3.22Å; E294-I298 WeakPolarHBondContact O-CG1 3.26Å; E294-I298 PolarHBondContact O-N 3.15Å
295	F	96.3	Very high	92.8	Very high	5 Å²	5	66 Å²	66	2%	0.022	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-45.5	174.7	-178.7	-100.1	0	0	0	112.1	V174 K176 P181 V183 P242 K291 S292 K297 I298 V299	V174-F295 HydrophobicContact CG1-CE1 3.7Å; V174-F295 HydrophobicContact CG1-CZ 3.94Å; K176-F295 HydrophobicContact CG-CE1 4.39Å; P181-F295 HydrophobicContact CB-CD1 3.8Å; P181-F295 HydrophobicContact CB-CD2 3.81Å; P181-F295 HydrophobicContact CB-CE1 3.71Å; P181-F295 HydrophobicContact CB-CE2 3.73Å; P181-F295 HydrophobicContact CB-CG 3.84Å; P181-F295 HydrophobicContact CB-CZ 3.68Å; P181-F295 HydrophobicContact CG-CB 4.45Å; P181-F295 HydrophobicContact CG-CD1 4.37Å; P181-F295 HydrophobicContact CG-CD2 3.88Å; P181-F295 HydrophobicContact CG-CE2 4.22Å; P181-F295 HydrophobicContact CG-CG 3.96Å; V183-F295 HydrophobicContact CG2-CE2 4.19Å; V183-F295 HydrophobicContact CG2-CZ 4.21Å; P242-F295 HydrophobicContact CG-CD2 3.69Å; P242-F295 HydrophobicContact CG-CE2 3.8Å; K291-F295 PolarHBondContact O-N 3.14Å; K291-F295 VanDerWaalsContact O-N 3.14Å; S292-F295 PolarHBondContact O-N 2.94Å; F295-K297 VanDerWaalsContact C-N 3.3Å; F295-K297 PolarHBondContact O-N 2.92Å; F295-I298 WeakPolarHBondContact O-CB 3.49Å; F295-I298 PolarHBondContact O-N 2.97Å; F295-I298 VanDerWaalsContact O-N 3.14Å; F295-V299 HydrophobicContact CD1-CG2 4.05Å; F295-V299 HydrophobicContact CE1-CG2 3.56Å; F295-V299 HydrophobicContact CE2-CG2 4.34Å; F295-V299 HydrophobicContact CZ-CG2 3.72Å; F295-V299 WeakPolarHBondContact O-CG2 3.37Å; F295-V299 PolarHBondContact O-N 2.84Å
296	D	96.3	Very high	93.1	Very high	58 Å²	58	64.5 Å²	64.5	31%	0.31	31%	0.305	S	S	.	.	H	α-helix	trans	-61.3	-40.3	178.8	-70.9	-35.7	0	0	0	111.2	K176 S292 I298 V299 D300	K176-D296 IonicContact NZ-OD1 3.71Å; K176-D296 PolarHBondContact NZ-OD1 2.78Å; S292-D296 PolarHBondContact O-N 3.11Å; D296-I298 PolarHBondContact O-N 2.91Å; D296-V299 WeakPolarHBondContact O-CB 3.41Å; D296-V299 PolarHBondContact O-N 3.38Å; D296-V299 VanDerWaalsContact O-N 3.15Å; D296-D300 PolarHBondContact O-N 3.18Å
297	K	97	Very high	93.2	Very high	126 Å²	126	63.5 Å²	63.5	55%	0.548	31%	0.311	S	S	.	.	H	α-helix	trans	-58.1	-45.7	172.7	-179.5	-178.2	172	-176.1	0	112.4	Y293 F295 V299 D300 E301	Y293-K297 WeakPolarHBondContact O-CB 3.48Å; Y293-K297 PolarHBondContact O-N 3.31Å; Y293-K297 VanDerWaalsContact O-N 3.15Å; F295-K297 VanDerWaalsContact C-N 3.3Å; F295-K297 PolarHBondContact O-N 2.92Å; K297-V299 VanDerWaalsContact C-N 3.3Å; K297-V299 PolarHBondContact O-N 3.04Å; K297-D300 PolarHBondContact O-N 3.18Å; K297-E301 WeakPolarHBondContact CE-OE1 2.93Å; K297-E301 IonicContact NZ-OE1 2.73Å; K297-E301 WeakPolarHBondContact O-CG 3.4Å; K297-E301 PolarHBondContact O-N 2.73Å
298	I	97	Very high	93.1	Very high	11 Å²	11	62.2 Å²	62.2	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-43.1	175.8	-75.5	168.1	0	0	0	110.8	F206 Q211 P242 L290 E294 F295 D296 E301 L302	F206-I298 HydrophobicContact CE1-CG2 3.66Å; F206-I298 HydrophobicContact CZ-CG2 4.37Å; Q211-I298 HydrophobicContact CG-CD1 3.9Å; P242-I298 HydrophobicContact CB-CD1 4.05Å; P242-I298 HydrophobicContact CG-CD1 4.37Å; L290-I298 HydrophobicContact CD1-CD1 3.61Å; E294-I298 WeakPolarHBondContact O-CG1 3.26Å; E294-I298 PolarHBondContact O-N 3.15Å; F295-I298 WeakPolarHBondContact O-CB 3.49Å; F295-I298 PolarHBondContact O-N 2.97Å; F295-I298 VanDerWaalsContact O-N 3.14Å; D296-I298 PolarHBondContact O-N 2.91Å; I298-E301 PolarHBondContact O-N 3.45Å; I298-L302 HydrophobicContact CG2-CD1 3.83Å; I298-L302 HydrophobicContact CG2-CG 4.43Å; I298-L302 WeakPolarHBondContact O-CB 3.26Å; I298-L302 VanDerWaalsContact O-CG 3.31Å; I298-L302 WeakPolarHBondContact O-CG 3.37Å; I298-L302 PolarHBondContact O-N 2.79Å
299	V	97.1	Very high	92	Very high	11 Å²	11	68.5 Å²	68.5	7%	0.067	36%	0.356	C	S	.	.	H	α-helix	trans	-62.4	-44.2	179.2	170.9	0	0	0	0	111	I168 V174 V183 F295 D296 K297 L302 K303	I168-V299 HydrophobicContact CD1-CG1 4.32Å; I168-V299 HydrophobicContact CG1-CG1 4.11Å; I168-V299 HydrophobicContact CG2-CG1 4.02Å; V174-V299 HydrophobicContact CG1-CG2 4.41Å; V174-V299 HydrophobicContact CG2-CB 4.44Å; V174-V299 HydrophobicContact CG2-CG1 3.85Å; V174-V299 HydrophobicContact CG2-CG2 3.66Å; V183-V299 HydrophobicContact CG2-CG2 4.4Å; F295-V299 HydrophobicContact CD1-CG2 4.05Å; F295-V299 HydrophobicContact CE1-CG2 3.56Å; F295-V299 HydrophobicContact CE2-CG2 4.34Å; F295-V299 HydrophobicContact CZ-CG2 3.72Å; F295-V299 WeakPolarHBondContact O-CG2 3.37Å; F295-V299 PolarHBondContact O-N 2.84Å; D296-V299 WeakPolarHBondContact O-CB 3.41Å; D296-V299 PolarHBondContact O-N 3.38Å; D296-V299 VanDerWaalsContact O-N 3.15Å; K297-V299 VanDerWaalsContact C-N 3.3Å; K297-V299 PolarHBondContact O-N 3.04Å; V299-L302 PolarHBondContact O-N 3.05Å; V299-K303 WeakPolarHBondContact O-CB 3.36Å; V299-K303 PolarHBondContact O-N 3.07Å
300	D	96.4	Very high	90.5	Very high	94 Å²	94	73.7 Å²	73.7	50%	0.503	37%	0.373	S	S	.	.	H	α-helix	trans	-63	-43.5	177.2	-74.1	-25.6	0	0	0	112.1	D296 K297 K303 Q304	D296-D300 PolarHBondContact O-N 3.18Å; K297-D300 PolarHBondContact O-N 3.18Å; D300-K303 WeakPolarHBondContact O-CB 3.19Å; D300-K303 PolarHBondContact O-N 2.73Å; D300-Q304 WeakPolarHBondContact O-CG 3.39Å; D300-Q304 PolarHBondContact O-N 3.23Å; D300-Q304 VanDerWaalsContact O-N 3.11Å
301	E	96.5	Very high	88.3	Confident	60 Å²	60	81.3 Å²	81.3	28%	0.28	41%	0.408	S	S	.	.	H	α-helix	trans	-64.3	-40.5	177.2	-71.9	173.8	171.6	0	0	111.8	H205 K297 I298 Q304 R305	H205-E301 IonicContact CE1-OE2 3.55Å; H205-E301 PolarHBondContact CE1-OE2 3.38Å; H205-E301 IonicContact NE2-OE2 3.75Å; K297-E301 WeakPolarHBondContact CE-OE1 2.93Å; K297-E301 IonicContact NZ-OE1 2.73Å; K297-E301 WeakPolarHBondContact O-CG 3.4Å; K297-E301 PolarHBondContact O-N 2.73Å; I298-E301 PolarHBondContact O-N 3.45Å; E301-Q304 PolarHBondContact O-N 3.23Å; E301-R305 WeakPolarHBondContact O-CG 2.77Å; E301-R305 PolarHBondContact O-N 3.13Å; E301-R305 VanDerWaalsContact O-N 3.14Å
302	L	96.6	Very high	85.7	Confident	0 Å²	0	81 Å²	81	0%	0	42%	0.416	C	S	.	.	H	α-helix	trans	-67.4	-39.9	174.8	-74.1	171.9	0	0	0	112.3	L172 V183 V202 H205 F206 I298 V299 Q304 R305 F306	L172-L302 HydrophobicContact CD2-CB 4.13Å; V183-L302 HydrophobicContact CB-CD1 4.49Å; V183-L302 HydrophobicContact CG1-CD1 4.12Å; V183-L302 HydrophobicContact CG2-CD1 3.9Å; V202-L302 HydrophobicContact CB-CD2 4.48Å; V202-L302 HydrophobicContact CG1-CD1 4.41Å; V202-L302 HydrophobicContact CG2-CD2 4.32Å; H205-L302 HydrophobicContact CB-CD2 3.63Å; F206-L302 HydrophobicContact CZ-CD1 4.46Å; I298-L302 HydrophobicContact CG2-CD1 3.83Å; I298-L302 HydrophobicContact CG2-CG 4.43Å; I298-L302 WeakPolarHBondContact O-CB 3.26Å; I298-L302 VanDerWaalsContact O-CG 3.31Å; I298-L302 WeakPolarHBondContact O-CG 3.37Å; I298-L302 PolarHBondContact O-N 2.79Å; V299-L302 PolarHBondContact O-N 3.05Å; L302-Q304 VanDerWaalsContact C-N 3.29Å; L302-Q304 PolarHBondContact O-N 2.97Å; L302-R305 PolarHBondContact O-N 3.35Å; L302-F306 WeakPolarHBondContact O-CD2 3.22Å; L302-F306 PolarHBondContact O-N 2.9Å
303	K	95	Very high	83.1	Confident	98 Å²	98	84 Å²	84	43%	0.426	42%	0.42	S	S	.	.	H	α-helix	trans	-57.7	-43.6	175.7	-173.7	178.8	-172.5	174.5	0	111.5	I168 V299 D300 F306 S307	I168-K303 HydrophobicContact CG2-CB 3.7Å; I168-K303 HydrophobicContact CG2-CD 3.73Å; I168-K303 HydrophobicContact CG2-CG 3.72Å; V299-K303 WeakPolarHBondContact O-CB 3.36Å; V299-K303 PolarHBondContact O-N 3.07Å; D300-K303 WeakPolarHBondContact O-CB 3.19Å; D300-K303 PolarHBondContact O-N 2.73Å; K303-F306 PolarHBondContact O-N 3.41Å; K303-S307 PolarHBondContact O-N 3.1Å; K303-S307 PolarHBondContact O-OG 2.68Å
304	Q	93.3	Very high	80.2	Confident	140 Å²	140	83.6 Å²	83.6	65%	0.654	43%	0.432	S	S	*	.	H	α-helix	trans	-63.1	-45	175.8	-68.8	175.4	12.8	0	0	111.6	D300 E301 L302 F306 S307 A308	D300-Q304 WeakPolarHBondContact O-CG 3.39Å; D300-Q304 PolarHBondContact O-N 3.23Å; D300-Q304 VanDerWaalsContact O-N 3.11Å; E301-Q304 PolarHBondContact O-N 3.23Å; L302-Q304 VanDerWaalsContact C-N 3.29Å; L302-Q304 PolarHBondContact O-N 2.97Å; Q304-F306 PolarHBondContact O-N 3.48Å; Q304-S307 PolarHBondContact O-N 3.15Å; Q304-S307 VanDerWaalsContact O-N 3.12Å; Q304-A308 PolarHBondContact O-N 3.37Å; Q304-A308 VanDerWaalsContact O-N 3.14Å
305	R	92.6	Very high	77.5	Confident	78 Å²	78	84.2 Å²	84.2	29%	0.294	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-38.8	178.1	-72.9	178.4	-178.6	-131.3	0.8	113.4	H205 E208 E301 L302 S307	H205-R305 VanDerWaalsContact ND1-CZ 3.31Å; H205-R305 PolarHBondContact ND1-NE 3.4Å; H205-R305 PolarHBondContact ND1-NH2 2.94Å; E208-R305 IonicContact OE1-NH1 2.78Å; E208-R305 IonicContact OE2-CZ 3.52Å; E208-R305 IonicContact OE2-NH1 3.41Å; E208-R305 PolarHBondContact OE2-NH1 3.15Å; E208-R305 IonicContact OE2-NH2 3.15Å; E208-R305 PolarHBondContact OE2-NH2 3.47Å; E301-R305 WeakPolarHBondContact O-CG 2.77Å; E301-R305 PolarHBondContact O-N 3.13Å; E301-R305 VanDerWaalsContact O-N 3.14Å; L302-R305 PolarHBondContact O-N 3.35Å; R305-S307 VanDerWaalsContact C-N 3.26Å; R305-S307 PolarHBondContact O-N 3.46Å
306	F	91.5	Very high	74.7	Confident	35 Å²	35	88.1 Å²	88.1	15%	0.154	47%	0.47	C	S	.	.	H	α-helix	trans	-72.1	-20.9	177	-88.5	-116.2	0	0	0	113.1	A169 L172 Q198 L201 V202 L302 K303 Q304	A169-F306 HydrophobicContact CB-CB 3.7Å; A169-F306 HydrophobicContact CB-CD1 4.36Å; A169-F306 HydrophobicContact CB-CG 4.33Å; L172-F306 HydrophobicContact CB-CD1 3.82Å; L172-F306 HydrophobicContact CB-CE1 3.77Å; L172-F306 HydrophobicContact CB-CG 4.36Å; L172-F306 HydrophobicContact CB-CZ 4.28Å; L172-F306 HydrophobicContact CD1-CE1 4.12Å; L172-F306 HydrophobicContact CD1-CE2 4.03Å; L172-F306 HydrophobicContact CD1-CZ 3.76Å; L172-F306 HydrophobicContact CD2-CD1 4.31Å; L172-F306 HydrophobicContact CD2-CD2 3.94Å; L172-F306 HydrophobicContact CD2-CE2 4.16Å; L172-F306 HydrophobicContact CD2-CG 4.02Å; L172-F306 HydrophobicContact CD2-CZ 4.45Å; L172-F306 HydrophobicContact CG-CE1 4.36Å; L172-F306 HydrophobicContact CG-CZ 4.39Å; Q198-F306 HydrophobicContact CB-CE1 3.84Å; Q198-F306 HydrophobicContact CB-CZ 3.9Å; Q198-F306 HydrophobicContact CG-CE1 3.64Å; Q198-F306 HydrophobicContact CG-CZ 4.18Å; L201-F306 HydrophobicContact CB-CD2 4.39Å; L201-F306 HydrophobicContact CB-CE2 3.71Å; L201-F306 HydrophobicContact CB-CZ 4.19Å; L201-F306 HydrophobicContact CD1-CD2 4.28Å; L201-F306 HydrophobicContact CD1-CE2 4.14Å; L201-F306 HydrophobicContact CD1-CZ 4.35Å; V202-F306 HydrophobicContact CG2-CE2 3.9Å; V202-F306 HydrophobicContact CG2-CZ 3.95Å; L302-F306 WeakPolarHBondContact O-CD2 3.22Å; L302-F306 PolarHBondContact O-N 2.9Å; K303-F306 PolarHBondContact O-N 3.41Å; Q304-F306 PolarHBondContact O-N 3.48Å
307	S	85.8	Confident	72	Confident	89 Å²	89	90 Å²	90	62%	0.622	49%	0.487	S	S	*	.	H	α-helix	trans	-90.7	-16.6	178.8	-53.9	0	0	0	0	113.2	K303 Q304 R305	K303-S307 PolarHBondContact O-N 3.1Å; K303-S307 PolarHBondContact O-OG 2.68Å; Q304-S307 PolarHBondContact O-N 3.15Å; Q304-S307 VanDerWaalsContact O-N 3.12Å; R305-S307 VanDerWaalsContact C-N 3.26Å; R305-S307 PolarHBondContact O-N 3.46Å
308	A	80.1	Confident	69.2	Low	57 Å²	57	86 Å²	86	47%	0.471	48%	0.482	S	S	.	.	S	Bend	trans	-69.5	139.7	-178.4	0	0	0	0	0	111.8	Q304 Y310	Q304-A308 PolarHBondContact O-N 3.37Å; Q304-A308 VanDerWaalsContact O-N 3.14Å; A308-Y310 PolarHBondContact O-N 2.79Å
309	P	61.9	Low	66.7	Low	131 Å²	131	87.8 Å²	87.8	85%	0.851	49%	0.493	S	S	*	.			trans	-58	113.6	173.7	-19.8	30	0	0	0	110.2	Q311	P309-Q311 PolarHBondContact O-N 2.8Å
310	Y	56.8	Low	64.3	Low	125 Å²	125	90.8 Å²	90.8	49%	0.49	51%	0.511	S	S	.	.			trans	-75.1	126.8	-175.6	-165.4	-96.5	0	0	0	110.7	L201 A308 T312	L201-Y310 HydrophobicContact CD2-CE2 4.11Å; A308-Y310 PolarHBondContact O-N 2.79Å; Y310-T312 PolarHBondContact O-N 3.19Å; Y310-T312 VanDerWaalsContact O-N 3.12Å
311	Q	46.9	Very low	61.7	Low	179 Å²	179	90.2 Å²	90.2	84%	0.836	52%	0.515	S	S	*	.			trans	-71.3	104.6	166.9	-69.6	-176.9	0.7	0	0	108.7	P309 Q313	P309-Q311 PolarHBondContact O-N 2.8Å; Q311-Q313 PolarHBondContact O-N 3.33Å
312	T	38.3	Very low	59.4	Low	109 Å²	109	95.5 Å²	95.5	67%	0.669	54%	0.537	S	S	*	.			trans	-58.2	105.9	-178.7	-5.4	0	0	0	0	111.7	Y310	Y310-T312 PolarHBondContact O-N 3.19Å; Y310-T312 VanDerWaalsContact O-N 3.12Å
313	Q	38.4	Very low	56.9	Low	157 Å²	157	97.5 Å²	97.5	73%	0.734	55%	0.546	S	S	*	.			trans	-86.9	112.1	150	-75.9	-174.3	2.9	0	0	108.1	R197 Q311 M315	R197-Q313 PolarHBondContact NH2-O 3.08Å; Q311-Q313 PolarHBondContact O-N 3.33Å; Q313-M315 PolarHBondContact O-N 2.66Å; Q313-M315 VanDerWaalsContact O-N 3.09Å
314	T	34.5	Very low	54.6	Low	132 Å²	132	95.3 Å²	95.3	81%	0.81	54%	0.539	S	S	*	.			trans	-61	107.5	-179.8	-33.2	0	0	0	0	109.5
315	M	40.3	Very low	52.4	Low	73 Å²	73	93.6 Å²	93.6	36%	0.36	53%	0.53	S	S	.	.			trans	-91.8	115.3	168.4	-74.6	-65.4	-55.6	0	0	106.9	V113 N193 Q313 S317	V113-M315 HydrophobicContact CG1-CE 3.36Å; V113-M315 HydrophobicContact CG1-SD 4.26Å; N193-M315 PolarHBondContact ND2-O 3.15Å; Q313-M315 PolarHBondContact O-N 2.66Å; Q313-M315 VanDerWaalsContact O-N 3.09Å; M315-S317 PolarHBondContact O-N 3.14Å
316	A	36.1	Very low	50.3	Low	88 Å²	88	95 Å²	95	73%	0.727	54%	0.538	S	S	*	.			trans	-56.2	125.2	174.2	0	0	0	0	0	109.4
317	S	39.6	Very low	48.3	Very low	97 Å²	97	94.2 Å²	94.2	68%	0.678	54%	0.535	S	S	*	.			trans	-106.4	123.8	179.1	58.7	0	0	0	0	109.8	N193 M315	N193-S317 VanDerWaalsContact ND2-CB 3.31Å; N193-S317 WeakPolarHBondContact ND2-CB 3.27Å; M315-S317 PolarHBondContact O-N 3.14Å
318	G	38.3	Very low	46.7	Very low	42 Å²	42	92.9 Å²	92.9	43%	0.433	52%	0.517	S	S	.	.			trans	172.1	70.3	160.2	0	0	0	0	0	115.2	E72 T320	E72-G318 VanDerWaalsContact CD-C 3.48Å; E72-G318 PolarHBondContact OE2-N 3.15Å; G318-T320 PolarHBondContact O-N 3.11Å
319	T	44.9	Very low	45.3	Very low	48 Å²	48	96.7 Å²	96.7	29%	0.294	52%	0.522	S	S	.	.			trans	-77.2	112.2	164.1	-50.1	0	0	0	0	109.3	E72 K121 E323 L324	E72-T319 WeakPolarHBondContact OE1-CA 3.39Å; E72-T319 WeakPolarHBondContact OE1-CB 3.32Å; E72-T319 PolarHBondContact OE1-N 2.83Å; E72-T319 PolarHBondContact OE1-OG1 2.98Å; K121-T319 WeakPolarHBondContact CE-OG1 3.2Å; K121-T319 PolarHBondContact NZ-OG1 3.27Å; T319-E323 HydrophobicContact CG2-CB 4.08Å; T319-L324 HydrophobicContact CG2-CG 4.36Å
320	T	45.8	Very low	44.9	Very low	74 Å²	74	93 Å²	93	45%	0.454	50%	0.497	S	S	.	.			trans	-77.9	151.3	-179.8	61.3	0	0	0	0	111.3	G318 K322 E323 L324	G318-T320 PolarHBondContact O-N 3.11Å; T320-K322 PolarHBondContact O-N 2.91Å; T320-E323 PolarHBondContact N-OE2 3.39Å; T320-E323 WeakPolarHBondContact O-CB 3.41Å; T320-E323 PolarHBondContact O-N 2.77Å; T320-E323 VanDerWaalsContact OG1-CD 3.26Å; T320-E323 WeakPolarHBondContact OG1-CG 3.13Å; T320-E323 PolarHBondContact OG1-OE2 3.41Å; T320-L324 PolarHBondContact O-N 3.34Å
321	S	43.7	Very low	44.6	Very low	83 Å²	83	87.3 Å²	87.3	58%	0.58	48%	0.476	S	S	*	.	H	α-helix	trans	-51.1	-30.1	175	164.3	0	0	0	0	113.8	K325	S321-K325 WeakPolarHBondContact O-CG 3.4Å; S321-K325 PolarHBondContact O-N 3.34Å
322	K	47.6	Very low	44.6	Very low	171 Å²	171	80.7 Å²	80.7	74%	0.743	44%	0.444	S	S	*	.	H	α-helix	trans	-67.7	-37.5	175.7	-73.5	-175.4	178.8	178.7	0	112.6	T320 K325 F326	T320-K322 PolarHBondContact O-N 2.91Å; K322-K325 WeakPolarHBondContact O-CB 2.83Å; K322-K325 PolarHBondContact O-N 3.46Å; K322-F326 PolarHBondContact O-N 3.47Å
323	E	44.4	Very low	45.2	Very low	41 Å²	41	82.3 Å²	82.3	19%	0.192	44%	0.442	C	S	.	.	H	α-helix	trans	-72.2	-38.6	-177.7	-70.3	165.4	143.4	0	0	111.5	N71 T319 T320 K325 F326 L327	N71-E323 PolarHBondContact ND2-OE1 3.04Å; T319-E323 HydrophobicContact CG2-CB 4.08Å; T320-E323 PolarHBondContact N-OE2 3.39Å; T320-E323 WeakPolarHBondContact O-CB 3.41Å; T320-E323 PolarHBondContact O-N 2.77Å; T320-E323 VanDerWaalsContact OG1-CD 3.26Å; T320-E323 WeakPolarHBondContact OG1-CG 3.13Å; T320-E323 PolarHBondContact OG1-OE2 3.41Å; E323-K325 VanDerWaalsContact C-N 3.3Å; E323-K325 PolarHBondContact O-N 2.95Å; E323-F326 PolarHBondContact O-N 2.88Å; E323-L327 WeakPolarHBondContact O-CB 3.48Å; E323-L327 PolarHBondContact O-N 2.8Å
324	L	45.7	Very low	45.7	Very low	52 Å²	52	75.3 Å²	75.3	27%	0.272	41%	0.411	S	S	.	.	H	α-helix	trans	-57.8	-43.2	168.8	-78.3	164.9	0	0	0	111	T319 T320 F326 R328	T319-L324 HydrophobicContact CG2-CG 4.36Å; T320-L324 PolarHBondContact O-N 3.34Å; L324-F326 PolarHBondContact O-N 3.22Å; L324-R328 WeakPolarHBondContact O-CB 3.34Å; L324-R328 WeakPolarHBondContact O-CG 3.38Å; L324-R328 PolarHBondContact O-N 3.08Å
325	K	48.1	Very low	46.4	Very low	105 Å²	105	69.6 Å²	69.6	46%	0.457	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-38.6	178.4	-74.6	179.8	-179	-177	0	113.5	S321 K322 E323 R328 K329	S321-K325 WeakPolarHBondContact O-CG 3.4Å; S321-K325 PolarHBondContact O-N 3.34Å; K322-K325 WeakPolarHBondContact O-CB 2.83Å; K322-K325 PolarHBondContact O-N 3.46Å; E323-K325 VanDerWaalsContact C-N 3.3Å; E323-K325 PolarHBondContact O-N 2.95Å; K325-R328 WeakPolarHBondContact O-CB 3.33Å; K325-K329 PolarHBondContact O-N 3.17Å
326	F	48.1	Very low	46.9	Very low	107 Å²	107	67.4 Å²	67.4	47%	0.469	37%	0.366	S	S	.	.	H	α-helix	trans	-72.6	-48.2	178.3	-176.8	-98.4	0	0	0	112.2	W83 K322 E323 L324 R328 K329 T330	W83-F326 HydrophobicContact CH2-CE1 4.38Å; W83-F326 HydrophobicContact CH2-CZ 4.36Å; W83-F326 HydrophobicContact CZ3-CE1 4.42Å; K322-F326 PolarHBondContact O-N 3.47Å; E323-F326 PolarHBondContact O-N 2.88Å; L324-F326 PolarHBondContact O-N 3.22Å; F326-R328 PolarHBondContact O-N 3.5Å; F326-K329 PolarHBondContact O-N 3.33Å; F326-K329 VanDerWaalsContact O-N 3.15Å; F326-T330 PolarHBondContact O-N 3.34Å; F326-T330 VanDerWaalsContact O-N 3.09Å; F326-T330 PolarHBondContact O-OG1 3.29Å
327	L	49.7	Very low	47.6	Very low	19 Å²	19	70.1 Å²	70.1	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-51.6	-42.5	172.9	-90	153.9	0	0	0	111.2	M68 L125 E323 L331	M68-L327 HydrophobicContact CG-CD2 4.38Å; M68-L327 HydrophobicContact SD-CD2 3.64Å; L125-L327 HydrophobicContact CD1-CB 4.38Å; L125-L327 HydrophobicContact CD1-CD2 4.42Å; L125-L327 HydrophobicContact CD2-CB 4.13Å; E323-L327 WeakPolarHBondContact O-CB 3.48Å; E323-L327 PolarHBondContact O-N 2.8Å; L327-L331 VanDerWaalsContact O-CB 3.23Å; L327-L331 WeakPolarHBondContact O-CB 3.28Å; L327-L331 PolarHBondContact O-N 3.28Å
328	R	51.2	Low	47.9	Very low	61 Å²	61	65.9 Å²	65.9	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-56.7	-55.6	176.8	-82.4	-178.1	-179.5	-176.9	4.7	112.1	L125 L324 K325 F326 T330 F332 F361	L125-R328 HydrophobicContact CD2-CB 4.19Å; L125-R328 HydrophobicContact CD2-CG 3.47Å; L125-R328 VanDerWaalsContact CD2-CG 3.47Å; L324-R328 WeakPolarHBondContact O-CB 3.34Å; L324-R328 WeakPolarHBondContact O-CG 3.38Å; L324-R328 PolarHBondContact O-N 3.08Å; K325-R328 WeakPolarHBondContact O-CB 3.33Å; F326-R328 PolarHBondContact O-N 3.5Å; R328-T330 PolarHBondContact O-N 2.79Å; R328-F332 WeakPolarHBondContact O-CB 3.38Å; R328-F332 PolarHBondContact O-N 2.88Å; R328-F361 VanDerWaalsContact C-CE1 3.43Å; R328-F361 HydrophobicContact CB-CD1 3.45Å; R328-F361 VanDerWaalsContact CB-CD1 3.45Å; R328-F361 HydrophobicContact CB-CE1 3.41Å; R328-F361 VanDerWaalsContact CB-CE1 3.41Å; R328-F361 HydrophobicContact CG-CD1 3.97Å; R328-F361 HydrophobicContact CG-CE1 3.58Å; R328-F361 WeakPolarHBondContact O-CD1 3.24Å; R328-F361 WeakPolarHBondContact O-CE1 3.05Å
329	K	51.2	Low	48.3	Very low	136 Å²	136	65.2 Å²	65.2	59%	0.591	31%	0.313	S	S	*	.	H	α-helix	trans	-67.8	-34.7	-177	-165.9	176.1	-178	178.5	0	113.8	K325 F326	K325-K329 PolarHBondContact O-N 3.17Å; F326-K329 PolarHBondContact O-N 3.33Å; F326-K329 VanDerWaalsContact O-N 3.15Å
330	T	52.3	Low	48.5	Very low	53 Å²	53	66.9 Å²	66.9	33%	0.325	33%	0.327	S	S	.	.	H	α-helix	trans	-79.4	-45.3	-177.6	-56.1	0	0	0	0	111.8	F326 R328 F332 K333 A334	F326-T330 PolarHBondContact O-N 3.34Å; F326-T330 VanDerWaalsContact O-N 3.09Å; F326-T330 PolarHBondContact O-OG1 3.29Å; R328-T330 PolarHBondContact O-N 2.79Å; T330-F332 PolarHBondContact O-N 3.45Å; T330-K333 PolarHBondContact O-N 3.2Å; T330-A334 PolarHBondContact O-N 3.13Å
331	L	51.5	Low	48.5	Very low	7 Å²	7	68.8 Å²	68.8	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-35.3	176	-171.6	68.7	0	0	0	110.9	I66 M88 L125 L327 K333 A334 I335	I66-L331 HydrophobicContact CD1-CD1 3.41Å; I66-L331 VanDerWaalsContact CD1-CD1 3.41Å; I66-L331 HydrophobicContact CG1-CD1 4.39Å; M88-L331 HydrophobicContact CE-CD1 4.11Å; L125-L331 HydrophobicContact CB-CD2 3.66Å; L125-L331 HydrophobicContact CD1-CB 4.06Å; L125-L331 HydrophobicContact CD1-CD2 3.17Å; L125-L331 HydrophobicContact CD1-CG 4.18Å; L125-L331 HydrophobicContact CG-CD2 3.96Å; L327-L331 VanDerWaalsContact O-CB 3.23Å; L327-L331 WeakPolarHBondContact O-CB 3.28Å; L327-L331 PolarHBondContact O-N 3.28Å; L331-K333 PolarHBondContact O-N 2.82Å; L331-A334 WeakPolarHBondContact O-CB 3.43Å; L331-A334 PolarHBondContact O-N 3.35Å; L331-A334 VanDerWaalsContact O-N 3.16Å; L331-I335 HydrophobicContact CD1-CD1 4.27Å; L331-I335 HydrophobicContact CD1-CG1 4.19Å; L331-I335 HydrophobicContact CD2-CD1 3.7Å; L331-I335 HydrophobicContact CD2-CG1 4.49Å; L331-I335 HydrophobicContact CG-CD1 3.63Å; L331-I335 HydrophobicContact CG-CG1 3.95Å; L331-I335 WeakPolarHBondContact O-CB 3.37Å; L331-I335 WeakPolarHBondContact O-CG1 3.48Å; L331-I335 PolarHBondContact O-N 3.16Å
332	F	46.6	Very low	48.6	Very low	39 Å²	39	65.7 Å²	65.7	17%	0.171	31%	0.308	C	S	.	.	H	α-helix	trans	-52.1	-57.5	175.6	174.7	-128.2	0	0	0	113.5	R328 T330 A334 I335 V336 L357 K358 F361	R328-F332 WeakPolarHBondContact O-CB 3.38Å; R328-F332 PolarHBondContact O-N 2.88Å; T330-F332 PolarHBondContact O-N 3.45Å; F332-A334 PolarHBondContact O-N 2.97Å; F332-I335 PolarHBondContact O-N 3.24Å; F332-V336 HydrophobicContact CD2-CG2 3.54Å; F332-V336 HydrophobicContact CE2-CB 4.48Å; F332-V336 HydrophobicContact CE2-CG2 3.09Å; F332-V336 HydrophobicContact CG-CG2 4.45Å; F332-V336 HydrophobicContact CZ-CG2 3.67Å; F332-V336 WeakPolarHBondContact O-CB 3.05Å; F332-V336 VanDerWaalsContact O-CG2 3.24Å; F332-V336 WeakPolarHBondContact O-CG2 3.36Å; F332-V336 PolarHBondContact O-N 3.47Å; F332-L357 HydrophobicContact CD2-CB 4.38Å; F332-K358 HydrophobicContact CE2-CB 3.64Å; F332-K358 HydrophobicContact CE2-CG 3.45Å; F332-K358 VanDerWaalsContact CE2-CG 3.45Å; F332-K358 VanDerWaalsContact CE2-N 3.27Å; F332-K358 HydrophobicContact CZ-CB 3.49Å; F332-K358 VanDerWaalsContact CZ-CB 3.49Å; F332-K358 HydrophobicContact CZ-CD 4.24Å; F332-K358 HydrophobicContact CZ-CG 3.42Å; F332-K358 VanDerWaalsContact CZ-CG 3.42Å; F332-F361 HydrophobicContact CB-CB 3.79Å; F332-F361 HydrophobicContact CB-CD1 4.1Å; F332-F361 HydrophobicContact CB-CD2 3.27Å; F332-F361 HydrophobicContact CB-CE1 4.46Å; F332-F361 HydrophobicContact CB-CE2 3.68Å; F332-F361 HydrophobicContact CB-CG 3.47Å; F332-F361 VanDerWaalsContact CB-CG 3.47Å; F332-F361 HydrophobicContact CB-CZ 4.28Å; F332-F361 HydrophobicContact CD1-CB 3.85Å; F332-F361 HydrophobicContact CD1-CD2 4.41Å; F332-F361 HydrophobicContact CD1-CG 4.43Å; F332-F361 HydrophobicContact CD2-CB 3.98Å; F332-F361 AromaticContact CD2-CD2 3.1Å; F332-F361 HydrophobicContact CD2-CD2 3.1Å; F332-F361 AromaticContact CD2-CE2 3.79Å; F332-F361 HydrophobicContact CD2-CE2 3.79Å; F332-F361 AromaticContact CD2-CG 3.87Å; F332-F361 HydrophobicContact CD2-CG 3.87Å; F332-F361 HydrophobicContact CE1-CB 4.46Å; F332-F361 HydrophobicContact CE2-CD2 4.01Å; F332-F361 HydrophobicContact CG-CB 3.56Å; F332-F361 AromaticContact CG-CD2 3.33Å; F332-F361 HydrophobicContact CG-CD2 3.33Å; F332-F361 HydrophobicContact CG-CE2 4.11Å; F332-F361 AromaticContact CG-CG 3.65Å; F332-F361 HydrophobicContact CG-CG 3.65Å
333	K	50.3	Low	48.4	Very low	143 Å²	143	63.3 Å²	63.3	62%	0.622	30%	0.303	S	S	*	.	H	α-helix	trans	-59.4	-36.2	-179.9	-72.6	-173.7	175.4	-171.3	0	111	T330 L331 R337	T330-K333 PolarHBondContact O-N 3.2Å; L331-K333 PolarHBondContact O-N 2.82Å; K333-R337 WeakPolarHBondContact O-CB 3.34Å; K333-R337 PolarHBondContact O-N 3.08Å
334	A	50.2	Low	48.4	Very low	11 Å²	11	62.6 Å²	62.6	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-69.6	-50.9	-178.2	0	0	0	0	0	111.4	L64 I66 T330 L331 F332 R337 T338	L64-A334 HydrophobicContact CD1-CB 3.94Å; L64-A334 HydrophobicContact CD2-CB 3.5Å; L64-A334 VanDerWaalsContact CD2-CB 3.5Å; L64-A334 HydrophobicContact CG-CB 4.24Å; I66-A334 HydrophobicContact CD1-CB 4.13Å; I66-A334 HydrophobicContact CG1-CB 3.74Å; T330-A334 PolarHBondContact O-N 3.13Å; L331-A334 WeakPolarHBondContact O-CB 3.43Å; L331-A334 PolarHBondContact O-N 3.35Å; L331-A334 VanDerWaalsContact O-N 3.16Å; F332-A334 PolarHBondContact O-N 2.97Å; A334-R337 PolarHBondContact O-N 3.48Å; A334-T338 PolarHBondContact O-N 3.08Å; A334-T338 PolarHBondContact O-OG1 2.69Å
335	I	48.8	Very low	48.4	Very low	12 Å²	12	61.4 Å²	61.4	6%	0.062	30%	0.298	C	S	.	.	H	α-helix	trans	-56.3	-56.8	174.1	-79.1	179	0	0	0	110.2	L331 F332 R337 T338 F339 L357	L331-I335 HydrophobicContact CD1-CD1 4.27Å; L331-I335 HydrophobicContact CD1-CG1 4.19Å; L331-I335 HydrophobicContact CD2-CD1 3.7Å; L331-I335 HydrophobicContact CD2-CG1 4.49Å; L331-I335 HydrophobicContact CG-CD1 3.63Å; L331-I335 HydrophobicContact CG-CG1 3.95Å; L331-I335 WeakPolarHBondContact O-CB 3.37Å; L331-I335 WeakPolarHBondContact O-CG1 3.48Å; L331-I335 PolarHBondContact O-N 3.16Å; F332-I335 PolarHBondContact O-N 3.24Å; I335-R337 PolarHBondContact O-N 3.34Å; I335-T338 PolarHBondContact O-N 3.4Å; I335-F339 HydrophobicContact CB-CD2 4.22Å; I335-F339 HydrophobicContact CB-CE2 4.23Å; I335-F339 HydrophobicContact CG1-CE2 4.36Å; I335-F339 HydrophobicContact CG2-CD2 3.5Å; I335-F339 VanDerWaalsContact CG2-CD2 3.5Å; I335-F339 HydrophobicContact CG2-CE2 3.63Å; I335-F339 VanDerWaalsContact O-CB 3.26Å; I335-F339 WeakPolarHBondContact O-CB 3.23Å; I335-F339 WeakPolarHBondContact O-CD2 3.39Å; I335-F339 VanDerWaalsContact O-CG 3.3Å; I335-F339 WeakPolarHBondContact O-CG 3.41Å; I335-F339 PolarHBondContact O-N 3.46Å; I335-L357 HydrophobicContact CD1-CD1 4.22Å; I335-L357 HydrophobicContact CG2-CD1 3.62Å
336	V	51	Low	48.2	Very low	26 Å²	26	64.4 Å²	64.4	16%	0.158	31%	0.311	C	S	.	.	H	α-helix	trans	-56	-39.9	-178.5	175.5	0	0	0	0	110.9	F332 F339 S340 V354 K358	F332-V336 HydrophobicContact CD2-CG2 3.54Å; F332-V336 HydrophobicContact CE2-CB 4.48Å; F332-V336 HydrophobicContact CE2-CG2 3.09Å; F332-V336 HydrophobicContact CG-CG2 4.45Å; F332-V336 HydrophobicContact CZ-CG2 3.67Å; F332-V336 WeakPolarHBondContact O-CB 3.05Å; F332-V336 VanDerWaalsContact O-CG2 3.24Å; F332-V336 WeakPolarHBondContact O-CG2 3.36Å; F332-V336 PolarHBondContact O-N 3.47Å; V336-F339 PolarHBondContact O-N 3.11Å; V336-S340 WeakPolarHBondContact O-CB 3.4Å; V336-S340 PolarHBondContact O-N 3.3Å; V336-S340 PolarHBondContact O-OG 3.35Å; V336-V354 HydrophobicContact CB-CG1 4.23Å; V336-V354 HydrophobicContact CG1-CG1 4.07Å; V336-V354 HydrophobicContact CG2-CG1 3.81Å; V336-K358 HydrophobicContact CG2-CG 4.2Å
337	R	49.7	Very low	48.3	Very low	146 Å²	146	61 Å²	61	55%	0.551	30%	0.301	S	S	*	.	H	α-helix	trans	-68.1	-50.3	178.9	-172.4	176.1	-177.3	179.7	-0.2	112.5	K333 A334 I335 F339 S340 E341	K333-R337 WeakPolarHBondContact O-CB 3.34Å; K333-R337 PolarHBondContact O-N 3.08Å; A334-R337 PolarHBondContact O-N 3.48Å; I335-R337 PolarHBondContact O-N 3.34Å; R337-F339 PolarHBondContact O-N 3.15Å; R337-F339 VanDerWaalsContact O-N 3.08Å; R337-S340 WeakPolarHBondContact CA-OG 3.3Å; R337-S340 PolarHBondContact O-N 3.1Å; R337-S340 PolarHBondContact O-OG 2.92Å; R337-E341 HydrophobicContact CG-CG 4.27Å; R337-E341 VanDerWaalsContact CG-OE1 3.3Å; R337-E341 WeakPolarHBondContact CG-OE1 3.12Å; R337-E341 IonicContact CZ-OE1 3.99Å; R337-E341 IonicContact NE-OE1 3.15Å; R337-E341 PolarHBondContact NE-OE1 2.7Å; R337-E341 IonicContact NE-OE2 2.76Å; R337-E341 IonicContact NH2-OE1 3.88Å; R337-E341 PolarHBondContact NH2-OE1 3.21Å; R337-E341 WeakPolarHBondContact O-CB 3.35Å; R337-E341 WeakPolarHBondContact O-CG 3.18Å; R337-E341 PolarHBondContact O-N 2.92Å
338	T	46.6	Very low	48	Very low	7 Å²	7	69.7 Å²	69.7	4%	0.043	33%	0.334	C	S	.	.	H	α-helix	trans	-52	-36.8	175.4	-60.2	0	0	0	0	111.6	L64 A334 I335 T342	L64-T338 WeakPolarHBondContact CD2-OG1 3.4Å; A334-T338 PolarHBondContact O-N 3.08Å; A334-T338 PolarHBondContact O-OG1 2.69Å; I335-T338 PolarHBondContact O-N 3.4Å; T338-T342 PolarHBondContact O-N 3.19Å; T338-T342 PolarHBondContact O-OG1 3Å
339	F	47	Very low	48	Very low	28 Å²	28	70.9 Å²	70.9	12%	0.123	34%	0.342	C	S	.	.	H	α-helix	trans	-92.2	-19	-172.2	-70.8	-42.7	0	0	0	114.8	P97 L151 I335 V336 R337 L345 F350 V354	P97-F339 HydrophobicContact CG-CE1 4.05Å; P97-F339 HydrophobicContact CG-CZ 4.2Å; L151-F339 HydrophobicContact CD2-CZ 4.38Å; I335-F339 HydrophobicContact CB-CD2 4.22Å; I335-F339 HydrophobicContact CB-CE2 4.23Å; I335-F339 HydrophobicContact CG1-CE2 4.36Å; I335-F339 HydrophobicContact CG2-CD2 3.5Å; I335-F339 VanDerWaalsContact CG2-CD2 3.5Å; I335-F339 HydrophobicContact CG2-CE2 3.63Å; I335-F339 VanDerWaalsContact O-CB 3.26Å; I335-F339 WeakPolarHBondContact O-CB 3.23Å; I335-F339 WeakPolarHBondContact O-CD2 3.39Å; I335-F339 VanDerWaalsContact O-CG 3.3Å; I335-F339 WeakPolarHBondContact O-CG 3.41Å; I335-F339 PolarHBondContact O-N 3.46Å; V336-F339 PolarHBondContact O-N 3.11Å; R337-F339 PolarHBondContact O-N 3.15Å; R337-F339 VanDerWaalsContact O-N 3.08Å; F339-L345 HydrophobicContact CD1-CD1 4.12Å; F339-L345 HydrophobicContact CE1-CD1 4.23Å; F339-F350 HydrophobicContact CB-CE1 3.45Å; F339-F350 VanDerWaalsContact CB-CE1 3.45Å; F339-F350 HydrophobicContact CB-CZ 3.86Å; F339-F350 AromaticContact CD1-CE1 3.27Å; F339-F350 HydrophobicContact CD1-CE1 3.27Å; F339-F350 HydrophobicContact CD1-CE2 4.28Å; F339-F350 AromaticContact CD1-CZ 3.07Å; F339-F350 HydrophobicContact CD1-CZ 3.07Å; F339-F350 HydrophobicContact CD2-CE1 4.08Å; F339-F350 AromaticContact CD2-CZ 3.52Å; F339-F350 HydrophobicContact CD2-CZ 3.52Å; F339-F350 AromaticContact CE1-CE1 3.97Å; F339-F350 HydrophobicContact CE1-CE1 3.97Å; F339-F350 HydrophobicContact CE1-CE2 4.19Å; F339-F350 AromaticContact CE1-CZ 3.3Å; F339-F350 HydrophobicContact CE1-CZ 3.3Å; F339-F350 AromaticContact CE2-CZ 3.77Å; F339-F350 HydrophobicContact CE2-CZ 3.77Å; F339-F350 AromaticContact CG-CE1 3.32Å; F339-F350 HydrophobicContact CG-CE1 3.32Å; F339-F350 HydrophobicContact CG-CE2 4.48Å; F339-F350 AromaticContact CG-CZ 3.18Å; F339-F350 HydrophobicContact CG-CZ 3.18Å; F339-F350 HydrophobicContact CZ-CE2 4.33Å; F339-F350 AromaticContact CZ-CZ 3.66Å; F339-F350 HydrophobicContact CZ-CZ 3.66Å; F339-V354 HydrophobicContact CB-CG2 3.94Å; F339-V354 HydrophobicContact CD2-CG2 4.35Å; F339-V354 HydrophobicContact CG-CG2 4.45Å
340	S	48.6	Very low	47.8	Very low	84 Å²	84	64.8 Å²	64.8	59%	0.587	32%	0.316	S	S	*	.	H	α-helix	trans	-88.7	-24.4	169.7	46.7	0	0	0	0	112.9	V336 R337	V336-S340 WeakPolarHBondContact O-CB 3.4Å; V336-S340 PolarHBondContact O-N 3.3Å; V336-S340 PolarHBondContact O-OG 3.35Å; R337-S340 WeakPolarHBondContact CA-OG 3.3Å; R337-S340 PolarHBondContact O-N 3.1Å; R337-S340 PolarHBondContact O-OG 2.92Å
341	E	47.4	Very low	47.8	Very low	113 Å²	113	66.3 Å²	66.3	53%	0.528	32%	0.322	S	S	.	.	S	Bend	trans	-92	-6.7	179	-66.6	176.4	178.5	0	0	113.2	R337	R337-E341 HydrophobicContact CG-CG 4.27Å; R337-E341 VanDerWaalsContact CG-OE1 3.3Å; R337-E341 WeakPolarHBondContact CG-OE1 3.12Å; R337-E341 IonicContact CZ-OE1 3.99Å; R337-E341 IonicContact NE-OE1 3.15Å; R337-E341 PolarHBondContact NE-OE1 2.7Å; R337-E341 IonicContact NE-OE2 2.76Å; R337-E341 IonicContact NH2-OE1 3.88Å; R337-E341 PolarHBondContact NH2-OE1 3.21Å; R337-E341 WeakPolarHBondContact O-CB 3.35Å; R337-E341 WeakPolarHBondContact O-CG 3.18Å; R337-E341 PolarHBondContact O-N 2.92Å
342	T	44.8	Very low	48	Very low	19 Å²	19	71.5 Å²	71.5	12%	0.117	34%	0.344	C	S	.	.			trans	-95.8	97.6	170.6	36.5	0	0	0	0	110.3	T338 A344 L345	T338-T342 PolarHBondContact O-N 3.19Å; T338-T342 PolarHBondContact O-OG1 3Å; T342-A344 PolarHBondContact O-N 3.3Å; T342-L345 PolarHBondContact O-N 3.23Å
343	D	44.2	Very low	48.2	Very low	120 Å²	120	70.4 Å²	70.4	64%	0.642	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-55.8	-13.2	172.1	-86.3	-45.3	0	0	0	113.5	L345 K346	D343-L345 VanDerWaalsContact C-N 3.35Å; D343-L345 PolarHBondContact O-N 2.79Å; D343-K346 IonicContact OD1-NZ 3.67Å
344	A	43.3	Very low	48.2	Very low	26 Å²	26	64 Å²	64	22%	0.215	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-79.7	0	-178.5	0	0	0	0	0	115.7	T342	T342-A344 PolarHBondContact O-N 3.3Å
345	L	45.6	Very low	48.5	Very low	27 Å²	27	66.7 Å²	66.7	14%	0.141	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-131.2	37.9	-171.1	-82.3	166.4	0	0	0	115.1	F339 T342 D343 S347 F350	F339-L345 HydrophobicContact CD1-CD1 4.12Å; F339-L345 HydrophobicContact CE1-CD1 4.23Å; T342-L345 PolarHBondContact O-N 3.23Å; D343-L345 VanDerWaalsContact C-N 3.35Å; D343-L345 PolarHBondContact O-N 2.79Å; L345-S347 PolarHBondContact O-N 2.93Å; L345-F350 HydrophobicContact CB-CD1 4.15Å; L345-F350 HydrophobicContact CB-CE1 4.3Å; L345-F350 HydrophobicContact CD1-CE1 4.4Å
346	K	44.1	Very low	48.8	Very low	168 Å²	168	69 Å²	69	73%	0.73	34%	0.336	S	S	*	.			trans	-76	60.8	173.8	-67.3	-177	-176.9	168.9	0	113.2	D343	D343-K346 IonicContact OD1-NZ 3.67Å
347	S	51.4	Low	48.6	Very low	37 Å²	37	68 Å²	68	26%	0.259	33%	0.33	S	S	.	.			trans	-98.3	127.9	167.6	160.8	0	0	0	0	109.3	L345 E349 F350 D351	L345-S347 PolarHBondContact O-N 2.93Å; S347-E349 PolarHBondContact O-N 3.47Å; S347-E349 VanDerWaalsContact O-N 3.16Å; S347-E349 PolarHBondContact OG-N 2.81Å; S347-F350 WeakPolarHBondContact O-CA 3.36Å; S347-F350 VanDerWaalsContact O-CB 3.22Å; S347-F350 WeakPolarHBondContact O-CB 3.25Å; S347-F350 PolarHBondContact O-N 2.57Å; S347-D351 PolarHBondContact O-N 3.21Å
348	Y	43.3	Very low	48.5	Very low	200 Å²	200	65 Å²	65	78%	0.784	32%	0.32	S	S	*	.	H	α-helix	trans	-53	-35	176.7	174	-100.2	0	0	0	113.2	F350 K352	Y348-F350 VanDerWaalsContact C-N 3.25Å; Y348-F350 PolarHBondContact O-N 3.19Å; Y348-K352 PolarHBondContact O-N 2.65Å
349	E	50.2	Low	48.8	Very low	87 Å²	87	70.9 Å²	70.9	41%	0.407	35%	0.347	S	S	.	.	H	α-helix	trans	-71.3	-25.5	177.3	-64.7	-135.8	146.2	0	0	112.9	P155 S347 K352 I353	P155-E349 WeakPolarHBondContact CB-OE2 3.33Å; S347-E349 PolarHBondContact O-N 3.47Å; S347-E349 VanDerWaalsContact O-N 3.16Å; S347-E349 PolarHBondContact OG-N 2.81Å; E349-K352 WeakPolarHBondContact O-CB 3.39Å; E349-I353 PolarHBondContact O-N 2.91Å
350	F	47	Very low	48.9	Very low	8 Å²	8	74.1 Å²	74.1	4%	0.035	36%	0.359	C	S	.	.	H	α-helix	trans	-77.4	-43	-179.4	-167.4	-110.8	0	0	0	111.7	Y153 F339 L345 S347 Y348 K352 I353 V354	Y153-F350 AromaticContact CD1-CD2 3.8Å; Y153-F350 HydrophobicContact CD1-CD2 3.8Å; Y153-F350 HydrophobicContact CD1-CE2 4.25Å; Y153-F350 HydrophobicContact CE1-CB 4.46Å; Y153-F350 AromaticContact CE1-CD2 3.7Å; Y153-F350 HydrophobicContact CE1-CD2 3.7Å; Y153-F350 HydrophobicContact CG-CD2 4.35Å; Y153-F350 HydrophobicContact CG-CE2 4.44Å; F339-F350 HydrophobicContact CB-CE1 3.45Å; F339-F350 VanDerWaalsContact CB-CE1 3.45Å; F339-F350 HydrophobicContact CB-CZ 3.86Å; F339-F350 AromaticContact CD1-CE1 3.27Å; F339-F350 HydrophobicContact CD1-CE1 3.27Å; F339-F350 HydrophobicContact CD1-CE2 4.28Å; F339-F350 AromaticContact CD1-CZ 3.07Å; F339-F350 HydrophobicContact CD1-CZ 3.07Å; F339-F350 HydrophobicContact CD2-CE1 4.08Å; F339-F350 AromaticContact CD2-CZ 3.52Å; F339-F350 HydrophobicContact CD2-CZ 3.52Å; F339-F350 AromaticContact CE1-CE1 3.97Å; F339-F350 HydrophobicContact CE1-CE1 3.97Å; F339-F350 HydrophobicContact CE1-CE2 4.19Å; F339-F350 AromaticContact CE1-CZ 3.3Å; F339-F350 HydrophobicContact CE1-CZ 3.3Å; F339-F350 AromaticContact CE2-CZ 3.77Å; F339-F350 HydrophobicContact CE2-CZ 3.77Å; F339-F350 AromaticContact CG-CE1 3.32Å; F339-F350 HydrophobicContact CG-CE1 3.32Å; F339-F350 HydrophobicContact CG-CE2 4.48Å; F339-F350 AromaticContact CG-CZ 3.18Å; F339-F350 HydrophobicContact CG-CZ 3.18Å; F339-F350 HydrophobicContact CZ-CE2 4.33Å; F339-F350 AromaticContact CZ-CZ 3.66Å; F339-F350 HydrophobicContact CZ-CZ 3.66Å; L345-F350 HydrophobicContact CB-CD1 4.15Å; L345-F350 HydrophobicContact CB-CE1 4.3Å; L345-F350 HydrophobicContact CD1-CE1 4.4Å; S347-F350 WeakPolarHBondContact O-CA 3.36Å; S347-F350 VanDerWaalsContact O-CB 3.22Å; S347-F350 WeakPolarHBondContact O-CB 3.25Å; S347-F350 PolarHBondContact O-N 2.57Å; Y348-F350 VanDerWaalsContact C-N 3.25Å; Y348-F350 PolarHBondContact O-N 3.19Å; F350-K352 PolarHBondContact O-N 3.11Å; F350-I353 PolarHBondContact O-N 2.91Å; F350-V354 HydrophobicContact CD1-CG2 4.35Å; F350-V354 HydrophobicContact CE1-CG2 4.01Å; F350-V354 HydrophobicContact CZ-CG2 4.22Å; F350-V354 WeakPolarHBondContact O-CG2 3.43Å; F350-V354 PolarHBondContact O-N 2.97Å
351	D	51.6	Low	48.6	Very low	85 Å²	85	71.5 Å²	71.5	46%	0.455	34%	0.337	S	S	.	.	H	α-helix	trans	-56.2	-39	169.5	-73.5	-32.4	0	0	0	111.2	S347 I353 V354 D355	S347-D351 PolarHBondContact O-N 3.21Å; D351-I353 VanDerWaalsContact C-N 3.32Å; D351-I353 PolarHBondContact O-N 2.74Å; D351-V354 PolarHBondContact O-N 3.31Å; D351-D355 VanDerWaalsContact O-CB 3.3Å; D351-D355 WeakPolarHBondContact O-CB 3.23Å; D351-D355 VanDerWaalsContact O-CG 3.27Å; D351-D355 PolarHBondContact O-N 3.02Å
352	K	56.4	Low	48.1	Very low	115 Å²	115	70.4 Å²	70.4	50%	0.5	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-37.4	174.4	-173	-178.7	176.2	-176.8	0	112.8	Y348 E349 F350 D355 E356	Y348-K352 PolarHBondContact O-N 2.65Å; E349-K352 WeakPolarHBondContact O-CB 3.39Å; F350-K352 PolarHBondContact O-N 3.11Å; K352-D355 PolarHBondContact O-N 3.19Å; K352-E356 WeakPolarHBondContact O-CB 3.22Å; K352-E356 WeakPolarHBondContact O-CG 3.19Å; K352-E356 PolarHBondContact O-N 3.14Å
353	I	50.1	Low	47.6	Very low	17 Å²	17	74 Å²	74	9%	0.087	36%	0.364	C	S	.	.	H	α-helix	trans	-73.2	-42.3	176.8	-71.1	160.6	0	0	0	111.1	C128 Y153 E349 F350 D351 D355 E356 L357	C128-I353 HydrophobicContact CB-CG1 4.4Å; C128-I353 HydrophobicContact CB-CG2 4.27Å; C128-I353 WeakPolarHBondContact SG-CD1 3.41Å; Y153-I353 HydrophobicContact CD2-CD1 3.8Å; Y153-I353 HydrophobicContact CE1-CD1 4.3Å; Y153-I353 HydrophobicContact CE2-CD1 2.88Å; Y153-I353 HydrophobicContact CE2-CG1 4.37Å; Y153-I353 WeakPolarHBondContact OH-CD1 2.91Å; E349-I353 PolarHBondContact O-N 2.91Å; F350-I353 PolarHBondContact O-N 2.91Å; D351-I353 VanDerWaalsContact C-N 3.32Å; D351-I353 PolarHBondContact O-N 2.74Å; I353-D355 PolarHBondContact O-N 3.18Å; I353-E356 PolarHBondContact O-N 3.44Å; I353-L357 HydrophobicContact CG2-CD1 3.93Å; I353-L357 HydrophobicContact CG2-CG 4.44Å; I353-L357 VanDerWaalsContact O-CB 3.28Å; I353-L357 WeakPolarHBondContact O-CB 3.29Å; I353-L357 WeakPolarHBondContact O-CG 3.45Å; I353-L357 PolarHBondContact O-N 2.92Å
354	V	51.9	Low	47	Very low	8 Å²	8	73.5 Å²	73.5	5%	0.048	37%	0.367	C	S	.	.	H	α-helix	trans	-56.1	-44.5	172.8	175.3	0	0	0	0	108.9	V336 F339 F350 D351 L357 K358	V336-V354 HydrophobicContact CB-CG1 4.23Å; V336-V354 HydrophobicContact CG1-CG1 4.07Å; V336-V354 HydrophobicContact CG2-CG1 3.81Å; F339-V354 HydrophobicContact CB-CG2 3.94Å; F339-V354 HydrophobicContact CD2-CG2 4.35Å; F339-V354 HydrophobicContact CG-CG2 4.45Å; F350-V354 HydrophobicContact CD1-CG2 4.35Å; F350-V354 HydrophobicContact CE1-CG2 4.01Å; F350-V354 HydrophobicContact CZ-CG2 4.22Å; F350-V354 WeakPolarHBondContact O-CG2 3.43Å; F350-V354 PolarHBondContact O-N 2.97Å; D351-V354 PolarHBondContact O-N 3.31Å; V354-L357 CarbonylContact O-C 3.53Å; V354-L357 VanDerWaalsContact O-CB 3.31Å; V354-L357 WeakPolarHBondContact O-CB 3.23Å; V354-L357 PolarHBondContact O-N 3.06Å; V354-K358 HydrophobicContact CG1-CG 4.49Å; V354-K358 WeakPolarHBondContact O-CG 3.32Å; V354-K358 PolarHBondContact O-N 3.4Å
355	D	55.3	Low	46.5	Very low	68 Å²	68	79.2 Å²	79.2	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-69.2	-40.9	177.5	-74.5	-12.9	0	0	0	114.3	D351 K352 I353 L357 K358 Q359	D351-D355 VanDerWaalsContact O-CB 3.3Å; D351-D355 WeakPolarHBondContact O-CB 3.23Å; D351-D355 VanDerWaalsContact O-CG 3.27Å; D351-D355 PolarHBondContact O-N 3.02Å; K352-D355 PolarHBondContact O-N 3.19Å; I353-D355 PolarHBondContact O-N 3.18Å; D355-L357 PolarHBondContact O-N 2.82Å; D355-K358 CarbonylContact O-C 3.55Å; D355-K358 WeakPolarHBondContact O-CA 3.26Å; D355-K358 WeakPolarHBondContact O-CB 3.39Å; D355-K358 PolarHBondContact O-N 3.1Å; D355-K358 WeakPolarHBondContact OD1-CD 3.37Å; D355-K358 IonicContact OD1-NZ 2.79Å; D355-K358 PolarHBondContact OD1-NZ 3.34Å; D355-Q359 WeakPolarHBondContact O-CG 3.41Å; D355-Q359 PolarHBondContact O-N 3.25Å
356	E	54.4	Low	45.7	Very low	60 Å²	60	86.3 Å²	86.3	28%	0.28	42%	0.417	S	S	.	.	H	α-helix	trans	-59.7	-39.9	171.2	-82.3	-177.2	-166.8	0	0	110.9	K352 I353 R360	K352-E356 WeakPolarHBondContact O-CB 3.22Å; K352-E356 WeakPolarHBondContact O-CG 3.19Å; K352-E356 PolarHBondContact O-N 3.14Å; I353-E356 PolarHBondContact O-N 3.44Å; E356-R360 PolarHBondContact O-N 3.17Å
357	L	47	Very low	44.8	Very low	5 Å²	5	81.7 Å²	81.7	3%	0.026	41%	0.41	C	S	.	.	H	α-helix	trans	-62	-51.1	170.2	-70.7	172.3	0	0	0	108.8	L125 S126 F332 I335 I353 V354 D355 Q359 R360 F361	L125-L357 WeakPolarHBondContact O-CD2 3.16Å; S126-L357 VanDerWaalsContact CB-CD2 3.42Å; F332-L357 HydrophobicContact CD2-CB 4.38Å; I335-L357 HydrophobicContact CD1-CD1 4.22Å; I335-L357 HydrophobicContact CG2-CD1 3.62Å; I353-L357 HydrophobicContact CG2-CD1 3.93Å; I353-L357 HydrophobicContact CG2-CG 4.44Å; I353-L357 VanDerWaalsContact O-CB 3.28Å; I353-L357 WeakPolarHBondContact O-CB 3.29Å; I353-L357 WeakPolarHBondContact O-CG 3.45Å; I353-L357 PolarHBondContact O-N 2.92Å; V354-L357 CarbonylContact O-C 3.53Å; V354-L357 VanDerWaalsContact O-CB 3.31Å; V354-L357 WeakPolarHBondContact O-CB 3.23Å; V354-L357 PolarHBondContact O-N 3.06Å; D355-L357 PolarHBondContact O-N 2.82Å; L357-Q359 VanDerWaalsContact C-N 3.28Å; L357-Q359 PolarHBondContact O-N 2.81Å; L357-R360 PolarHBondContact O-N 2.66Å; L357-F361 HydrophobicContact CB-CD2 3.88Å; L357-F361 HydrophobicContact CB-CE2 3.66Å; L357-F361 HydrophobicContact CD2-CD2 4.3Å; L357-F361 HydrophobicContact CD2-CE2 3.42Å; L357-F361 VanDerWaalsContact CD2-CE2 3.42Å; L357-F361 HydrophobicContact CD2-CZ 3.91Å; L357-F361 HydrophobicContact CG-CE2 4.08Å; L357-F361 WeakPolarHBondContact O-CB 3.47Å; L357-F361 WeakPolarHBondContact O-CD2 3.27Å; L357-F361 VanDerWaalsContact O-CG 3.31Å; L357-F361 WeakPolarHBondContact O-CG 3.05Å; L357-F361 PolarHBondContact O-N 3.48Å
358	K	49.3	Very low	43.7	Very low	82 Å²	82	88.4 Å²	88.4	36%	0.357	44%	0.437	S	S	.	.	H	α-helix	trans	-50.3	-46.6	177	-51.9	-162.7	-179	117.1	0	112.9	F332 V336 V354 D355 S362	F332-K358 HydrophobicContact CE2-CB 3.64Å; F332-K358 HydrophobicContact CE2-CG 3.45Å; F332-K358 VanDerWaalsContact CE2-CG 3.45Å; F332-K358 VanDerWaalsContact CE2-N 3.27Å; F332-K358 HydrophobicContact CZ-CB 3.49Å; F332-K358 VanDerWaalsContact CZ-CB 3.49Å; F332-K358 HydrophobicContact CZ-CD 4.24Å; F332-K358 HydrophobicContact CZ-CG 3.42Å; F332-K358 VanDerWaalsContact CZ-CG 3.42Å; V336-K358 HydrophobicContact CG2-CG 4.2Å; V354-K358 HydrophobicContact CG1-CG 4.49Å; V354-K358 WeakPolarHBondContact O-CG 3.32Å; V354-K358 PolarHBondContact O-N 3.4Å; D355-K358 CarbonylContact O-C 3.55Å; D355-K358 WeakPolarHBondContact O-CA 3.26Å; D355-K358 WeakPolarHBondContact O-CB 3.39Å; D355-K358 PolarHBondContact O-N 3.1Å; D355-K358 WeakPolarHBondContact OD1-CD 3.37Å; D355-K358 IonicContact OD1-NZ 2.79Å; D355-K358 PolarHBondContact OD1-NZ 3.34Å; K358-S362 WeakPolarHBondContact O-CB 3.13Å; K358-S362 PolarHBondContact O-N 3.34Å; K358-S362 VanDerWaalsContact O-N 3.15Å; K358-S362 PolarHBondContact O-OG 2.63Å
359	Q	52.1	Low	42.8	Very low	131 Å²	131	84.5 Å²	84.5	61%	0.612	43%	0.434	S	S	*	.	H	α-helix	trans	-68	-44.4	-178.5	-71.3	-178.2	5.5	0	0	112.8	D355 L357 F361 S362 T363	D355-Q359 WeakPolarHBondContact O-CG 3.41Å; D355-Q359 PolarHBondContact O-N 3.25Å; L357-Q359 VanDerWaalsContact C-N 3.28Å; L357-Q359 PolarHBondContact O-N 2.81Å; Q359-F361 VanDerWaalsContact C-N 3.29Å; Q359-F361 PolarHBondContact O-N 2.85Å; Q359-S362 WeakPolarHBondContact CA-OG 3.45Å; Q359-S362 PolarHBondContact O-N 2.64Å; Q359-S362 PolarHBondContact O-OG 3.14Å; Q359-T363 PolarHBondContact O-N 3.13Å; Q359-T363 VanDerWaalsContact O-N 3.15Å; Q359-T363 PolarHBondContact O-OG1 2.83Å
360	R	49.7	Very low	41.7	Very low	97 Å²	97	87.4 Å²	87.4	37%	0.366	45%	0.451	S	S	.	.	H	α-helix	trans	-71.2	-26	179.9	-77.2	-168.3	179.8	128.4	2.7	113.9	N127 E356 L357	N127-R360 VanDerWaalsContact CB-CZ 3.46Å; N127-R360 PolarHBondContact ND2-NE 2.72Å; N127-R360 VanDerWaalsContact ND2-NE 3.2Å; N127-R360 PolarHBondContact ND2-NH1 2.86Å; N127-R360 PolarHBondContact ND2-NH2 3.21Å; E356-R360 PolarHBondContact O-N 3.17Å; L357-R360 PolarHBondContact O-N 2.66Å
361	F	41	Very low	40.7	Very low	29 Å²	29	90.7 Å²	90.7	13%	0.127	48%	0.48	C	S	.	.	H	α-helix	trans	-85.2	-13.7	176.7	-64.3	-55.6	0	0	0	113.1	L125 R328 F332 L357 Q359	L125-F361 HydrophobicContact CB-CZ 4.29Å; L125-F361 HydrophobicContact CD2-CE1 4.42Å; R328-F361 VanDerWaalsContact C-CE1 3.43Å; R328-F361 HydrophobicContact CB-CD1 3.45Å; R328-F361 VanDerWaalsContact CB-CD1 3.45Å; R328-F361 HydrophobicContact CB-CE1 3.41Å; R328-F361 VanDerWaalsContact CB-CE1 3.41Å; R328-F361 HydrophobicContact CG-CD1 3.97Å; R328-F361 HydrophobicContact CG-CE1 3.58Å; R328-F361 WeakPolarHBondContact O-CD1 3.24Å; R328-F361 WeakPolarHBondContact O-CE1 3.05Å; F332-F361 HydrophobicContact CB-CB 3.79Å; F332-F361 HydrophobicContact CB-CD1 4.1Å; F332-F361 HydrophobicContact CB-CD2 3.27Å; F332-F361 HydrophobicContact CB-CE1 4.46Å; F332-F361 HydrophobicContact CB-CE2 3.68Å; F332-F361 HydrophobicContact CB-CG 3.47Å; F332-F361 VanDerWaalsContact CB-CG 3.47Å; F332-F361 HydrophobicContact CB-CZ 4.28Å; F332-F361 HydrophobicContact CD1-CB 3.85Å; F332-F361 HydrophobicContact CD1-CD2 4.41Å; F332-F361 HydrophobicContact CD1-CG 4.43Å; F332-F361 HydrophobicContact CD2-CB 3.98Å; F332-F361 AromaticContact CD2-CD2 3.1Å; F332-F361 HydrophobicContact CD2-CD2 3.1Å; F332-F361 AromaticContact CD2-CE2 3.79Å; F332-F361 HydrophobicContact CD2-CE2 3.79Å; F332-F361 AromaticContact CD2-CG 3.87Å; F332-F361 HydrophobicContact CD2-CG 3.87Å; F332-F361 HydrophobicContact CE1-CB 4.46Å; F332-F361 HydrophobicContact CE2-CD2 4.01Å; F332-F361 HydrophobicContact CG-CB 3.56Å; F332-F361 AromaticContact CG-CD2 3.33Å; F332-F361 HydrophobicContact CG-CD2 3.33Å; F332-F361 HydrophobicContact CG-CE2 4.11Å; F332-F361 AromaticContact CG-CG 3.65Å; F332-F361 HydrophobicContact CG-CG 3.65Å; L357-F361 HydrophobicContact CB-CD2 3.88Å; L357-F361 HydrophobicContact CB-CE2 3.66Å; L357-F361 HydrophobicContact CD2-CD2 4.3Å; L357-F361 HydrophobicContact CD2-CE2 3.42Å; L357-F361 VanDerWaalsContact CD2-CE2 3.42Å; L357-F361 HydrophobicContact CD2-CZ 3.91Å; L357-F361 HydrophobicContact CG-CE2 4.08Å; L357-F361 WeakPolarHBondContact O-CB 3.47Å; L357-F361 WeakPolarHBondContact O-CD2 3.27Å; L357-F361 VanDerWaalsContact O-CG 3.31Å; L357-F361 WeakPolarHBondContact O-CG 3.05Å; L357-F361 PolarHBondContact O-N 3.48Å; Q359-F361 VanDerWaalsContact C-N 3.29Å; Q359-F361 PolarHBondContact O-N 2.85Å
362	S	37.2	Very low	39.6	Very low	90 Å²	90	97.7 Å²	97.7	63%	0.629	50%	0.5	S	S	*	.	H	α-helix	trans	-97.9	-16.9	174.9	46	0	0	0	0	114.3	K358 Q359	K358-S362 WeakPolarHBondContact O-CB 3.13Å; K358-S362 PolarHBondContact O-N 3.34Å; K358-S362 VanDerWaalsContact O-N 3.15Å; K358-S362 PolarHBondContact O-OG 2.63Å; Q359-S362 WeakPolarHBondContact CA-OG 3.45Å; Q359-S362 PolarHBondContact O-N 2.64Å; Q359-S362 PolarHBondContact O-OG 3.14Å
363	T	34.5	Very low	38.1	Very low	94 Å²	94	103.5 Å²	103.5	58%	0.577	52%	0.519	S	S	*	.	S	Bend	trans	-96.8	127.1	176.3	35.3	0	0	0	0	112.6	Q359 Y365	Q359-T363 PolarHBondContact O-N 3.13Å; Q359-T363 VanDerWaalsContact O-N 3.15Å; Q359-T363 PolarHBondContact O-OG1 2.83Å; T363-Y365 PolarHBondContact O-N 3.16Å
364	P	31.9	Very low	37.1	Very low	110 Å²	110	108.3 Å²	108.3	71%	0.714	55%	0.551	S	S	*	*			trans	-63	121.5	170.5	-17.2	29.2	0	0	0	110.5	Q366	P364-Q366 PolarHBondContact O-N 3.01Å; P364-Q366 VanDerWaalsContact O-N 3.12Å
365	Y	32.2	Very low	35.9	Very low	145 Å²	145	113.8 Å²	113.8	57%	0.569	59%	0.59	S	S	*	*			trans	-61.6	113.9	175.9	-165.1	-95.8	0	0	0	110.8	T363 A367	T363-Y365 PolarHBondContact O-N 3.16Å; Y365-A367 HydrophobicContact CD1-CB 4.46Å; Y365-A367 HydrophobicContact CE1-CB 4.22Å
366	Q	28.1	Very low	34.8	Very low	176 Å²	176	114.5 Å²	114.5	82%	0.822	61%	0.605	S	S	*	*			trans	-82.5	118.1	157.9	-73.8	-178	-13.1	0	0	107.4	P364 Q368	P364-Q366 PolarHBondContact O-N 3.01Å; P364-Q366 VanDerWaalsContact O-N 3.12Å; Q366-Q368 PolarHBondContact O-N 3.2Å
367	A	27.1	Very low	33.6	Very low	72 Å²	72	120.6 Å²	120.6	60%	0.595	64%	0.638	S	S	*	*			trans	-65.5	105.5	171.2	0	0	0	0	0	108.5	Y365 T369	Y365-A367 HydrophobicContact CD1-CB 4.46Å; Y365-A367 HydrophobicContact CE1-CB 4.22Å; A367-T369 VanDerWaalsContact C-N 3.28Å; A367-T369 PolarHBondContact O-N 2.86Å
368	Q	26.7	Very low	33	Very low	177 Å²	177	127.4 Å²	127.4	83%	0.827	67%	0.674	S	S	*	*			trans	-71.9	94.4	160	-80.6	-177.3	-10.3	0	0	107.5	Q366 I370	Q366-Q368 PolarHBondContact O-N 3.2Å; Q368-I370 PolarHBondContact O-N 2.75Å; Q368-I370 VanDerWaalsContact O-N 3.08Å
369	T	25.6	Very low	32.2	Very low	118 Å²	118	128.2 Å²	128.2	72%	0.724	69%	0.69	S	S	*	*			trans	-64.5	99.5	164.5	-46.7	0	0	0	0	107.5	A367 A371	A367-T369 VanDerWaalsContact C-N 3.28Å; A367-T369 PolarHBondContact O-N 2.86Å; T369-A371 HydrophobicContact CG2-CB 4.06Å; T369-A371 PolarHBondContact O-N 3.22Å
370	I	26.2	Very low	31.4	Very low	148 Å²	148	129.9 Å²	129.9	76%	0.759	70%	0.703	S	S	*	*			trans	-75.7	77.9	160.1	-58.5	177.7	0	0	0	105.9	Q368 R372	Q368-I370 PolarHBondContact O-N 2.75Å; Q368-I370 VanDerWaalsContact O-N 3.08Å; I370-R372 PolarHBondContact O-N 2.74Å; I370-R372 VanDerWaalsContact O-N 3.16Å
371	A	26.5	Very low	30.9	Very low	77 Å²	77	131.6 Å²	131.6	64%	0.636	72%	0.72	S	S	*	*			trans	-71.9	99.1	164.2	0	0	0	0	0	107	T369 R373	T369-A371 HydrophobicContact CG2-CB 4.06Å; T369-A371 PolarHBondContact O-N 3.22Å; A371-R373 PolarHBondContact O-N 3.04Å
372	R	28.9	Very low	30.7	Very low	232 Å²	232	137 Å²	137	88%	0.875	75%	0.75	S	S	*	*			trans	-65.1	104.3	157.3	-79	-174.7	172.9	-177.3	-1.9	106.5	I370 P374	I370-R372 PolarHBondContact O-N 2.74Å; I370-R372 VanDerWaalsContact O-N 3.16Å; R372-P374 WeakPolarHBondContact O-CD 3.42Å
373	R	24.5	Very low	30.5	Very low	237 Å²	237	143.8 Å²	143.8	89%	0.894	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-52.6	127.6	169.3	-84.3	-178.2	173.2	177	-2.5	109	A371	A371-R373 PolarHBondContact O-N 3.04Å
374	P	27.9	Very low	30.7	Very low	118 Å²	118	147.3 Å²	147.3	77%	0.766	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.7	139.2	154.9	-7.3	24.4	0	0	0	108.5	R372 A376	R372-P374 WeakPolarHBondContact O-CD 3.42Å; P374-A376 PolarHBondContact O-N 3.19Å
375	S	27.5	Very low	30.8	Very low	124 Å²	124	152.7 Å²	152.7	87%	0.867	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-47.6	123.4	168.8	46	0	0	0	0	112.8
376	A	32	Very low	31.2	Very low	82 Å²	82	158.5 Å²	158.5	68%	0.678	82%	0.815	S	S	*	*			trans	-155.8	90.2	156.1	0	0	0	0	0	108.7	P374 L378	P374-A376 PolarHBondContact O-N 3.19Å; A376-L378 VanDerWaalsContact C-N 3.29Å; A376-L378 PolarHBondContact O-N 3.48Å
377	L	30.5	Very low	31.4	Very low	188 Å²	188	157.7 Å²	157.7	98%	0.984	82%	0.815	S	S	*	*			trans	-72.6	93.6	154.2	-84.1	159.8	0	0	0	105.9
378	L	33.7	Very low	31.6	Very low	148 Å²	148	162.2 Å²	162.2	78%	0.775	83%	0.827	S	S	*	*			trans	-95.9	122.6	164.7	-87.7	161.4	0	0	0	107.8	A376 N380	A376-L378 VanDerWaalsContact C-N 3.29Å; A376-L378 PolarHBondContact O-N 3.48Å; L378-N380 PolarHBondContact O-N 3.04Å
379	S	31.7	Very low	31.9	Very low	100 Å²	100	161.3 Å²	161.3	70%	0.699	83%	0.827	S	S	*	*			trans	-38.4	126.3	166.1	50.8	0	0	0	0	112.5
380	N	36.2	Very low	32.2	Very low	165 Å²	165	163.9 Å²	163.9	88%	0.882	83%	0.833	S	S	*	*			trans	-106.1	130.3	156.5	-109.8	-9.8	0	0	0	109.4	L378	L378-N380 PolarHBondContact O-N 3.04Å
381	N	37.9	Very low	32.6	Very low	133 Å²	133	164.9 Å²	164.9	71%	0.711	84%	0.837	S	S	*	*			trans	-61.8	168.6	177.9	-74.9	-43.4	0	0	0	113.4
382	N	37.6	Very low	33	Very low	143 Å²	143	170.7 Å²	170.7	77%	0.765	85%	0.851	S	S	*	*			trans	92.2	96.6	160.4	-56.6	-23.2	0	0	0	113.8
383	R	32.4	Very low	33.3	Very low	232 Å²	232	166.4 Å²	166.4	88%	0.875	85%	0.849	S	S	*	*				49.7	111.2	84.4	-76.9	-172.9	174.4	177.7	-1.3	111.3
384	I	39.8	Very low	34	Very low	168 Å²	168	160.9 Å²	160.9	86%	0.862	85%	0.845	S	S	*	*				-162.8	132.6	112.7	-86.5	146.1	0	0	0	107.3
385	Y	33.4	Very low	34.5	Very low	224 Å²	224	164.5 Å²	164.5	88%	0.878	85%	0.852	S	S	*	*			trans	-78.7	136.9	166.4	-87.5	-99.8	0	0	0	108.9
386	E	40.9	Very low	35.1	Very low	267 Å²	267	168.2 Å²	168.2	100%	1.248	85%	0.851	S	S	*	*			trans	136.8	0	157.2	-80.8	-172.4	174.6	0	0	111.8

Retrieved 386 of 386 residues in 113 ms (Link to these results)

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