A0A077YXV9_TRITR Loading...

Y phosphatase domain containing protein

AlphaFold DB , UniProt , Accession A0A077YXV9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 337 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	49.1	Very low	59.7	Low	230 Å²	230	100.3 Å²	100.3	100%	1.133	58%	0.583	S	S	*	*				0	2.4	0	-75.1	-172.7	149.5	0	0	113.8
2	S	51.4	Low	61.3	Low	102 Å²	102	96.8 Å²	96.8	71%	0.713	57%	0.569	S	S	*	*			trans	-87.1	-6.9	-174.3	-16	0	0	0	0	115.5
3	S	53.2	Low	62.6	Low	81 Å²	81	95.2 Å²	95.2	57%	0.566	56%	0.556	S	S	*	*	H	α-helix	trans	-79.8	-38.4	-175.7	51.4	0	0	0	0	113	S5 S6	S3-S5 PolarHBondContact O-N 3.21Å; S3-S6 PolarHBondContact O-N 3.23Å; S3-S6 PolarHBondContact O-OG 3.44Å
4	N	54.5	Low	63.9	Low	103 Å²	103	97.4 Å²	97.4	55%	0.551	56%	0.558	S	S	*	*	H	α-helix	trans	-67.8	-39.3	-173.6	-78.2	17.5	0	0	0	113	S6 S7 E8	N4-S6 VanDerWaalsContact C-N 3.3Å; N4-S6 PolarHBondContact O-N 2.84Å; N4-S7 PolarHBondContact O-N 3.09Å; N4-S7 VanDerWaalsContact O-N 3.15Å; N4-S7 PolarHBondContact O-OG 2.89Å; N4-E8 PolarHBondContact O-N 2.92Å
5	S	58.1	Low	65.1	Low	68 Å²	68	97.7 Å²	97.7	48%	0.476	56%	0.562	S	S	.	*	H	α-helix	trans	-62	-37.5	-178.5	61.1	0	0	0	0	112.6	S3 T9	S3-S5 PolarHBondContact O-N 3.21Å; S5-T9 WeakPolarHBondContact O-CB 3.34Å; S5-T9 PolarHBondContact O-N 3.09Å; S5-T9 PolarHBondContact O-OG1 3.08Å
6	S	58.5	Low	66.2	Low	77 Å²	77	98 Å²	98	54%	0.538	56%	0.56	S	S	.	*	H	α-helix	trans	-65.9	-39.9	177.1	69.3	0	0	0	0	112.2	S3 N4 S10	S3-S6 PolarHBondContact O-N 3.23Å; S3-S6 PolarHBondContact O-OG 3.44Å; N4-S6 VanDerWaalsContact C-N 3.3Å; N4-S6 PolarHBondContact O-N 2.84Å; S6-S10 WeakPolarHBondContact O-CB 3.39Å; S6-S10 PolarHBondContact O-N 3.38Å
7	S	58.7	Low	67	Low	52 Å²	52	92.5 Å²	92.5	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-69.4	-41.9	178.8	65.2	0	0	0	0	112.5	N4 S10 Q11	N4-S7 PolarHBondContact O-N 3.09Å; N4-S7 VanDerWaalsContact O-N 3.15Å; N4-S7 PolarHBondContact O-OG 2.89Å; S7-S10 PolarHBondContact O-N 3.28Å; S7-Q11 WeakPolarHBondContact O-CG 3.36Å; S7-Q11 PolarHBondContact O-N 3.47Å
8	E	58.4	Low	68	Low	124 Å²	124	91.8 Å²	91.8	58%	0.579	52%	0.52	S	S	*	.	H	α-helix	trans	-66.2	-39.6	176.7	-72.3	173.4	-175.7	0	0	111.6	N4 Q11 S12	N4-E8 PolarHBondContact O-N 2.92Å; E8-Q11 PolarHBondContact O-N 3.29Å; E8-S12 WeakPolarHBondContact O-CB 3.5Å; E8-S12 PolarHBondContact O-N 3.01Å; E8-S12 PolarHBondContact O-OG 3.39Å
9	T	69.7	Low	69	Low	77 Å²	77	91.1 Å²	91.1	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-40.4	175	-52.5	0	0	0	0	111.3	S5 S12 L13	S5-T9 WeakPolarHBondContact O-CB 3.34Å; S5-T9 PolarHBondContact O-N 3.09Å; S5-T9 PolarHBondContact O-OG1 3.08Å; T9-S12 WeakPolarHBondContact CA-OG 3.16Å; T9-S12 PolarHBondContact O-OG 2.76Å; T9-L13 HydrophobicContact CG2-CD1 4.29Å; T9-L13 WeakPolarHBondContact O-CB 3.17Å; T9-L13 WeakPolarHBondContact O-CG 3.46Å; T9-L13 PolarHBondContact O-N 3.29Å; T9-L13 VanDerWaalsContact O-N 3.09Å
10	S	70.8	Confident	70.2	Confident	61 Å²	61	87.5 Å²	87.5	43%	0.427	50%	0.502	S	S	.	.	H	α-helix	trans	-66.6	-45.1	177.9	-165.2	0	0	0	0	111.9	S6 S7 L13 E14	S6-S10 WeakPolarHBondContact O-CB 3.39Å; S6-S10 PolarHBondContact O-N 3.38Å; S7-S10 PolarHBondContact O-N 3.28Å; S10-L13 PolarHBondContact O-N 3.4Å; S10-E14 PolarHBondContact O-N 2.91Å
11	Q	74.7	Confident	71.3	Confident	128 Å²	128	83.3 Å²	83.3	60%	0.598	48%	0.478	S	S	*	.	H	α-helix	trans	-64.1	-42.4	178.9	-72.9	177.9	7.1	0	0	111.9	S7 E8 L13 E14 V15	S7-Q11 WeakPolarHBondContact O-CG 3.36Å; S7-Q11 PolarHBondContact O-N 3.47Å; E8-Q11 PolarHBondContact O-N 3.29Å; Q11-L13 PolarHBondContact O-N 3.44Å; Q11-E14 PolarHBondContact O-N 2.71Å; Q11-V15 WeakPolarHBondContact O-CG2 3.17Å; Q11-V15 PolarHBondContact O-N 2.87Å; Q11-V15 VanDerWaalsContact O-N 3.1Å
12	S	78.8	Confident	73.3	Confident	58 Å²	58	74.1 Å²	74.1	41%	0.406	43%	0.434	S	S	.	.	H	α-helix	trans	-63.9	-39.9	176.6	54.7	0	0	0	0	112.6	E8 T9 V15 L16	E8-S12 WeakPolarHBondContact O-CB 3.5Å; E8-S12 PolarHBondContact O-N 3.01Å; E8-S12 PolarHBondContact O-OG 3.39Å; T9-S12 WeakPolarHBondContact CA-OG 3.16Å; T9-S12 PolarHBondContact O-OG 2.76Å; S12-V15 PolarHBondContact O-N 3.44Å; S12-L16 WeakPolarHBondContact O-CG 3.14Å; S12-L16 PolarHBondContact O-N 3.39Å
13	L	77.7	Confident	75.3	Confident	77 Å²	77	75.6 Å²	75.6	40%	0.403	43%	0.428	S	S	.	.	H	α-helix	trans	-64.5	-40.5	174.8	-76	172.9	0	0	0	112.7	T9 S10 Q11 L16 A17	T9-L13 HydrophobicContact CG2-CD1 4.29Å; T9-L13 WeakPolarHBondContact O-CB 3.17Å; T9-L13 WeakPolarHBondContact O-CG 3.46Å; T9-L13 PolarHBondContact O-N 3.29Å; T9-L13 VanDerWaalsContact O-N 3.09Å; S10-L13 PolarHBondContact O-N 3.4Å; Q11-L13 PolarHBondContact O-N 3.44Å; L13-L16 PolarHBondContact O-N 3.05Å; L13-A17 VanDerWaalsContact O-CB 3.26Å; L13-A17 WeakPolarHBondContact O-CB 3.39Å; L13-A17 PolarHBondContact O-N 2.89Å
14	E	80.4	Confident	77.3	Confident	125 Å²	125	72.9 Å²	72.9	58%	0.584	41%	0.405	S	S	*	.	H	α-helix	trans	-63.4	-41.5	176.5	-77.1	-177.6	180	0	0	112.3	S10 Q11 A17 K18	S10-E14 PolarHBondContact O-N 2.91Å; Q11-E14 PolarHBondContact O-N 2.71Å; E14-A17 PolarHBondContact O-N 2.98Å; E14-K18 WeakPolarHBondContact O-CB 3.49Å; E14-K18 PolarHBondContact O-N 2.74Å
15	V	83.2	Confident	79.1	Confident	102 Å²	102	68 Å²	68	62%	0.618	38%	0.379	S	S	*	.	H	α-helix	trans	-63.8	-42.9	175.9	173	0	0	0	0	110.9	Q11 S12 K18 S19	Q11-V15 WeakPolarHBondContact O-CG2 3.17Å; Q11-V15 PolarHBondContact O-N 2.87Å; Q11-V15 VanDerWaalsContact O-N 3.1Å; S12-V15 PolarHBondContact O-N 3.44Å; V15-K18 PolarHBondContact O-N 3.4Å; V15-S19 WeakPolarHBondContact O-CB 3.47Å; V15-S19 PolarHBondContact O-N 3.46Å
16	L	81.6	Confident	80.7	Confident	103 Å²	103	66.6 Å²	66.6	54%	0.539	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-45.2	175.5	-72.8	169.9	0	0	0	112	S12 L13 S19 S20	S12-L16 WeakPolarHBondContact O-CG 3.14Å; S12-L16 PolarHBondContact O-N 3.39Å; L13-L16 PolarHBondContact O-N 3.05Å; L16-S19 PolarHBondContact O-N 3.31Å; L16-S20 PolarHBondContact O-N 3.27Å; L16-S20 PolarHBondContact O-OG 3.41Å
17	A	80.8	Confident	82.3	Confident	4 Å²	4	67.1 Å²	67.1	3%	0.033	37%	0.365	C	S	.	.	H	α-helix	trans	-58.7	-46	176.1	0	0	0	0	0	112	L13 E14 A21 I269 W313	L13-A17 VanDerWaalsContact O-CB 3.26Å; L13-A17 WeakPolarHBondContact O-CB 3.39Å; L13-A17 PolarHBondContact O-N 2.89Å; E14-A17 PolarHBondContact O-N 2.98Å; A17-A21 VanDerWaalsContact O-CB 3.23Å; A17-A21 WeakPolarHBondContact O-CB 3.26Å; A17-A21 PolarHBondContact O-N 3.33Å; A17-I269 WeakPolarHBondContact CB-O 3.21Å; A17-W313 VanDerWaalsContact C-CZ2 3.43Å; A17-W313 HydrophobicContact CB-CH2 4.46Å; A17-W313 HydrophobicContact CB-CZ2 3.77Å; A17-W313 VanDerWaalsContact O-CH2 3.28Å; A17-W313 WeakPolarHBondContact O-CH2 3.47Å; A17-W313 WeakPolarHBondContact O-CZ2 3.49Å
18	K	85.1	Confident	83.8	Confident	81 Å²	81	65.8 Å²	65.8	35%	0.352	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-51.9	173.7	-176.9	176.5	-178.7	177.1	0	110.9	E14 V15 S20 V22 W313 D314	E14-K18 WeakPolarHBondContact O-CB 3.49Å; E14-K18 PolarHBondContact O-N 2.74Å; V15-K18 PolarHBondContact O-N 3.4Å; K18-S20 PolarHBondContact O-N 2.98Å; K18-V22 HydrophobicContact CG-CG2 4.15Å; K18-V22 VanDerWaalsContact O-CB 3.23Å; K18-V22 WeakPolarHBondContact O-CB 3.29Å; K18-V22 WeakPolarHBondContact O-CG2 3.32Å; K18-V22 PolarHBondContact O-N 2.9Å; K18-W313 HydrophobicContact CB-CD2 4.37Å; K18-W313 HydrophobicContact CB-CG 4.11Å; K18-W313 HydrophobicContact CD-CB 4.47Å; K18-W313 HydrophobicContact CD-CG 4.44Å; K18-W313 HydrophobicContact CG-CB 4.16Å; K18-W313 HydrophobicContact CG-CD2 4.46Å; K18-W313 HydrophobicContact CG-CG 3.88Å; K18-D314 WeakPolarHBondContact CE-O 3.47Å; K18-D314 PolarHBondContact NZ-O 3.29Å; K18-D314 VanDerWaalsContact NZ-O 3.12Å
19	S	87.2	Confident	85.3	Confident	78 Å²	78	60 Å²	60	55%	0.545	33%	0.327	S	S	.	.	H	α-helix	trans	-59.5	-51.1	-174.4	-176.2	0	0	0	0	112.5	V15 L16 K23	V15-S19 WeakPolarHBondContact O-CB 3.47Å; V15-S19 PolarHBondContact O-N 3.46Å; L16-S19 PolarHBondContact O-N 3.31Å; S19-K23 VanDerWaalsContact O-CB 3.25Å; S19-K23 WeakPolarHBondContact O-CB 3.36Å; S19-K23 PolarHBondContact O-N 2.69Å
20	S	91.6	Very high	86	Confident	19 Å²	19	60.6 Å²	60.6	13%	0.133	33%	0.328	C	S	.	.	H	α-helix	trans	-68.9	-40.6	-176.1	63.1	0	0	0	0	112.8	L16 K18 W24 G272	L16-S20 PolarHBondContact O-N 3.27Å; L16-S20 PolarHBondContact O-OG 3.41Å; K18-S20 PolarHBondContact O-N 2.98Å; S20-W24 WeakPolarHBondContact O-CB 3.38Å; S20-W24 PolarHBondContact O-N 2.85Å; S20-G272 WeakPolarHBondContact CB-O 3.46Å; S20-G272 PolarHBondContact OG-O 3.31Å
21	A	93.1	Very high	85.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-73.3	-39.6	-179.2	0	0	0	0	0	112.5	A17 K23 W24 A25 I269 I309 W313	A17-A21 VanDerWaalsContact O-CB 3.23Å; A17-A21 WeakPolarHBondContact O-CB 3.26Å; A17-A21 PolarHBondContact O-N 3.33Å; A21-K23 VanDerWaalsContact C-N 3.34Å; A21-W24 PolarHBondContact O-N 2.89Å; A21-A25 WeakPolarHBondContact O-CB 3.46Å; A21-A25 PolarHBondContact O-N 3.34Å; A21-I269 HydrophobicContact CB-CG2 4.09Å; A21-I309 HydrophobicContact CB-CD1 4.26Å; A21-I309 HydrophobicContact CB-CG1 4.18Å; A21-I309 HydrophobicContact CB-CG2 4.42Å; A21-W313 HydrophobicContact CB-CE3 4.09Å; A21-W313 HydrophobicContact CB-CH2 3.31Å; A21-W313 HydrophobicContact CB-CZ2 4.46Å; A21-W313 HydrophobicContact CB-CZ3 3.13Å
22	V	92.6	Very high	85	Confident	36 Å²	36	59.3 Å²	59.3	22%	0.218	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-42.5	174	171.1	0	0	0	0	110.6	K18 A25 T26 I309 I315 W323	K18-V22 HydrophobicContact CG-CG2 4.15Å; K18-V22 VanDerWaalsContact O-CB 3.23Å; K18-V22 WeakPolarHBondContact O-CB 3.29Å; K18-V22 WeakPolarHBondContact O-CG2 3.32Å; K18-V22 PolarHBondContact O-N 2.9Å; V22-A25 PolarHBondContact O-N 3.28Å; V22-T26 WeakPolarHBondContact O-CB 3.48Å; V22-T26 PolarHBondContact O-N 3.25Å; V22-T26 PolarHBondContact O-OG1 2.76Å; V22-I309 HydrophobicContact CG2-CG2 4.39Å; V22-I315 HydrophobicContact CB-CD1 4.48Å; V22-I315 HydrophobicContact CG1-CD1 4.26Å; V22-I315 HydrophobicContact CG2-CD1 3.41Å; V22-I315 VanDerWaalsContact CG2-CD1 3.41Å; V22-W323 HydrophobicContact CG1-CH2 4.04Å; V22-W323 HydrophobicContact CG1-CZ2 4.46Å
23	K	93	Very high	84.1	Confident	134 Å²	134	65.6 Å²	65.6	58%	0.583	35%	0.348	S	S	*	.	H	α-helix	trans	-58.9	-50.3	173.4	-177.9	178.5	178.4	-177.8	0	111.3	S19 A21 A25 T26 D27	S19-K23 VanDerWaalsContact O-CB 3.25Å; S19-K23 WeakPolarHBondContact O-CB 3.36Å; S19-K23 PolarHBondContact O-N 2.69Å; A21-K23 VanDerWaalsContact C-N 3.34Å; K23-A25 PolarHBondContact O-N 3.44Å; K23-T26 WeakPolarHBondContact O-CB 3.27Å; K23-T26 PolarHBondContact O-N 3.25Å; K23-T26 VanDerWaalsContact O-N 3.16Å; K23-D27 WeakPolarHBondContact O-CB 3.2Å; K23-D27 VanDerWaalsContact O-CG 3.25Å; K23-D27 PolarHBondContact O-N 3.2Å
24	W	94.3	Very high	84.1	Confident	24 Å²	24	65.3 Å²	65.3	9%	0.091	35%	0.347	C	S	.	.	H	α-helix	trans	-57.3	-45.7	178.3	175.5	85.5	0	0	0	112.9	S20 A21 T26 D27 T28 T274 P275 I277 Y302 L305 I306 I309	S20-W24 WeakPolarHBondContact O-CB 3.38Å; S20-W24 PolarHBondContact O-N 2.85Å; A21-W24 PolarHBondContact O-N 2.89Å; W24-T26 VanDerWaalsContact C-N 3.34Å; W24-D27 PolarHBondContact O-N 3.22Å; W24-T28 VanDerWaalsContact O-CB 3.26Å; W24-T28 WeakPolarHBondContact O-CB 3.19Å; W24-T28 PolarHBondContact O-N 2.76Å; W24-T28 PolarHBondContact O-OG1 3Å; W24-T274 HydrophobicContact CB-CG2 4.18Å; W24-T274 HydrophobicContact CG-CG2 4.16Å; W24-P275 HydrophobicContact CB-CG 4.36Å; W24-P275 HydrophobicContact CD2-CG 3.55Å; W24-P275 HydrophobicContact CE3-CG 3.88Å; W24-P275 HydrophobicContact CG-CG 3.74Å; W24-P275 HydrophobicContact CZ2-CG 4.43Å; W24-P275 HydrophobicContact CZ3-CG 4.45Å; W24-P275 PolarHBondContact NE1-O 2.78Å; W24-P275 VanDerWaalsContact NE1-O 3.1Å; W24-I277 HydrophobicContact CH2-CD1 3.97Å; W24-I277 HydrophobicContact CZ2-CD1 3.62Å; W24-I277 HydrophobicContact CZ2-CG1 4.27Å; W24-Y302 HydrophobicContact CH2-CD1 4.26Å; W24-Y302 HydrophobicContact CZ2-CD1 4.13Å; W24-Y302 HydrophobicContact CZ2-CE1 4.09Å; W24-L305 HydrophobicContact CH2-CB 3.91Å; W24-L305 HydrophobicContact CH2-CD1 4.12Å; W24-L305 HydrophobicContact CZ3-CB 4Å; W24-I306 HydrophobicContact CH2-CG1 4.4Å; W24-I306 HydrophobicContact CZ3-CG1 4.03Å; W24-I309 HydrophobicContact CE3-CD1 3.46Å; W24-I309 VanDerWaalsContact CE3-CD1 3.46Å; W24-I309 HydrophobicContact CZ3-CD1 3.6Å
25	A	93.6	Very high	84.3	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-40.9	178.1	0	0	0	0	0	111.5	A21 V22 K23 L29 I309 W323	A21-A25 WeakPolarHBondContact O-CB 3.46Å; A21-A25 PolarHBondContact O-N 3.34Å; V22-A25 PolarHBondContact O-N 3.28Å; K23-A25 PolarHBondContact O-N 3.44Å; A25-L29 VanDerWaalsContact O-CB 3.28Å; A25-L29 WeakPolarHBondContact O-CB 3.31Å; A25-L29 VanDerWaalsContact O-CG 3.27Å; A25-L29 WeakPolarHBondContact O-CG 3.19Å; A25-L29 PolarHBondContact O-N 2.79Å; A25-I309 HydrophobicContact CB-CD1 3.91Å; A25-I309 HydrophobicContact CB-CG2 4.27Å; A25-W323 HydrophobicContact CB-CE3 4.2Å; A25-W323 HydrophobicContact CB-CH2 3.52Å; A25-W323 HydrophobicContact CB-CZ2 4.03Å; A25-W323 HydrophobicContact CB-CZ3 3.61Å
26	T	92	Very high	84.5	Confident	38 Å²	38	56.1 Å²	56.1	23%	0.233	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-53	174.1	-56	0	0	0	0	110.7	V22 K23 W24 T28 L29 N30 W323	V22-T26 WeakPolarHBondContact O-CB 3.48Å; V22-T26 PolarHBondContact O-N 3.25Å; V22-T26 PolarHBondContact O-OG1 2.76Å; K23-T26 WeakPolarHBondContact O-CB 3.27Å; K23-T26 PolarHBondContact O-N 3.25Å; K23-T26 VanDerWaalsContact O-N 3.16Å; W24-T26 VanDerWaalsContact C-N 3.34Å; T26-T28 PolarHBondContact O-N 3.42Å; T26-L29 PolarHBondContact O-N 3.22Å; T26-N30 WeakPolarHBondContact CG2-ND2 3.28Å; T26-N30 WeakPolarHBondContact O-CB 3.36Å; T26-N30 PolarHBondContact O-N 2.69Å; T26-W323 WeakPolarHBondContact OG1-CZ2 3.26Å
27	D	90.9	Very high	84.9	Confident	89 Å²	89	57 Å²	57	48%	0.476	30%	0.3	S	S	.	.	H	α-helix	trans	-62.8	-43	-177.8	-66.5	-16.2	0	0	0	111	K23 W24 L29 N31	K23-D27 WeakPolarHBondContact O-CB 3.2Å; K23-D27 VanDerWaalsContact O-CG 3.25Å; K23-D27 PolarHBondContact O-N 3.2Å; W24-D27 PolarHBondContact O-N 3.22Å; D27-L29 VanDerWaalsContact C-N 3.34Å; D27-L29 PolarHBondContact O-N 2.98Å; D27-N31 WeakPolarHBondContact O-CB 3.17Å; D27-N31 PolarHBondContact O-N 3.47Å
28	T	90.9	Very high	85.3	Confident	24 Å²	24	60.1 Å²	60.1	15%	0.147	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-40.6	177.5	-60.3	0	0	0	0	112	W24 T26 Y302 I306	W24-T28 VanDerWaalsContact O-CB 3.26Å; W24-T28 WeakPolarHBondContact O-CB 3.19Å; W24-T28 PolarHBondContact O-N 2.76Å; W24-T28 PolarHBondContact O-OG1 3Å; T26-T28 PolarHBondContact O-N 3.42Å; T28-Y302 HydrophobicContact CG2-CD1 3.85Å; T28-Y302 HydrophobicContact CG2-CE1 4Å; T28-I306 HydrophobicContact CG2-CD1 4.5Å
29	L	89.8	Confident	85.7	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-90.4	-22.6	-175.2	-68.8	174.6	0	0	0	114	A25 T26 D27 F35 I306 W323 K326 I330	A25-L29 VanDerWaalsContact O-CB 3.28Å; A25-L29 WeakPolarHBondContact O-CB 3.31Å; A25-L29 VanDerWaalsContact O-CG 3.27Å; A25-L29 WeakPolarHBondContact O-CG 3.19Å; A25-L29 PolarHBondContact O-N 2.79Å; T26-L29 PolarHBondContact O-N 3.22Å; D27-L29 VanDerWaalsContact C-N 3.34Å; D27-L29 PolarHBondContact O-N 2.98Å; L29-F35 HydrophobicContact CD2-CE2 4.47Å; L29-I306 HydrophobicContact CD1-CD1 4.28Å; L29-I306 HydrophobicContact CD1-CG1 4.44Å; L29-I306 HydrophobicContact CD1-CG2 4.01Å; L29-I306 HydrophobicContact CD2-CD1 3.75Å; L29-I306 HydrophobicContact CG-CD1 4.06Å; L29-W323 HydrophobicContact CD1-CB 3.74Å; L29-W323 HydrophobicContact CD1-CD2 3.8Å; L29-W323 HydrophobicContact CD1-CE3 4.45Å; L29-W323 HydrophobicContact CD1-CG 3.42Å; L29-W323 VanDerWaalsContact CD1-CG 3.42Å; L29-K326 HydrophobicContact CB-CD 4.01Å; L29-K326 HydrophobicContact CD2-CB 3.79Å; L29-K326 WeakPolarHBondContact O-CD 3.17Å; L29-K326 PolarHBondContact O-NZ 3.26Å; L29-I330 HydrophobicContact CD2-CD1 4.26Å
30	N	83.4	Confident	85.9	Confident	90 Å²	90	57.3 Å²	57.3	48%	0.481	29%	0.294	S	S	.	.	H	α-helix	trans	-92.7	-7.5	179.3	-72.5	-13.8	0	0	0	113.4	T26 S32 K326	T26-N30 WeakPolarHBondContact CG2-ND2 3.28Å; T26-N30 WeakPolarHBondContact O-CB 3.36Å; T26-N30 PolarHBondContact O-N 2.69Å; N30-S32 PolarHBondContact O-N 2.87Å; N30-K326 PolarHBondContact OD1-NZ 2.76Å
31	N	68.4	Low	85.9	Confident	95 Å²	95	59.3 Å²	59.3	51%	0.508	31%	0.312	S	S	.	.	S	Bend	trans	-71.9	71.4	176.4	-160.7	-6.8	0	0	0	111.9	D27 F35	D27-N31 WeakPolarHBondContact O-CB 3.17Å; D27-N31 PolarHBondContact O-N 3.47Å; N31-F35 PolarHBondContact O-N 3.03Å
32	S	56.7	Low	85.8	Confident	66 Å²	66	61.9 Å²	61.9	46%	0.462	32%	0.324	S	S	.	.			trans	56.4	171	170.5	73	0	0	0	0	116.1	N30 N34 F35	N30-S32 PolarHBondContact O-N 2.87Å; S32-N34 PolarHBondContact O-N 2.96Å; S32-F35 WeakPolarHBondContact O-CD1 3.28Å; S32-F35 PolarHBondContact O-N 3.03Å
33	Q	60.3	Low	85.8	Confident	191 Å²	191	60.8 Å²	60.8	89%	0.893	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-10.2	176.9	-67.9	-178.5	-9	0	0	113.7
34	N	78.5	Confident	85.7	Confident	70 Å²	70	57 Å²	57	37%	0.374	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	6.2	-173.6	-63.8	-19.5	0	0	0	114.9	S32 V36 Q37 N38	S32-N34 PolarHBondContact O-N 2.96Å; N34-V36 PolarHBondContact O-N 2.9Å; N34-Q37 HydrophobicContact CB-CB 4.42Å; N34-Q37 CarbonylContact O-C 3.58Å; N34-Q37 WeakPolarHBondContact O-CA 3.34Å; N34-Q37 WeakPolarHBondContact O-CB 3.45Å; N34-Q37 PolarHBondContact O-N 3.19Å; N34-Q37 PolarHBondContact OD1-OE1 3.3Å; N34-N38 PolarHBondContact O-N 3.05Å
35	F	83.9	Confident	85.6	Confident	13 Å²	13	62.4 Å²	62.4	6%	0.057	33%	0.33	C	S	.	.	H	α-helix	trans	-52.3	-36	-178.6	70.4	-88	0	0	0	113.6	L29 N31 S32 N38 I39 K326 L329 I330	L29-F35 HydrophobicContact CD2-CE2 4.47Å; N31-F35 PolarHBondContact O-N 3.03Å; S32-F35 WeakPolarHBondContact O-CD1 3.28Å; S32-F35 PolarHBondContact O-N 3.03Å; F35-N38 PolarHBondContact O-N 3.29Å; F35-I39 WeakPolarHBondContact O-CG1 3.35Å; F35-I39 PolarHBondContact O-N 3.44Å; F35-K326 HydrophobicContact CE1-CB 4.45Å; F35-K326 HydrophobicContact CZ-CB 4.06Å; F35-L329 HydrophobicContact CE1-CD1 4.23Å; F35-L329 HydrophobicContact CZ-CB 4.01Å; F35-L329 HydrophobicContact CZ-CD1 4Å; F35-I330 HydrophobicContact CD2-CD1 4.25Å; F35-I330 HydrophobicContact CD2-CG1 4.12Å; F35-I330 HydrophobicContact CE2-CD1 3.9Å; F35-I330 HydrophobicContact CE2-CG1 3.45Å; F35-I330 VanDerWaalsContact CE2-CG1 3.45Å; F35-I330 HydrophobicContact CZ-CG1 4.47Å
36	V	87.9	Confident	85.4	Confident	21 Å²	21	62.8 Å²	62.8	13%	0.127	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-42.1	174.6	179	0	0	0	0	111.6	N34 N38 I39 F40 Y299 L329 K333	N34-V36 PolarHBondContact O-N 2.9Å; V36-N38 VanDerWaalsContact C-N 3.34Å; V36-I39 PolarHBondContact O-N 2.82Å; V36-F40 PolarHBondContact O-N 3.05Å; V36-Y299 HydrophobicContact CG1-CE1 3.94Å; V36-Y299 WeakPolarHBondContact O-CE1 3.47Å; V36-Y299 PolarHBondContact O-OH 3.27Å; V36-L329 HydrophobicContact CG2-CB 4.18Å; V36-K333 HydrophobicContact CG1-CB 4.42Å; V36-K333 HydrophobicContact CG1-CD 4.41Å; V36-K333 HydrophobicContact CG1-CG 3.48Å; V36-K333 VanDerWaalsContact CG1-CG 3.48Å
37	Q	88.7	Confident	85.1	Confident	123 Å²	123	62.9 Å²	62.9	58%	0.575	33%	0.33	S	S	*	.	H	α-helix	trans	-68.3	-36	176.5	-63.3	174.9	-8.4	0	0	111.2	N34 F40 A41	N34-Q37 HydrophobicContact CB-CB 4.42Å; N34-Q37 CarbonylContact O-C 3.58Å; N34-Q37 WeakPolarHBondContact O-CA 3.34Å; N34-Q37 WeakPolarHBondContact O-CB 3.45Å; N34-Q37 PolarHBondContact O-N 3.19Å; N34-Q37 PolarHBondContact OD1-OE1 3.3Å; Q37-F40 WeakPolarHBondContact O-CB 3.45Å; Q37-F40 PolarHBondContact O-N 2.8Å; Q37-A41 WeakPolarHBondContact O-CB 3.17Å; Q37-A41 PolarHBondContact O-N 2.91Å
38	N	90.6	Very high	84.9	Confident	69 Å²	69	61.5 Å²	61.5	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-44.2	176.5	-65.1	-13.7	0	0	0	111.4	N34 F35 V36 F40 A41 E42	N34-N38 PolarHBondContact O-N 3.05Å; F35-N38 PolarHBondContact O-N 3.29Å; V36-N38 VanDerWaalsContact C-N 3.34Å; N38-F40 VanDerWaalsContact C-N 3.25Å; N38-F40 PolarHBondContact O-N 3.28Å; N38-A41 PolarHBondContact O-N 3.06Å; N38-E42 VanDerWaalsContact O-CB 3.27Å; N38-E42 WeakPolarHBondContact O-CB 3.49Å; N38-E42 PolarHBondContact O-N 3.23Å
39	I	92.1	Very high	84.4	Confident	7 Å²	7	64.9 Å²	64.9	4%	0.036	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-39.6	174.3	-66.5	166.1	0	0	0	110.7	F35 V36 F43 Y298 Y299 Y302 I330	F35-I39 WeakPolarHBondContact O-CG1 3.35Å; F35-I39 PolarHBondContact O-N 3.44Å; V36-I39 PolarHBondContact O-N 2.82Å; I39-F43 PolarHBondContact O-N 3.15Å; I39-Y298 HydrophobicContact CG2-CD1 3.72Å; I39-Y298 HydrophobicContact CG2-CE1 3.96Å; I39-Y299 HydrophobicContact CB-CD1 4.14Å; I39-Y299 HydrophobicContact CB-CE1 3.89Å; I39-Y299 HydrophobicContact CG2-CD1 3.49Å; I39-Y299 VanDerWaalsContact CG2-CD1 3.49Å; I39-Y299 HydrophobicContact CG2-CE1 3.62Å; I39-Y299 HydrophobicContact CG2-CG 4.36Å; I39-Y302 HydrophobicContact CD1-CD1 3.91Å; I39-Y302 HydrophobicContact CD1-CD2 4.16Å; I39-Y302 HydrophobicContact CD1-CE1 4.35Å; I39-Y302 HydrophobicContact CD1-CG 3.81Å; I39-Y302 HydrophobicContact CG1-CD1 4.18Å; I39-Y302 HydrophobicContact CG1-CD2 4.11Å; I39-Y302 HydrophobicContact CG1-CE1 4.12Å; I39-Y302 HydrophobicContact CG1-CE2 4.07Å; I39-Y302 HydrophobicContact CG1-CG 4.17Å; I39-Y302 HydrophobicContact CG2-CD2 3.77Å; I39-Y302 HydrophobicContact CG2-CE2 3.88Å; I39-Y302 HydrophobicContact CG2-CG 4.48Å; I39-I330 HydrophobicContact CD1-CD1 4.12Å; I39-I330 HydrophobicContact CD1-CG1 4.42Å
40	F	91.1	Very high	83.6	Confident	93 Å²	93	65.8 Å²	65.8	41%	0.408	35%	0.349	S	S	.	.	H	α-helix	trans	-67.5	-47.2	176.7	-165.7	-117.6	0	0	0	113	V36 Q37 N38 E42 F43 C44 P295 Y299	V36-F40 PolarHBondContact O-N 3.05Å; Q37-F40 WeakPolarHBondContact O-CB 3.45Å; Q37-F40 PolarHBondContact O-N 2.8Å; N38-F40 VanDerWaalsContact C-N 3.25Å; N38-F40 PolarHBondContact O-N 3.28Å; F40-E42 PolarHBondContact O-N 3.5Å; F40-F43 WeakPolarHBondContact O-CB 3.49Å; F40-F43 PolarHBondContact O-N 3.16Å; F40-F43 VanDerWaalsContact O-N 3.16Å; F40-C44 PolarHBondContact O-N 3.05Å; F40-C44 PolarHBondContact O-SG 3.13Å; F40-C44 VanDerWaalsContact O-SG 3.37Å; F40-P295 HydrophobicContact CD2-CB 4.28Å; F40-P295 HydrophobicContact CE2-CB 4.04Å; F40-P295 HydrophobicContact CE2-CG 4.04Å; F40-Y299 VanDerWaalsContact CB-OH 3.28Å; F40-Y299 WeakPolarHBondContact CB-OH 3.42Å; F40-Y299 HydrophobicContact CD2-CE2 4.35Å
41	A	91.7	Very high	83.1	Confident	60 Å²	60	65.2 Å²	65.2	50%	0.496	35%	0.352	S	S	.	.	H	α-helix	trans	-60.9	-39.4	179.6	0	0	0	0	0	111.1	Q37 N38 C44 K45	Q37-A41 WeakPolarHBondContact O-CB 3.17Å; Q37-A41 PolarHBondContact O-N 2.91Å; N38-A41 PolarHBondContact O-N 3.06Å; A41-C44 PolarHBondContact O-N 3.25Å; A41-K45 PolarHBondContact O-N 3.49Å
42	E	92.4	Very high	83.2	Confident	54 Å²	54	64 Å²	64	25%	0.252	36%	0.355	S	S	.	.	H	α-helix	trans	-62.5	-46	173.4	-177.2	-177.4	85.6	0	0	112.3	N38 F40 C44 K45 L46 P278 Y298 Y302	N38-E42 VanDerWaalsContact O-CB 3.27Å; N38-E42 WeakPolarHBondContact O-CB 3.49Å; N38-E42 PolarHBondContact O-N 3.23Å; F40-E42 PolarHBondContact O-N 3.5Å; E42-C44 PolarHBondContact O-N 2.86Å; E42-K45 WeakPolarHBondContact O-CB 3.44Å; E42-K45 PolarHBondContact O-N 3.18Å; E42-L46 WeakPolarHBondContact O-CG 3.36Å; E42-L46 PolarHBondContact O-N 2.73Å; E42-P278 HydrophobicContact CG-CB 4.11Å; E42-P278 HydrophobicContact CG-CG 4.03Å; E42-P278 WeakPolarHBondContact OE1-CG 3.2Å; E42-P278 WeakPolarHBondContact OE2-CG 3.2Å; E42-Y298 VanDerWaalsContact CD-OH 3.3Å; E42-Y298 HydrophobicContact CG-CE1 4.4Å; E42-Y298 VanDerWaalsContact OE1-CE1 3.26Å; E42-Y298 WeakPolarHBondContact OE1-CE1 3.36Å; E42-Y298 VanDerWaalsContact OE1-CZ 3.28Å; E42-Y298 PolarHBondContact OE1-OH 3.12Å; E42-Y302 PolarHBondContact OE1-OH 3.06Å; E42-Y302 PolarHBondContact OE2-OH 3.29Å
43	F	91.4	Very high	83.6	Confident	13 Å²	13	64.9 Å²	64.9	6%	0.057	36%	0.361	C	S	.	.	H	α-helix	trans	-56.7	-49.2	173.1	176.7	-98.3	0	0	0	111.4	I39 F40 K45 L46 Q47 I292 H293 P295 Y298	I39-F43 PolarHBondContact O-N 3.15Å; F40-F43 WeakPolarHBondContact O-CB 3.49Å; F40-F43 PolarHBondContact O-N 3.16Å; F40-F43 VanDerWaalsContact O-N 3.16Å; F43-K45 VanDerWaalsContact C-N 3.27Å; F43-K45 PolarHBondContact O-N 3.33Å; F43-L46 PolarHBondContact O-N 3.42Å; F43-L46 VanDerWaalsContact O-N 3.16Å; F43-Q47 HydrophobicContact CD1-CG 4.13Å; F43-Q47 HydrophobicContact CE1-CG 3.65Å; F43-Q47 HydrophobicContact CE2-CG 4.2Å; F43-Q47 HydrophobicContact CZ-CG 3.7Å; F43-Q47 VanDerWaalsContact CZ-NE2 3.32Å; F43-Q47 WeakPolarHBondContact O-CG 3.48Å; F43-Q47 PolarHBondContact O-N 3.05Å; F43-I292 HydrophobicContact CE2-CG2 4.16Å; F43-I292 WeakPolarHBondContact CE2-O 3.34Å; F43-H293 WeakPolarHBondContact CZ-O 3.29Å; F43-P295 HydrophobicContact CD1-CB 4.1Å; F43-P295 HydrophobicContact CD1-CG 4.02Å; F43-P295 HydrophobicContact CE1-CB 4.07Å; F43-P295 HydrophobicContact CE1-CG 3.59Å; F43-P295 HydrophobicContact CZ-CB 4.48Å; F43-P295 HydrophobicContact CZ-CG 4.12Å; F43-Y298 HydrophobicContact CB-CD1 3.73Å; F43-Y298 HydrophobicContact CB-CE1 4.07Å; F43-Y298 HydrophobicContact CB-CG 4.2Å; F43-Y298 HydrophobicContact CD2-CD1 4.07Å; F43-Y298 HydrophobicContact CD2-CD2 4Å; F43-Y298 AromaticContact CD2-CG 3.64Å; F43-Y298 HydrophobicContact CD2-CG 3.64Å; F43-Y298 HydrophobicContact CG-CD1 4.33Å; F43-Y298 HydrophobicContact CG-CG 4.33Å
44	C	91.5	Very high	83.4	Confident	55 Å²	55	61 Å²	61	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-58.3	-39.3	177.7	-68.4	0	0	0	0	112.2	F40 A41 E42 Q47 A48	F40-C44 PolarHBondContact O-N 3.05Å; F40-C44 PolarHBondContact O-SG 3.13Å; F40-C44 VanDerWaalsContact O-SG 3.37Å; A41-C44 PolarHBondContact O-N 3.25Å; E42-C44 PolarHBondContact O-N 2.86Å; C44-Q47 PolarHBondContact O-N 3.37Å; C44-A48 WeakPolarHBondContact O-CB 3.38Å; C44-A48 PolarHBondContact O-N 3.18Å
45	K	91.6	Very high	81.6	Confident	138 Å²	138	64.3 Å²	64.3	60%	0.6	36%	0.359	S	S	*	.	H	α-helix	trans	-63.6	-44.3	176.4	-174.4	179.9	177.6	-178.2	0	111.9	A41 E42 F43 Q47 A48 Q49	A41-K45 PolarHBondContact O-N 3.49Å; E42-K45 WeakPolarHBondContact O-CB 3.44Å; E42-K45 PolarHBondContact O-N 3.18Å; F43-K45 VanDerWaalsContact C-N 3.27Å; F43-K45 PolarHBondContact O-N 3.33Å; K45-Q47 VanDerWaalsContact C-N 3.34Å; K45-Q47 PolarHBondContact O-N 3.02Å; K45-A48 PolarHBondContact O-N 2.82Å; K45-Q49 WeakPolarHBondContact O-CG 3.29Å; K45-Q49 PolarHBondContact O-N 2.96Å
46	L	89.6	Confident	79.5	Confident	8 Å²	8	68.8 Å²	68.8	4%	0.042	39%	0.39	C	S	.	.	H	α-helix	trans	-61.8	-41.5	176.7	-71.3	168.1	0	0	0	111.6	E42 F43 Q49 Q50 V281 L285 Y298	E42-L46 WeakPolarHBondContact O-CG 3.36Å; E42-L46 PolarHBondContact O-N 2.73Å; F43-L46 PolarHBondContact O-N 3.42Å; F43-L46 VanDerWaalsContact O-N 3.16Å; L46-Q49 PolarHBondContact O-N 2.94Å; L46-Q50 PolarHBondContact O-N 3.35Å; L46-V281 HydrophobicContact CD1-CB 4.19Å; L46-V281 HydrophobicContact CD1-CG1 4.08Å; L46-L285 HydrophobicContact CB-CD1 4.12Å; L46-Y298 HydrophobicContact CD1-CE2 3.77Å; L46-Y298 WeakPolarHBondContact CD1-OH 3.37Å
47	Q	86.5	Confident	77	Confident	40 Å²	40	72.5 Å²	72.5	19%	0.187	42%	0.423	C	S	.	.	H	α-helix	trans	-63.9	-42.3	175.8	-62.1	-58.1	-49.8	0	0	111.8	F43 C44 K45 Q50 S51 I292	F43-Q47 HydrophobicContact CD1-CG 4.13Å; F43-Q47 HydrophobicContact CE1-CG 3.65Å; F43-Q47 HydrophobicContact CE2-CG 4.2Å; F43-Q47 HydrophobicContact CZ-CG 3.7Å; F43-Q47 VanDerWaalsContact CZ-NE2 3.32Å; F43-Q47 WeakPolarHBondContact O-CG 3.48Å; F43-Q47 PolarHBondContact O-N 3.05Å; C44-Q47 PolarHBondContact O-N 3.37Å; K45-Q47 VanDerWaalsContact C-N 3.34Å; K45-Q47 PolarHBondContact O-N 3.02Å; Q47-Q50 WeakPolarHBondContact O-CB 3.05Å; Q47-Q50 PolarHBondContact O-N 2.98Å; Q47-S51 PolarHBondContact O-N 3.43Å; Q47-S51 VanDerWaalsContact O-N 3.07Å; Q47-S51 PolarHBondContact O-OG 3.43Å; Q47-I292 PolarHBondContact NE2-O 2.88Å
48	A	86	Confident	74.2	Confident	60 Å²	60	69.9 Å²	69.9	50%	0.496	43%	0.429	S	S	.	.	H	α-helix	trans	-65.4	-40.8	179	0	0	0	0	0	112.8	C44 K45 Q50 S51 A52	C44-A48 WeakPolarHBondContact O-CB 3.38Å; C44-A48 PolarHBondContact O-N 3.18Å; K45-A48 PolarHBondContact O-N 2.82Å; A48-Q50 PolarHBondContact O-N 2.91Å; A48-S51 PolarHBondContact O-N 2.79Å; A48-A52 PolarHBondContact O-N 3.48Å; A48-A52 VanDerWaalsContact O-N 3.1Å
49	Q	80.3	Confident	71.3	Confident	95 Å²	95	73.5 Å²	73.5	44%	0.444	45%	0.453	S	S	.	.	H	α-helix	trans	-58.6	-39.8	174.5	-74.2	172.8	-35.6	0	0	111.5	K45 L46 A52 S53	K45-Q49 WeakPolarHBondContact O-CG 3.29Å; K45-Q49 PolarHBondContact O-N 2.96Å; L46-Q49 PolarHBondContact O-N 2.94Å; Q49-A52 PolarHBondContact O-N 3.16Å; Q49-S53 PolarHBondContact O-N 3.39Å
50	Q	74	Confident	68.2	Low	21 Å²	21	76.5 Å²	76.5	10%	0.098	49%	0.486	C	S	.	.	H	α-helix	trans	-68.3	-41.3	177.4	-172.6	176.9	56.9	0	0	112.8	L46 Q47 A48 A52 S53 L285	L46-Q50 PolarHBondContact O-N 3.35Å; Q47-Q50 WeakPolarHBondContact O-CB 3.05Å; Q47-Q50 PolarHBondContact O-N 2.98Å; A48-Q50 PolarHBondContact O-N 2.91Å; Q50-A52 VanDerWaalsContact C-N 3.29Å; Q50-A52 PolarHBondContact O-N 3.28Å; Q50-S53 PolarHBondContact O-N 3.1Å; Q50-L285 VanDerWaalsContact NE2-CD2 3.3Å
51	S	71.8	Confident	65.1	Low	78 Å²	78	81 Å²	81	55%	0.545	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-37.9	176.3	-60.5	0	0	0	0	112.1	Q47 A48 K54	Q47-S51 PolarHBondContact O-N 3.43Å; Q47-S51 VanDerWaalsContact O-N 3.07Å; Q47-S51 PolarHBondContact O-OG 3.43Å; A48-S51 PolarHBondContact O-N 2.79Å; S51-K54 PolarHBondContact O-N 3.02Å
52	A	70.4	Confident	61.9	Low	69 Å²	69	87.6 Å²	87.6	57%	0.57	53%	0.528	S	S	*	.	H	α-helix	trans	-66.7	-39.8	176.6	0	0	0	0	0	112.5	A48 Q49 Q50 K54 N55	A48-A52 PolarHBondContact O-N 3.48Å; A48-A52 VanDerWaalsContact O-N 3.1Å; Q49-A52 PolarHBondContact O-N 3.16Å; Q50-A52 VanDerWaalsContact C-N 3.29Å; Q50-A52 PolarHBondContact O-N 3.28Å; A52-K54 PolarHBondContact O-N 3.37Å; A52-K54 VanDerWaalsContact O-N 3.15Å; A52-N55 PolarHBondContact O-N 2.94Å; A52-N55 VanDerWaalsContact O-N 3.09Å
53	S	65.1	Low	58.7	Low	84 Å²	84	94 Å²	94	59%	0.587	56%	0.558	S	S	*	*	H	α-helix	trans	-63.8	-17.6	179.5	-176	0	0	0	0	114.4	Q49 Q50 P56	Q49-S53 PolarHBondContact O-N 3.39Å; Q50-S53 PolarHBondContact O-N 3.1Å; S53-P56 WeakPolarHBondContact O-CD 3.36Å
54	K	57.4	Low	55.6	Low	111 Å²	111	103.3 Å²	103.3	48%	0.483	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84	-15.3	175.9	-70.1	-177.6	-174.3	161.7	0	113.9	S51 A52 P56 W291	S51-K54 PolarHBondContact O-N 3.02Å; A52-K54 PolarHBondContact O-N 3.37Å; A52-K54 VanDerWaalsContact O-N 3.15Å; K54-P56 VanDerWaalsContact O-CD 3.23Å; K54-P56 WeakPolarHBondContact O-CD 3.28Å; K54-W291 VanDerWaalsContact CE-CZ2 3.42Å
55	N	40.3	Very low	52.3	Low	139 Å²	139	106.3 Å²	106.3	74%	0.743	62%	0.62	S	S	*	*			trans	-111.2	52.1	177.8	-70.1	-9.5	0	0	0	112.5	A52 A57	A52-N55 PolarHBondContact O-N 2.94Å; A52-N55 VanDerWaalsContact O-N 3.09Å; N55-A57 VanDerWaalsContact C-N 3.27Å; N55-A57 PolarHBondContact O-N 3.4Å
56	P	40.5	Very low	49.2	Very low	107 Å²	107	110 Å²	110	70%	0.695	64%	0.637	S	S	*	*			trans	-75.5	91.8	165.9	31.5	-25.5	0	0	0	107.1	S53 K54 G58	S53-P56 WeakPolarHBondContact O-CD 3.36Å; K54-P56 VanDerWaalsContact O-CD 3.23Å; K54-P56 WeakPolarHBondContact O-CD 3.28Å; P56-G58 PolarHBondContact O-N 2.83Å; P56-G58 VanDerWaalsContact O-N 3.13Å
57	A	35	Very low	46.2	Very low	99 Å²	99	114.7 Å²	114.7	82%	0.818	67%	0.67	S	S	*	*			trans	-57.7	113.6	165.8	0	0	0	0	0	108.8	N55	N55-A57 VanDerWaalsContact C-N 3.27Å; N55-A57 PolarHBondContact O-N 3.4Å
58	G	29.6	Very low	43.5	Very low	68 Å²	68	118 Å²	118	70%	0.701	70%	0.704	S	S	*	*			trans	67.8	118.7	159.7	0	0	0	0	0	116.3	P56	P56-G58 PolarHBondContact O-N 2.83Å; P56-G58 VanDerWaalsContact O-N 3.13Å
59	V	29.4	Very low	40.9	Very low	144 Å²	144	118.8 Å²	118.8	87%	0.873	70%	0.702	S	S	*	*			trans	168.3	111	131	159.4	0	0	0	0	105.4
60	G	26.3	Very low	38.6	Very low	71 Å²	71	119.3 Å²	119.3	73%	0.732	72%	0.716	S	S	*	*			trans	-72.3	144.3	176.2	0	0	0	0	0	111.1
61	Q	26.6	Very low	36.5	Very low	188 Å²	188	124.2 Å²	124.2	88%	0.879	75%	0.753	S	S	*	*			trans	-153	113.6	151.2	-107.1	173.1	-3	0	0	107.7	E63	Q61-E63 PolarHBondContact O-N 3.16Å
62	E	24.7	Very low	34.5	Very low	197 Å²	197	122.5 Å²	122.5	92%	0.921	75%	0.748	S	S	*	*			trans	-71.3	116.1	170.6	-72.9	-179.4	136.5	0	0	109
63	E	25.3	Very low	32.4	Very low	188 Å²	188	125.5 Å²	125.5	88%	0.879	75%	0.754	S	S	*	*			trans	-126	120.2	158.1	-78.1	-160.2	156.3	0	0	111.1	Q61 S65	Q61-E63 PolarHBondContact O-N 3.16Å; E63-S65 PolarHBondContact O-N 2.75Å
64	K	25.3	Very low	30.6	Very low	210 Å²	210	126.8 Å²	126.8	91%	0.913	76%	0.758	S	S	*	*			trans	-69.9	119.8	178.6	-69.4	171.5	177.1	169.9	0	109.6
65	S	23.3	Very low	29.2	Very low	117 Å²	117	125.5 Å²	125.5	82%	0.818	77%	0.768	S	S	*	*			trans	-144	120.1	164.5	-78	0	0	0	0	111.7	E63 S67	E63-S65 PolarHBondContact O-N 2.75Å; S65-S67 PolarHBondContact O-N 2.88Å
66	K	25.1	Very low	28.4	Very low	217 Å²	217	124.4 Å²	124.4	94%	0.943	77%	0.772	S	S	*	*			trans	-75.4	106.3	179.1	-67.8	172.7	176.1	175.9	0	110.1
67	S	27	Very low	27.8	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	78%	0.775	S	S	*	*			trans	-165.2	116.4	142.6	62	0	0	0	0	108.2	S65 V69	S65-S67 PolarHBondContact O-N 2.88Å; S67-V69 VanDerWaalsContact C-N 3.3Å; S67-V69 PolarHBondContact O-N 2.8Å
68	A	29.1	Very low	27.3	Very low	109 Å²	109	129.4 Å²	129.4	90%	0.901	78%	0.777	S	S	*	*			trans	-79.8	78.5	-174.7	0	0	0	0	0	110.6
69	V	33.3	Very low	27.2	Very low	77 Å²	77	134.2 Å²	134.2	47%	0.467	79%	0.786	S	S	.	*	S	Bend	trans	-132.8	99.7	148.8	180	0	0	0	0	103.5	S67 S71 I97	S67-V69 VanDerWaalsContact C-N 3.3Å; S67-V69 PolarHBondContact O-N 2.8Å; V69-S71 PolarHBondContact O-N 2.64Å; V69-I97 HydrophobicContact CG1-CD1 4.32Å; V69-I97 HydrophobicContact CG1-CG1 4.3Å
70	S	31.5	Very low	27.1	Very low	105 Å²	105	133 Å²	133	73%	0.734	78%	0.784	S	S	*	*			trans	-66.9	98.4	-171.1	-177.5	0	0	0	0	109.9	G72	S70-G72 PolarHBondContact O-N 2.92Å
71	S	29.2	Very low	27.2	Very low	125 Å²	125	140 Å²	140	87%	0.874	79%	0.794	S	S	*	*			trans	-68.4	86.8	154.3	-51.6	0	0	0	0	106.2	V69	V69-S71 PolarHBondContact O-N 2.64Å
72	G	29.6	Very low	27.3	Very low	42 Å²	42	134 Å²	134	43%	0.433	78%	0.783	S	S	.	*			trans	-129.1	117.5	-164.3	0	0	0	0	0	112.9	S70	S70-G72 PolarHBondContact O-N 2.92Å
73	N	27.2	Very low	27.5	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	78%	0.784	S	S	*	*			trans	-46.8	148.6	-176.6	-74.5	-32.1	0	0	0	116.6	A75	N73-A75 PolarHBondContact O-N 3.11Å
74	V	27.7	Very low	27.6	Very low	111 Å²	111	133.5 Å²	133.5	67%	0.673	79%	0.785	S	S	*	*			trans	-57.7	121.6	170.5	179.1	0	0	0	0	111.2
75	A	26.2	Very low	27.5	Very low	83 Å²	83	133.1 Å²	133.1	69%	0.686	78%	0.784	S	S	*	*			trans	-144.7	100.4	148.4	0	0	0	0	0	108	N73 V77	N73-A75 PolarHBondContact O-N 3.11Å; A75-V77 PolarHBondContact O-N 3.04Å; A75-V77 VanDerWaalsContact O-N 3.11Å
76	S	23.4	Very low	27.9	Very low	117 Å²	117	136.9 Å²	136.9	82%	0.818	79%	0.789	S	S	*	*			trans	-64.9	104.1	167.5	-54.6	0	0	0	0	107.8
77	V	28.2	Very low	27.9	Very low	127 Å²	127	135 Å²	135	77%	0.77	78%	0.783	S	S	*	*			trans	-82.8	115.6	175	176.4	0	0	0	0	108.3	A75 L79	A75-V77 PolarHBondContact O-N 3.04Å; A75-V77 VanDerWaalsContact O-N 3.11Å; V77-L79 PolarHBondContact O-N 3.34Å
78	E	24.3	Very low	28.1	Very low	183 Å²	183	138.4 Å²	138.4	86%	0.855	79%	0.787	S	S	*	*			trans	-54.1	124.5	168.2	-79.3	-178	141.2	0	0	110	S80	E78-S80 PolarHBondContact O-N 3.37Å
79	L	29.5	Very low	28.1	Very low	170 Å²	170	142 Å²	142	89%	0.89	78%	0.782	S	S	*	*			trans	-72.3	91.5	179.5	-71.2	160.5	0	0	0	109.6	V77 K81	V77-L79 PolarHBondContact O-N 3.34Å; L79-K81 PolarHBondContact O-N 2.94Å
80	S	25.5	Very low	28.4	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	80%	0.797	S	S	*	*			trans	-71.1	122.1	162.4	53	0	0	0	0	109.3	E78 G82	E78-S80 PolarHBondContact O-N 3.37Å; S80-G82 PolarHBondContact O-N 3.43Å
81	K	29.8	Very low	28.7	Very low	217 Å²	217	149.2 Å²	149.2	94%	0.943	80%	0.797	S	S	*	*			trans	-64.7	112.5	175.9	-70.5	178.1	175.2	-179.6	0	109.4	L79	L79-K81 PolarHBondContact O-N 2.94Å
82	G	27.5	Very low	29.4	Very low	64 Å²	64	147 Å²	147	66%	0.66	78%	0.781	S	S	*	*			trans	-160.7	111.1	172	0	0	0	0	0	109.5	S80 L84	S80-G82 PolarHBondContact O-N 3.43Å; G82-L84 PolarHBondContact O-N 3.18Å
83	E	29.1	Very low	30.4	Very low	200 Å²	200	148.5 Å²	148.5	94%	0.935	78%	0.782	S	S	*	*			trans	-58.8	116.7	-178.6	-64	158.8	137.3	0	0	111
84	L	27.8	Very low	32.2	Very low	173 Å²	173	149.4 Å²	149.4	91%	0.906	78%	0.78	S	S	*	*			trans	-137.2	134.9	168.6	-89	161.5	0	0	0	110.2	G82	G82-L84 PolarHBondContact O-N 3.18Å
85	K	23.7	Very low	34.3	Very low	203 Å²	203	144.9 Å²	144.9	88%	0.883	75%	0.752	S	S	*	*			trans	-64.2	157.7	-161.6	-70.8	171.9	171.3	177.2	0	114.8	E87	K85-E87 PolarHBondContact O-N 3.36Å
86	E	30.3	Very low	37	Very low	196 Å²	196	145 Å²	145	92%	0.916	74%	0.738	S	S	*	*			trans	-46.6	86.8	176.3	-143.7	168.7	-162	0	0	114
87	E	27	Very low	40	Very low	178 Å²	178	140.7 Å²	140.7	83%	0.832	71%	0.705	S	S	*	*			trans	-115.6	125.1	147.6	-79	-174.8	167.9	0	0	106.2	K85 K89	K85-E87 PolarHBondContact O-N 3.36Å; E87-K89 PolarHBondContact O-N 3.47Å
88	Q	30.5	Very low	42.8	Very low	177 Å²	177	135.3 Å²	135.3	83%	0.827	67%	0.672	S	S	*	*			trans	-59.9	77.8	176.8	-70.1	-163.6	-11.3	0	0	110.4	H90	Q88-H90 PolarHBondContact O-N 3.07Å
89	K	29.6	Very low	45.9	Very low	183 Å²	183	131.2 Å²	131.2	80%	0.796	65%	0.649	S	S	*	*			trans	-68.6	87.3	161.3	-126.2	175.2	-175.3	171.3	0	104.2	E87 K91	E87-K89 PolarHBondContact O-N 3.47Å; K89-K91 PolarHBondContact O-N 3.35Å
90	H	38.6	Very low	48.9	Very low	169 Å²	169	123.4 Å²	123.4	78%	0.782	61%	0.608	S	S	*	*			trans	-54.3	82.2	148.3	-89.6	-74	0	0	0	105.6	Q88 S92	Q88-H90 PolarHBondContact O-N 3.07Å; H90-S92 PolarHBondContact O-N 2.99Å
91	K	37.4	Very low	51.8	Low	166 Å²	166	123.7 Å²	123.7	72%	0.722	60%	0.601	S	S	*	*			trans	-55.5	102.9	160.3	-94.9	180	172.4	177.2	0	102.5	K89 T93	K89-K91 PolarHBondContact O-N 3.35Å; K91-T93 PolarHBondContact O-N 3.4Å; K91-T93 PolarHBondContact O-OG1 2.78Å
92	S	43.7	Very low	54.9	Low	78 Å²	78	113.7 Å²	113.7	55%	0.545	56%	0.557	S	S	.	*			trans	-60.1	99.9	174.3	57.8	0	0	0	0	105.4	H90 F94	H90-S92 PolarHBondContact O-N 2.99Å; S92-F94 PolarHBondContact O-N 2.9Å; S92-F94 WeakPolarHBondContact OG-CD2 3.5Å; S92-F94 WeakPolarHBondContact OG-CE2 3.41Å
93	T	51.2	Low	58	Low	74 Å²	74	113.2 Å²	113.2	45%	0.454	54%	0.543	S	S	.	.			trans	-84.3	55	-171.1	-46.5	0	0	0	0	106.9	K91 I95 T119	K91-T93 PolarHBondContact O-N 3.4Å; K91-T93 PolarHBondContact O-OG1 2.78Å; T93-I95 PolarHBondContact O-N 3.47Å; T93-T119 HydrophobicContact CG2-CG2 3.81Å; T93-T119 WeakPolarHBondContact O-CG2 3.37Å
94	F	64.3	Low	61.1	Low	151 Å²	151	108.4 Å²	108.4	66%	0.662	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-58.3	129.4	-173.5	-73	-63.3	0	0	0	109.2	S92 H96	S92-F94 PolarHBondContact O-N 2.9Å; S92-F94 WeakPolarHBondContact OG-CD2 3.5Å; S92-F94 WeakPolarHBondContact OG-CE2 3.41Å; F94-H96 PolarHBondContact O-N 3.28Å
95	I	73.3	Confident	64.2	Low	15 Å²	15	101.4 Å²	101.4	8%	0.077	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-64	125.4	171.7	-158.6	176.1	0	0	0	108.8	T93 I97 T112 R113 D122 F123	T93-I95 PolarHBondContact O-N 3.47Å; I95-I97 HydrophobicContact CG2-CG2 4.16Å; I95-I97 PolarHBondContact O-N 3.15Å; I95-T112 HydrophobicContact CD1-CG2 4.3Å; I95-T112 WeakPolarHBondContact CD1-OG1 3.47Å; I95-T112 WeakPolarHBondContact CG1-OG1 3.49Å; I95-R113 HydrophobicContact CD1-CG 4.41Å; I95-R113 HydrophobicContact CG1-CG 4.22Å; I95-D122 HydrophobicContact CB-CB 4.31Å; I95-D122 HydrophobicContact CG2-CB 4.15Å; I95-F123 HydrophobicContact CD1-CB 4.1Å; I95-F123 HydrophobicContact CD1-CD2 3.88Å
96	H	81.6	Confident	67.4	Low	87 Å²	87	93.9 Å²	93.9	40%	0.403	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-69.5	129.6	176.9	-173.6	-95.9	0	0	0	109.7	F94 N98 T112 Y290	F94-H96 PolarHBondContact O-N 3.28Å; H96-N98 VanDerWaalsContact CE1-CG 3.5Å; H96-N98 PolarHBondContact CE1-ND2 3.46Å; H96-N98 VanDerWaalsContact CE1-ND2 3.32Å; H96-N98 PolarHBondContact CE1-OD1 3.44Å; H96-N98 PolarHBondContact ND1-ND2 3.35Å; H96-T112 WeakPolarHBondContact O-CB 3.23Å; H96-T112 PolarHBondContact O-OG1 3.45Å; H96-Y290 PolarHBondContact O-OH 2.97Å
97	I	86.3	Confident	70.3	Confident	25 Å²	25	85.7 Å²	85.7	13%	0.128	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	137.8	179.2	62.3	161.1	0	0	0	110.2	V69 I95 I110 T126	V69-I97 HydrophobicContact CG1-CD1 4.32Å; V69-I97 HydrophobicContact CG1-CG1 4.3Å; I95-I97 HydrophobicContact CG2-CG2 4.16Å; I95-I97 PolarHBondContact O-N 3.15Å; I97-I110 HydrophobicContact CB-CG2 3.85Å; I97-I110 HydrophobicContact CG2-CG2 4.22Å; I97-T126 HydrophobicContact CD1-CG2 4.3Å; I97-T126 HydrophobicContact CG2-CG2 3.8Å
98	N	87.6	Confident	73.3	Confident	15 Å²	15	80.4 Å²	80.4	8%	0.08	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	116.4	179.1	-75.9	-41.2	0	0	0	110.1	H96 I100 I110 L111 A289 Y290	H96-N98 VanDerWaalsContact CE1-CG 3.5Å; H96-N98 PolarHBondContact CE1-ND2 3.46Å; H96-N98 VanDerWaalsContact CE1-ND2 3.32Å; H96-N98 PolarHBondContact CE1-OD1 3.44Å; H96-N98 PolarHBondContact ND1-ND2 3.35Å; N98-I100 HydrophobicContact CB-CD1 4.15Å; N98-I110 CarbonylContact O-C 3.57Å; N98-I110 VanDerWaalsContact O-CA 3.3Å; N98-I110 WeakPolarHBondContact O-CA 3.41Å; N98-L111 HydrophobicContact CB-CB 4.39Å; N98-L111 PolarHBondContact N-O 2.92Å; N98-L111 PolarHBondContact O-N 3.39Å; N98-A289 HydrophobicContact CB-CB 3.72Å; N98-A289 WeakPolarHBondContact ND2-CA 3.49Å; N98-Y290 HydrophobicContact CB-CD2 4.25Å; N98-Y290 HydrophobicContact CB-CE2 3.95Å; N98-Y290 WeakPolarHBondContact ND2-CD2 3.37Å; N98-Y290 WeakPolarHBondContact ND2-CE2 3.48Å
99	R	90.1	Very high	76.4	Confident	97 Å²	97	72 Å²	72	37%	0.366	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	124.4	173.1	-72.5	-179	171.8	82.9	-2.1	109.3	E108 I110 E130	R99-E108 VanDerWaalsContact CD-OE1 3.27Å; R99-E108 WeakPolarHBondContact CD-OE1 3.4Å; R99-E108 IonicContact NE-OE1 3.52Å; R99-E108 PolarHBondContact NE-OE1 3.48Å; R99-I110 HydrophobicContact CG-CG1 4.41Å; R99-E130 IonicContact CZ-OE1 2.88Å; R99-E130 IonicContact CZ-OE2 2.67Å; R99-E130 IonicContact NH2-OE1 2.75Å; R99-E130 PolarHBondContact NH2-OE1 3.05Å; R99-E130 IonicContact NH2-OE2 3.25Å; R99-E130 PolarHBondContact NH2-OE2 2.89Å
100	I	91.2	Very high	79.4	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.4	-176.2	-51	-47.3	0	0	0	109.8	N98 L102 L105 F109 L111 V260 L284 A289	N98-I100 HydrophobicContact CB-CD1 4.15Å; I100-L102 HydrophobicContact CG2-CB 4.27Å; I100-L102 HydrophobicContact CG2-CD1 3.92Å; I100-L102 HydrophobicContact CG2-CG 3.6Å; I100-L105 HydrophobicContact CB-CD1 4.45Å; I100-L105 HydrophobicContact CG2-CD1 3.98Å; I100-F109 HydrophobicContact CB-CB 4.1Å; I100-F109 HydrophobicContact CG1-CB 4.4Å; I100-F109 PolarHBondContact N-O 3.44Å; I100-L111 HydrophobicContact CD1-CB 4.37Å; I100-L111 HydrophobicContact CD1-CD1 3.94Å; I100-L111 HydrophobicContact CD1-CD2 4.33Å; I100-L111 HydrophobicContact CD1-CG 4.43Å; I100-L111 HydrophobicContact CG1-CD1 3.29Å; I100-L111 HydrophobicContact CG1-CD2 4.47Å; I100-L111 HydrophobicContact CG1-CG 4.27Å; I100-V260 HydrophobicContact CG2-CG1 3.91Å; I100-L284 HydrophobicContact CD1-CD1 3.57Å; I100-L284 HydrophobicContact CG1-CD1 4.21Å; I100-L284 HydrophobicContact CG2-CD1 3.77Å; I100-A289 HydrophobicContact CD1-CB 3.39Å
101	N	88.3	Confident	82	Confident	125 Å²	125	55.2 Å²	55.2	67%	0.668	28%	0.279	S	S	*	.			trans	-112.7	87.9	170.2	-173.9	8.8	0	0	0	108.8	I283 Q287	N101-I283 WeakPolarHBondContact O-CG2 3.5Å; N101-Q287 VanDerWaalsContact N-OE1 3.11Å; N101-Q287 PolarHBondContact O-NE2 2.93Å
102	L	93.2	Very high	84.5	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.031	24%	0.244	C	C	.	.			trans	-111.5	150.9	171.9	-69.5	179.3	0	0	0	110.6	I100 K104 L105 V260 I261 T280 I283 L284	I100-L102 HydrophobicContact CG2-CB 4.27Å; I100-L102 HydrophobicContact CG2-CD1 3.92Å; I100-L102 HydrophobicContact CG2-CG 3.6Å; L102-K104 PolarHBondContact O-N 3.17Å; L102-L105 HydrophobicContact CB-CD1 3.82Å; L102-L105 HydrophobicContact CB-CG 4.04Å; L102-V260 HydrophobicContact CD1-CG1 4.14Å; L102-I261 HydrophobicContact CD1-CG1 4.17Å; L102-T280 HydrophobicContact CD1-CG2 3.96Å; L102-T280 HydrophobicContact CD2-CG2 3.97Å; L102-T280 WeakPolarHBondContact CD2-O 3.42Å; L102-T280 HydrophobicContact CG-CG2 4.46Å; L102-I283 HydrophobicContact CD2-CB 3.85Å; L102-I283 HydrophobicContact CD2-CG2 3.7Å; L102-L284 HydrophobicContact CD2-CB 4.47Å
103	P	92.8	Very high	86.6	Confident	55 Å²	55	48.9 Å²	48.9	36%	0.357	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	136.3	177.6	-25.3	34.1	0	0	0	112.4	L105 S264 V268 I283	P103-L105 PolarHBondContact O-N 3.35Å; P103-S264 PolarHBondContact O-OG 3.48Å; P103-V268 HydrophobicContact CB-CG2 4.05Å; P103-I283 HydrophobicContact CG-CD1 4.49Å
104	K	94.1	Very high	88.3	Confident	99 Å²	99	45.6 Å²	45.6	43%	0.43	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	20.9	169.2	-48	-63.2	162.2	168.7	0	115.1	L102 V268 I271	L102-K104 PolarHBondContact O-N 3.17Å; K104-V268 HydrophobicContact CB-CG2 4.1Å; K104-V268 HydrophobicContact CG-CG2 3.79Å; K104-I271 HydrophobicContact CD-CD1 3.6Å; K104-I271 HydrophobicContact CD-CG1 4.4Å; K104-I271 HydrophobicContact CG-CD1 4.06Å
105	L	93.5	Very high	89.5	Confident	25 Å²	25	38.4 Å²	38.4	13%	0.131	19%	0.187	C	C	.	.			trans	-63	139	155.8	-70	179.4	0	0	0	109.2	I100 L102 P103 C107 F109 V260 R263	I100-L105 HydrophobicContact CB-CD1 4.45Å; I100-L105 HydrophobicContact CG2-CD1 3.98Å; L102-L105 HydrophobicContact CB-CD1 3.82Å; L102-L105 HydrophobicContact CB-CG 4.04Å; P103-L105 PolarHBondContact O-N 3.35Å; L105-C107 PolarHBondContact O-N 2.86Å; L105-F109 HydrophobicContact CB-CD2 4.12Å; L105-F109 HydrophobicContact CB-CE2 4.23Å; L105-F109 HydrophobicContact CD1-CB 4.13Å; L105-F109 HydrophobicContact CD1-CD2 3.9Å; L105-F109 HydrophobicContact CD1-CG 4.08Å; L105-F109 HydrophobicContact CD2-CD2 4.12Å; L105-F109 HydrophobicContact CD2-CE2 4.07Å; L105-F109 HydrophobicContact CD2-CG 4.45Å; L105-F109 HydrophobicContact CD2-CZ 4.32Å; L105-F109 HydrophobicContact CG-CD2 4.28Å; L105-V260 HydrophobicContact CD1-CG1 3.96Å; L105-V260 HydrophobicContact CD2-CG1 4.08Å; L105-R263 HydrophobicContact CD2-CB 4.36Å; L105-R263 HydrophobicContact CD2-CG 4.06Å
106	P	90.8	Very high	90.1	Very high	45 Å²	45	39.8 Å²	39.8	29%	0.292	20%	0.198	S	C	.	.	S	Bend	trans	-72.6	-15.7	-174.9	29.3	-37	0	0	0	113.9	F109 L231	P106-F109 HydrophobicContact CG-CE2 3.93Å; P106-F109 HydrophobicContact CG-CZ 4.26Å; P106-L231 HydrophobicContact CB-CD2 3.73Å; P106-L231 HydrophobicContact CG-CD2 3.5Å; P106-L231 VanDerWaalsContact CG-CD2 3.5Å
107	C	90.8	Very high	90.2	Very high	25 Å²	25	41.5 Å²	41.5	17%	0.169	21%	0.21	C	C	.	.	S	Bend	trans	-161.3	-173.9	175.9	64.1	0	0	0	0	108.6	L105 F109 F243 V245	L105-C107 PolarHBondContact O-N 2.86Å; C107-F109 WeakPolarHBondContact O-CD2 3.15Å; C107-F243 HydrophobicContact CB-CE2 4.07Å; C107-V245 VanDerWaalsContact SG-CG2 3.54Å
108	E	91.6	Very high	90.2	Very high	66 Å²	66	46.9 Å²	46.9	31%	0.308	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	133.1	171.7	-171.9	172.5	109.5	0	0	110.4	R99 R244 V245	R99-E108 VanDerWaalsContact CD-OE1 3.27Å; R99-E108 WeakPolarHBondContact CD-OE1 3.4Å; R99-E108 IonicContact NE-OE1 3.52Å; R99-E108 PolarHBondContact NE-OE1 3.48Å; E108-R244 HydrophobicContact CB-CG 4.23Å; E108-R244 WeakPolarHBondContact O-CA 3.46Å; E108-R244 WeakPolarHBondContact OE1-CD 3.29Å; E108-R244 IonicContact OE1-CZ 2.83Å; E108-R244 IonicContact OE1-NE 3.5Å; E108-R244 PolarHBondContact OE1-NE 3.24Å; E108-R244 IonicContact OE1-NH2 3.43Å; E108-V245 PolarHBondContact O-N 2.89Å
109	F	94	Very high	90.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140.9	174.8	-81.5	-121.9	0	0	0	108.7	I100 L105 P106 C107 V245 V247 F259 V260 R263	I100-F109 HydrophobicContact CB-CB 4.1Å; I100-F109 HydrophobicContact CG1-CB 4.4Å; I100-F109 PolarHBondContact N-O 3.44Å; L105-F109 HydrophobicContact CB-CD2 4.12Å; L105-F109 HydrophobicContact CB-CE2 4.23Å; L105-F109 HydrophobicContact CD1-CB 4.13Å; L105-F109 HydrophobicContact CD1-CD2 3.9Å; L105-F109 HydrophobicContact CD1-CG 4.08Å; L105-F109 HydrophobicContact CD2-CD2 4.12Å; L105-F109 HydrophobicContact CD2-CE2 4.07Å; L105-F109 HydrophobicContact CD2-CG 4.45Å; L105-F109 HydrophobicContact CD2-CZ 4.32Å; L105-F109 HydrophobicContact CG-CD2 4.28Å; P106-F109 HydrophobicContact CG-CE2 3.93Å; P106-F109 HydrophobicContact CG-CZ 4.26Å; C107-F109 WeakPolarHBondContact O-CD2 3.15Å; F109-V245 CarbonylContact C-O 3.45Å; F109-V245 VanDerWaalsContact CA-O 3.29Å; F109-V245 WeakPolarHBondContact CA-O 3.45Å; F109-V245 HydrophobicContact CD1-CB 3.98Å; F109-V245 HydrophobicContact CD1-CG1 3.92Å; F109-V245 HydrophobicContact CD2-CB 4.18Å; F109-V245 HydrophobicContact CE1-CB 3.91Å; F109-V245 HydrophobicContact CE1-CG1 3.66Å; F109-V245 HydrophobicContact CE1-CG2 4.37Å; F109-V245 HydrophobicContact CE2-CB 4.08Å; F109-V245 HydrophobicContact CE2-CG2 4.03Å; F109-V245 HydrophobicContact CG-CB 4.12Å; F109-V245 HydrophobicContact CZ-CB 3.95Å; F109-V245 HydrophobicContact CZ-CG1 4.07Å; F109-V245 HydrophobicContact CZ-CG2 3.95Å; F109-V247 HydrophobicContact CD1-CG2 3.69Å; F109-V247 HydrophobicContact CE1-CG2 4.13Å; F109-F259 HydrophobicContact CE1-CE1 4.18Å; F109-V260 HydrophobicContact CB-CG1 4.38Å; F109-V260 HydrophobicContact CD1-CG1 4.17Å; F109-V260 HydrophobicContact CD1-CG2 3.66Å; F109-V260 HydrophobicContact CE1-CG2 4.28Å; F109-V260 HydrophobicContact CG-CG1 4.41Å; F109-R263 HydrophobicContact CZ-CG 4.35Å
110	I	93.7	Very high	90.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.4	172.3	-63.5	173.7	0	0	0	107.3	I97 N98 R99 E130 R244 V245 L246 V247	I97-I110 HydrophobicContact CB-CG2 3.85Å; I97-I110 HydrophobicContact CG2-CG2 4.22Å; N98-I110 CarbonylContact O-C 3.57Å; N98-I110 VanDerWaalsContact O-CA 3.3Å; N98-I110 WeakPolarHBondContact O-CA 3.41Å; R99-I110 HydrophobicContact CG-CG1 4.41Å; I110-E130 HydrophobicContact CD1-CB 3.77Å; I110-E130 HydrophobicContact CD1-CG 3.8Å; I110-R244 HydrophobicContact CD1-CB 4.24Å; I110-R244 VanDerWaalsContact CD1-CD 3.47Å; I110-R244 HydrophobicContact CD1-CG 4.49Å; I110-V245 PolarHBondContact N-O 2.77Å; I110-L246 HydrophobicContact CG2-CD1 4.48Å; I110-L246 HydrophobicContact CG2-CG 4.45Å; I110-L246 CarbonylContact O-C 3.59Å; I110-L246 WeakPolarHBondContact O-CA 3.42Å; I110-V247 PolarHBondContact O-N 3.49Å
111	L	92.5	Very high	90.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.8	168.2	-85.9	59.5	0	0	0	109	N98 I100 V247 A257 V260 Y290	N98-L111 HydrophobicContact CB-CB 4.39Å; N98-L111 PolarHBondContact N-O 2.92Å; N98-L111 PolarHBondContact O-N 3.39Å; I100-L111 HydrophobicContact CD1-CB 4.37Å; I100-L111 HydrophobicContact CD1-CD1 3.94Å; I100-L111 HydrophobicContact CD1-CD2 4.33Å; I100-L111 HydrophobicContact CD1-CG 4.43Å; I100-L111 HydrophobicContact CG1-CD1 3.29Å; I100-L111 HydrophobicContact CG1-CD2 4.47Å; I100-L111 HydrophobicContact CG1-CG 4.27Å; L111-V247 WeakPolarHBondContact CA-O 3.48Å; L111-V247 HydrophobicContact CD1-CB 4.27Å; L111-A257 HydrophobicContact CD2-CB 4.36Å; L111-V260 HydrophobicContact CD1-CB 4.35Å; L111-V260 HydrophobicContact CD1-CG1 4.48Å; L111-V260 HydrophobicContact CD1-CG2 3.66Å; L111-Y290 HydrophobicContact CB-CD2 3.6Å; L111-Y290 HydrophobicContact CB-CE2 3.57Å; L111-Y290 HydrophobicContact CD2-CD2 4.03Å; L111-Y290 HydrophobicContact CG-CD2 4.44Å
112	T	90.4	Very high	90.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	173.5	170.7	-167.5	0	0	0	0	110.3	I95 H96 F123 L246 V247 H248 G252 Y290	I95-T112 HydrophobicContact CD1-CG2 4.3Å; I95-T112 WeakPolarHBondContact CD1-OG1 3.47Å; I95-T112 WeakPolarHBondContact CG1-OG1 3.49Å; H96-T112 WeakPolarHBondContact O-CB 3.23Å; H96-T112 PolarHBondContact O-OG1 3.45Å; T112-F123 HydrophobicContact CG2-CD2 4.35Å; T112-F123 HydrophobicContact CG2-CE2 4.16Å; T112-L246 HydrophobicContact CG2-CD1 4.12Å; T112-L246 HydrophobicContact CG2-CD2 3.73Å; T112-L246 HydrophobicContact CG2-CG 4.06Å; T112-V247 PolarHBondContact N-O 3.37Å; T112-V247 VanDerWaalsContact N-O 3.08Å; T112-H248 HydrophobicContact CG2-CB 3.97Å; T112-H248 VanDerWaalsContact O-CA 3.27Å; T112-H248 WeakPolarHBondContact O-CA 3.35Å; T112-H248 WeakPolarHBondContact O-CB 3.45Å; T112-G252 WeakPolarHBondContact O-CA 3.36Å; T112-Y290 WeakPolarHBondContact CA-OH 3.15Å
113	R	87.8	Confident	90.8	Very high	111 Å²	111	40.7 Å²	40.7	42%	0.419	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	159.6	172.5	67.7	-175.7	-56.9	149.7	7	110.9	I95	I95-R113 HydrophobicContact CD1-CG 4.41Å; I95-R113 HydrophobicContact CG1-CG 4.22Å
114	A	87	Confident	90.9	Very high	5 Å²	5	38 Å²	38	4%	0.041	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-61	138.2	171.1	0	0	0	0	0	110.1	L150 D249	A114-L150 HydrophobicContact CB-CD1 3.65Å; A114-L150 HydrophobicContact CB-CD2 3.43Å; A114-L150 VanDerWaalsContact CB-CD2 3.43Å; A114-L150 HydrophobicContact CB-CG 4.2Å; A114-D249 WeakPolarHBondContact CB-O 3.25Å; A114-D249 PolarHBondContact N-O 3.09Å
115	P	88.6	Confident	91	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.006	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-70.1	137.9	-178.3	27.6	-33.6	0	0	0	111.3	V120 F123 Y153	P115-V120 HydrophobicContact CB-CB 4.3Å; P115-F123 HydrophobicContact CB-CB 3.81Å; P115-F123 HydrophobicContact CB-CD2 4.2Å; P115-F123 HydrophobicContact CB-CG 4.05Å; P115-F123 HydrophobicContact CG-CB 4.24Å; P115-F123 HydrophobicContact CG-CD1 4.34Å; P115-F123 HydrophobicContact CG-CD2 3.98Å; P115-F123 HydrophobicContact CG-CE2 4.43Å; P115-F123 HydrophobicContact CG-CG 3.93Å; P115-Y153 HydrophobicContact CG-CD1 3.17Å; P115-Y153 HydrophobicContact CG-CD2 4.24Å; P115-Y153 HydrophobicContact CG-CE1 3.87Å; P115-Y153 HydrophobicContact CG-CG 3.41Å; P115-Y153 VanDerWaalsContact CG-CG 3.41Å
116	S	86.1	Confident	91.1	Very high	44 Å²	44	34.3 Å²	34.3	31%	0.308	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-88.1	173.8	164.1	69.6	0	0	0	0	110.7	E118 T119 V120	S116-E118 WeakPolarHBondContact CB-OE2 3.35Å; S116-E118 PolarHBondContact O-N 3.36Å; S116-E118 PolarHBondContact OG-N 3.02Å; S116-E118 PolarHBondContact OG-OE2 3.37Å; S116-T119 PolarHBondContact N-OG1 2.68Å; S116-T119 PolarHBondContact O-N 3.49Å; S116-T119 PolarHBondContact O-OG1 3.11Å; S116-T119 PolarHBondContact OG-N 3.3Å; S116-T119 PolarHBondContact OG-OG1 3.39Å; S116-V120 WeakPolarHBondContact O-CB 3.44Å; S116-V120 PolarHBondContact O-N 2.92Å
117	D	84.6	Confident	91.3	Very high	123 Å²	123	32.4 Å²	32.4	66%	0.658	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.2	177.1	-67.1	-18.2	0	0	0	112	V120	D117-V120 WeakPolarHBondContact O-CG1 3.48Å
118	E	86.3	Confident	91.5	Very high	137 Å²	137	32.2 Å²	32.2	64%	0.64	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-24.4	177.8	-49.4	79.4	-171.6	0	0	113.2	S116	S116-E118 WeakPolarHBondContact CB-OE2 3.35Å; S116-E118 PolarHBondContact O-N 3.36Å; S116-E118 PolarHBondContact OG-N 3.02Å; S116-E118 PolarHBondContact OG-OE2 3.37Å
119	T	89.4	Confident	91.5	Very high	13 Å²	13	35.9 Å²	35.9	8%	0.08	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-2.2	-171.4	57	0	0	0	0	113.6	T93 S116 V121 D122 F123	T93-T119 HydrophobicContact CG2-CG2 3.81Å; T93-T119 WeakPolarHBondContact O-CG2 3.37Å; S116-T119 PolarHBondContact N-OG1 2.68Å; S116-T119 PolarHBondContact O-N 3.49Å; S116-T119 PolarHBondContact O-OG1 3.11Å; S116-T119 PolarHBondContact OG-N 3.3Å; S116-T119 PolarHBondContact OG-OG1 3.39Å; T119-V121 VanDerWaalsContact C-N 3.31Å; T119-V121 PolarHBondContact O-N 2.96Å; T119-D122 PolarHBondContact O-N 2.9Å; T119-D122 VanDerWaalsContact O-N 3.12Å; T119-F123 PolarHBondContact O-N 3.26Å
120	V	91.7	Very high	91.4	Very high	14 Å²	14	36.9 Å²	36.9	9%	0.085	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-35.8	-177.8	67.8	0	0	0	0	113.4	P115 S116 D117 D122 F123 W124 F166	P115-V120 HydrophobicContact CB-CB 4.3Å; S116-V120 WeakPolarHBondContact O-CB 3.44Å; S116-V120 PolarHBondContact O-N 2.92Å; D117-V120 WeakPolarHBondContact O-CG1 3.48Å; V120-D122 VanDerWaalsContact C-N 3.34Å; V120-F123 PolarHBondContact O-N 3.01Å; V120-W124 VanDerWaalsContact O-CD1 3.28Å; V120-W124 PolarHBondContact O-N 3.37Å; V120-W124 VanDerWaalsContact O-N 3.11Å; V120-F166 HydrophobicContact CB-CD1 4.18Å; V120-F166 HydrophobicContact CB-CE1 4.44Å; V120-F166 HydrophobicContact CG1-CD1 3.57Å; V120-F166 HydrophobicContact CG1-CE1 4.03Å; V120-F166 HydrophobicContact CG1-CG 4.39Å; V120-F166 HydrophobicContact CG2-CB 4.5Å; V120-F166 HydrophobicContact CG2-CD1 3.47Å; V120-F166 VanDerWaalsContact CG2-CD1 3.47Å; V120-F166 HydrophobicContact CG2-CD2 4.27Å; V120-F166 HydrophobicContact CG2-CE1 3.58Å; V120-F166 HydrophobicContact CG2-CE2 4.36Å; V120-F166 HydrophobicContact CG2-CG 3.82Å; V120-F166 HydrophobicContact CG2-CZ 4.03Å
121	V	93.9	Very high	91.3	Very high	58 Å²	58	41 Å²	41	35%	0.352	20%	0.201	S	C	.	.	H	α-helix	trans	-67.8	-38.4	176.4	-178.6	0	0	0	0	110.6	T119 W124 T125 F166	T119-V121 VanDerWaalsContact C-N 3.31Å; T119-V121 PolarHBondContact O-N 2.96Å; V121-W124 PolarHBondContact O-N 3.4Å; V121-T125 WeakPolarHBondContact O-CB 3.16Å; V121-T125 PolarHBondContact O-N 3.15Å; V121-T125 PolarHBondContact O-OG1 3.38Å; V121-F166 HydrophobicContact CG2-CB 4.37Å
122	D	92.8	Very high	91.4	Very high	32 Å²	32	41.2 Å²	41.2	17%	0.171	20%	0.202	C	C	.	.	H	α-helix	trans	-70.5	-36.7	177.2	-72.3	-29.7	0	0	0	111.9	I95 T119 V120 T125 T126	I95-D122 HydrophobicContact CB-CB 4.31Å; I95-D122 HydrophobicContact CG2-CB 4.15Å; T119-D122 PolarHBondContact O-N 2.9Å; T119-D122 VanDerWaalsContact O-N 3.12Å; V120-D122 VanDerWaalsContact C-N 3.34Å; D122-T125 PolarHBondContact O-N 2.98Å; D122-T126 WeakPolarHBondContact O-CB 3.49Å; D122-T126 PolarHBondContact O-N 2.72Å; D122-T126 PolarHBondContact O-OG1 2.94Å
123	F	94.5	Very high	91.5	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-58	-50.9	171.7	179.7	-86.5	0	0	0	111.4	I95 T112 P115 T119 V120 T125 T126 V127 I135 Y153 L246 H248	I95-F123 HydrophobicContact CD1-CB 4.1Å; I95-F123 HydrophobicContact CD1-CD2 3.88Å; T112-F123 HydrophobicContact CG2-CD2 4.35Å; T112-F123 HydrophobicContact CG2-CE2 4.16Å; P115-F123 HydrophobicContact CB-CB 3.81Å; P115-F123 HydrophobicContact CB-CD2 4.2Å; P115-F123 HydrophobicContact CB-CG 4.05Å; P115-F123 HydrophobicContact CG-CB 4.24Å; P115-F123 HydrophobicContact CG-CD1 4.34Å; P115-F123 HydrophobicContact CG-CD2 3.98Å; P115-F123 HydrophobicContact CG-CE2 4.43Å; P115-F123 HydrophobicContact CG-CG 3.93Å; T119-F123 PolarHBondContact O-N 3.26Å; V120-F123 PolarHBondContact O-N 3.01Å; F123-T125 PolarHBondContact O-N 3.48Å; F123-T126 WeakPolarHBondContact O-CB 3.37Å; F123-T126 PolarHBondContact O-N 2.9Å; F123-V127 HydrophobicContact CD1-CG2 4.11Å; F123-V127 HydrophobicContact CE1-CG2 3.75Å; F123-V127 HydrophobicContact CZ-CG2 4.18Å; F123-V127 WeakPolarHBondContact O-CG2 3.5Å; F123-V127 PolarHBondContact O-N 3.5Å; F123-I135 HydrophobicContact CE1-CD1 4.14Å; F123-I135 HydrophobicContact CZ-CD1 4.24Å; F123-I135 HydrophobicContact CZ-CG2 4.3Å; F123-Y153 HydrophobicContact CD1-CD2 4Å; F123-Y153 HydrophobicContact CD1-CE2 4.34Å; F123-Y153 AromaticContact CE1-CD2 3.57Å; F123-Y153 HydrophobicContact CE1-CD2 3.57Å; F123-Y153 AromaticContact CE1-CE2 3.47Å; F123-Y153 HydrophobicContact CE1-CE2 3.47Å; F123-Y153 VanDerWaalsContact CE1-CE2 3.47Å; F123-Y153 HydrophobicContact CE1-CG 4.45Å; F123-Y153 HydrophobicContact CZ-CD2 4.19Å; F123-Y153 AromaticContact CZ-CE2 3.72Å; F123-Y153 HydrophobicContact CZ-CE2 3.72Å; F123-L246 HydrophobicContact CE2-CD1 4.36Å; F123-L246 HydrophobicContact CE2-CD2 3.7Å; F123-L246 HydrophobicContact CZ-CD2 3.91Å; F123-H248 AromaticContact CE2-CD2 3.91Å; F123-H248 AromaticContact CZ-NE2 3.98Å
124	W	96.1	Very high	91.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-70.2	-32.1	178.6	-75.4	112.4	0	0	0	113.3	V120 V121 T126 V127 W128 I135 Y153 W154 F166 Y169 I171 L187 V189	V120-W124 VanDerWaalsContact O-CD1 3.28Å; V120-W124 PolarHBondContact O-N 3.37Å; V120-W124 VanDerWaalsContact O-N 3.11Å; V121-W124 PolarHBondContact O-N 3.4Å; W124-T126 VanDerWaalsContact C-N 3.28Å; W124-T126 PolarHBondContact O-N 3.22Å; W124-V127 HydrophobicContact CE3-CB 4Å; W124-V127 HydrophobicContact CE3-CG1 3.87Å; W124-V127 HydrophobicContact CE3-CG2 4.26Å; W124-V127 HydrophobicContact CZ3-CB 4.38Å; W124-V127 HydrophobicContact CZ3-CG1 3.84Å; W124-V127 HydrophobicContact CZ3-CG2 4.47Å; W124-V127 PolarHBondContact O-N 2.77Å; W124-W128 WeakPolarHBondContact O-CB 3.41Å; W124-W128 PolarHBondContact O-N 2.96Å; W124-I135 HydrophobicContact CH2-CD1 4.15Å; W124-I135 HydrophobicContact CZ3-CD1 4.17Å; W124-Y153 VanDerWaalsContact CE2-O 3.26Å; W124-Y153 AromaticContact CZ2-CD2 3.72Å; W124-Y153 HydrophobicContact CZ2-CD2 3.72Å; W124-Y153 HydrophobicContact CZ2-CE2 4.21Å; W124-Y153 WeakPolarHBondContact CZ2-O 3.41Å; W124-Y153 PolarHBondContact NE1-O 2.92Å; W124-W154 HydrophobicContact CZ2-CB 4.45Å; W124-F166 AromaticContact CD1-CD2 3.38Å; W124-F166 AromaticContact CD1-CG 3.72Å; W124-F166 HydrophobicContact CG-CB 4.47Å; W124-F166 HydrophobicContact CG-CD2 4.38Å; W124-F166 AromaticContact NE1-CD2 3.3Å; W124-F166 VanDerWaalsContact NE1-CD2 3.3Å; W124-F166 AromaticContact NE1-CE2 3.63Å; W124-Y169 HydrophobicContact CB-CD2 3.84Å; W124-Y169 HydrophobicContact CB-CG 4.27Å; W124-I171 HydrophobicContact CD2-CD1 3.91Å; W124-I171 HydrophobicContact CD2-CG1 3.67Å; W124-I171 VanDerWaalsContact CE2-CG1 3.47Å; W124-I171 HydrophobicContact CE3-CD1 4.19Å; W124-I171 HydrophobicContact CE3-CG1 3.89Å; W124-I171 HydrophobicContact CG-CD1 4.17Å; W124-I171 HydrophobicContact CG-CG1 4.36Å; W124-I171 HydrophobicContact CH2-CG1 3.76Å; W124-I171 HydrophobicContact CH2-CG2 3.93Å; W124-I171 HydrophobicContact CZ2-CB 4.31Å; W124-I171 HydrophobicContact CZ2-CG1 3.51Å; W124-I171 HydrophobicContact CZ2-CG2 3.85Å; W124-I171 HydrophobicContact CZ3-CG1 3.93Å; W124-L187 HydrophobicContact CH2-CD1 3.77Å; W124-L187 HydrophobicContact CZ2-CD1 4.45Å; W124-V189 HydrophobicContact CE3-CG1 4.25Å; W124-V189 HydrophobicContact CE3-CG2 4.17Å; W124-V189 HydrophobicContact CH2-CG2 4.34Å; W124-V189 HydrophobicContact CZ3-CG1 4.48Å; W124-V189 HydrophobicContact CZ3-CG2 3.57Å
125	T	95.5	Very high	92.3	Very high	27 Å²	27	36.6 Å²	36.6	17%	0.166	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-42.1	169.7	-61.8	0	0	0	0	111.1	V121 D122 F123 W128 K129 Y169	V121-T125 WeakPolarHBondContact O-CB 3.16Å; V121-T125 PolarHBondContact O-N 3.15Å; V121-T125 PolarHBondContact O-OG1 3.38Å; D122-T125 PolarHBondContact O-N 2.98Å; F123-T125 PolarHBondContact O-N 3.48Å; T125-W128 PolarHBondContact O-N 3.33Å; T125-K129 HydrophobicContact CG2-CD 3.83Å; T125-K129 HydrophobicContact CG2-CG 4.26Å; T125-K129 WeakPolarHBondContact O-CB 3.48Å; T125-K129 WeakPolarHBondContact O-CG 3.26Å; T125-K129 PolarHBondContact O-N 3.29Å; T125-Y169 WeakPolarHBondContact OG1-CE2 3.38Å
126	T	94.7	Very high	92.7	Very high	19 Å²	19	36.6 Å²	36.6	12%	0.117	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-53.5	176.1	-61.4	0	0	0	0	110.2	I97 D122 F123 W124 W128 K129 E130 L246	I97-T126 HydrophobicContact CD1-CG2 4.3Å; I97-T126 HydrophobicContact CG2-CG2 3.8Å; D122-T126 WeakPolarHBondContact O-CB 3.49Å; D122-T126 PolarHBondContact O-N 2.72Å; D122-T126 PolarHBondContact O-OG1 2.94Å; F123-T126 WeakPolarHBondContact O-CB 3.37Å; F123-T126 PolarHBondContact O-N 2.9Å; W124-T126 VanDerWaalsContact C-N 3.28Å; W124-T126 PolarHBondContact O-N 3.22Å; T126-W128 PolarHBondContact O-N 3.42Å; T126-W128 VanDerWaalsContact O-N 3.16Å; T126-K129 PolarHBondContact O-N 3.29Å; T126-E130 HydrophobicContact CG2-CG 3.83Å; T126-E130 WeakPolarHBondContact O-CB 3.16Å; T126-E130 VanDerWaalsContact O-CG 3.26Å; T126-E130 WeakPolarHBondContact O-CG 3.18Å; T126-E130 PolarHBondContact O-N 3.45Å; T126-L246 HydrophobicContact CG2-CD1 4.24Å
127	V	95.1	Very high	93	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-51.2	-43.3	177.4	168.4	0	0	0	0	111.3	F123 W124 Y131 V132 I135 V200 L246	F123-V127 HydrophobicContact CD1-CG2 4.11Å; F123-V127 HydrophobicContact CE1-CG2 3.75Å; F123-V127 HydrophobicContact CZ-CG2 4.18Å; F123-V127 WeakPolarHBondContact O-CG2 3.5Å; F123-V127 PolarHBondContact O-N 3.5Å; W124-V127 HydrophobicContact CE3-CB 4Å; W124-V127 HydrophobicContact CE3-CG1 3.87Å; W124-V127 HydrophobicContact CE3-CG2 4.26Å; W124-V127 HydrophobicContact CZ3-CB 4.38Å; W124-V127 HydrophobicContact CZ3-CG1 3.84Å; W124-V127 HydrophobicContact CZ3-CG2 4.47Å; W124-V127 PolarHBondContact O-N 2.77Å; V127-Y131 PolarHBondContact O-N 2.91Å; V127-V132 HydrophobicContact CB-CB 4.38Å; V127-V132 HydrophobicContact CG1-CB 4.07Å; V127-V132 HydrophobicContact CG1-CG1 4.47Å; V127-V132 PolarHBondContact O-N 3.1Å; V127-I135 HydrophobicContact CG1-CD1 4.26Å; V127-I135 HydrophobicContact CG2-CD1 3.85Å; V127-I135 HydrophobicContact CG2-CG1 4.37Å; V127-V200 HydrophobicContact CG1-CG2 4.11Å; V127-L246 HydrophobicContact CG2-CD1 4.14Å
128	W	94.5	Very high	93.3	Very high	22 Å²	22	28.8 Å²	28.8	8%	0.083	14%	0.138	C	C	.	.	H	α-helix	trans	-67.9	-56.2	177.5	-171.4	-91.7	0	0	0	112.9	W124 T125 T126 E130 Y131 Y169 V189 N191 E196 R198	W124-W128 WeakPolarHBondContact O-CB 3.41Å; W124-W128 PolarHBondContact O-N 2.96Å; T125-W128 PolarHBondContact O-N 3.33Å; T126-W128 PolarHBondContact O-N 3.42Å; T126-W128 VanDerWaalsContact O-N 3.16Å; W128-E130 VanDerWaalsContact C-N 3.3Å; W128-E130 PolarHBondContact O-N 2.92Å; W128-Y131 PolarHBondContact O-N 3.41Å; W128-Y169 HydrophobicContact CB-CD1 4.26Å; W128-Y169 HydrophobicContact CB-CE1 3.53Å; W128-Y169 AromaticContact CD1-CE1 3.87Å; W128-Y169 HydrophobicContact CD2-CD1 4.12Å; W128-Y169 AromaticContact CD2-CE1 3.6Å; W128-Y169 HydrophobicContact CD2-CE1 3.6Å; W128-Y169 HydrophobicContact CE3-CD1 4.05Å; W128-Y169 HydrophobicContact CE3-CE1 4.02Å; W128-Y169 HydrophobicContact CG-CD1 4.22Å; W128-Y169 AromaticContact CG-CE1 3.36Å; W128-Y169 HydrophobicContact CG-CE1 3.36Å; W128-Y169 AromaticContact CG-CZ 3.94Å; W128-V189 HydrophobicContact CE3-CG1 3.86Å; W128-V189 HydrophobicContact CZ3-CB 4.5Å; W128-V189 HydrophobicContact CZ3-CG1 4.15Å; W128-V189 WeakPolarHBondContact CZ3-O 2.91Å; W128-N191 HydrophobicContact CD2-CB 4.25Å; W128-N191 HydrophobicContact CE3-CB 4.33Å; W128-N191 HydrophobicContact CH2-CB 3.49Å; W128-N191 VanDerWaalsContact CH2-CB 3.49Å; W128-N191 HydrophobicContact CZ2-CB 3.36Å; W128-N191 HydrophobicContact CZ3-CB 3.98Å; W128-E196 HydrophobicContact CH2-CB 3.87Å; W128-E196 HydrophobicContact CH2-CG 3.98Å; W128-E196 WeakPolarHBondContact CH2-O 3.31Å; W128-E196 HydrophobicContact CZ2-CB 3.95Å; W128-E196 HydrophobicContact CZ2-CG 4.14Å; W128-E196 WeakPolarHBondContact CZ2-OE2 3.29Å; W128-R198 HydrophobicContact CH2-CG 3.92Å; W128-R198 HydrophobicContact CZ3-CB 4.18Å; W128-R198 HydrophobicContact CZ3-CG 3.84Å; W128-R198 PolarHBondContact O-NH1 2.93Å
129	K	93	Very high	93	Very high	143 Å²	143	24.7 Å²	24.7	62%	0.622	12%	0.119	S	C	*	.	H	α-helix	trans	-64.2	-36.1	-175.7	-74.5	-177.4	177.6	177.5	0	112.5	T125 T126 Y131	T125-K129 HydrophobicContact CG2-CD 3.83Å; T125-K129 HydrophobicContact CG2-CG 4.26Å; T125-K129 WeakPolarHBondContact O-CB 3.48Å; T125-K129 WeakPolarHBondContact O-CG 3.26Å; T125-K129 PolarHBondContact O-N 3.29Å; T126-K129 PolarHBondContact O-N 3.29Å; K129-Y131 VanDerWaalsContact C-N 3.27Å; K129-Y131 VanDerWaalsContact O-CD2 3.3Å; K129-Y131 WeakPolarHBondContact O-CD2 3.17Å; K129-Y131 PolarHBondContact O-N 3.16Å
130	E	91.8	Very high	92.2	Very high	20 Å²	20	25.6 Å²	25.6	9%	0.093	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	1	-176.7	-63.1	-59.3	157.8	0	0	113.5	R99 I110 T126 W128 V132 R244	R99-E130 IonicContact CZ-OE1 2.88Å; R99-E130 IonicContact CZ-OE2 2.67Å; R99-E130 IonicContact NH2-OE1 2.75Å; R99-E130 PolarHBondContact NH2-OE1 3.05Å; R99-E130 IonicContact NH2-OE2 3.25Å; R99-E130 PolarHBondContact NH2-OE2 2.89Å; I110-E130 HydrophobicContact CD1-CB 3.77Å; I110-E130 HydrophobicContact CD1-CG 3.8Å; T126-E130 HydrophobicContact CG2-CG 3.83Å; T126-E130 WeakPolarHBondContact O-CB 3.16Å; T126-E130 VanDerWaalsContact O-CG 3.26Å; T126-E130 WeakPolarHBondContact O-CG 3.18Å; T126-E130 PolarHBondContact O-N 3.45Å; W128-E130 VanDerWaalsContact C-N 3.3Å; W128-E130 PolarHBondContact O-N 2.92Å; E130-V132 HydrophobicContact CB-CG2 3.98Å; E130-V132 PolarHBondContact O-N 3.21Å; E130-R244 WeakPolarHBondContact O-CD 3.09Å; E130-R244 WeakPolarHBondContact O-CG 3.38Å; E130-R244 PolarHBondContact O-NH1 3.32Å; E130-R244 IonicContact OE2-CZ 3.28Å; E130-R244 IonicContact OE2-NE 3.01Å; E130-R244 IonicContact OE2-NH1 3.01Å
131	Y	91.8	Very high	90.7	Very high	88 Å²	88	27.1 Å²	27.1	35%	0.345	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	43.5	-177.1	-64.8	-94.1	0	0	0	112	V127 W128 K129 K133 R198 V240 R244	V127-Y131 PolarHBondContact O-N 2.91Å; W128-Y131 PolarHBondContact O-N 3.41Å; K129-Y131 VanDerWaalsContact C-N 3.27Å; K129-Y131 VanDerWaalsContact O-CD2 3.3Å; K129-Y131 WeakPolarHBondContact O-CD2 3.17Å; K129-Y131 PolarHBondContact O-N 3.16Å; Y131-K133 PolarHBondContact O-N 3.04Å; Y131-R198 VanDerWaalsContact CD1-NH1 3.34Å; Y131-R198 VanDerWaalsContact CE1-NH1 3.28Å; Y131-V240 HydrophobicContact CD1-CB 4.5Å; Y131-V240 HydrophobicContact CD1-CG1 3.67Å; Y131-V240 HydrophobicContact CE1-CG1 3.74Å; Y131-V240 HydrophobicContact CG-CG1 4.26Å; Y131-R244 PolarHBondContact O-N 2.82Å
132	V	93.9	Very high	88.6	Confident	4 Å²	4	27.8 Å²	27.8	2%	0.024	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	124.8	178.1	172	0	0	0	0	109	V127 E130 V134 I135 R244 L246	V127-V132 HydrophobicContact CB-CB 4.38Å; V127-V132 HydrophobicContact CG1-CB 4.07Å; V127-V132 HydrophobicContact CG1-CG1 4.47Å; V127-V132 PolarHBondContact O-N 3.1Å; E130-V132 HydrophobicContact CB-CG2 3.98Å; E130-V132 PolarHBondContact O-N 3.21Å; V132-V134 WeakPolarHBondContact CG1-O 3.44Å; V132-I135 HydrophobicContact CG1-CG1 3.79Å; V132-R244 WeakPolarHBondContact CA-O 3.44Å; V132-R244 HydrophobicContact CG2-CB 4.37Å; V132-L246 HydrophobicContact CB-CB 4.45Å; V132-L246 HydrophobicContact CG1-CB 3.66Å; V132-L246 HydrophobicContact CG2-CB 3.89Å; V132-L246 HydrophobicContact CG2-CD1 4.24Å
133	K	93.1	Very high	86.5	Confident	19 Å²	19	27 Å²	27	8%	0.083	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-26.6	178.2	-69.1	-66.6	-175.2	178.2	0	112.8	Y131 R201 S238 F243 R244	Y131-K133 PolarHBondContact O-N 3.04Å; K133-R201 WeakPolarHBondContact O-CD 3.5Å; K133-R201 PolarHBondContact O-N 3.5Å; K133-S238 WeakPolarHBondContact CE-OG 3.41Å; K133-S238 VanDerWaalsContact NZ-CB 3.28Å; K133-S238 PolarHBondContact NZ-OG 2.79Å; K133-F243 HydrophobicContact CB-CB 4.25Å; K133-F243 HydrophobicContact CG-CB 3.43Å; K133-F243 VanDerWaalsContact CG-CB 3.43Å; K133-F243 HydrophobicContact CG-CD2 4.46Å; K133-F243 HydrophobicContact CG-CG 3.99Å; K133-R244 PolarHBondContact N-O 3.27Å
134	V	95.5	Very high	84.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	123.7	178.3	-173.2	0	0	0	0	108.6	V132 V136 R201 L203 V227 L231 V245 L246	V132-V134 WeakPolarHBondContact CG1-O 3.44Å; V134-V136 HydrophobicContact CG1-CG2 4.13Å; V134-R201 CarbonylContact C-O 3.55Å; V134-R201 VanDerWaalsContact CA-O 3.27Å; V134-R201 WeakPolarHBondContact CA-O 3.4Å; V134-R201 HydrophobicContact CG2-CB 4.39Å; V134-L203 HydrophobicContact CG1-CD1 3.77Å; V134-V227 HydrophobicContact CG1-CG1 4.41Å; V134-L231 HydrophobicContact CG2-CB 4.44Å; V134-L231 HydrophobicContact CG2-CD1 4.1Å; V134-V245 HydrophobicContact CB-CG1 4.39Å; V134-V245 HydrophobicContact CB-CG2 4.18Å; V134-V245 CarbonylContact O-C 3.57Å; V134-V245 WeakPolarHBondContact O-CA 3.36Å; V134-L246 PolarHBondContact O-N 2.97Å
135	I	96.3	Very high	81.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.7	166.8	-62.2	169.3	0	0	0	107.1	F123 W124 V127 V132 V200 R201 L203 L246	F123-I135 HydrophobicContact CE1-CD1 4.14Å; F123-I135 HydrophobicContact CZ-CD1 4.24Å; F123-I135 HydrophobicContact CZ-CG2 4.3Å; W124-I135 HydrophobicContact CH2-CD1 4.15Å; W124-I135 HydrophobicContact CZ3-CD1 4.17Å; V127-I135 HydrophobicContact CG1-CD1 4.26Å; V127-I135 HydrophobicContact CG2-CD1 3.85Å; V127-I135 HydrophobicContact CG2-CG1 4.37Å; V132-I135 HydrophobicContact CG1-CG1 3.79Å; I135-V200 HydrophobicContact CD1-CG1 3.66Å; I135-V200 HydrophobicContact CG1-CG1 3.73Å; I135-R201 PolarHBondContact N-O 3.38Å; I135-L203 PolarHBondContact O-N 2.84Å; I135-L246 CarbonylContact C-O 3.59Å; I135-L246 WeakPolarHBondContact CA-O 3.42Å; I135-L246 HydrophobicContact CG2-CD2 4.28Å
136	V	95.8	Very high	79.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	116.5	171.3	175.9	0	0	0	0	107.7	V134 I138 L203 F223 V227 V245 L246 V247 H248 F259	V134-V136 HydrophobicContact CG1-CG2 4.13Å; V136-I138 HydrophobicContact CG1-CG1 4.19Å; V136-L203 WeakPolarHBondContact CA-O 3.5Å; V136-F223 HydrophobicContact CG1-CE1 3.6Å; V136-F223 HydrophobicContact CG1-CZ 3.87Å; V136-V227 HydrophobicContact CG2-CG1 3.96Å; V136-V227 HydrophobicContact CG2-CG2 3.7Å; V136-V245 HydrophobicContact CG2-CG1 4Å; V136-L246 PolarHBondContact N-O 3.37Å; V136-V247 HydrophobicContact CB-CB 4.41Å; V136-V247 HydrophobicContact CB-CG1 4.17Å; V136-V247 HydrophobicContact CB-CG2 4.12Å; V136-V247 HydrophobicContact CG1-CG1 4.06Å; V136-V247 CarbonylContact O-C 3.54Å; V136-V247 VanDerWaalsContact O-CA 3.31Å; V136-V247 WeakPolarHBondContact O-CA 3.27Å; V136-H248 PolarHBondContact O-N 2.58Å; V136-F259 HydrophobicContact CG1-CD1 4.43Å; V136-F259 HydrophobicContact CG1-CE1 4.04Å; V136-F259 HydrophobicContact CG1-CZ 4.1Å; V136-F259 HydrophobicContact CG2-CE1 4.33Å; V136-F259 HydrophobicContact CG2-CZ 4.32Å
137	Y	93.2	Very high	76.6	Confident	3 Å²	3	48.4 Å²	48.4	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.8	170.6	176	-135.8	0	0	0	109.3	E139 L150 W154 L203 V204 Y205 H248	Y137-E139 HydrophobicContact CD1-CB 4.28Å; Y137-E139 HydrophobicContact CE1-CB 3.67Å; Y137-E139 HydrophobicContact CE1-CG 3.85Å; Y137-L150 HydrophobicContact CE2-CD1 4.11Å; Y137-L150 WeakPolarHBondContact OH-CD1 3.18Å; Y137-W154 AromaticContact CD1-CH2 3.88Å; Y137-W154 HydrophobicContact CD1-CH2 3.88Å; Y137-W154 HydrophobicContact CE1-CH2 4.1Å; Y137-L203 PolarHBondContact N-O 3.23Å; Y137-V204 HydrophobicContact CD1-CB 4.33Å; Y137-V204 HydrophobicContact CD1-CG1 3.56Å; Y137-V204 HydrophobicContact CD1-CG2 4.05Å; Y137-V204 HydrophobicContact CE1-CG1 4.14Å; Y137-V204 HydrophobicContact CG-CG1 4.43Å; Y137-V204 CarbonylContact O-C 3.51Å; Y137-V204 WeakPolarHBondContact O-CA 3.32Å; Y137-Y205 PolarHBondContact O-N 2.99Å; Y137-H248 WeakPolarHBondContact CA-O 3.22Å; Y137-H248 AromaticContact CD2-CE1 3.1Å; Y137-H248 WeakPolarHBondContact CD2-CE1 3.41Å; Y137-H248 AromaticContact CD2-ND1 3.27Å; Y137-H248 VanDerWaalsContact CD2-ND1 3.27Å; Y137-H248 WeakPolarHBondContact CD2-ND1 3.43Å; Y137-H248 AromaticContact CD2-NE2 3.93Å; Y137-H248 WeakPolarHBondContact CD2-O 3.47Å; Y137-H248 AromaticContact CE2-CE1 3.85Å; Y137-H248 AromaticContact CE2-ND1 3.84Å; Y137-H248 AromaticContact CG-CE1 3.52Å
138	I	90.2	Very high	74.1	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	100	173.5	-53.1	175.9	0	0	0	107.4	V136 Y205 W208 V247 H248 D249 R255 F259	V136-I138 HydrophobicContact CG1-CG1 4.19Å; I138-Y205 HydrophobicContact CG2-CD1 4.24Å; I138-W208 HydrophobicContact CG2-CB 4.25Å; I138-W208 HydrophobicContact CG2-CD2 3.84Å; I138-W208 HydrophobicContact CG2-CE3 3.45Å; I138-W208 VanDerWaalsContact CG2-CE3 3.45Å; I138-W208 HydrophobicContact CG2-CG 4.21Å; I138-W208 HydrophobicContact CG2-CZ3 4.05Å; I138-V247 HydrophobicContact CD1-CG1 4.28Å; I138-H248 PolarHBondContact N-O 2.53Å; I138-D249 HydrophobicContact CB-CB 4.3Å; I138-D249 WeakPolarHBondContact O-CB 3.36Å; I138-R255 HydrophobicContact CB-CB 4.32Å; I138-R255 HydrophobicContact CD1-CB 4.32Å; I138-R255 WeakPolarHBondContact CD1-O 3.44Å; I138-R255 HydrophobicContact CG2-CB 3.83Å; I138-F259 HydrophobicContact CD1-CB 3.39Å; I138-F259 HydrophobicContact CD1-CD2 4.43Å; I138-F259 HydrophobicContact CD1-CG 3.89Å
139	E	81.4	Confident	72	Confident	50 Å²	50	56.4 Å²	56.4	23%	0.234	29%	0.289	C	S	.	.			trans	-68.5	143.9	-172.6	-173.8	166.7	-171.5	0	0	111.6	Y137 V204 Y205 R255	Y137-E139 HydrophobicContact CD1-CB 4.28Å; Y137-E139 HydrophobicContact CE1-CB 3.67Å; Y137-E139 HydrophobicContact CE1-CG 3.85Å; E139-V204 HydrophobicContact CB-CG1 4.06Å; E139-Y205 WeakPolarHBondContact CB-O 3.48Å; E139-Y205 PolarHBondContact N-O 3.38Å; E139-R255 PolarHBondContact O-NH1 2.92Å; E139-R255 VanDerWaalsContact O-NH1 3.13Å
140	N	70.8	Confident	70.2	Confident	32 Å²	32	50.7 Å²	50.7	17%	0.171	27%	0.265	C	S	.	.			trans	-110.3	109.3	167	-171.7	11.7	0	0	0	109.8	E142 A143 T144 R255	N140-E142 PolarHBondContact O-N 3.13Å; N140-E142 PolarHBondContact OD1-N 3.02Å; N140-A143 HydrophobicContact CB-CB 4.12Å; N140-A143 PolarHBondContact O-N 3.11Å; N140-T144 PolarHBondContact O-N 3.2Å; N140-T144 PolarHBondContact O-OG1 3.28Å; N140-R255 VanDerWaalsContact CG-CZ 3.46Å; N140-R255 PolarHBondContact ND2-NH2 2.74Å; N140-R255 PolarHBondContact OD1-NH1 3.41Å; N140-R255 VanDerWaalsContact OD1-NH1 3.11Å; N140-R255 PolarHBondContact OD1-NH2 3.16Å
141	S	60.7	Low	68.7	Low	46 Å²	46	50.7 Å²	50.7	32%	0.322	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-20	178.4	58	0	0	0	0	114.7
142	E	50.3	Low	67.5	Low	73 Å²	73	49 Å²	49	34%	0.341	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-39.3	174.4	-156.2	74	-149.8	0	0	112.7	N140 T144 K145 S146 K210	N140-E142 PolarHBondContact O-N 3.13Å; N140-E142 PolarHBondContact OD1-N 3.02Å; E142-T144 PolarHBondContact O-N 3.46Å; E142-K145 WeakPolarHBondContact O-CA 3.39Å; E142-K145 PolarHBondContact O-N 3.48Å; E142-S146 PolarHBondContact O-N 2.99Å; E142-S146 PolarHBondContact O-OG 3Å; E142-K210 IonicContact OE2-NZ 3.67Å
143	A	48.5	Very low	67.1	Low	15 Å²	15	48.9 Å²	48.9	12%	0.124	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32.3	-178.4	0	0	0	0	0	111.5	N140 K145 I148 A250	N140-A143 HydrophobicContact CB-CB 4.12Å; N140-A143 PolarHBondContact O-N 3.11Å; A143-K145 PolarHBondContact O-N 3.26Å; A143-I148 CarbonylContact O-C 3.58Å; A143-I148 VanDerWaalsContact O-C 3.3Å; A143-A250 HydrophobicContact CB-CB 4.15Å
144	T	46.8	Very low	66.8	Low	52 Å²	52	49 Å²	49	32%	0.319	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.3	172.7	16.3	0	0	0	0	114	N140 E142	N140-T144 PolarHBondContact O-N 3.2Å; N140-T144 PolarHBondContact O-OG1 3.28Å; E142-T144 PolarHBondContact O-N 3.46Å
145	K	42.8	Very low	65.9	Low	175 Å²	175	49 Å²	49	76%	0.761	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-34.6	-179	-70	-176.2	179.9	-179.6	0	114.4	E142 A143	E142-K145 WeakPolarHBondContact O-CA 3.39Å; E142-K145 PolarHBondContact O-N 3.48Å; A143-K145 PolarHBondContact O-N 3.26Å
146	S	41.6	Very low	64.7	Low	65 Å²	65	54.7 Å²	54.7	46%	0.455	29%	0.294	S	S	.	.	S	Bend	trans	-100.3	90.6	-176.3	63.7	0	0	0	0	111.4	E142 I148	E142-S146 PolarHBondContact O-N 2.99Å; E142-S146 PolarHBondContact O-OG 3Å; S146-I148 PolarHBondContact O-N 3.4Å
147	E	40.5	Very low	63.3	Low	204 Å²	204	59 Å²	59	95%	0.953	32%	0.32	S	S	*	.	S	Bend	trans	52.5	-17.9	163.9	-70.1	-179.7	165.1	0	0	120.5
148	I	44	Very low	61.9	Low	128 Å²	128	63.3 Å²	63.3	66%	0.656	34%	0.339	S	S	*	.			trans	-110.8	53.5	171.8	-44.4	172.6	0	0	0	106.6	A143 S146 L150	A143-I148 CarbonylContact O-C 3.58Å; A143-I148 VanDerWaalsContact O-C 3.3Å; S146-I148 PolarHBondContact O-N 3.4Å; I148-L150 VanDerWaalsContact C-N 3.26Å; I148-L150 PolarHBondContact O-N 2.91Å
149	A	49.7	Very low	60.4	Low	66 Å²	66	64.7 Å²	64.7	55%	0.545	35%	0.353	S	S	.	.			trans	-57.3	102	166.4	0	0	0	0	0	105.6	G151	A149-G151 PolarHBondContact O-N 3.41Å
150	L	54.4	Low	59.5	Low	23 Å²	23	69.6 Å²	69.6	12%	0.12	38%	0.38	C	S	.	.			trans	-46.5	112.5	179.8	-75.2	166.1	0	0	0	107.3	A114 Y137 I148	A114-L150 HydrophobicContact CB-CD1 3.65Å; A114-L150 HydrophobicContact CB-CD2 3.43Å; A114-L150 VanDerWaalsContact CB-CD2 3.43Å; A114-L150 HydrophobicContact CB-CG 4.2Å; Y137-L150 HydrophobicContact CE2-CD1 4.11Å; Y137-L150 WeakPolarHBondContact OH-CD1 3.18Å; I148-L150 VanDerWaalsContact C-N 3.26Å; I148-L150 PolarHBondContact O-N 2.91Å
151	G	60.4	Low	59.6	Low	21 Å²	21	77 Å²	77	22%	0.216	41%	0.411	C	S	.	.			trans	-49.8	129.7	171.6	0	0	0	0	0	106.3	A149 Y153	A149-G151 PolarHBondContact O-N 3.41Å; G151-Y153 VanDerWaalsContact C-N 3.34Å; G151-Y153 PolarHBondContact O-N 3.14Å
152	P	68.2	Low	60.7	Low	51 Å²	51	78.9 Å²	78.9	33%	0.331	42%	0.415	S	S	.	.			trans	-60	97.4	-176.3	21.6	-30.9	0	0	0	109.8	W154 K156 H164	P152-W154 VanDerWaalsContact CB-O 3.29Å; P152-W154 WeakPolarHBondContact CB-O 3.18Å; P152-W154 PolarHBondContact O-N 3.39Å; P152-K156 HydrophobicContact CB-CD 4.38Å; P152-K156 HydrophobicContact CB-CG 4.14Å; P152-H164 PolarHBondContact O-ND1 3.34Å
153	Y	85.7	Confident	62.5	Low	2 Å²	2	79.6 Å²	79.6	1%	0.008	42%	0.418	C	S	.	.	S	Bend	trans	-67.7	-3.9	172	72.3	-98.5	0	0	0	111.9	P115 F123 W124 G151 F166 H202 H248	P115-Y153 HydrophobicContact CG-CD1 3.17Å; P115-Y153 HydrophobicContact CG-CD2 4.24Å; P115-Y153 HydrophobicContact CG-CE1 3.87Å; P115-Y153 HydrophobicContact CG-CG 3.41Å; P115-Y153 VanDerWaalsContact CG-CG 3.41Å; F123-Y153 HydrophobicContact CD1-CD2 4Å; F123-Y153 HydrophobicContact CD1-CE2 4.34Å; F123-Y153 AromaticContact CE1-CD2 3.57Å; F123-Y153 HydrophobicContact CE1-CD2 3.57Å; F123-Y153 AromaticContact CE1-CE2 3.47Å; F123-Y153 HydrophobicContact CE1-CE2 3.47Å; F123-Y153 VanDerWaalsContact CE1-CE2 3.47Å; F123-Y153 HydrophobicContact CE1-CG 4.45Å; F123-Y153 HydrophobicContact CZ-CD2 4.19Å; F123-Y153 AromaticContact CZ-CE2 3.72Å; F123-Y153 HydrophobicContact CZ-CE2 3.72Å; W124-Y153 VanDerWaalsContact CE2-O 3.26Å; W124-Y153 AromaticContact CZ2-CD2 3.72Å; W124-Y153 HydrophobicContact CZ2-CD2 3.72Å; W124-Y153 HydrophobicContact CZ2-CE2 4.21Å; W124-Y153 WeakPolarHBondContact CZ2-O 3.41Å; W124-Y153 PolarHBondContact NE1-O 2.92Å; G151-Y153 VanDerWaalsContact C-N 3.34Å; G151-Y153 PolarHBondContact O-N 3.14Å; Y153-F166 WeakPolarHBondContact O-CE2 3.48Å; Y153-H202 AromaticContact CE2-NE2 3.88Å; Y153-H202 AromaticContact CZ-NE2 3.62Å; Y153-H202 PolarHBondContact OH-NE2 2.88Å; Y153-H248 AromaticContact CE1-CE1 3.52Å; Y153-H248 AromaticContact CE1-NE2 3.79Å; Y153-H248 AromaticContact CZ-CE1 3.66Å; Y153-H248 AromaticContact CZ-NE2 3.43Å; Y153-H248 PolarHBondContact OH-CE1 3.16Å; Y153-H248 PolarHBondContact OH-NE2 3.32Å
154	W	85	Confident	64.5	Low	21 Å²	21	81.7 Å²	81.7	8%	0.08	43%	0.425	C	S	.	.	S	Bend	trans	-137.6	148.6	171.2	71.5	94.5	0	0	0	109.3	W124 Y137 P152 K156 L187 H202 V204	W124-W154 HydrophobicContact CZ2-CB 4.45Å; Y137-W154 AromaticContact CD1-CH2 3.88Å; Y137-W154 HydrophobicContact CD1-CH2 3.88Å; Y137-W154 HydrophobicContact CE1-CH2 4.1Å; P152-W154 VanDerWaalsContact CB-O 3.29Å; P152-W154 WeakPolarHBondContact CB-O 3.18Å; P152-W154 PolarHBondContact O-N 3.39Å; W154-K156 PolarHBondContact O-N 2.98Å; W154-L187 HydrophobicContact CB-CD1 4.11Å; W154-H202 AromaticContact CD2-CE1 3.57Å; W154-H202 AromaticContact CD2-NE2 3.87Å; W154-H202 AromaticContact CE2-CE1 3.37Å; W154-H202 AromaticContact CZ2-CE1 3.63Å; W154-H202 AromaticContact NE1-CE1 3.79Å; W154-V204 HydrophobicContact CZ2-CG2 4.06Å
155	P	76.7	Confident	66.7	Low	1 Å²	1	82.6 Å²	82.6	1%	0.006	43%	0.433	C	S	.	.			trans	-60.8	123.9	174.1	-20	31.3	0	0	0	110.9	H164 I171 P173	P155-H164 HydrophobicContact CG-CB 4.05Å; P155-I171 WeakPolarHBondContact CG-O 3.05Å; P155-P173 HydrophobicContact CB-CG 4.08Å
156	K	71.1	Confident	69.1	Low	120 Å²	120	75.7 Å²	75.7	52%	0.522	40%	0.403	S	S	.	.			trans	-75.9	-32.2	178.4	-70.6	-178	178.1	175.2	0	112.1	P152 W154	P152-K156 HydrophobicContact CB-CD 4.38Å; P152-K156 HydrophobicContact CB-CG 4.14Å; W154-K156 PolarHBondContact O-N 2.98Å
157	V	67.7	Low	71.6	Confident	90 Å²	90	75.2 Å²	75.2	55%	0.545	41%	0.408	S	S	.	.	S	Bend	trans	-86.7	136.7	-177.4	-176.4	0	0	0	0	110.1	E162 P173	V157-E162 HydrophobicContact CB-CG 4.32Å; V157-E162 HydrophobicContact CG1-CG 4.23Å; V157-P173 WeakPolarHBondContact O-CG 3.49Å
158	F	63.3	Low	74.3	Confident	94 Å²	94	69 Å²	69	41%	0.412	38%	0.378	S	S	.	.			trans	-82.2	132.7	172.3	-68.8	-75.9	0	0	0	110.4	P173 Y175 K185	F158-P173 HydrophobicContact CD1-CB 4Å; F158-P173 HydrophobicContact CD1-CG 4.5Å; F158-P173 HydrophobicContact CE1-CB 4.08Å; F158-Y175 WeakPolarHBondContact CE1-O 3.49Å; F158-K185 HydrophobicContact CE1-CD 3.94Å; F158-K185 HydrophobicContact CE1-CG 4.03Å; F158-K185 HydrophobicContact CZ-CD 3.72Å; F158-K185 HydrophobicContact CZ-CG 3.77Å
159	G	59.8	Low	76.8	Confident	29 Å²	29	63.1 Å²	63.1	30%	0.299	35%	0.347	S	S	.	.			trans	173.5	143.9	173	0	0	0	0	0	111.3	K161 E162	G159-K161 PolarHBondContact O-N 3.01Å; G159-K161 VanDerWaalsContact O-N 3.14Å; G159-E162 PolarHBondContact O-N 3.21Å
160	L	62.3	Low	79	Confident	153 Å²	153	63.3 Å²	63.3	80%	0.801	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-24.6	179.7	-69.7	166.6	0	0	0	112.9
161	K	72.2	Confident	80.9	Confident	189 Å²	189	62.2 Å²	62.2	82%	0.822	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-19.3	178.3	-62.8	-174	178.3	-177.7	0	113.2	G159 H163	G159-K161 PolarHBondContact O-N 3.01Å; G159-K161 VanDerWaalsContact O-N 3.14Å; K161-H163 PolarHBondContact O-N 2.94Å; K161-H163 PolarHBondContact O-ND1 2.86Å
162	E	82.9	Confident	82.4	Confident	84 Å²	84	63.4 Å²	63.4	39%	0.393	33%	0.326	S	S	.	.			trans	-78	115.9	-177	-68.2	-63.3	159.8	0	0	110.3	V157 G159	V157-E162 HydrophobicContact CB-CG 4.32Å; V157-E162 HydrophobicContact CG1-CG 4.23Å; G159-E162 PolarHBondContact O-N 3.21Å
163	H	89.1	Confident	83.5	Confident	89 Å²	89	61.2 Å²	61.2	41%	0.412	31%	0.312	S	S	.	.			trans	-150.3	148.1	174.6	64.3	-79	0	0	0	110	K161 R170 I171 R172	K161-H163 PolarHBondContact O-N 2.94Å; K161-H163 PolarHBondContact O-ND1 2.86Å; H163-R170 HydrophobicContact CB-CG 4Å; H163-I171 VanDerWaalsContact CA-O 3.25Å; H163-I171 WeakPolarHBondContact CA-O 3.44Å; H163-I171 WeakPolarHBondContact CB-O 3.36Å; H163-R172 HydrophobicContact CB-CB 4.22Å
164	H	91.2	Very high	83.7	Confident	59 Å²	59	64.1 Å²	64.1	27%	0.273	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	140.5	170.6	-68.4	-175.7	0	0	0	108.8	P152 P155 F166 I171	P152-H164 PolarHBondContact O-ND1 3.34Å; P155-H164 HydrophobicContact CG-CB 4.05Å; H164-F166 HydrophobicContact CB-CD2 4.28Å; H164-F166 HydrophobicContact CB-CE2 3.45Å; H164-F166 VanDerWaalsContact CB-CE2 3.45Å; H164-F166 HydrophobicContact CB-CZ 3.62Å; H164-F166 AromaticContact ND1-CZ 3.81Å; H164-I171 PolarHBondContact N-O 3.09Å; H164-I171 PolarHBondContact O-N 3.5Å
165	C	92.8	Very high	84	Confident	70 Å²	70	68.2 Å²	68.2	47%	0.473	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.5	174.1	-69.8	0	0	0	0	109.4	Y169	C165-Y169 CarbonylContact C-O 3.48Å; C165-Y169 WeakPolarHBondContact CA-O 3.39Å
166	F	93	Very high	84.6	Confident	30 Å²	30	69.5 Å²	69.5	13%	0.132	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	102.2	175.8	-58.4	-70.7	0	0	0	108.4	V120 V121 W124 Y153 H164 K168 Y169 I171	V120-F166 HydrophobicContact CB-CD1 4.18Å; V120-F166 HydrophobicContact CB-CE1 4.44Å; V120-F166 HydrophobicContact CG1-CD1 3.57Å; V120-F166 HydrophobicContact CG1-CE1 4.03Å; V120-F166 HydrophobicContact CG1-CG 4.39Å; V120-F166 HydrophobicContact CG2-CB 4.5Å; V120-F166 HydrophobicContact CG2-CD1 3.47Å; V120-F166 VanDerWaalsContact CG2-CD1 3.47Å; V120-F166 HydrophobicContact CG2-CD2 4.27Å; V120-F166 HydrophobicContact CG2-CE1 3.58Å; V120-F166 HydrophobicContact CG2-CE2 4.36Å; V120-F166 HydrophobicContact CG2-CG 3.82Å; V120-F166 HydrophobicContact CG2-CZ 4.03Å; V121-F166 HydrophobicContact CG2-CB 4.37Å; W124-F166 AromaticContact CD1-CD2 3.38Å; W124-F166 AromaticContact CD1-CG 3.72Å; W124-F166 HydrophobicContact CG-CB 4.47Å; W124-F166 HydrophobicContact CG-CD2 4.38Å; W124-F166 AromaticContact NE1-CD2 3.3Å; W124-F166 VanDerWaalsContact NE1-CD2 3.3Å; W124-F166 AromaticContact NE1-CE2 3.63Å; Y153-F166 WeakPolarHBondContact O-CE2 3.48Å; H164-F166 HydrophobicContact CB-CD2 4.28Å; H164-F166 HydrophobicContact CB-CE2 3.45Å; H164-F166 VanDerWaalsContact CB-CE2 3.45Å; H164-F166 HydrophobicContact CB-CZ 3.62Å; H164-F166 AromaticContact ND1-CZ 3.81Å; F166-K168 PolarHBondContact O-N 3.03Å; F166-Y169 PolarHBondContact N-O 3.35Å; F166-Y169 PolarHBondContact O-N 3.42Å; F166-Y169 VanDerWaalsContact O-N 3.07Å; F166-I171 HydrophobicContact CD2-CD1 4.24Å; F166-I171 HydrophobicContact CD2-CG1 4.32Å
167	G	94.1	Very high	85.4	Confident	55 Å²	55	68 Å²	68	57%	0.567	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	-124.7	-167.2	0	0	0	0	0	110.5	Y169	G167-Y169 VanDerWaalsContact C-N 3.32Å; G167-Y169 PolarHBondContact O-N 3.1Å
168	K	96	Very high	86.4	Confident	74 Å²	74	69.1 Å²	69.1	32%	0.322	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	3.3	178.9	66.8	-177.5	176.5	-170.9	0	115.4	F166 L192 E193	F166-K168 PolarHBondContact O-N 3.03Å; K168-L192 WeakPolarHBondContact O-CB 2.99Å; K168-L192 WeakPolarHBondContact O-CG 3.41Å; K168-L192 PolarHBondContact O-N 2.87Å; K168-E193 HydrophobicContact CB-CG 4.16Å; K168-E193 HydrophobicContact CD-CG 3.97Å; K168-E193 WeakPolarHBondContact CD-OE1 3.33Å; K168-E193 WeakPolarHBondContact CD-OE2 3.27Å; K168-E193 WeakPolarHBondContact CE-OE2 3.35Å; K168-E193 IonicContact NZ-OE1 2.72Å; K168-E193 IonicContact NZ-OE2 3.73Å; K168-E193 PolarHBondContact NZ-OE2 3.35Å
169	Y	97.2	Very high	87.6	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.016	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.3	-178.1	-53.5	-71.5	0	0	0	110.5	W124 T125 W128 C165 F166 G167 I171 V189 K190 N191	W124-Y169 HydrophobicContact CB-CD2 3.84Å; W124-Y169 HydrophobicContact CB-CG 4.27Å; T125-Y169 WeakPolarHBondContact OG1-CE2 3.38Å; W128-Y169 HydrophobicContact CB-CD1 4.26Å; W128-Y169 HydrophobicContact CB-CE1 3.53Å; W128-Y169 AromaticContact CD1-CE1 3.87Å; W128-Y169 HydrophobicContact CD2-CD1 4.12Å; W128-Y169 AromaticContact CD2-CE1 3.6Å; W128-Y169 HydrophobicContact CD2-CE1 3.6Å; W128-Y169 HydrophobicContact CE3-CD1 4.05Å; W128-Y169 HydrophobicContact CE3-CE1 4.02Å; W128-Y169 HydrophobicContact CG-CD1 4.22Å; W128-Y169 AromaticContact CG-CE1 3.36Å; W128-Y169 HydrophobicContact CG-CE1 3.36Å; W128-Y169 AromaticContact CG-CZ 3.94Å; C165-Y169 CarbonylContact C-O 3.48Å; C165-Y169 WeakPolarHBondContact CA-O 3.39Å; F166-Y169 PolarHBondContact N-O 3.35Å; F166-Y169 PolarHBondContact O-N 3.42Å; F166-Y169 VanDerWaalsContact O-N 3.07Å; G167-Y169 VanDerWaalsContact C-N 3.32Å; G167-Y169 PolarHBondContact O-N 3.1Å; Y169-I171 WeakPolarHBondContact O-CD1 3.37Å; Y169-V189 HydrophobicContact CD1-CG1 4.48Å; Y169-K190 CarbonylContact C-O 3.3Å; Y169-K190 WeakPolarHBondContact CA-O 3.42Å; Y169-N191 HydrophobicContact CD1-CB 4.25Å; Y169-N191 HydrophobicContact CE1-CB 4.21Å
170	R	95.3	Very high	88.9	Confident	70 Å²	70	75 Å²	75	26%	0.264	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.1	170.5	-177.3	-179	72.2	-176.7	8.1	109.7	H163 V189 K190 L192	H163-R170 HydrophobicContact CB-CG 4Å; R170-V189 WeakPolarHBondContact O-CA 3.4Å; R170-K190 HydrophobicContact CB-CB 4.41Å; R170-K190 PolarHBondContact N-O 3.45Å; R170-K190 PolarHBondContact O-N 3.14Å; R170-L192 HydrophobicContact CB-CD1 4.38Å; R170-L192 HydrophobicContact CB-CD2 3.99Å; R170-L192 HydrophobicContact CB-CG 4.29Å
171	I	95.1	Very high	90.2	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	123.6	-174.3	-66.3	44.1	0	0	0	107.9	W124 P155 H163 H164 F166 Y169 L187 E188 V189	W124-I171 HydrophobicContact CD2-CD1 3.91Å; W124-I171 HydrophobicContact CD2-CG1 3.67Å; W124-I171 VanDerWaalsContact CE2-CG1 3.47Å; W124-I171 HydrophobicContact CE3-CD1 4.19Å; W124-I171 HydrophobicContact CE3-CG1 3.89Å; W124-I171 HydrophobicContact CG-CD1 4.17Å; W124-I171 HydrophobicContact CG-CG1 4.36Å; W124-I171 HydrophobicContact CH2-CG1 3.76Å; W124-I171 HydrophobicContact CH2-CG2 3.93Å; W124-I171 HydrophobicContact CZ2-CB 4.31Å; W124-I171 HydrophobicContact CZ2-CG1 3.51Å; W124-I171 HydrophobicContact CZ2-CG2 3.85Å; W124-I171 HydrophobicContact CZ3-CG1 3.93Å; P155-I171 WeakPolarHBondContact CG-O 3.05Å; H163-I171 VanDerWaalsContact CA-O 3.25Å; H163-I171 WeakPolarHBondContact CA-O 3.44Å; H163-I171 WeakPolarHBondContact CB-O 3.36Å; H164-I171 PolarHBondContact N-O 3.09Å; H164-I171 PolarHBondContact O-N 3.5Å; F166-I171 HydrophobicContact CD2-CD1 4.24Å; F166-I171 HydrophobicContact CD2-CG1 4.32Å; Y169-I171 WeakPolarHBondContact O-CD1 3.37Å; I171-L187 HydrophobicContact CG2-CB 4.36Å; I171-L187 HydrophobicContact CG2-CD1 4.18Å; I171-E188 CarbonylContact C-O 3.54Å; I171-E188 WeakPolarHBondContact CA-O 3.41Å; I171-V189 HydrophobicContact CD1-CG1 4.12Å
172	R	91.9	Very high	91.1	Very high	46 Å²	46	61 Å²	61	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	121.7	-177	-178.7	172.4	67.7	91.3	-1.9	110.9	H163 I174 L187 E188	H163-R172 HydrophobicContact CB-CB 4.22Å; R172-I174 HydrophobicContact CG-CG2 4.45Å; R172-I174 PolarHBondContact O-N 3.04Å; R172-L187 CarbonylContact O-C 3.58Å; R172-L187 WeakPolarHBondContact O-CA 3.18Å; R172-E188 HydrophobicContact CB-CB 4.45Å; R172-E188 IonicContact CZ-OE1 2.73Å; R172-E188 IonicContact CZ-OE2 2.82Å; R172-E188 VanDerWaalsContact CZ-OE2 3.23Å; R172-E188 PolarHBondContact N-O 3.01Å; R172-E188 IonicContact NE-OE2 2.68Å; R172-E188 PolarHBondContact NE-OE2 3.41Å; R172-E188 IonicContact NH2-OE1 3.76Å; R172-E188 PolarHBondContact NH2-OE1 3.22Å; R172-E188 IonicContact NH2-OE2 3.68Å; R172-E188 PolarHBondContact NH2-OE2 2.92Å; R172-E188 PolarHBondContact O-N 3.44Å
173	P	90.6	Very high	91.5	Very high	5 Å²	5	58.5 Å²	58.5	3%	0.032	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	124.1	172.6	29.5	-33.2	0	0	0	110.1	P155 V157 F158 L187	P155-P173 HydrophobicContact CB-CG 4.08Å; V157-P173 WeakPolarHBondContact O-CG 3.49Å; F158-P173 HydrophobicContact CD1-CB 4Å; F158-P173 HydrophobicContact CD1-CG 4.5Å; F158-P173 HydrophobicContact CE1-CB 4.08Å; P173-L187 HydrophobicContact CB-CD2 3.93Å
174	I	91	Very high	91.6	Very high	63 Å²	63	54.8 Å²	54.8	32%	0.323	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-18.9	-179.2	62.8	164.4	0	0	0	113.2	R172 I186 E188 W199	R172-I174 HydrophobicContact CG-CG2 4.45Å; R172-I174 PolarHBondContact O-N 3.04Å; I174-I186 HydrophobicContact CD1-CB 4.42Å; I174-I186 HydrophobicContact CD1-CG2 3.8Å; I174-I186 HydrophobicContact CG1-CB 3.93Å; I174-I186 HydrophobicContact CG1-CG2 3.78Å; I174-I186 WeakPolarHBondContact CG1-O 3.04Å; I174-I186 PolarHBondContact N-O 2.84Å; I174-E188 HydrophobicContact CG2-CB 3.82Å; I174-W199 HydrophobicContact CD1-CD2 4.28Å; I174-W199 HydrophobicContact CD1-CG 4.35Å; I174-W199 HydrophobicContact CD1-CZ2 4.46Å
175	Y	90	Very high	91.7	Very high	107 Å²	107	52.9 Å²	52.9	42%	0.42	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	151	175.3	174.4	-96.4	0	0	0	109.9	F158 Q177 K185 I186	F158-Y175 WeakPolarHBondContact CE1-O 3.49Å; Y175-Q177 HydrophobicContact CE1-CB 4.03Å; Y175-Q177 PolarHBondContact OH-OE1 3.47Å; Y175-K185 CarbonylContact O-C 3.49Å; Y175-K185 WeakPolarHBondContact O-CA 3.45Å; Y175-I186 HydrophobicContact CD1-CD1 4.14Å; Y175-I186 HydrophobicContact CD1-CG1 4.11Å; Y175-I186 HydrophobicContact CG-CD1 4.37Å; Y175-I186 PolarHBondContact N-O 3.34Å; Y175-I186 PolarHBondContact O-N 2.99Å
176	G	89.2	Confident	91.7	Very high	29 Å²	29	51.2 Å²	51.2	30%	0.299	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	140.5	-178.6	0	0	0	0	0	113	Q184	G176-Q184 WeakPolarHBondContact CA-O 3.49Å
177	Q	89.7	Confident	91.7	Very high	89 Å²	89	49.8 Å²	49.8	42%	0.416	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	136.7	169.1	177.4	178	20.4	0	0	110	Y175 Q184	Y175-Q177 HydrophobicContact CE1-CB 4.03Å; Y175-Q177 PolarHBondContact OH-OE1 3.47Å; Q177-Q184 HydrophobicContact CB-CG 3.73Å; Q177-Q184 PolarHBondContact N-O 3.22Å; Q177-Q184 PolarHBondContact O-N 2.93Å
178	V	88	Confident	91.7	Very high	113 Å²	113	48.4 Å²	48.4	69%	0.685	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	122.6	176.2	178.9	0	0	0	0	107.6	T183	V178-T183 HydrophobicContact CG1-CG2 4.26Å; V178-T183 HydrophobicContact CG2-CG2 4.16Å
179	A	88.6	Confident	91.6	Very high	33 Å²	33	44.9 Å²	44.9	27%	0.273	22%	0.224	S	C	.	.			trans	-102.3	175.7	167.9	0	0	0	0	0	109.2	S181 Y182	A179-S181 VanDerWaalsContact C-N 3.29Å; A179-S181 PolarHBondContact O-N 3.44Å; A179-Y182 CarbonylContact C-O 3.57Å; A179-Y182 WeakPolarHBondContact CA-O 3.42Å; A179-Y182 HydrophobicContact CB-CD1 4.3Å; A179-Y182 HydrophobicContact CB-CD2 3.96Å; A179-Y182 HydrophobicContact CB-CE1 4.08Å; A179-Y182 HydrophobicContact CB-CE2 3.67Å; A179-Y182 HydrophobicContact CB-CG 4.25Å; A179-Y182 WeakPolarHBondContact CB-O 3.28Å; A179-Y182 PolarHBondContact N-O 2.98Å
180	K	87.4	Confident	91.6	Very high	212 Å²	212	46.5 Å²	46.5	92%	0.922	23%	0.231	S	C	*	.	S	Bend	trans	-56.7	-42.5	-178.8	-176	-179.6	177	-176.1	0	113
181	S	88.7	Confident	91.7	Very high	17 Å²	17	43.6 Å²	43.6	12%	0.119	22%	0.221	C	C	.	.	S	Bend	trans	-117.7	-6.9	-168.3	-62.9	0	0	0	0	114.4	A179 A206 D207 S219	A179-S181 VanDerWaalsContact C-N 3.29Å; A179-S181 PolarHBondContact O-N 3.44Å; S181-A206 PolarHBondContact O-N 3.34Å; S181-D207 VanDerWaalsContact CB-CB 3.48Å; S181-D207 WeakPolarHBondContact CB-OD2 3.33Å; S181-D207 PolarHBondContact O-N 3.12Å; S181-D207 PolarHBondContact OG-OD2 2.91Å; S181-S219 WeakPolarHBondContact CB-OG 3.46Å; S181-S219 PolarHBondContact OG-OG 3.18Å
182	Y	91.2	Very high	91.8	Very high	31 Å²	31	47.4 Å²	47.4	12%	0.122	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	158.8	179.9	60.3	-97.2	0	0	0	111.4	A179 V204 F223 K226	A179-Y182 CarbonylContact C-O 3.57Å; A179-Y182 WeakPolarHBondContact CA-O 3.42Å; A179-Y182 HydrophobicContact CB-CD1 4.3Å; A179-Y182 HydrophobicContact CB-CD2 3.96Å; A179-Y182 HydrophobicContact CB-CE1 4.08Å; A179-Y182 HydrophobicContact CB-CE2 3.67Å; A179-Y182 HydrophobicContact CB-CG 4.25Å; A179-Y182 WeakPolarHBondContact CB-O 3.28Å; A179-Y182 PolarHBondContact N-O 2.98Å; Y182-V204 CarbonylContact C-O 3.5Å; Y182-V204 WeakPolarHBondContact CA-O 3.23Å; Y182-V204 WeakPolarHBondContact CB-O 3.41Å; Y182-F223 HydrophobicContact CD1-CB 4.19Å; Y182-F223 AromaticContact CD1-CD2 3.62Å; Y182-F223 HydrophobicContact CD1-CD2 3.62Å; Y182-F223 HydrophobicContact CD1-CG 4.38Å; Y182-F223 HydrophobicContact CD2-CD2 4.13Å; Y182-F223 HydrophobicContact CD2-CE2 4.36Å; Y182-F223 HydrophobicContact CE1-CD2 4.32Å; Y182-F223 AromaticContact CG-CD2 3.5Å; Y182-F223 HydrophobicContact CG-CD2 3.5Å; Y182-F223 AromaticContact CG-CE2 3.96Å; Y182-F223 HydrophobicContact CG-CE2 3.96Å; Y182-K226 HydrophobicContact CE2-CB 4.34Å; Y182-K226 HydrophobicContact CE2-CG 3.72Å; Y182-K226 WeakPolarHBondContact OH-CG 3.21Å
183	T	91.1	Very high	92	Very high	33 Å²	33	52 Å²	52	20%	0.202	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	147.9	168	72.9	0	0	0	0	109.7	V178 L203 V204	V178-T183 HydrophobicContact CG1-CG2 4.26Å; V178-T183 HydrophobicContact CG2-CG2 4.16Å; T183-L203 CarbonylContact O-C 3.56Å; T183-L203 WeakPolarHBondContact O-CA 3.39Å; T183-V204 PolarHBondContact N-O 3.12Å; T183-V204 PolarHBondContact O-N 3.28Å
184	Q	92.1	Very high	92.3	Very high	11 Å²	11	54.9 Å²	54.9	5%	0.051	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	142.8	173.4	73.4	-167.8	-69.5	0	0	109.4	G176 Q177 H202 L203 K226	G176-Q184 WeakPolarHBondContact CA-O 3.49Å; Q177-Q184 HydrophobicContact CB-CG 3.73Å; Q177-Q184 PolarHBondContact N-O 3.22Å; Q177-Q184 PolarHBondContact O-N 2.93Å; Q184-H202 CarbonylContact C-O 3.51Å; Q184-H202 WeakPolarHBondContact CA-O 3.47Å; Q184-L203 HydrophobicContact CB-CG 4.14Å; Q184-K226 VanDerWaalsContact OE1-NZ 3.13Å
185	K	91.7	Very high	92.5	Very high	19 Å²	19	57.1 Å²	57.1	8%	0.083	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.1	174.5	-54.4	-170.3	179.3	66	0	109.6	F158 Y175 L187 R201 H202	F158-K185 HydrophobicContact CE1-CD 3.94Å; F158-K185 HydrophobicContact CE1-CG 4.03Å; F158-K185 HydrophobicContact CZ-CD 3.72Å; F158-K185 HydrophobicContact CZ-CG 3.77Å; Y175-K185 CarbonylContact O-C 3.49Å; Y175-K185 WeakPolarHBondContact O-CA 3.45Å; K185-L187 HydrophobicContact CB-CD2 4.13Å; K185-R201 CarbonylContact O-C 3.52Å; K185-R201 WeakPolarHBondContact O-CA 3.5Å; K185-H202 HydrophobicContact CB-CB 4.36Å; K185-H202 PolarHBondContact N-O 3Å; K185-H202 PolarHBondContact O-N 2.73Å
186	I	92.8	Very high	92.7	Very high	35 Å²	35	55.9 Å²	55.9	18%	0.179	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	121.6	160.7	-56.8	174.9	0	0	0	106.3	I174 Y175 W199 R201	I174-I186 HydrophobicContact CD1-CB 4.42Å; I174-I186 HydrophobicContact CD1-CG2 3.8Å; I174-I186 HydrophobicContact CG1-CB 3.93Å; I174-I186 HydrophobicContact CG1-CG2 3.78Å; I174-I186 WeakPolarHBondContact CG1-O 3.04Å; I174-I186 PolarHBondContact N-O 2.84Å; Y175-I186 HydrophobicContact CD1-CD1 4.14Å; Y175-I186 HydrophobicContact CD1-CG1 4.11Å; Y175-I186 HydrophobicContact CG-CD1 4.37Å; Y175-I186 PolarHBondContact N-O 3.34Å; Y175-I186 PolarHBondContact O-N 2.99Å; I186-W199 HydrophobicContact CG2-CB 3.99Å; I186-W199 HydrophobicContact CG2-CG 4.3Å; I186-R201 HydrophobicContact CG1-CG 4.44Å
187	L	93.6	Very high	93	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.3	177.4	-54.7	-179.2	0	0	0	108.4	W124 W154 I171 R172 P173 K185 W199 V200 H202	W124-L187 HydrophobicContact CH2-CD1 3.77Å; W124-L187 HydrophobicContact CZ2-CD1 4.45Å; W154-L187 HydrophobicContact CB-CD1 4.11Å; I171-L187 HydrophobicContact CG2-CB 4.36Å; I171-L187 HydrophobicContact CG2-CD1 4.18Å; R172-L187 CarbonylContact O-C 3.58Å; R172-L187 WeakPolarHBondContact O-CA 3.18Å; P173-L187 HydrophobicContact CB-CD2 3.93Å; K185-L187 HydrophobicContact CB-CD2 4.13Å; L187-W199 WeakPolarHBondContact O-CA 3.23Å; L187-V200 PolarHBondContact N-O 3.13Å; L187-V200 PolarHBondContact O-N 3.39Å; L187-H202 HydrophobicContact CD1-CB 3.67Å; L187-H202 HydrophobicContact CG-CB 3.91Å
188	E	93.6	Very high	93.1	Very high	25 Å²	25	54.2 Å²	54.2	12%	0.117	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	119.6	159.9	178.6	-173.2	-97.2	0	0	108.1	I171 R172 I174	I171-E188 CarbonylContact C-O 3.54Å; I171-E188 WeakPolarHBondContact CA-O 3.41Å; R172-E188 HydrophobicContact CB-CB 4.45Å; R172-E188 IonicContact CZ-OE1 2.73Å; R172-E188 IonicContact CZ-OE2 2.82Å; R172-E188 VanDerWaalsContact CZ-OE2 3.23Å; R172-E188 PolarHBondContact N-O 3.01Å; R172-E188 IonicContact NE-OE2 2.68Å; R172-E188 PolarHBondContact NE-OE2 3.41Å; R172-E188 IonicContact NH2-OE1 3.76Å; R172-E188 PolarHBondContact NH2-OE1 3.22Å; R172-E188 IonicContact NH2-OE2 3.68Å; R172-E188 PolarHBondContact NH2-OE2 2.92Å; R172-E188 PolarHBondContact O-N 3.44Å; I174-E188 HydrophobicContact CG2-CB 3.82Å
189	V	95.4	Very high	93.4	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.006	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.5	171.5	-173.3	0	0	0	0	106.8	W124 W128 Y169 R170 I171 S197 R198 V200	W124-V189 HydrophobicContact CE3-CG1 4.25Å; W124-V189 HydrophobicContact CE3-CG2 4.17Å; W124-V189 HydrophobicContact CH2-CG2 4.34Å; W124-V189 HydrophobicContact CZ3-CG1 4.48Å; W124-V189 HydrophobicContact CZ3-CG2 3.57Å; W128-V189 HydrophobicContact CE3-CG1 3.86Å; W128-V189 HydrophobicContact CZ3-CB 4.5Å; W128-V189 HydrophobicContact CZ3-CG1 4.15Å; W128-V189 WeakPolarHBondContact CZ3-O 2.91Å; Y169-V189 HydrophobicContact CD1-CG1 4.48Å; R170-V189 WeakPolarHBondContact O-CA 3.4Å; I171-V189 HydrophobicContact CD1-CG1 4.12Å; V189-S197 CarbonylContact O-C 3.58Å; V189-S197 WeakPolarHBondContact O-CA 3.44Å; V189-R198 PolarHBondContact N-O 2.92Å; V189-R198 PolarHBondContact O-N 3.41Å; V189-V200 HydrophobicContact CG2-CB 4.23Å; V189-V200 HydrophobicContact CG2-CG2 3.66Å
190	K	95.9	Very high	93.6	Very high	37 Å²	37	53.5 Å²	53.5	16%	0.161	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.5	177.8	-178.1	173	-174.5	176.5	0	110.2	Y169 R170 L192 N195 E196 S197	Y169-K190 CarbonylContact C-O 3.3Å; Y169-K190 WeakPolarHBondContact CA-O 3.42Å; R170-K190 HydrophobicContact CB-CB 4.41Å; R170-K190 PolarHBondContact N-O 3.45Å; R170-K190 PolarHBondContact O-N 3.14Å; K190-L192 HydrophobicContact CD-CD2 4.35Å; K190-L192 HydrophobicContact CG-CD2 4.37Å; K190-N195 WeakPolarHBondContact CE-OD1 3.5Å; K190-N195 PolarHBondContact NZ-OD1 3.35Å; K190-E196 WeakPolarHBondContact CA-O 3.46Å; K190-S197 WeakPolarHBondContact CG-OG 3.23Å
191	N	97.6	Very high	94	Very high	9 Å²	9	44 Å²	44	5%	0.048	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	116.4	167.4	-178.8	-28.9	0	0	0	108.3	W128 Y169 E193 S194 N195 E196	W128-N191 HydrophobicContact CD2-CB 4.25Å; W128-N191 HydrophobicContact CE3-CB 4.33Å; W128-N191 HydrophobicContact CH2-CB 3.49Å; W128-N191 VanDerWaalsContact CH2-CB 3.49Å; W128-N191 HydrophobicContact CZ2-CB 3.36Å; W128-N191 HydrophobicContact CZ3-CB 3.98Å; Y169-N191 HydrophobicContact CD1-CB 4.25Å; Y169-N191 HydrophobicContact CE1-CB 4.21Å; N191-E193 VanDerWaalsContact C-N 3.31Å; N191-E193 PolarHBondContact O-N 2.92Å; N191-E193 WeakPolarHBondContact OD1-CB 3.37Å; N191-E193 PolarHBondContact OD1-N 2.92Å; N191-S194 WeakPolarHBondContact CB-OG 3.35Å; N191-S194 PolarHBondContact OD1-N 3.01Å; N191-N195 WeakPolarHBondContact O-CA 3.48Å; N191-N195 PolarHBondContact O-N 3.22Å; N191-E196 PolarHBondContact N-O 2.84Å
192	L	97.3	Very high	94.2	Very high	80 Å²	80	43.2 Å²	43.2	42%	0.419	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-21.4	-174.1	-62.6	176.6	0	0	0	113.1	K168 R170 K190	K168-L192 WeakPolarHBondContact O-CB 2.99Å; K168-L192 WeakPolarHBondContact O-CG 3.41Å; K168-L192 PolarHBondContact O-N 2.87Å; R170-L192 HydrophobicContact CB-CD1 4.38Å; R170-L192 HydrophobicContact CB-CD2 3.99Å; R170-L192 HydrophobicContact CB-CG 4.29Å; K190-L192 HydrophobicContact CD-CD2 4.35Å; K190-L192 HydrophobicContact CG-CD2 4.37Å
193	E	96.8	Very high	94.4	Very high	142 Å²	142	41.8 Å²	41.8	66%	0.664	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-47.1	175.9	-66.3	172.6	178.1	0	0	111.2	K168 N191	K168-E193 HydrophobicContact CB-CG 4.16Å; K168-E193 HydrophobicContact CD-CG 3.97Å; K168-E193 WeakPolarHBondContact CD-OE1 3.33Å; K168-E193 WeakPolarHBondContact CD-OE2 3.27Å; K168-E193 WeakPolarHBondContact CE-OE2 3.35Å; K168-E193 IonicContact NZ-OE1 2.72Å; K168-E193 IonicContact NZ-OE2 3.73Å; K168-E193 PolarHBondContact NZ-OE2 3.35Å; N191-E193 VanDerWaalsContact C-N 3.31Å; N191-E193 PolarHBondContact O-N 2.92Å; N191-E193 WeakPolarHBondContact OD1-CB 3.37Å; N191-E193 PolarHBondContact OD1-N 2.92Å
194	S	96.2	Very high	94.5	Very high	66 Å²	66	40.4 Å²	40.4	46%	0.462	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.1	-179.3	69.6	0	0	0	0	113.8	N191 E196	N191-S194 WeakPolarHBondContact CB-OG 3.35Å; N191-S194 PolarHBondContact OD1-N 3.01Å; S194-E196 PolarHBondContact O-N 2.87Å; S194-E196 WeakPolarHBondContact OG-CB 3.26Å; S194-E196 PolarHBondContact OG-N 2.84Å
195	N	94.9	Very high	94.5	Very high	110 Å²	110	39.9 Å²	39.9	59%	0.588	20%	0.199	S	C	*	.			trans	59.9	6.3	-172.6	-157.5	37.7	0	0	0	114.6	K190 N191	K190-N195 WeakPolarHBondContact CE-OD1 3.5Å; K190-N195 PolarHBondContact NZ-OD1 3.35Å; N191-N195 WeakPolarHBondContact O-CA 3.48Å; N191-N195 PolarHBondContact O-N 3.22Å
196	E	95.6	Very high	94.2	Very high	81 Å²	81	41.6 Å²	41.6	38%	0.379	22%	0.217	S	C	.	.			trans	-72.4	143.2	176.9	-171.4	-168.1	160.9	0	0	110.5	W128 K190 N191 S194 R198	W128-E196 HydrophobicContact CH2-CB 3.87Å; W128-E196 HydrophobicContact CH2-CG 3.98Å; W128-E196 WeakPolarHBondContact CH2-O 3.31Å; W128-E196 HydrophobicContact CZ2-CB 3.95Å; W128-E196 HydrophobicContact CZ2-CG 4.14Å; W128-E196 WeakPolarHBondContact CZ2-OE2 3.29Å; K190-E196 WeakPolarHBondContact CA-O 3.46Å; N191-E196 PolarHBondContact N-O 2.84Å; S194-E196 PolarHBondContact O-N 2.87Å; S194-E196 WeakPolarHBondContact OG-CB 3.26Å; S194-E196 PolarHBondContact OG-N 2.84Å; E196-R198 IonicContact OE1-CZ 3.98Å; E196-R198 VanDerWaalsContact OE1-CZ 3.25Å; E196-R198 IonicContact OE1-NE 3.17Å; E196-R198 PolarHBondContact OE1-NE 2.9Å; E196-R198 IonicContact OE1-NH2 3.97Å; E196-R198 PolarHBondContact OE1-NH2 3.38Å; E196-R198 IonicContact OE2-CZ 2.68Å; E196-R198 IonicContact OE2-NE 2.78Å; E196-R198 IonicContact OE2-NH2 3.83Å; E196-R198 PolarHBondContact OE2-NH2 3.39Å
197	S	93.9	Very high	93.7	Very high	56 Å²	56	42.7 Å²	42.7	39%	0.392	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	142.4	175.1	-58.9	0	0	0	0	111.2	V189 K190	V189-S197 CarbonylContact O-C 3.58Å; V189-S197 WeakPolarHBondContact O-CA 3.44Å; K190-S197 WeakPolarHBondContact CG-OG 3.23Å
198	R	93.5	Very high	93.1	Very high	28 Å²	28	42.8 Å²	42.8	11%	0.106	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	145.9	178.6	-63.2	177.5	-175	174.2	4.3	109.8	W128 Y131 V189 E196	W128-R198 HydrophobicContact CH2-CG 3.92Å; W128-R198 HydrophobicContact CZ3-CB 4.18Å; W128-R198 HydrophobicContact CZ3-CG 3.84Å; W128-R198 PolarHBondContact O-NH1 2.93Å; Y131-R198 VanDerWaalsContact CD1-NH1 3.34Å; Y131-R198 VanDerWaalsContact CE1-NH1 3.28Å; V189-R198 PolarHBondContact N-O 2.92Å; V189-R198 PolarHBondContact O-N 3.41Å; E196-R198 IonicContact OE1-CZ 3.98Å; E196-R198 VanDerWaalsContact OE1-CZ 3.25Å; E196-R198 IonicContact OE1-NE 3.17Å; E196-R198 PolarHBondContact OE1-NE 2.9Å; E196-R198 IonicContact OE1-NH2 3.97Å; E196-R198 PolarHBondContact OE1-NH2 3.38Å; E196-R198 IonicContact OE2-CZ 2.68Å; E196-R198 IonicContact OE2-NE 2.78Å; E196-R198 IonicContact OE2-NH2 3.83Å; E196-R198 PolarHBondContact OE2-NH2 3.39Å
199	W	92.9	Very high	91.9	Very high	127 Å²	127	43 Å²	43	48%	0.481	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.3	172.4	-61.9	-15.5	0	0	0	110.7	I174 I186 L187	I174-W199 HydrophobicContact CD1-CD2 4.28Å; I174-W199 HydrophobicContact CD1-CG 4.35Å; I174-W199 HydrophobicContact CD1-CZ2 4.46Å; I186-W199 HydrophobicContact CG2-CB 3.99Å; I186-W199 HydrophobicContact CG2-CG 4.3Å; L187-W199 WeakPolarHBondContact O-CA 3.23Å
200	V	93.7	Very high	90.1	Very high	4 Å²	4	50 Å²	50	2%	0.024	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.8	178.3	-177.6	0	0	0	0	108.4	V127 I135 L187 V189	V127-V200 HydrophobicContact CG1-CG2 4.11Å; I135-V200 HydrophobicContact CD1-CG1 3.66Å; I135-V200 HydrophobicContact CG1-CG1 3.73Å; L187-V200 PolarHBondContact N-O 3.13Å; L187-V200 PolarHBondContact O-N 3.39Å; V189-V200 HydrophobicContact CG2-CB 4.23Å; V189-V200 HydrophobicContact CG2-CG2 3.66Å
201	R	94.8	Very high	88.4	Confident	13 Å²	13	54.1 Å²	54.1	5%	0.049	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	124.9	172.5	-63.4	102.3	-177.2	-66.9	-10.2	108.6	K133 V134 I135 K185 I186 L203 E230 D237	K133-R201 WeakPolarHBondContact O-CD 3.5Å; K133-R201 PolarHBondContact O-N 3.5Å; V134-R201 CarbonylContact C-O 3.55Å; V134-R201 VanDerWaalsContact CA-O 3.27Å; V134-R201 WeakPolarHBondContact CA-O 3.4Å; V134-R201 HydrophobicContact CG2-CB 4.39Å; I135-R201 PolarHBondContact N-O 3.38Å; K185-R201 CarbonylContact O-C 3.52Å; K185-R201 WeakPolarHBondContact O-CA 3.5Å; I186-R201 HydrophobicContact CG1-CG 4.44Å; R201-L203 HydrophobicContact CB-CD1 3.97Å; R201-E230 HydrophobicContact CB-CB 4.4Å; R201-E230 HydrophobicContact CG-CB 4.34Å; R201-E230 IonicContact CZ-OE2 2.81Å; R201-E230 PolarHBondContact NH1-O 2.95Å; R201-E230 IonicContact NH1-OE2 2.86Å; R201-E230 PolarHBondContact NH1-OE2 2.95Å; R201-D237 IonicContact CZ-OD2 3.75Å; R201-D237 IonicContact NE-OD2 3.22Å; R201-D237 IonicContact NH2-OD2 2.73Å; R201-D237 PolarHBondContact NH2-OD2 3.25Å
202	H	94.6	Very high	86.5	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.9	-178.3	179.8	-100.1	0	0	0	108.9	Y153 W154 Q184 K185 L187 V204	Y153-H202 AromaticContact CE2-NE2 3.88Å; Y153-H202 AromaticContact CZ-NE2 3.62Å; Y153-H202 PolarHBondContact OH-NE2 2.88Å; W154-H202 AromaticContact CD2-CE1 3.57Å; W154-H202 AromaticContact CD2-NE2 3.87Å; W154-H202 AromaticContact CE2-CE1 3.37Å; W154-H202 AromaticContact CZ2-CE1 3.63Å; W154-H202 AromaticContact NE1-CE1 3.79Å; Q184-H202 CarbonylContact C-O 3.51Å; Q184-H202 WeakPolarHBondContact CA-O 3.47Å; K185-H202 HydrophobicContact CB-CB 4.36Å; K185-H202 PolarHBondContact N-O 3Å; K185-H202 PolarHBondContact O-N 2.73Å; L187-H202 HydrophobicContact CD1-CB 3.67Å; L187-H202 HydrophobicContact CG-CB 3.91Å; H202-V204 WeakPolarHBondContact CE1-CG2 3.38Å
203	L	95.3	Very high	84.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.2	-176.3	-73.7	89.7	0	0	0	109.1	V134 I135 V136 Y137 T183 Q184 R201 F223 K226 V227 E230	V134-L203 HydrophobicContact CG1-CD1 3.77Å; I135-L203 PolarHBondContact O-N 2.84Å; V136-L203 WeakPolarHBondContact CA-O 3.5Å; Y137-L203 PolarHBondContact N-O 3.23Å; T183-L203 CarbonylContact O-C 3.56Å; T183-L203 WeakPolarHBondContact O-CA 3.39Å; Q184-L203 HydrophobicContact CB-CG 4.14Å; R201-L203 HydrophobicContact CB-CD1 3.97Å; L203-F223 HydrophobicContact CB-CE2 3.78Å; L203-F223 HydrophobicContact CB-CZ 3.83Å; L203-F223 HydrophobicContact CD2-CE2 4.11Å; L203-K226 HydrophobicContact CD2-CG 3.85Å; L203-V227 HydrophobicContact CD2-CG2 3.95Å; L203-E230 HydrophobicContact CD1-CB 4.3Å; L203-E230 HydrophobicContact CD1-CG 4.3Å; L203-E230 HydrophobicContact CD2-CG 4.32Å
204	V	92.3	Very high	82.2	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.024	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	113.5	178.8	-177.4	0	0	0	0	109.1	Y137 E139 W154 Y182 T183 H202	Y137-V204 HydrophobicContact CD1-CB 4.33Å; Y137-V204 HydrophobicContact CD1-CG1 3.56Å; Y137-V204 HydrophobicContact CD1-CG2 4.05Å; Y137-V204 HydrophobicContact CE1-CG1 4.14Å; Y137-V204 HydrophobicContact CG-CG1 4.43Å; Y137-V204 CarbonylContact O-C 3.51Å; Y137-V204 WeakPolarHBondContact O-CA 3.32Å; E139-V204 HydrophobicContact CB-CG1 4.06Å; W154-V204 HydrophobicContact CZ2-CG2 4.06Å; Y182-V204 CarbonylContact C-O 3.5Å; Y182-V204 WeakPolarHBondContact CA-O 3.23Å; Y182-V204 WeakPolarHBondContact CB-O 3.41Å; T183-V204 PolarHBondContact N-O 3.12Å; T183-V204 PolarHBondContact O-N 3.28Å; H202-V204 WeakPolarHBondContact CE1-CG2 3.38Å
205	Y	91.8	Very high	81	Confident	1 Å²	1	43.7 Å²	43.7	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	115.5	171.4	-174.7	-102	0	0	0	109.7	Y137 I138 E139 D207 W208 S219 L220 F223	Y137-Y205 PolarHBondContact O-N 2.99Å; I138-Y205 HydrophobicContact CG2-CD1 4.24Å; E139-Y205 WeakPolarHBondContact CB-O 3.48Å; E139-Y205 PolarHBondContact N-O 3.38Å; Y205-D207 HydrophobicContact CE1-CB 4.26Å; Y205-D207 VanDerWaalsContact CE1-O 3.27Å; Y205-D207 WeakPolarHBondContact CE1-O 3.47Å; Y205-D207 HydrophobicContact CE2-CB 4.09Å; Y205-D207 PolarHBondContact OH-O 2.85Å; Y205-W208 HydrophobicContact CD1-CB 4.01Å; Y205-W208 HydrophobicContact CD1-CE3 4.02Å; Y205-W208 HydrophobicContact CE1-CB 3.86Å; Y205-W208 AromaticContact CE1-CE3 3.83Å; Y205-W208 HydrophobicContact CE1-CE3 3.83Å; Y205-S219 WeakPolarHBondContact CE2-OG 3.23Å; Y205-S219 PolarHBondContact OH-OG 3.49Å; Y205-S219 VanDerWaalsContact OH-OG 3.05Å; Y205-L220 HydrophobicContact CE1-CD1 4.41Å; Y205-F223 HydrophobicContact CD2-CB 3.65Å; Y205-F223 AromaticContact CD2-CD1 3.83Å; Y205-F223 HydrophobicContact CD2-CD1 3.83Å; Y205-F223 AromaticContact CD2-CD2 3.91Å; Y205-F223 HydrophobicContact CD2-CD2 3.91Å; Y205-F223 HydrophobicContact CD2-CE1 4.46Å; Y205-F223 HydrophobicContact CD2-CE2 4.49Å; Y205-F223 AromaticContact CD2-CG 3.51Å; Y205-F223 HydrophobicContact CD2-CG 3.51Å; Y205-F223 HydrophobicContact CE2-CB 3.94Å; Y205-F223 HydrophobicContact CE2-CG 4.3Å; Y205-F223 HydrophobicContact CG-CD1 4.05Å; Y205-F223 HydrophobicContact CG-CE1 4.32Å; Y205-F223 HydrophobicContact CG-CG 4.17Å
206	A	85.5	Confident	80.2	Confident	54 Å²	54	40.1 Å²	40.1	45%	0.446	22%	0.215	S	C	.	.			trans	-106.9	-9.4	-175	0	0	0	0	0	113.2	S181 W208	S181-A206 PolarHBondContact O-N 3.34Å; A206-W208 PolarHBondContact O-N 2.87Å
207	D	83.5	Confident	79.8	Confident	58 Å²	58	36.3 Å²	36.3	31%	0.31	20%	0.197	S	C	.	.			trans	-91.2	37.1	-178.4	-164	23.6	0	0	0	112	S181 Y205 P209 S219	S181-D207 VanDerWaalsContact CB-CB 3.48Å; S181-D207 WeakPolarHBondContact CB-OD2 3.33Å; S181-D207 PolarHBondContact O-N 3.12Å; S181-D207 PolarHBondContact OG-OD2 2.91Å; Y205-D207 HydrophobicContact CE1-CB 4.26Å; Y205-D207 VanDerWaalsContact CE1-O 3.27Å; Y205-D207 WeakPolarHBondContact CE1-O 3.47Å; Y205-D207 HydrophobicContact CE2-CB 4.09Å; Y205-D207 PolarHBondContact OH-O 2.85Å; D207-P209 VanDerWaalsContact O-CD 3.22Å; D207-P209 WeakPolarHBondContact O-CD 3.38Å; D207-S219 WeakPolarHBondContact OD2-CB 3.49Å; D207-S219 PolarHBondContact OD2-OG 3.45Å
208	W	80.4	Confident	79.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.008	20%	0.199	C	C	.	.			trans	-101.1	94.3	169.8	-158.7	-66.7	0	0	0	108.7	I138 Y205 A206 M215 L220 R255 T258 L297	I138-W208 HydrophobicContact CG2-CB 4.25Å; I138-W208 HydrophobicContact CG2-CD2 3.84Å; I138-W208 HydrophobicContact CG2-CE3 3.45Å; I138-W208 VanDerWaalsContact CG2-CE3 3.45Å; I138-W208 HydrophobicContact CG2-CG 4.21Å; I138-W208 HydrophobicContact CG2-CZ3 4.05Å; Y205-W208 HydrophobicContact CD1-CB 4.01Å; Y205-W208 HydrophobicContact CD1-CE3 4.02Å; Y205-W208 HydrophobicContact CE1-CB 3.86Å; Y205-W208 AromaticContact CE1-CE3 3.83Å; Y205-W208 HydrophobicContact CE1-CE3 3.83Å; A206-W208 PolarHBondContact O-N 2.87Å; W208-M215 HydrophobicContact CD2-CG 4.16Å; W208-M215 HydrophobicContact CD2-SD 3.55Å; W208-M215 VanDerWaalsContact CD2-SD 3.55Å; W208-M215 HydrophobicContact CE3-SD 3.91Å; W208-M215 HydrophobicContact CG-CG 4.28Å; W208-M215 HydrophobicContact CG-SD 4.24Å; W208-M215 HydrophobicContact CH2-SD 3.59Å; W208-M215 VanDerWaalsContact CH2-SD 3.59Å; W208-M215 HydrophobicContact CZ2-CE 3.89Å; W208-M215 HydrophobicContact CZ2-SD 3.18Å; W208-M215 WeakPolarHBondContact CZ2-SD 3.45Å; W208-M215 HydrophobicContact CZ3-SD 3.93Å; W208-L220 HydrophobicContact CZ3-CD1 4.17Å; W208-L220 HydrophobicContact CZ3-CD2 4.27Å; W208-R255 VanDerWaalsContact CD1-CZ 3.49Å; W208-R255 HydrophobicContact CD2-CB 4.31Å; W208-R255 HydrophobicContact CD2-CG 4.22Å; W208-R255 HydrophobicContact CH2-CB 3.93Å; W208-R255 HydrophobicContact CH2-CG 4.38Å; W208-R255 HydrophobicContact CZ2-CB 3.68Å; W208-R255 HydrophobicContact CZ2-CG 3.62Å; W208-R255 HydrophobicContact CZ3-CB 4.34Å; W208-T258 HydrophobicContact CH2-CG2 3.89Å; W208-L297 HydrophobicContact CZ2-CD2 3.76Å
209	P	67.7	Low	79.5	Confident	31 Å²	31	37.1 Å²	37.1	20%	0.201	20%	0.197	C	C	.	.			trans	-67.4	159.9	-171.8	21.9	-30.5	0	0	0	113.5	D207 E211 A214 M215	D207-P209 VanDerWaalsContact O-CD 3.22Å; D207-P209 WeakPolarHBondContact O-CD 3.38Å; P209-E211 CarbonylContact O-C 3.56Å; P209-A214 HydrophobicContact CB-CB 3.75Å; P209-A214 HydrophobicContact CG-CB 3.48Å; P209-A214 VanDerWaalsContact CG-CB 3.48Å; P209-M215 HydrophobicContact CG-CB 4.47Å; P209-M215 HydrophobicContact CG-CG 4.15Å
210	K	58.6	Low	79.5	Confident	146 Å²	146	31.1 Å²	31.1	64%	0.635	17%	0.174	S	C	*	.	S	Bend	trans	-52.2	-53.4	178.1	178.3	178.4	-176.7	165	0	112.3	E142 E212	E142-K210 IonicContact OE2-NZ 3.67Å; K210-E212 PolarHBondContact O-N 3.37Å
211	E	58.6	Low	79.5	Confident	124 Å²	124	32.1 Å²	32.1	58%	0.579	18%	0.178	S	C	*	.	S	Bend	trans	-82.4	109.9	165.4	-55	-176.5	-179.8	0	0	106.4	P209 A213 A214	P209-E211 CarbonylContact O-C 3.56Å; E211-A213 HydrophobicContact CB-CB 3.38Å; E211-A213 PolarHBondContact O-N 3.15Å; E211-A214 PolarHBondContact O-N 2.83Å
212	E	58.1	Low	79.5	Confident	7 Å²	7	35.1 Å²	35.1	3%	0.033	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-46	-29.6	171.6	-68.9	-173	156.4	0	0	111.9	K210 A214 M215 E294 R296 L297 R331	K210-E212 PolarHBondContact O-N 3.37Å; E212-A214 PolarHBondContact O-N 2.9Å; E212-M215 HydrophobicContact CB-CE 3.81Å; E212-M215 HydrophobicContact CG-CE 4.44Å; E212-M215 WeakPolarHBondContact O-CB 3.29Å; E212-M215 WeakPolarHBondContact O-CE 3.26Å; E212-M215 WeakPolarHBondContact O-CG 3.27Å; E212-M215 PolarHBondContact O-N 2.81Å; E212-M215 VanDerWaalsContact O-N 3.15Å; E212-E294 VanDerWaalsContact OE2-OE2 3.13Å; E212-R296 IonicContact OE2-NE 3.45Å; E212-L297 HydrophobicContact CB-CD2 4.49Å; E212-L297 HydrophobicContact CG-CD2 4.2Å; E212-L297 VanDerWaalsContact OE1-CD2 3.31Å; E212-L297 WeakPolarHBondContact OE1-CD2 3.18Å; E212-L297 WeakPolarHBondContact OE1-CG 3.29Å; E212-L297 VanDerWaalsContact OE2-CD2 3.29Å; E212-L297 WeakPolarHBondContact OE2-CD2 3.29Å; E212-L297 VanDerWaalsContact OE2-CG 3.23Å; E212-L297 WeakPolarHBondContact OE2-CG 3.03Å; E212-R331 PolarHBondContact O-NH1 3.49Å
213	A	50	Low	79.5	Confident	9 Å²	9	35.1 Å²	35.1	7%	0.074	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-32.6	-32.4	159	0	0	0	0	0	119.2	E211 R331 S334 V335	E211-A213 HydrophobicContact CB-CB 3.38Å; E211-A213 PolarHBondContact O-N 3.15Å; A213-R331 VanDerWaalsContact C-CZ 3.44Å; A213-R331 VanDerWaalsContact C-NH2 3.26Å; A213-R331 PolarHBondContact O-NE 2.86Å; A213-R331 PolarHBondContact O-NH2 2.83Å; A213-S334 WeakPolarHBondContact CA-O 3.36Å; A213-S334 PolarHBondContact N-O 3.36Å; A213-V335 VanDerWaalsContact CB-CA 3.45Å; A213-V335 HydrophobicContact CB-CB 3.47Å; A213-V335 VanDerWaalsContact CB-CB 3.47Å; A213-V335 HydrophobicContact CB-CG1 3.36Å; A213-V335 HydrophobicContact CB-CG2 3.41Å; A213-V335 VanDerWaalsContact CB-CG2 3.41Å; A213-V335 VanDerWaalsContact O-CG2 3.29Å; A213-V335 WeakPolarHBondContact O-CG2 3.48Å
214	A	55.3	Low	79.6	Confident	61 Å²	61	35.3 Å²	35.3	50%	0.504	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-107.6	-1.5	-171	0	0	0	0	0	112.4	P209 E211 E212 S216	P209-A214 HydrophobicContact CB-CB 3.75Å; P209-A214 HydrophobicContact CG-CB 3.48Å; P209-A214 VanDerWaalsContact CG-CB 3.48Å; E211-A214 PolarHBondContact O-N 2.83Å; E212-A214 PolarHBondContact O-N 2.9Å; A214-S216 PolarHBondContact O-N 2.84Å
215	M	69.3	Low	79.7	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.214	C	C	.	.			trans	-54.1	121.6	-179.5	-77.9	-173.4	-81.7	0	0	112.2	W208 P209 E212 T217 L297 Y300 R331	W208-M215 HydrophobicContact CD2-CG 4.16Å; W208-M215 HydrophobicContact CD2-SD 3.55Å; W208-M215 VanDerWaalsContact CD2-SD 3.55Å; W208-M215 HydrophobicContact CE3-SD 3.91Å; W208-M215 HydrophobicContact CG-CG 4.28Å; W208-M215 HydrophobicContact CG-SD 4.24Å; W208-M215 HydrophobicContact CH2-SD 3.59Å; W208-M215 VanDerWaalsContact CH2-SD 3.59Å; W208-M215 HydrophobicContact CZ2-CE 3.89Å; W208-M215 HydrophobicContact CZ2-SD 3.18Å; W208-M215 WeakPolarHBondContact CZ2-SD 3.45Å; W208-M215 HydrophobicContact CZ3-SD 3.93Å; P209-M215 HydrophobicContact CG-CB 4.47Å; P209-M215 HydrophobicContact CG-CG 4.15Å; E212-M215 HydrophobicContact CB-CE 3.81Å; E212-M215 HydrophobicContact CG-CE 4.44Å; E212-M215 WeakPolarHBondContact O-CB 3.29Å; E212-M215 WeakPolarHBondContact O-CE 3.26Å; E212-M215 WeakPolarHBondContact O-CG 3.27Å; E212-M215 PolarHBondContact O-N 2.81Å; E212-M215 VanDerWaalsContact O-N 3.15Å; M215-T217 PolarHBondContact O-N 3.25Å; M215-L297 HydrophobicContact CE-CD2 3.84Å; M215-Y300 HydrophobicContact CB-CD2 4.41Å; M215-Y300 HydrophobicContact CB-CE1 4.49Å; M215-Y300 HydrophobicContact CB-CE2 3.62Å; M215-Y300 HydrophobicContact CE-CD1 3.48Å; M215-Y300 VanDerWaalsContact CE-CD1 3.48Å; M215-Y300 HydrophobicContact CE-CD2 3.68Å; M215-Y300 HydrophobicContact CE-CE1 3.75Å; M215-Y300 HydrophobicContact CE-CE2 3.93Å; M215-Y300 HydrophobicContact CE-CG 3.42Å; M215-Y300 VanDerWaalsContact CE-CG 3.42Å; M215-Y300 HydrophobicContact SD-CD1 3.98Å; M215-Y300 HydrophobicContact SD-CE1 3.61Å; M215-Y300 HydrophobicContact SD-CE2 4.2Å; M215-Y300 HydrophobicContact SD-CG 4.39Å; M215-R331 PolarHBondContact O-NH2 3.21Å
216	S	79.4	Confident	79.9	Confident	36 Å²	36	41.1 Å²	41.1	25%	0.252	22%	0.218	S	C	.	.			trans	-74	124	171.8	169.6	0	0	0	0	110	A214 E218 S219 L220	A214-S216 PolarHBondContact O-N 2.84Å; S216-E218 VanDerWaalsContact C-N 3.31Å; S216-E218 PolarHBondContact OG-N 2.91Å; S216-E218 PolarHBondContact OG-OE2 3.38Å; S216-E218 VanDerWaalsContact OG-OE2 3.04Å; S216-S219 WeakPolarHBondContact OG-CB 3.4Å; S216-S219 PolarHBondContact OG-N 3.26Å; S216-S219 VanDerWaalsContact OG-N 3.11Å; S216-L220 PolarHBondContact O-N 3.11Å
217	T	87.1	Confident	80.4	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-65.4	-39.1	173	41.5	0	0	0	0	111.4	M215 L220 F221 Y300 Y303 A304 K307	M215-T217 PolarHBondContact O-N 3.25Å; T217-L220 PolarHBondContact O-N 3.02Å; T217-F221 WeakPolarHBondContact O-CD2 3.38Å; T217-F221 WeakPolarHBondContact O-CG 3.44Å; T217-F221 PolarHBondContact O-N 2.69Å; T217-Y300 HydrophobicContact CG2-CE2 3.99Å; T217-Y303 HydrophobicContact CG2-CD1 3.74Å; T217-Y303 HydrophobicContact CG2-CE1 3.45Å; T217-Y303 VanDerWaalsContact CG2-CE1 3.45Å; T217-A304 HydrophobicContact CG2-CB 3.88Å; T217-K307 HydrophobicContact CG2-CB 4.23Å; T217-K307 HydrophobicContact CG2-CG 4.36Å; T217-K307 VanDerWaalsContact OG1-CE 3.31Å; T217-K307 WeakPolarHBondContact OG1-CE 3.27Å
218	E	89.5	Confident	80.9	Confident	93 Å²	93	37.1 Å²	37.1	44%	0.435	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-49.5	-179.8	-61.8	76.9	-171.4	0	0	110.4	S216 L220 F221 D222 K307	S216-E218 VanDerWaalsContact C-N 3.31Å; S216-E218 PolarHBondContact OG-N 2.91Å; S216-E218 PolarHBondContact OG-OE2 3.38Å; S216-E218 VanDerWaalsContact OG-OE2 3.04Å; E218-L220 PolarHBondContact O-N 3.4Å; E218-F221 PolarHBondContact O-N 3.05Å; E218-D222 WeakPolarHBondContact O-CB 3.19Å; E218-D222 PolarHBondContact O-N 2.77Å; E218-K307 WeakPolarHBondContact OE1-CE 3.12Å; E218-K307 IonicContact OE1-NZ 3.97Å; E218-K307 PolarHBondContact OE1-NZ 3.22Å
219	S	91.7	Very high	81.6	Confident	8 Å²	8	40.4 Å²	40.4	6%	0.056	20%	0.204	C	C	.	.	H	α-helix	trans	-58.6	-44.8	176.2	179.8	0	0	0	0	113	S181 Y205 D207 S216 D222 F223	S181-S219 WeakPolarHBondContact CB-OG 3.46Å; S181-S219 PolarHBondContact OG-OG 3.18Å; Y205-S219 WeakPolarHBondContact CE2-OG 3.23Å; Y205-S219 PolarHBondContact OH-OG 3.49Å; Y205-S219 VanDerWaalsContact OH-OG 3.05Å; D207-S219 WeakPolarHBondContact OD2-CB 3.49Å; D207-S219 PolarHBondContact OD2-OG 3.45Å; S216-S219 WeakPolarHBondContact OG-CB 3.4Å; S216-S219 PolarHBondContact OG-N 3.26Å; S216-S219 VanDerWaalsContact OG-N 3.11Å; S219-D222 PolarHBondContact O-N 3.3Å; S219-F223 WeakPolarHBondContact O-CB 3.45Å; S219-F223 PolarHBondContact O-N 3.26Å
220	L	92.2	Very high	82.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.4	-38.1	178.6	-174.8	60.5	0	0	0	112.3	Y205 W208 S216 T217 E218 F223 I224 F259 L262 Y300	Y205-L220 HydrophobicContact CE1-CD1 4.41Å; W208-L220 HydrophobicContact CZ3-CD1 4.17Å; W208-L220 HydrophobicContact CZ3-CD2 4.27Å; S216-L220 PolarHBondContact O-N 3.11Å; T217-L220 PolarHBondContact O-N 3.02Å; E218-L220 PolarHBondContact O-N 3.4Å; L220-F223 WeakPolarHBondContact O-CB 3.42Å; L220-F223 PolarHBondContact O-N 3.07Å; L220-I224 HydrophobicContact CG-CD1 4.4Å; L220-I224 WeakPolarHBondContact O-CG1 3.41Å; L220-I224 PolarHBondContact O-N 3Å; L220-F259 HydrophobicContact CD1-CD2 4.19Å; L220-L262 HydrophobicContact CD2-CD1 3.59Å; L220-Y300 HydrophobicContact CD2-CE1 3.66Å; L220-Y300 WeakPolarHBondContact CD2-OH 3.14Å
221	F	94.1	Very high	84.3	Confident	26 Å²	26	32.5 Å²	32.5	11%	0.114	17%	0.167	C	C	.	.	H	α-helix	trans	-69	-39	175.4	-62.5	-34.9	0	0	0	112.6	T217 E218 F223 I224 R225 I266 A304 K307 Y308	T217-F221 WeakPolarHBondContact O-CD2 3.38Å; T217-F221 WeakPolarHBondContact O-CG 3.44Å; T217-F221 PolarHBondContact O-N 2.69Å; E218-F221 PolarHBondContact O-N 3.05Å; F221-F223 VanDerWaalsContact C-N 3.25Å; F221-F223 PolarHBondContact O-N 3.1Å; F221-I224 HydrophobicContact CD1-CD1 4.34Å; F221-I224 PolarHBondContact O-N 3.49Å; F221-R225 WeakPolarHBondContact O-CB 3.47Å; F221-R225 PolarHBondContact O-N 3.29Å; F221-I266 HydrophobicContact CD1-CD1 3.89Å; F221-I266 HydrophobicContact CE1-CD1 4Å; F221-A304 HydrophobicContact CE1-CB 4.38Å; F221-A304 HydrophobicContact CZ-CB 3.9Å; F221-A304 WeakPolarHBondContact CZ-O 3.39Å; F221-K307 HydrophobicContact CE2-CB 4.45Å; F221-Y308 HydrophobicContact CD1-CD2 4.02Å; F221-Y308 HydrophobicContact CD2-CD2 4.14Å; F221-Y308 HydrophobicContact CE1-CD2 4.15Å; F221-Y308 HydrophobicContact CE2-CD2 4.25Å; F221-Y308 HydrophobicContact CG-CD2 4.06Å; F221-Y308 HydrophobicContact CZ-CD2 4.29Å; F221-Y308 HydrophobicContact CZ-CG 4.45Å
222	D	93.8	Very high	85.7	Confident	75 Å²	75	30.8 Å²	30.8	40%	0.401	16%	0.159	S	C	.	.	H	α-helix	trans	-60.2	-39.8	172.3	-79	-18.7	0	0	0	111.4	E218 S219 R225 K226	E218-D222 WeakPolarHBondContact O-CB 3.19Å; E218-D222 PolarHBondContact O-N 2.77Å; S219-D222 PolarHBondContact O-N 3.3Å; D222-R225 VanDerWaalsContact CG-NH2 3.27Å; D222-R225 IonicContact OD1-CZ 3.39Å; D222-R225 IonicContact OD1-NE 3.85Å; D222-R225 IonicContact OD1-NH2 2.68Å; D222-R225 PolarHBondContact OD1-NH2 3.15Å; D222-K226 WeakPolarHBondContact O-CB 3.44Å; D222-K226 PolarHBondContact O-N 3.02Å
223	F	95.7	Very high	87.1	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.9	-44.7	175	-174.2	-113	0	0	0	112.8	V136 Y182 L203 Y205 S219 L220 F221 R225 K226 V227 F259	V136-F223 HydrophobicContact CG1-CE1 3.6Å; V136-F223 HydrophobicContact CG1-CZ 3.87Å; Y182-F223 HydrophobicContact CD1-CB 4.19Å; Y182-F223 AromaticContact CD1-CD2 3.62Å; Y182-F223 HydrophobicContact CD1-CD2 3.62Å; Y182-F223 HydrophobicContact CD1-CG 4.38Å; Y182-F223 HydrophobicContact CD2-CD2 4.13Å; Y182-F223 HydrophobicContact CD2-CE2 4.36Å; Y182-F223 HydrophobicContact CE1-CD2 4.32Å; Y182-F223 AromaticContact CG-CD2 3.5Å; Y182-F223 HydrophobicContact CG-CD2 3.5Å; Y182-F223 AromaticContact CG-CE2 3.96Å; Y182-F223 HydrophobicContact CG-CE2 3.96Å; L203-F223 HydrophobicContact CB-CE2 3.78Å; L203-F223 HydrophobicContact CB-CZ 3.83Å; L203-F223 HydrophobicContact CD2-CE2 4.11Å; Y205-F223 HydrophobicContact CD2-CB 3.65Å; Y205-F223 AromaticContact CD2-CD1 3.83Å; Y205-F223 HydrophobicContact CD2-CD1 3.83Å; Y205-F223 AromaticContact CD2-CD2 3.91Å; Y205-F223 HydrophobicContact CD2-CD2 3.91Å; Y205-F223 HydrophobicContact CD2-CE1 4.46Å; Y205-F223 HydrophobicContact CD2-CE2 4.49Å; Y205-F223 AromaticContact CD2-CG 3.51Å; Y205-F223 HydrophobicContact CD2-CG 3.51Å; Y205-F223 HydrophobicContact CE2-CB 3.94Å; Y205-F223 HydrophobicContact CE2-CG 4.3Å; Y205-F223 HydrophobicContact CG-CD1 4.05Å; Y205-F223 HydrophobicContact CG-CE1 4.32Å; Y205-F223 HydrophobicContact CG-CG 4.17Å; S219-F223 WeakPolarHBondContact O-CB 3.45Å; S219-F223 PolarHBondContact O-N 3.26Å; L220-F223 WeakPolarHBondContact O-CB 3.42Å; L220-F223 PolarHBondContact O-N 3.07Å; F221-F223 VanDerWaalsContact C-N 3.25Å; F221-F223 PolarHBondContact O-N 3.1Å; F223-R225 VanDerWaalsContact C-N 3.35Å; F223-R225 PolarHBondContact O-N 3.31Å; F223-K226 WeakPolarHBondContact O-CB 3.38Å; F223-K226 PolarHBondContact O-N 3.31Å; F223-K226 VanDerWaalsContact O-N 3.13Å; F223-V227 HydrophobicContact CD1-CG2 4.36Å; F223-V227 HydrophobicContact CE1-CG2 3.98Å; F223-V227 HydrophobicContact CE2-CG2 4.42Å; F223-V227 HydrophobicContact CZ-CG2 4.03Å; F223-V227 WeakPolarHBondContact O-CG2 3.09Å; F223-V227 PolarHBondContact O-N 2.9Å; F223-F259 HydrophobicContact CD1-CD2 4.3Å; F223-F259 AromaticContact CD1-CE2 3.74Å; F223-F259 HydrophobicContact CD1-CE2 3.74Å; F223-F259 HydrophobicContact CE1-CD2 4.44Å; F223-F259 AromaticContact CE1-CE2 3.86Å; F223-F259 HydrophobicContact CE1-CE2 3.86Å; F223-F259 HydrophobicContact CE1-CZ 4.38Å
224	I	96.2	Very high	88.5	Confident	5 Å²	5	34.6 Å²	34.6	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-56.8	-48.2	174.8	-78.8	169.6	0	0	0	111	L220 F221 K226 V227 D228 F259 L262 I266	L220-I224 HydrophobicContact CG-CD1 4.4Å; L220-I224 WeakPolarHBondContact O-CG1 3.41Å; L220-I224 PolarHBondContact O-N 3Å; F221-I224 HydrophobicContact CD1-CD1 4.34Å; F221-I224 PolarHBondContact O-N 3.49Å; I224-K226 VanDerWaalsContact C-N 3.27Å; I224-K226 PolarHBondContact O-N 2.98Å; I224-V227 PolarHBondContact O-N 2.67Å; I224-D228 PolarHBondContact O-N 2.76Å; I224-F259 HydrophobicContact CD1-CD2 4.49Å; I224-F259 HydrophobicContact CD1-CE2 4.48Å; I224-F259 HydrophobicContact CG1-CD2 3.95Å; I224-F259 HydrophobicContact CG1-CE2 3.5Å; I224-F259 HydrophobicContact CG1-CZ 4.32Å; I224-L262 HydrophobicContact CD1-CB 4.17Å; I224-I266 HydrophobicContact CD1-CD1 3.89Å; I224-I266 HydrophobicContact CG2-CD1 4.26Å
225	R	95.3	Very high	89.7	Confident	110 Å²	110	34.2 Å²	34.2	42%	0.415	16%	0.161	S	C	.	.	H	α-helix	trans	-59.8	-41.1	176.7	177.9	179.8	44.6	65.6	2.3	111	F221 D222 F223 D228 E229	F221-R225 WeakPolarHBondContact O-CB 3.47Å; F221-R225 PolarHBondContact O-N 3.29Å; D222-R225 VanDerWaalsContact CG-NH2 3.27Å; D222-R225 IonicContact OD1-CZ 3.39Å; D222-R225 IonicContact OD1-NE 3.85Å; D222-R225 IonicContact OD1-NH2 2.68Å; D222-R225 PolarHBondContact OD1-NH2 3.15Å; F223-R225 VanDerWaalsContact C-N 3.35Å; F223-R225 PolarHBondContact O-N 3.31Å; R225-D228 WeakPolarHBondContact O-CB 3.27Å; R225-D228 PolarHBondContact O-N 3.49Å; R225-E229 WeakPolarHBondContact CG-OE1 3.43Å; R225-E229 IonicContact NH1-OE1 3.23Å; R225-E229 PolarHBondContact NH1-OE1 3.33Å; R225-E229 WeakPolarHBondContact O-CG 3.45Å; R225-E229 PolarHBondContact O-N 3.39Å
226	K	95.9	Very high	90.1	Very high	16 Å²	16	42 Å²	42	7%	0.07	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-40.1	177	-173.6	55.8	168.4	163	0	112.9	Y182 Q184 L203 D222 F223 I224 D228 E229 E230	Y182-K226 HydrophobicContact CE2-CB 4.34Å; Y182-K226 HydrophobicContact CE2-CG 3.72Å; Y182-K226 WeakPolarHBondContact OH-CG 3.21Å; Q184-K226 VanDerWaalsContact OE1-NZ 3.13Å; L203-K226 HydrophobicContact CD2-CG 3.85Å; D222-K226 WeakPolarHBondContact O-CB 3.44Å; D222-K226 PolarHBondContact O-N 3.02Å; F223-K226 WeakPolarHBondContact O-CB 3.38Å; F223-K226 PolarHBondContact O-N 3.31Å; F223-K226 VanDerWaalsContact O-N 3.13Å; I224-K226 VanDerWaalsContact C-N 3.27Å; I224-K226 PolarHBondContact O-N 2.98Å; K226-D228 VanDerWaalsContact C-N 3.31Å; K226-D228 PolarHBondContact O-N 2.99Å; K226-E229 WeakPolarHBondContact CD-OE2 3.38Å; K226-E229 IonicContact NZ-OE2 3.91Å; K226-E229 PolarHBondContact O-N 3Å; K226-E230 HydrophobicContact CD-CG 4.35Å; K226-E230 IonicContact NZ-OE1 3.55Å; K226-E230 PolarHBondContact NZ-OE1 2.73Å; K226-E230 WeakPolarHBondContact O-CG 3.34Å; K226-E230 PolarHBondContact O-N 3.49Å
227	V	96.3	Very high	89.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-42.8	173.5	170.2	0	0	0	0	110.6	V134 V136 L203 F223 I224 E230 L231 F259	V134-V227 HydrophobicContact CG1-CG1 4.41Å; V136-V227 HydrophobicContact CG2-CG1 3.96Å; V136-V227 HydrophobicContact CG2-CG2 3.7Å; L203-V227 HydrophobicContact CD2-CG2 3.95Å; F223-V227 HydrophobicContact CD1-CG2 4.36Å; F223-V227 HydrophobicContact CE1-CG2 3.98Å; F223-V227 HydrophobicContact CE2-CG2 4.42Å; F223-V227 HydrophobicContact CZ-CG2 4.03Å; F223-V227 WeakPolarHBondContact O-CG2 3.09Å; F223-V227 PolarHBondContact O-N 2.9Å; I224-V227 PolarHBondContact O-N 2.67Å; V227-E230 PolarHBondContact O-N 2.94Å; V227-L231 VanDerWaalsContact O-CB 3.31Å; V227-L231 WeakPolarHBondContact O-CB 3.45Å; V227-L231 PolarHBondContact O-N 2.99Å; V227-F259 HydrophobicContact CB-CZ 4.35Å; V227-F259 HydrophobicContact CG1-CZ 4.27Å; V227-F259 HydrophobicContact CG2-CZ 4.03Å
228	D	94.5	Very high	88.9	Confident	28 Å²	28	45.4 Å²	45.4	15%	0.15	21%	0.212	C	C	.	.	H	α-helix	trans	-62.9	-43.3	175.7	-76.7	-22.5	0	0	0	112.6	I224 R225 K226 L231 E232 R263	I224-D228 PolarHBondContact O-N 2.76Å; R225-D228 WeakPolarHBondContact O-CB 3.27Å; R225-D228 PolarHBondContact O-N 3.49Å; K226-D228 VanDerWaalsContact C-N 3.31Å; K226-D228 PolarHBondContact O-N 2.99Å; D228-L231 WeakPolarHBondContact O-CB 3.47Å; D228-L231 PolarHBondContact O-N 2.92Å; D228-E232 PolarHBondContact O-N 2.78Å; D228-R263 VanDerWaalsContact CG-NE 3.25Å; D228-R263 IonicContact OD1-CZ 3.54Å; D228-R263 IonicContact OD1-NE 3.17Å; D228-R263 PolarHBondContact OD1-NE 2.73Å; D228-R263 IonicContact OD1-NH2 2.67Å; D228-R263 PolarHBondContact OD1-NH2 2.97Å; D228-R263 IonicContact OD2-CZ 3.73Å; D228-R263 VanDerWaalsContact OD2-CZ 3.28Å; D228-R263 IonicContact OD2-NE 4Å; D228-R263 PolarHBondContact OD2-NE 3.09Å; D228-R263 IonicContact OD2-NH2 3.9Å; D228-R263 PolarHBondContact OD2-NH2 2.83Å
229	E	93.9	Very high	87.8	Confident	72 Å²	72	50.4 Å²	50.4	34%	0.336	24%	0.237	S	C	.	.	H	α-helix	trans	-60.3	-45.3	175.6	-72.8	167.4	-157.3	0	0	111.8	R225 K226 L231 E232 K233	R225-E229 WeakPolarHBondContact CG-OE1 3.43Å; R225-E229 IonicContact NH1-OE1 3.23Å; R225-E229 PolarHBondContact NH1-OE1 3.33Å; R225-E229 WeakPolarHBondContact O-CG 3.45Å; R225-E229 PolarHBondContact O-N 3.39Å; K226-E229 WeakPolarHBondContact CD-OE2 3.38Å; K226-E229 IonicContact NZ-OE2 3.91Å; K226-E229 PolarHBondContact O-N 3Å; E229-L231 VanDerWaalsContact C-N 3.33Å; E229-E232 PolarHBondContact O-N 2.88Å; E229-K233 WeakPolarHBondContact O-CG 3.29Å; E229-K233 PolarHBondContact O-N 3.01Å
230	E	92.9	Very high	86.6	Confident	9 Å²	9	53 Å²	53	4%	0.042	25%	0.253	C	S	.	.	H	α-helix	trans	-72.8	-28	178.9	-66.5	-50.2	131.7	0	0	112.6	R201 L203 K226 V227 K233 G234	R201-E230 HydrophobicContact CB-CB 4.4Å; R201-E230 HydrophobicContact CG-CB 4.34Å; R201-E230 IonicContact CZ-OE2 2.81Å; R201-E230 PolarHBondContact NH1-O 2.95Å; R201-E230 IonicContact NH1-OE2 2.86Å; R201-E230 PolarHBondContact NH1-OE2 2.95Å; L203-E230 HydrophobicContact CD1-CB 4.3Å; L203-E230 HydrophobicContact CD1-CG 4.3Å; L203-E230 HydrophobicContact CD2-CG 4.32Å; K226-E230 HydrophobicContact CD-CG 4.35Å; K226-E230 IonicContact NZ-OE1 3.55Å; K226-E230 PolarHBondContact NZ-OE1 2.73Å; K226-E230 WeakPolarHBondContact O-CG 3.34Å; K226-E230 PolarHBondContact O-N 3.49Å; V227-E230 PolarHBondContact O-N 2.94Å; E230-K233 IonicContact OE1-NZ 2.93Å; E230-K233 PolarHBondContact OE1-NZ 2.88Å; E230-K233 IonicContact OE2-NZ 2.72Å; E230-G234 PolarHBondContact O-N 2.82Å
231	L	90.1	Very high	85.3	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-48.3	169.9	-173.4	64.1	0	0	0	110.3	P106 V134 V227 D228 E229 G234 K235 F243 V245	P106-L231 HydrophobicContact CB-CD2 3.73Å; P106-L231 HydrophobicContact CG-CD2 3.5Å; P106-L231 VanDerWaalsContact CG-CD2 3.5Å; V134-L231 HydrophobicContact CG2-CB 4.44Å; V134-L231 HydrophobicContact CG2-CD1 4.1Å; V227-L231 VanDerWaalsContact O-CB 3.31Å; V227-L231 WeakPolarHBondContact O-CB 3.45Å; V227-L231 PolarHBondContact O-N 2.99Å; D228-L231 WeakPolarHBondContact O-CB 3.47Å; D228-L231 PolarHBondContact O-N 2.92Å; E229-L231 VanDerWaalsContact C-N 3.33Å; L231-G234 WeakPolarHBondContact O-CA 3.39Å; L231-G234 PolarHBondContact O-N 3.32Å; L231-G234 VanDerWaalsContact O-N 3.11Å; L231-K235 WeakPolarHBondContact O-CG 3.37Å; L231-K235 PolarHBondContact O-N 3.27Å; L231-K235 VanDerWaalsContact O-N 3.1Å; L231-F243 HydrophobicContact CD1-CD2 3.76Å; L231-F243 HydrophobicContact CD1-CE2 3.45Å; L231-F243 VanDerWaalsContact CD1-CE2 3.45Å; L231-F243 HydrophobicContact CG-CE2 4.07Å; L231-V245 HydrophobicContact CD1-CG2 3.68Å; L231-V245 HydrophobicContact CD2-CG2 4.34Å
232	E	89	Confident	84.2	Confident	87 Å²	87	62.5 Å²	62.5	41%	0.407	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-43.9	-178	-171.6	53.5	-144.6	0	0	112.5	D228 E229 G234 K235	D228-E232 PolarHBondContact O-N 2.78Å; E229-E232 PolarHBondContact O-N 2.88Å; E232-G234 VanDerWaalsContact C-N 3.31Å; E232-G234 PolarHBondContact O-N 2.84Å; E232-K235 WeakPolarHBondContact O-CB 3.38Å; E232-K235 PolarHBondContact O-N 3.01Å; E232-K235 WeakPolarHBondContact OE2-CD 3.45Å; E232-K235 WeakPolarHBondContact OE2-CE 3.41Å; E232-K235 IonicContact OE2-NZ 2.78Å; E232-K235 PolarHBondContact OE2-NZ 2.77Å
233	K	87.2	Confident	83.5	Confident	96 Å²	96	59 Å²	59	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-61.1	-40.7	171.9	-71	173.4	-171.8	173.3	0	111.8	E229 E230 K235 K236 D237	E229-K233 WeakPolarHBondContact O-CG 3.29Å; E229-K233 PolarHBondContact O-N 3.01Å; E230-K233 IonicContact OE1-NZ 2.93Å; E230-K233 PolarHBondContact OE1-NZ 2.88Å; E230-K233 IonicContact OE2-NZ 2.72Å; K233-K235 PolarHBondContact O-N 2.99Å; K233-K236 PolarHBondContact O-N 2.86Å; K233-K236 VanDerWaalsContact O-N 3.09Å; K233-D237 PolarHBondContact O-N 3.03Å
234	G	80	Confident	83.3	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-29.2	178	0	0	0	0	0	113.8	E230 L231 E232	E230-G234 PolarHBondContact O-N 2.82Å; L231-G234 WeakPolarHBondContact O-CA 3.39Å; L231-G234 PolarHBondContact O-N 3.32Å; L231-G234 VanDerWaalsContact O-N 3.11Å; E232-G234 VanDerWaalsContact C-N 3.31Å; E232-G234 PolarHBondContact O-N 2.84Å
235	K	79.8	Confident	83.3	Confident	52 Å²	52	60.3 Å²	60.3	23%	0.226	28%	0.284	C	S	.	.	H	α-helix	trans	-67.2	-37.5	173.6	-41.6	-166	178.9	147.7	0	112.2	L231 E232 K233 D237 S238 F243	L231-K235 WeakPolarHBondContact O-CG 3.37Å; L231-K235 PolarHBondContact O-N 3.27Å; L231-K235 VanDerWaalsContact O-N 3.1Å; E232-K235 WeakPolarHBondContact O-CB 3.38Å; E232-K235 PolarHBondContact O-N 3.01Å; E232-K235 WeakPolarHBondContact OE2-CD 3.45Å; E232-K235 WeakPolarHBondContact OE2-CE 3.41Å; E232-K235 IonicContact OE2-NZ 2.78Å; E232-K235 PolarHBondContact OE2-NZ 2.77Å; K233-K235 PolarHBondContact O-N 2.99Å; K235-D237 VanDerWaalsContact C-N 3.33Å; K235-S238 VanDerWaalsContact O-O 3.12Å; K235-F243 HydrophobicContact CB-CE1 3.98Å; K235-F243 HydrophobicContact CB-CZ 4.12Å; K235-F243 HydrophobicContact CD-CE1 4.1Å; K235-F243 HydrophobicContact CD-CE2 4.39Å; K235-F243 HydrophobicContact CD-CZ 3.49Å; K235-F243 VanDerWaalsContact CD-CZ 3.49Å; K235-F243 VanDerWaalsContact CE-CZ 3.49Å; K235-F243 HydrophobicContact CG-CE1 3.66Å; K235-F243 HydrophobicContact CG-CE2 4.05Å; K235-F243 HydrophobicContact CG-CZ 3.28Å
236	K	77.8	Confident	83.3	Confident	164 Å²	164	55 Å²	55	71%	0.713	26%	0.264	S	S	*	.	H	α-helix	trans	-70.7	-31	-178.7	-63.4	-179.1	-178.9	-178.3	0	112.1	K233 S238	K233-K236 PolarHBondContact O-N 2.86Å; K233-K236 VanDerWaalsContact O-N 3.09Å; K236-S238 VanDerWaalsContact C-N 3.32Å; K236-S238 PolarHBondContact O-N 2.93Å
237	D	72.9	Confident	83.3	Confident	89 Å²	89	54.3 Å²	54.3	48%	0.476	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-10.9	-178.5	-61.9	-18.6	0	0	0	113.8	R201 K233 K235	R201-D237 IonicContact CZ-OD2 3.75Å; R201-D237 IonicContact NE-OD2 3.22Å; R201-D237 IonicContact NH2-OD2 2.73Å; R201-D237 PolarHBondContact NH2-OD2 3.25Å; K233-D237 PolarHBondContact O-N 3.03Å; K235-D237 VanDerWaalsContact C-N 3.33Å
238	S	67.1	Low	83	Confident	21 Å²	21	54.3 Å²	54.3	15%	0.147	26%	0.261	C	S	.	.			trans	-146.8	124.1	-169	-161.6	0	0	0	0	112.6	K133 K235 K236 V240	K133-S238 WeakPolarHBondContact CE-OG 3.41Å; K133-S238 VanDerWaalsContact NZ-CB 3.28Å; K133-S238 PolarHBondContact NZ-OG 2.79Å; K235-S238 VanDerWaalsContact O-O 3.12Å; K236-S238 VanDerWaalsContact C-N 3.32Å; K236-S238 PolarHBondContact O-N 2.93Å; S238-V240 PolarHBondContact O-N 2.82Å
239	M	66.9	Low	82.7	Confident	197 Å²	197	53.3 Å²	53.3	97%	0.97	26%	0.256	S	S	*	.			trans	-78.8	5.5	172.8	-57.7	-166.1	83.9	0	0	113.5
240	V	67.4	Low	82.1	Confident	63 Å²	63	51.1 Å²	51.1	38%	0.382	25%	0.25	S	C	.	.			trans	-92.9	117.3	-177.6	-175.1	0	0	0	0	110	Y131 S238	Y131-V240 HydrophobicContact CD1-CB 4.5Å; Y131-V240 HydrophobicContact CD1-CG1 3.67Å; Y131-V240 HydrophobicContact CE1-CG1 3.74Å; Y131-V240 HydrophobicContact CG-CG1 4.26Å; S238-V240 PolarHBondContact O-N 2.82Å
241	Y	64.6	Low	81.3	Confident	154 Å²	154	55.6 Å²	55.6	60%	0.604	27%	0.272	S	S	*	.	S	Bend	trans	-120.6	148.2	174.1	-108.5	-91.3	0	0	0	110.2	F243	Y241-F243 HydrophobicContact CD1-CE1 4.32Å; Y241-F243 HydrophobicContact CD2-CD1 4.3Å; Y241-F243 AromaticContact CD2-CE1 3.98Å; Y241-F243 HydrophobicContact CD2-CE1 3.98Å; Y241-F243 HydrophobicContact CE1-CD1 4.41Å; Y241-F243 AromaticContact CE1-CE1 3.74Å; Y241-F243 HydrophobicContact CE1-CE1 3.74Å; Y241-F243 HydrophobicContact CE1-CZ 4.02Å; Y241-F243 HydrophobicContact CE2-CD1 4.15Å; Y241-F243 AromaticContact CE2-CE1 3.38Å; Y241-F243 HydrophobicContact CE2-CE1 3.38Å; Y241-F243 HydrophobicContact CE2-CZ 4.21Å; Y241-F243 HydrophobicContact CG-CE1 4.41Å; Y241-F243 AromaticContact CZ-CE1 3.24Å; Y241-F243 AromaticContact CZ-CZ 3.63Å; Y241-F243 WeakPolarHBondContact OH-CE1 3.43Å; Y241-F243 WeakPolarHBondContact OH-CZ 3.43Å
242	P	70.1	Confident	80.1	Confident	71 Å²	71	55.5 Å²	55.5	46%	0.461	27%	0.272	S	S	.	.			cis	-80.7	139.3	-6.8	32.5	-33.1	0	0	0	112.1
243	F	80.8	Confident	79.3	Confident	2 Å²	2	53 Å²	53	1%	0.009	26%	0.262	C	S	.	.			trans	-95.3	160.1	163.9	56.2	-97.5	0	0	0	110.7	C107 K133 L231 K235 Y241	C107-F243 HydrophobicContact CB-CE2 4.07Å; K133-F243 HydrophobicContact CB-CB 4.25Å; K133-F243 HydrophobicContact CG-CB 3.43Å; K133-F243 VanDerWaalsContact CG-CB 3.43Å; K133-F243 HydrophobicContact CG-CD2 4.46Å; K133-F243 HydrophobicContact CG-CG 3.99Å; L231-F243 HydrophobicContact CD1-CD2 3.76Å; L231-F243 HydrophobicContact CD1-CE2 3.45Å; L231-F243 VanDerWaalsContact CD1-CE2 3.45Å; L231-F243 HydrophobicContact CG-CE2 4.07Å; K235-F243 HydrophobicContact CB-CE1 3.98Å; K235-F243 HydrophobicContact CB-CZ 4.12Å; K235-F243 HydrophobicContact CD-CE1 4.1Å; K235-F243 HydrophobicContact CD-CE2 4.39Å; K235-F243 HydrophobicContact CD-CZ 3.49Å; K235-F243 VanDerWaalsContact CD-CZ 3.49Å; K235-F243 VanDerWaalsContact CE-CZ 3.49Å; K235-F243 HydrophobicContact CG-CE1 3.66Å; K235-F243 HydrophobicContact CG-CE2 4.05Å; K235-F243 HydrophobicContact CG-CZ 3.28Å; Y241-F243 HydrophobicContact CD1-CE1 4.32Å; Y241-F243 HydrophobicContact CD2-CD1 4.3Å; Y241-F243 AromaticContact CD2-CE1 3.98Å; Y241-F243 HydrophobicContact CD2-CE1 3.98Å; Y241-F243 HydrophobicContact CE1-CD1 4.41Å; Y241-F243 AromaticContact CE1-CE1 3.74Å; Y241-F243 HydrophobicContact CE1-CE1 3.74Å; Y241-F243 HydrophobicContact CE1-CZ 4.02Å; Y241-F243 HydrophobicContact CE2-CD1 4.15Å; Y241-F243 AromaticContact CE2-CE1 3.38Å; Y241-F243 HydrophobicContact CE2-CE1 3.38Å; Y241-F243 HydrophobicContact CE2-CZ 4.21Å; Y241-F243 HydrophobicContact CG-CE1 4.41Å; Y241-F243 AromaticContact CZ-CE1 3.24Å; Y241-F243 AromaticContact CZ-CZ 3.63Å; Y241-F243 WeakPolarHBondContact OH-CE1 3.43Å; Y241-F243 WeakPolarHBondContact OH-CZ 3.43Å
244	R	91.7	Very high	79	Confident	32 Å²	32	49 Å²	49	12%	0.121	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.1	-170	-56.4	-174.8	172.2	81.3	-2.3	112.4	E108 I110 E130 Y131 V132 K133	E108-R244 HydrophobicContact CB-CG 4.23Å; E108-R244 WeakPolarHBondContact O-CA 3.46Å; E108-R244 WeakPolarHBondContact OE1-CD 3.29Å; E108-R244 IonicContact OE1-CZ 2.83Å; E108-R244 IonicContact OE1-NE 3.5Å; E108-R244 PolarHBondContact OE1-NE 3.24Å; E108-R244 IonicContact OE1-NH2 3.43Å; I110-R244 HydrophobicContact CD1-CB 4.24Å; I110-R244 VanDerWaalsContact CD1-CD 3.47Å; I110-R244 HydrophobicContact CD1-CG 4.49Å; E130-R244 WeakPolarHBondContact O-CD 3.09Å; E130-R244 WeakPolarHBondContact O-CG 3.38Å; E130-R244 PolarHBondContact O-NH1 3.32Å; E130-R244 IonicContact OE2-CZ 3.28Å; E130-R244 IonicContact OE2-NE 3.01Å; E130-R244 IonicContact OE2-NH1 3.01Å; Y131-R244 PolarHBondContact O-N 2.82Å; V132-R244 WeakPolarHBondContact CA-O 3.44Å; V132-R244 HydrophobicContact CG2-CB 4.37Å; K133-R244 PolarHBondContact N-O 3.27Å
245	V	95.3	Very high	79.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	120.4	168	178.2	0	0	0	0	107.7	C107 E108 F109 I110 V134 V136 L231 V247	C107-V245 VanDerWaalsContact SG-CG2 3.54Å; E108-V245 PolarHBondContact O-N 2.89Å; F109-V245 CarbonylContact C-O 3.45Å; F109-V245 VanDerWaalsContact CA-O 3.29Å; F109-V245 WeakPolarHBondContact CA-O 3.45Å; F109-V245 HydrophobicContact CD1-CB 3.98Å; F109-V245 HydrophobicContact CD1-CG1 3.92Å; F109-V245 HydrophobicContact CD2-CB 4.18Å; F109-V245 HydrophobicContact CE1-CB 3.91Å; F109-V245 HydrophobicContact CE1-CG1 3.66Å; F109-V245 HydrophobicContact CE1-CG2 4.37Å; F109-V245 HydrophobicContact CE2-CB 4.08Å; F109-V245 HydrophobicContact CE2-CG2 4.03Å; F109-V245 HydrophobicContact CG-CB 4.12Å; F109-V245 HydrophobicContact CZ-CB 3.95Å; F109-V245 HydrophobicContact CZ-CG1 4.07Å; F109-V245 HydrophobicContact CZ-CG2 3.95Å; I110-V245 PolarHBondContact N-O 2.77Å; V134-V245 HydrophobicContact CB-CG1 4.39Å; V134-V245 HydrophobicContact CB-CG2 4.18Å; V134-V245 CarbonylContact O-C 3.57Å; V134-V245 WeakPolarHBondContact O-CA 3.36Å; V136-V245 HydrophobicContact CG2-CG1 4Å; L231-V245 HydrophobicContact CD1-CG2 3.68Å; L231-V245 HydrophobicContact CD2-CG2 4.34Å; V245-V247 HydrophobicContact CG1-CG2 3.93Å
246	L	95.6	Very high	79.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	122.5	172.2	-174.9	153.5	0	0	0	108.5	I110 T112 F123 T126 V127 V132 V134 I135 V136 H248	I110-L246 HydrophobicContact CG2-CD1 4.48Å; I110-L246 HydrophobicContact CG2-CG 4.45Å; I110-L246 CarbonylContact O-C 3.59Å; I110-L246 WeakPolarHBondContact O-CA 3.42Å; T112-L246 HydrophobicContact CG2-CD1 4.12Å; T112-L246 HydrophobicContact CG2-CD2 3.73Å; T112-L246 HydrophobicContact CG2-CG 4.06Å; F123-L246 HydrophobicContact CE2-CD1 4.36Å; F123-L246 HydrophobicContact CE2-CD2 3.7Å; F123-L246 HydrophobicContact CZ-CD2 3.91Å; T126-L246 HydrophobicContact CG2-CD1 4.24Å; V127-L246 HydrophobicContact CG2-CD1 4.14Å; V132-L246 HydrophobicContact CB-CB 4.45Å; V132-L246 HydrophobicContact CG1-CB 3.66Å; V132-L246 HydrophobicContact CG2-CB 3.89Å; V132-L246 HydrophobicContact CG2-CD1 4.24Å; V134-L246 PolarHBondContact O-N 2.97Å; I135-L246 CarbonylContact C-O 3.59Å; I135-L246 WeakPolarHBondContact CA-O 3.42Å; I135-L246 HydrophobicContact CG2-CD2 4.28Å; V136-L246 PolarHBondContact N-O 3.37Å; L246-H248 HydrophobicContact CD2-CB 4.43Å
247	V	94.6	Very high	80.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.1	177.1	-170.2	0	0	0	0	108.6	F109 I110 L111 T112 V136 I138 V245 F259 V260	F109-V247 HydrophobicContact CD1-CG2 3.69Å; F109-V247 HydrophobicContact CE1-CG2 4.13Å; I110-V247 PolarHBondContact O-N 3.49Å; L111-V247 WeakPolarHBondContact CA-O 3.48Å; L111-V247 HydrophobicContact CD1-CB 4.27Å; T112-V247 PolarHBondContact N-O 3.37Å; T112-V247 VanDerWaalsContact N-O 3.08Å; V136-V247 HydrophobicContact CB-CB 4.41Å; V136-V247 HydrophobicContact CB-CG1 4.17Å; V136-V247 HydrophobicContact CB-CG2 4.12Å; V136-V247 HydrophobicContact CG1-CG1 4.06Å; V136-V247 CarbonylContact O-C 3.54Å; V136-V247 VanDerWaalsContact O-CA 3.31Å; V136-V247 WeakPolarHBondContact O-CA 3.27Å; I138-V247 HydrophobicContact CD1-CG1 4.28Å; V245-V247 HydrophobicContact CG1-CG2 3.93Å; V247-F259 HydrophobicContact CG1-CD1 3.89Å; V247-F259 HydrophobicContact CG1-CE1 4.41Å; V247-F259 HydrophobicContact CG2-CD1 4.16Å; V247-F259 HydrophobicContact CG2-CE1 4.05Å; V247-V260 HydrophobicContact CB-CG2 4.23Å; V247-V260 HydrophobicContact CG1-CG2 4.35Å; V247-V260 HydrophobicContact CG2-CG2 3.78Å
248	H	91.7	Very high	81.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	159.3	170.8	70.4	94.2	0	0	0	112.3	T112 F123 V136 Y137 I138 Y153 L246 S256	T112-H248 HydrophobicContact CG2-CB 3.97Å; T112-H248 VanDerWaalsContact O-CA 3.27Å; T112-H248 WeakPolarHBondContact O-CA 3.35Å; T112-H248 WeakPolarHBondContact O-CB 3.45Å; F123-H248 AromaticContact CE2-CD2 3.91Å; F123-H248 AromaticContact CZ-NE2 3.98Å; V136-H248 PolarHBondContact O-N 2.58Å; Y137-H248 WeakPolarHBondContact CA-O 3.22Å; Y137-H248 AromaticContact CD2-CE1 3.1Å; Y137-H248 WeakPolarHBondContact CD2-CE1 3.41Å; Y137-H248 AromaticContact CD2-ND1 3.27Å; Y137-H248 VanDerWaalsContact CD2-ND1 3.27Å; Y137-H248 WeakPolarHBondContact CD2-ND1 3.43Å; Y137-H248 AromaticContact CD2-NE2 3.93Å; Y137-H248 WeakPolarHBondContact CD2-O 3.47Å; Y137-H248 AromaticContact CE2-CE1 3.85Å; Y137-H248 AromaticContact CE2-ND1 3.84Å; Y137-H248 AromaticContact CG-CE1 3.52Å; I138-H248 PolarHBondContact N-O 2.53Å; Y153-H248 AromaticContact CE1-CE1 3.52Å; Y153-H248 AromaticContact CE1-NE2 3.79Å; Y153-H248 AromaticContact CZ-CE1 3.66Å; Y153-H248 AromaticContact CZ-NE2 3.43Å; Y153-H248 PolarHBondContact OH-CE1 3.16Å; Y153-H248 PolarHBondContact OH-NE2 3.32Å; L246-H248 HydrophobicContact CD2-CB 4.43Å; H248-S256 WeakPolarHBondContact CA-OG 3.45Å
249	D	87.1	Confident	82.4	Confident	8 Å²	8	34.6 Å²	34.6	4%	0.043	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	-174.5	166.8	64.8	49.5	0	0	0	107.4	A114 I138 M251 G252 T253 R255 S256	A114-D249 WeakPolarHBondContact CB-O 3.25Å; A114-D249 PolarHBondContact N-O 3.09Å; I138-D249 HydrophobicContact CB-CB 4.3Å; I138-D249 WeakPolarHBondContact O-CB 3.36Å; D249-M251 PolarHBondContact O-N 3.02Å; D249-M251 VanDerWaalsContact O-N 3.12Å; D249-M251 PolarHBondContact OD1-N 2.99Å; D249-G252 PolarHBondContact O-N 2.85Å; D249-G252 WeakPolarHBondContact OD1-CA 3.48Å; D249-G252 PolarHBondContact OD1-N 3.27Å; D249-T253 PolarHBondContact OD1-N 3.24Å; D249-R255 HydrophobicContact CB-CB 4.26Å; D249-R255 PolarHBondContact OD2-N 2.77Å; D249-R255 VanDerWaalsContact OD2-N 3.11Å; D249-S256 WeakPolarHBondContact CB-OG 3.32Å; D249-S256 VanDerWaalsContact CG-OG 3.24Å; D249-S256 PolarHBondContact N-OG 3.12Å; D249-S256 WeakPolarHBondContact OD2-CB 3.4Å; D249-S256 PolarHBondContact OD2-N 3.25Å; D249-S256 PolarHBondContact OD2-OG 3.2Å
250	A	80.8	Confident	83.7	Confident	25 Å²	25	25.2 Å²	25.2	21%	0.207	13%	0.13	C	C	.	.	S	Bend	trans	-51	-39.6	-177.5	0	0	0	0	0	114.2	A143	A143-A250 HydrophobicContact CB-CB 4.15Å
251	M	76	Confident	85	Confident	104 Å²	104	22.2 Å²	22.2	51%	0.512	11%	0.112	S	C	.	.	S	Bend	trans	-111.4	-9.4	-178.1	-62.8	-58.9	-70.5	0	0	113	D249 T253	D249-M251 PolarHBondContact O-N 3.02Å; D249-M251 VanDerWaalsContact O-N 3.12Å; D249-M251 PolarHBondContact OD1-N 2.99Å; M251-T253 HydrophobicContact CB-CG2 4.3Å; M251-T253 PolarHBondContact O-N 3.08Å
252	G	66.3	Low	86.5	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.083	C	C	.	.	S	Bend	trans	74.4	1.3	-172.3	0	0	0	0	0	114.1	T112 D249 Y290	T112-G252 WeakPolarHBondContact O-CA 3.36Å; D249-G252 PolarHBondContact O-N 2.85Å; D249-G252 WeakPolarHBondContact OD1-CA 3.48Å; D249-G252 PolarHBondContact OD1-N 3.27Å; G252-Y290 WeakPolarHBondContact O-CD2 3.35Å
253	T	71.6	Confident	87.7	Confident	34 Å²	34	12.4 Å²	12.4	21%	0.209	6%	0.064	C	C	.	.	S	Bend	trans	-97.1	-45.6	-156.9	50.9	0	0	0	0	116.1	D249 M251 A257 Y290	D249-T253 PolarHBondContact OD1-N 3.24Å; M251-T253 HydrophobicContact CB-CG2 4.3Å; M251-T253 PolarHBondContact O-N 3.08Å; T253-A257 VanDerWaalsContact O-CB 3.29Å; T253-A257 WeakPolarHBondContact O-CB 3.46Å; T253-Y290 HydrophobicContact CG2-CD1 3.41Å; T253-Y290 VanDerWaalsContact CG2-CD1 3.41Å; T253-Y290 HydrophobicContact CG2-CE1 4.12Å; T253-Y290 HydrophobicContact CG2-CG 4.23Å; T253-Y290 WeakPolarHBondContact O-CB 3.45Å
254	S	80	Confident	88.5	Confident	12 Å²	12	12.3 Å²	12.3	8%	0.084	6%	0.064	C	C	.	.	S	Bend	trans	-121	-46.2	-155.8	-53.6	0	0	0	0	112.1	T258 W291	S254-T258 WeakPolarHBondContact O-CB 3.21Å; S254-T258 PolarHBondContact O-N 2.78Å; S254-T258 PolarHBondContact O-OG1 2.82Å; S254-W291 PolarHBondContact OG-O 3.08Å; S254-W291 VanDerWaalsContact OG-O 3.05Å
255	R	85.8	Confident	88.8	Confident	25 Å²	25	10.8 Å²	10.8	9%	0.094	6%	0.058	C	C	.	.	H	α-helix	trans	-78.1	-41.2	179.1	-53.2	-179.2	-178.2	-174.9	2.2	110.8	I138 E139 N140 W208 D249 T258 F259	I138-R255 HydrophobicContact CB-CB 4.32Å; I138-R255 HydrophobicContact CD1-CB 4.32Å; I138-R255 WeakPolarHBondContact CD1-O 3.44Å; I138-R255 HydrophobicContact CG2-CB 3.83Å; E139-R255 PolarHBondContact O-NH1 2.92Å; E139-R255 VanDerWaalsContact O-NH1 3.13Å; N140-R255 VanDerWaalsContact CG-CZ 3.46Å; N140-R255 PolarHBondContact ND2-NH2 2.74Å; N140-R255 PolarHBondContact OD1-NH1 3.41Å; N140-R255 VanDerWaalsContact OD1-NH1 3.11Å; N140-R255 PolarHBondContact OD1-NH2 3.16Å; W208-R255 VanDerWaalsContact CD1-CZ 3.49Å; W208-R255 HydrophobicContact CD2-CB 4.31Å; W208-R255 HydrophobicContact CD2-CG 4.22Å; W208-R255 HydrophobicContact CH2-CB 3.93Å; W208-R255 HydrophobicContact CH2-CG 4.38Å; W208-R255 HydrophobicContact CZ2-CB 3.68Å; W208-R255 HydrophobicContact CZ2-CG 3.62Å; W208-R255 HydrophobicContact CZ3-CB 4.34Å; D249-R255 HydrophobicContact CB-CB 4.26Å; D249-R255 PolarHBondContact OD2-N 2.77Å; D249-R255 VanDerWaalsContact OD2-N 3.11Å; R255-T258 PolarHBondContact O-N 2.72Å; R255-F259 WeakPolarHBondContact O-CB 3.44Å; R255-F259 PolarHBondContact O-N 3.31Å
256	S	89.4	Confident	88.8	Confident	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-58.5	-48.3	173.8	-55.2	0	0	0	0	110.9	H248 D249 T258 F259 V260	H248-S256 WeakPolarHBondContact CA-OG 3.45Å; D249-S256 WeakPolarHBondContact CB-OG 3.32Å; D249-S256 VanDerWaalsContact CG-OG 3.24Å; D249-S256 PolarHBondContact N-OG 3.12Å; D249-S256 WeakPolarHBondContact OD2-CB 3.4Å; D249-S256 PolarHBondContact OD2-N 3.25Å; D249-S256 PolarHBondContact OD2-OG 3.2Å; S256-T258 PolarHBondContact O-N 3.28Å; S256-F259 PolarHBondContact O-N 3.39Å; S256-V260 WeakPolarHBondContact O-CG2 3.33Å; S256-V260 PolarHBondContact O-N 2.99Å
257	A	90.5	Very high	88.9	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-58.4	-49	174.6	0	0	0	0	0	111.6	L111 T253 F259 V260 I261 L284 I292	L111-A257 HydrophobicContact CD2-CB 4.36Å; T253-A257 VanDerWaalsContact O-CB 3.29Å; T253-A257 WeakPolarHBondContact O-CB 3.46Å; A257-F259 VanDerWaalsContact C-N 3.34Å; A257-F259 PolarHBondContact O-N 3.12Å; A257-V260 PolarHBondContact O-N 3.04Å; A257-I261 WeakPolarHBondContact O-CB 3.31Å; A257-I261 WeakPolarHBondContact O-CD1 3.41Å; A257-I261 VanDerWaalsContact O-CG1 3.29Å; A257-I261 WeakPolarHBondContact O-CG1 3.33Å; A257-I261 PolarHBondContact O-N 3.41Å; A257-L284 HydrophobicContact CB-CD2 3.7Å; A257-I292 HydrophobicContact CB-CG1 4.28Å
258	T	90.8	Very high	89	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-57.8	-44.6	178.5	-61.2	0	0	0	0	112.1	W208 S254 R255 S256 L262 Y300 I301	W208-T258 HydrophobicContact CH2-CG2 3.89Å; S254-T258 WeakPolarHBondContact O-CB 3.21Å; S254-T258 PolarHBondContact O-N 2.78Å; S254-T258 PolarHBondContact O-OG1 2.82Å; R255-T258 PolarHBondContact O-N 2.72Å; S256-T258 PolarHBondContact O-N 3.28Å; T258-L262 HydrophobicContact CG2-CD1 4.05Å; T258-L262 WeakPolarHBondContact O-CB 3.37Å; T258-L262 WeakPolarHBondContact O-CG 3.21Å; T258-L262 PolarHBondContact O-N 3.46Å; T258-Y300 HydrophobicContact CG2-CD1 4.02Å; T258-Y300 HydrophobicContact CG2-CE1 4.49Å; T258-I301 HydrophobicContact CG2-CD1 4.44Å; T258-I301 HydrophobicContact CG2-CG1 3.92Å
259	F	93.4	Very high	89.2	Confident	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-61.2	-47.9	176.4	169.4	-94.4	0	0	0	112.1	F109 V136 I138 L220 F223 I224 V227 V247 R255 S256 A257 L262 R263	F109-F259 HydrophobicContact CE1-CE1 4.18Å; V136-F259 HydrophobicContact CG1-CD1 4.43Å; V136-F259 HydrophobicContact CG1-CE1 4.04Å; V136-F259 HydrophobicContact CG1-CZ 4.1Å; V136-F259 HydrophobicContact CG2-CE1 4.33Å; V136-F259 HydrophobicContact CG2-CZ 4.32Å; I138-F259 HydrophobicContact CD1-CB 3.39Å; I138-F259 HydrophobicContact CD1-CD2 4.43Å; I138-F259 HydrophobicContact CD1-CG 3.89Å; L220-F259 HydrophobicContact CD1-CD2 4.19Å; F223-F259 HydrophobicContact CD1-CD2 4.3Å; F223-F259 AromaticContact CD1-CE2 3.74Å; F223-F259 HydrophobicContact CD1-CE2 3.74Å; F223-F259 HydrophobicContact CE1-CD2 4.44Å; F223-F259 AromaticContact CE1-CE2 3.86Å; F223-F259 HydrophobicContact CE1-CE2 3.86Å; F223-F259 HydrophobicContact CE1-CZ 4.38Å; I224-F259 HydrophobicContact CD1-CD2 4.49Å; I224-F259 HydrophobicContact CD1-CE2 4.48Å; I224-F259 HydrophobicContact CG1-CD2 3.95Å; I224-F259 HydrophobicContact CG1-CE2 3.5Å; I224-F259 HydrophobicContact CG1-CZ 4.32Å; V227-F259 HydrophobicContact CB-CZ 4.35Å; V227-F259 HydrophobicContact CG1-CZ 4.27Å; V227-F259 HydrophobicContact CG2-CZ 4.03Å; V247-F259 HydrophobicContact CG1-CD1 3.89Å; V247-F259 HydrophobicContact CG1-CE1 4.41Å; V247-F259 HydrophobicContact CG2-CD1 4.16Å; V247-F259 HydrophobicContact CG2-CE1 4.05Å; R255-F259 WeakPolarHBondContact O-CB 3.44Å; R255-F259 PolarHBondContact O-N 3.31Å; S256-F259 PolarHBondContact O-N 3.39Å; A257-F259 VanDerWaalsContact C-N 3.34Å; A257-F259 PolarHBondContact O-N 3.12Å; F259-L262 PolarHBondContact O-N 3.15Å; F259-R263 WeakPolarHBondContact O-CB 3.45Å; F259-R263 PolarHBondContact O-N 3.17Å
260	V	94.3	Very high	89.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.6	-38.3	-178.2	176.6	0	0	0	0	111.8	I100 L102 L105 F109 L111 V247 S256 A257 R263 S264	I100-V260 HydrophobicContact CG2-CG1 3.91Å; L102-V260 HydrophobicContact CD1-CG1 4.14Å; L105-V260 HydrophobicContact CD1-CG1 3.96Å; L105-V260 HydrophobicContact CD2-CG1 4.08Å; F109-V260 HydrophobicContact CB-CG1 4.38Å; F109-V260 HydrophobicContact CD1-CG1 4.17Å; F109-V260 HydrophobicContact CD1-CG2 3.66Å; F109-V260 HydrophobicContact CE1-CG2 4.28Å; F109-V260 HydrophobicContact CG-CG1 4.41Å; L111-V260 HydrophobicContact CD1-CB 4.35Å; L111-V260 HydrophobicContact CD1-CG1 4.48Å; L111-V260 HydrophobicContact CD1-CG2 3.66Å; V247-V260 HydrophobicContact CB-CG2 4.23Å; V247-V260 HydrophobicContact CG1-CG2 4.35Å; V247-V260 HydrophobicContact CG2-CG2 3.78Å; S256-V260 WeakPolarHBondContact O-CG2 3.33Å; S256-V260 PolarHBondContact O-N 2.99Å; A257-V260 PolarHBondContact O-N 3.04Å; V260-R263 PolarHBondContact O-N 3.43Å; V260-S264 WeakPolarHBondContact O-CB 3.31Å; V260-S264 PolarHBondContact O-N 3.47Å
261	I	94.3	Very high	90	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-49.5	173.1	-73	159.2	0	0	0	110.7	L102 A257 R263 S264 L265 T280 V281 L284 I292 I301	L102-I261 HydrophobicContact CD1-CG1 4.17Å; A257-I261 WeakPolarHBondContact O-CB 3.31Å; A257-I261 WeakPolarHBondContact O-CD1 3.41Å; A257-I261 VanDerWaalsContact O-CG1 3.29Å; A257-I261 WeakPolarHBondContact O-CG1 3.33Å; A257-I261 PolarHBondContact O-N 3.41Å; I261-R263 VanDerWaalsContact C-N 3.3Å; I261-R263 PolarHBondContact O-N 3.46Å; I261-S264 WeakPolarHBondContact O-CB 3.41Å; I261-S264 PolarHBondContact O-N 2.84Å; I261-L265 HydrophobicContact CG2-CD1 3.44Å; I261-L265 VanDerWaalsContact CG2-CD1 3.44Å; I261-L265 HydrophobicContact CG2-CG 4.3Å; I261-L265 WeakPolarHBondContact O-CB 3.38Å; I261-L265 WeakPolarHBondContact O-CD1 3.1Å; I261-L265 VanDerWaalsContact O-CG 3.27Å; I261-L265 WeakPolarHBondContact O-CG 3.28Å; I261-L265 PolarHBondContact O-N 2.69Å; I261-T280 HydrophobicContact CG1-CG2 4.41Å; I261-T280 HydrophobicContact CG2-CG2 4.13Å; I261-V281 HydrophobicContact CD1-CG2 3.85Å; I261-V281 HydrophobicContact CG2-CG2 4.43Å; I261-L284 HydrophobicContact CD1-CD2 3.6Å; I261-L284 HydrophobicContact CG1-CD2 3.96Å; I261-I292 HydrophobicContact CD1-CD1 3.54Å; I261-I292 HydrophobicContact CD1-CG1 4.46Å; I261-I301 HydrophobicContact CB-CD1 4.49Å; I261-I301 HydrophobicContact CD1-CD1 4.35Å; I261-I301 HydrophobicContact CG2-CD1 3.98Å; I261-I301 HydrophobicContact CG2-CG1 4.5Å; I261-I301 HydrophobicContact CG2-CG2 4.11Å
262	L	95.7	Very high	90.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60	-42.3	177.5	-78.7	171.1	0	0	0	111.7	L220 I224 T258 F259 S264 L265 I266 Y300 I301 A304 L305	L220-L262 HydrophobicContact CD2-CD1 3.59Å; I224-L262 HydrophobicContact CD1-CB 4.17Å; T258-L262 HydrophobicContact CG2-CD1 4.05Å; T258-L262 WeakPolarHBondContact O-CB 3.37Å; T258-L262 WeakPolarHBondContact O-CG 3.21Å; T258-L262 PolarHBondContact O-N 3.46Å; F259-L262 PolarHBondContact O-N 3.15Å; L262-S264 PolarHBondContact O-N 3.31Å; L262-L265 PolarHBondContact O-N 3.06Å; L262-I266 WeakPolarHBondContact O-CB 3.27Å; L262-I266 WeakPolarHBondContact O-CD1 3.4Å; L262-I266 VanDerWaalsContact O-CG1 3.23Å; L262-I266 WeakPolarHBondContact O-CG1 3.49Å; L262-I266 PolarHBondContact O-N 2.72Å; L262-Y300 HydrophobicContact CD1-CE1 4.11Å; L262-I301 HydrophobicContact CD2-CG2 4.09Å; L262-I301 HydrophobicContact CG-CG1 4.46Å; L262-A304 HydrophobicContact CD1-CB 4.19Å; L262-A304 HydrophobicContact CD2-CB 3.81Å; L262-L305 HydrophobicContact CD2-CD2 4.11Å; L262-L305 HydrophobicContact CD2-CG 4.09Å
263	R	96.7	Very high	92.1	Very high	19 Å²	19	18.7 Å²	18.7	7%	0.072	10%	0.096	C	C	.	.	H	α-helix	trans	-62	-44.8	177.3	177.5	59.5	-170.5	78	-3.8	112.3	L105 F109 D228 F259 V260 I261 G267	L105-R263 HydrophobicContact CD2-CB 4.36Å; L105-R263 HydrophobicContact CD2-CG 4.06Å; F109-R263 HydrophobicContact CZ-CG 4.35Å; D228-R263 VanDerWaalsContact CG-NE 3.25Å; D228-R263 IonicContact OD1-CZ 3.54Å; D228-R263 IonicContact OD1-NE 3.17Å; D228-R263 PolarHBondContact OD1-NE 2.73Å; D228-R263 IonicContact OD1-NH2 2.67Å; D228-R263 PolarHBondContact OD1-NH2 2.97Å; D228-R263 IonicContact OD2-CZ 3.73Å; D228-R263 VanDerWaalsContact OD2-CZ 3.28Å; D228-R263 IonicContact OD2-NE 4Å; D228-R263 PolarHBondContact OD2-NE 3.09Å; D228-R263 IonicContact OD2-NH2 3.9Å; D228-R263 PolarHBondContact OD2-NH2 2.83Å; F259-R263 WeakPolarHBondContact O-CB 3.45Å; F259-R263 PolarHBondContact O-N 3.17Å; V260-R263 PolarHBondContact O-N 3.43Å; I261-R263 VanDerWaalsContact C-N 3.3Å; I261-R263 PolarHBondContact O-N 3.46Å; R263-G267 PolarHBondContact O-N 3.04Å; R263-G267 VanDerWaalsContact O-N 3.14Å
264	S	97.1	Very high	93.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-57.7	-53.6	175.5	161.4	0	0	0	0	110.7	P103 V260 I261 L262 I266 G267 V268	P103-S264 PolarHBondContact O-OG 3.48Å; V260-S264 WeakPolarHBondContact O-CB 3.31Å; V260-S264 PolarHBondContact O-N 3.47Å; I261-S264 WeakPolarHBondContact O-CB 3.41Å; I261-S264 PolarHBondContact O-N 2.84Å; L262-S264 PolarHBondContact O-N 3.31Å; S264-I266 VanDerWaalsContact C-N 3.34Å; S264-I266 PolarHBondContact O-N 2.7Å; S264-G267 WeakPolarHBondContact O-CA 3.43Å; S264-G267 PolarHBondContact O-N 3.1Å; S264-V268 PolarHBondContact O-N 3.33Å
265	L	97.6	Very high	93.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-62.6	-38.4	-178	-68.2	162.6	0	0	0	112.6	I261 L262 G267 V268 I269 P275 I277 T280 I301 L305	I261-L265 HydrophobicContact CG2-CD1 3.44Å; I261-L265 VanDerWaalsContact CG2-CD1 3.44Å; I261-L265 HydrophobicContact CG2-CG 4.3Å; I261-L265 WeakPolarHBondContact O-CB 3.38Å; I261-L265 WeakPolarHBondContact O-CD1 3.1Å; I261-L265 VanDerWaalsContact O-CG 3.27Å; I261-L265 WeakPolarHBondContact O-CG 3.28Å; I261-L265 PolarHBondContact O-N 2.69Å; L262-L265 PolarHBondContact O-N 3.06Å; L265-G267 VanDerWaalsContact C-N 3.27Å; L265-G267 PolarHBondContact O-N 3.11Å; L265-V268 WeakPolarHBondContact O-CB 3.33Å; L265-V268 PolarHBondContact O-N 3.36Å; L265-I269 WeakPolarHBondContact O-CB 3.33Å; L265-I269 VanDerWaalsContact O-CG1 3.23Å; L265-I269 WeakPolarHBondContact O-CG1 3.49Å; L265-I269 PolarHBondContact O-N 2.78Å; L265-P275 HydrophobicContact CB-CB 4.45Å; L265-P275 HydrophobicContact CD2-CB 3.89Å; L265-I277 HydrophobicContact CD1-CG1 3.86Å; L265-I277 HydrophobicContact CD2-CG1 4.39Å; L265-T280 HydrophobicContact CD2-CG2 4.34Å; L265-T280 WeakPolarHBondContact CD2-OG1 3.35Å; L265-T280 HydrophobicContact CG-CG2 4.27Å; L265-I301 HydrophobicContact CD1-CG2 3.84Å; L265-L305 HydrophobicContact CB-CD1 3.96Å; L265-L305 HydrophobicContact CB-CD2 3.94Å; L265-L305 HydrophobicContact CD1-CD1 3.65Å; L265-L305 HydrophobicContact CD1-CG 4.49Å; L265-L305 HydrophobicContact CD2-CD1 4.49Å; L265-L305 HydrophobicContact CG-CD1 4.25Å
266	I	96.6	Very high	94.3	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-60.3	-39.4	171.7	-73	165.3	0	0	0	110.9	F221 I224 L262 S264 I269 K270 L305 Y308	F221-I266 HydrophobicContact CD1-CD1 3.89Å; F221-I266 HydrophobicContact CE1-CD1 4Å; I224-I266 HydrophobicContact CD1-CD1 3.89Å; I224-I266 HydrophobicContact CG2-CD1 4.26Å; L262-I266 WeakPolarHBondContact O-CB 3.27Å; L262-I266 WeakPolarHBondContact O-CD1 3.4Å; L262-I266 VanDerWaalsContact O-CG1 3.23Å; L262-I266 WeakPolarHBondContact O-CG1 3.49Å; L262-I266 PolarHBondContact O-N 2.72Å; S264-I266 VanDerWaalsContact C-N 3.34Å; S264-I266 PolarHBondContact O-N 2.7Å; I266-I269 PolarHBondContact O-N 2.74Å; I266-K270 HydrophobicContact CG2-CD 4.12Å; I266-K270 HydrophobicContact CG2-CG 4.45Å; I266-K270 WeakPolarHBondContact O-CB 3.46Å; I266-K270 VanDerWaalsContact O-CG 3.27Å; I266-K270 WeakPolarHBondContact O-CG 3.31Å; I266-K270 PolarHBondContact O-N 3.41Å; I266-L305 HydrophobicContact CG1-CD2 4.39Å; I266-Y308 HydrophobicContact CD1-CD2 4.01Å; I266-Y308 HydrophobicContact CD1-CE2 4.03Å; I266-Y308 HydrophobicContact CG1-CD1 4.49Å; I266-Y308 HydrophobicContact CG1-CD2 4.03Å; I266-Y308 HydrophobicContact CG1-CE1 4.46Å; I266-Y308 HydrophobicContact CG1-CE2 3.97Å; I266-Y308 HydrophobicContact CG1-CG 4.3Å; I266-Y308 HydrophobicContact CG2-CE1 4.41Å; I266-Y308 HydrophobicContact CG2-CE2 3.94Å
267	G	96.4	Very high	94.5	Very high	7 Å²	7	22.7 Å²	22.7	7%	0.072	12%	0.119	C	C	.	.	H	α-helix	trans	-63	-41.8	174.7	0	0	0	0	0	113	R263 S264 L265 K270	R263-G267 PolarHBondContact O-N 3.04Å; R263-G267 VanDerWaalsContact O-N 3.14Å; S264-G267 WeakPolarHBondContact O-CA 3.43Å; S264-G267 PolarHBondContact O-N 3.1Å; L265-G267 VanDerWaalsContact C-N 3.27Å; L265-G267 PolarHBondContact O-N 3.11Å; G267-K270 PolarHBondContact O-N 3.48Å
268	V	96.8	Very high	94.7	Very high	10 Å²	10	23.8 Å²	23.8	6%	0.061	13%	0.127	C	C	.	.	H	α-helix	trans	-61.8	-47.6	175	174.5	0	0	0	0	111	P103 K104 S264 L265 K270 I271 Q273 T274	P103-V268 HydrophobicContact CB-CG2 4.05Å; K104-V268 HydrophobicContact CB-CG2 4.1Å; K104-V268 HydrophobicContact CG-CG2 3.79Å; S264-V268 PolarHBondContact O-N 3.33Å; L265-V268 WeakPolarHBondContact O-CB 3.33Å; L265-V268 PolarHBondContact O-N 3.36Å; V268-K270 PolarHBondContact O-N 3.4Å; V268-I271 WeakPolarHBondContact O-CG1 3.01Å; V268-I271 PolarHBondContact O-N 2.86Å; V268-Q273 HydrophobicContact CG1-CB 3.47Å; V268-Q273 VanDerWaalsContact CG1-CB 3.47Å; V268-Q273 PolarHBondContact O-N 2.79Å; V268-Q273 VanDerWaalsContact O-N 3.12Å; V268-T274 WeakPolarHBondContact CG1-O 3.27Å
269	I	95.2	Very high	94.8	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-59	-46	177.9	-74.2	174.3	0	0	0	111.2	A17 A21 L265 I266 I271 G272 P275 L305 Y308 I309 W313	A17-I269 WeakPolarHBondContact CB-O 3.21Å; A21-I269 HydrophobicContact CB-CG2 4.09Å; L265-I269 WeakPolarHBondContact O-CB 3.33Å; L265-I269 VanDerWaalsContact O-CG1 3.23Å; L265-I269 WeakPolarHBondContact O-CG1 3.49Å; L265-I269 PolarHBondContact O-N 2.78Å; I266-I269 PolarHBondContact O-N 2.74Å; I269-I271 PolarHBondContact O-N 2.81Å; I269-I271 VanDerWaalsContact O-N 3.12Å; I269-G272 PolarHBondContact O-N 2.95Å; I269-P275 HydrophobicContact CD1-CB 3.86Å; I269-P275 HydrophobicContact CD1-CG 3.81Å; I269-P275 HydrophobicContact CG1-CB 3.72Å; I269-P275 HydrophobicContact CG1-CG 3.7Å; I269-L305 HydrophobicContact CD1-CD2 3.78Å; I269-Y308 HydrophobicContact CD1-CD1 4.49Å; I269-Y308 HydrophobicContact CG2-CD1 4.36Å; I269-Y308 HydrophobicContact CG2-CE1 3.94Å; I269-I309 HydrophobicContact CD1-CG1 4.44Å; I269-W313 HydrophobicContact CG2-CH2 3.21Å; I269-W313 HydrophobicContact CG2-CZ2 4.23Å; I269-W313 HydrophobicContact CG2-CZ3 3.75Å
270	K	92.9	Very high	94.9	Very high	109 Å²	109	28.8 Å²	28.8	47%	0.474	15%	0.15	S	C	.	.	H	α-helix	trans	-60.6	-21.6	-178.2	-80	177	176.6	-177.1	0	114.3	I266 G267 V268 Y308	I266-K270 HydrophobicContact CG2-CD 4.12Å; I266-K270 HydrophobicContact CG2-CG 4.45Å; I266-K270 WeakPolarHBondContact O-CB 3.46Å; I266-K270 VanDerWaalsContact O-CG 3.27Å; I266-K270 WeakPolarHBondContact O-CG 3.31Å; I266-K270 PolarHBondContact O-N 3.41Å; G267-K270 PolarHBondContact O-N 3.48Å; V268-K270 PolarHBondContact O-N 3.4Å; K270-Y308 VanDerWaalsContact CE-OH 3.29Å; K270-Y308 WeakPolarHBondContact CE-OH 3.47Å
271	I	92.3	Very high	94.8	Very high	62 Å²	62	28.9 Å²	28.9	32%	0.318	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	14.3	-178.9	65	152.3	0	0	0	113.7	K104 V268 I269 Q273	K104-I271 HydrophobicContact CD-CD1 3.6Å; K104-I271 HydrophobicContact CD-CG1 4.4Å; K104-I271 HydrophobicContact CG-CD1 4.06Å; V268-I271 WeakPolarHBondContact O-CG1 3.01Å; V268-I271 PolarHBondContact O-N 2.86Å; I269-I271 PolarHBondContact O-N 2.81Å; I269-I271 VanDerWaalsContact O-N 3.12Å; I271-Q273 HydrophobicContact CD1-CB 4.42Å; I271-Q273 VanDerWaalsContact CD1-CD 3.44Å; I271-Q273 HydrophobicContact CD1-CG 3.79Å; I271-Q273 HydrophobicContact CG1-CB 4.3Å; I271-Q273 HydrophobicContact CG1-CG 4.07Å
272	G	92.2	Very high	94.6	Very high	18 Å²	18	30.1 Å²	30.1	19%	0.186	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	0.9	179.6	0	0	0	0	0	115.8	S20 I269	S20-G272 WeakPolarHBondContact CB-O 3.46Å; S20-G272 PolarHBondContact OG-O 3.31Å; I269-G272 PolarHBondContact O-N 2.95Å
273	Q	94	Very high	94.3	Very high	94 Å²	94	32.6 Å²	32.6	44%	0.439	17%	0.172	S	C	.	.			trans	-95.8	150.2	-175.1	-69.2	-175.2	-17.3	0	0	112.7	V268 I271	V268-Q273 HydrophobicContact CG1-CB 3.47Å; V268-Q273 VanDerWaalsContact CG1-CB 3.47Å; V268-Q273 PolarHBondContact O-N 2.79Å; V268-Q273 VanDerWaalsContact O-N 3.12Å; I271-Q273 HydrophobicContact CD1-CB 4.42Å; I271-Q273 VanDerWaalsContact CD1-CD 3.44Å; I271-Q273 HydrophobicContact CD1-CG 3.79Å; I271-Q273 HydrophobicContact CG1-CB 4.3Å; I271-Q273 HydrophobicContact CG1-CG 4.07Å
274	T	94.2	Very high	93.9	Very high	68 Å²	68	31.9 Å²	31.9	42%	0.417	17%	0.17	S	C	.	.			trans	-67.9	125.8	177.2	-57	0	0	0	0	110.6	W24 V268 L276	W24-T274 HydrophobicContact CB-CG2 4.18Å; W24-T274 HydrophobicContact CG-CG2 4.16Å; V268-T274 WeakPolarHBondContact CG1-O 3.27Å; T274-L276 HydrophobicContact CG2-CD2 3.97Å; T274-L276 PolarHBondContact O-N 2.81Å
275	P	95.1	Very high	93.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.			trans	-72.8	96.2	176.8	28.2	-32.9	0	0	0	111.2	W24 L265 I269 I277 L305	W24-P275 HydrophobicContact CB-CG 4.36Å; W24-P275 HydrophobicContact CD2-CG 3.55Å; W24-P275 HydrophobicContact CE3-CG 3.88Å; W24-P275 HydrophobicContact CG-CG 3.74Å; W24-P275 HydrophobicContact CZ2-CG 4.43Å; W24-P275 HydrophobicContact CZ3-CG 4.45Å; W24-P275 PolarHBondContact NE1-O 2.78Å; W24-P275 VanDerWaalsContact NE1-O 3.1Å; L265-P275 HydrophobicContact CB-CB 4.45Å; L265-P275 HydrophobicContact CD2-CB 3.89Å; I269-P275 HydrophobicContact CD1-CB 3.86Å; I269-P275 HydrophobicContact CD1-CG 3.81Å; I269-P275 HydrophobicContact CG1-CB 3.72Å; I269-P275 HydrophobicContact CG1-CG 3.7Å; P275-I277 PolarHBondContact O-N 3.07Å; P275-I277 VanDerWaalsContact O-N 3.16Å; P275-L305 HydrophobicContact CB-CD1 4.08Å
276	L	94.3	Very high	92.6	Very high	85 Å²	85	38.9 Å²	38.9	45%	0.445	20%	0.203	S	C	.	.			trans	-85	83.4	178.9	-67.5	-175.6	0	0	0	111	T274 P278 Q279 T280	T274-L276 HydrophobicContact CG2-CD2 3.97Å; T274-L276 PolarHBondContact O-N 2.81Å; L276-P278 VanDerWaalsContact C-CD 3.49Å; L276-Q279 HydrophobicContact CB-CB 4.14Å; L276-Q279 HydrophobicContact CB-CG 4.39Å; L276-Q279 HydrophobicContact CD1-CG 4.43Å; L276-T280 WeakPolarHBondContact O-CB 3.31Å; L276-T280 PolarHBondContact O-N 3.07Å; L276-T280 PolarHBondContact O-OG1 3.06Å
277	I	95.2	Very high	91.9	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-53	-51.5	179.5	-62.7	169.3	0	0	0	112.2	W24 L265 P275 Q279 T280 V281 Y298 I301 Y302 L305	W24-I277 HydrophobicContact CH2-CD1 3.97Å; W24-I277 HydrophobicContact CZ2-CD1 3.62Å; W24-I277 HydrophobicContact CZ2-CG1 4.27Å; L265-I277 HydrophobicContact CD1-CG1 3.86Å; L265-I277 HydrophobicContact CD2-CG1 4.39Å; P275-I277 PolarHBondContact O-N 3.07Å; P275-I277 VanDerWaalsContact O-N 3.16Å; I277-Q279 PolarHBondContact O-N 3.14Å; I277-T280 PolarHBondContact O-N 2.8Å; I277-T280 VanDerWaalsContact O-N 3.15Å; I277-V281 HydrophobicContact CG2-CG2 4.25Å; I277-V281 WeakPolarHBondContact O-CG2 3.38Å; I277-V281 PolarHBondContact O-N 2.81Å; I277-Y298 HydrophobicContact CG2-CE2 3.98Å; I277-I301 HydrophobicContact CD1-CG2 4.01Å; I277-I301 HydrophobicContact CG1-CG2 4.09Å; I277-I301 HydrophobicContact CG2-CG2 4Å; I277-Y302 HydrophobicContact CB-CE2 4.18Å; I277-Y302 HydrophobicContact CD1-CD1 3.53Å; I277-Y302 HydrophobicContact CD1-CD2 3.68Å; I277-Y302 HydrophobicContact CD1-CE1 3.56Å; I277-Y302 HydrophobicContact CD1-CE2 3.71Å; I277-Y302 HydrophobicContact CD1-CG 3.59Å; I277-Y302 HydrophobicContact CG2-CD2 4.37Å; I277-Y302 HydrophobicContact CG2-CE2 3.83Å; I277-L305 HydrophobicContact CD1-CD1 3.72Å; I277-L305 HydrophobicContact CG1-CD1 3.74Å
278	P	93.7	Very high	90.7	Very high	24 Å²	24	46.3 Å²	46.3	16%	0.156	24%	0.236	C	C	.	.	H	α-helix	trans	-64.2	-42.4	-171.6	-20	33.2	0	0	0	112	E42 L276 V281 S282	E42-P278 HydrophobicContact CG-CB 4.11Å; E42-P278 HydrophobicContact CG-CG 4.03Å; E42-P278 WeakPolarHBondContact OE1-CG 3.2Å; E42-P278 WeakPolarHBondContact OE2-CG 3.2Å; L276-P278 VanDerWaalsContact C-CD 3.49Å; P278-V281 PolarHBondContact O-N 2.87Å; P278-S282 WeakPolarHBondContact O-CB 3.07Å; P278-S282 PolarHBondContact O-N 2.89Å
279	Q	93.5	Very high	88.9	Confident	98 Å²	98	45.8 Å²	45.8	46%	0.458	23%	0.233	S	C	.	.	H	α-helix	trans	-65.3	-42.3	176.8	-68.3	77.2	1.8	0	0	110.8	L276 I277 V281 S282 I283	L276-Q279 HydrophobicContact CB-CB 4.14Å; L276-Q279 HydrophobicContact CB-CG 4.39Å; L276-Q279 HydrophobicContact CD1-CG 4.43Å; I277-Q279 PolarHBondContact O-N 3.14Å; Q279-V281 VanDerWaalsContact C-N 3.32Å; Q279-V281 PolarHBondContact O-N 2.82Å; Q279-S282 PolarHBondContact O-N 2.75Å; Q279-I283 VanDerWaalsContact O-CG1 3.28Å; Q279-I283 WeakPolarHBondContact O-CG1 3.49Å; Q279-I283 PolarHBondContact O-N 2.78Å
280	T	94.3	Very high	87.4	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.037	24%	0.237	C	C	.	.	H	α-helix	trans	-62.3	-41.1	177.2	-55.7	0	0	0	0	111.2	L102 I261 L265 L276 I277 L284	L102-T280 HydrophobicContact CD1-CG2 3.96Å; L102-T280 HydrophobicContact CD2-CG2 3.97Å; L102-T280 WeakPolarHBondContact CD2-O 3.42Å; L102-T280 HydrophobicContact CG-CG2 4.46Å; I261-T280 HydrophobicContact CG1-CG2 4.41Å; I261-T280 HydrophobicContact CG2-CG2 4.13Å; L265-T280 HydrophobicContact CD2-CG2 4.34Å; L265-T280 WeakPolarHBondContact CD2-OG1 3.35Å; L265-T280 HydrophobicContact CG-CG2 4.27Å; L276-T280 WeakPolarHBondContact O-CB 3.31Å; L276-T280 PolarHBondContact O-N 3.07Å; L276-T280 PolarHBondContact O-OG1 3.06Å; I277-T280 PolarHBondContact O-N 2.8Å; I277-T280 VanDerWaalsContact O-N 3.15Å; T280-L284 PolarHBondContact O-N 2.9Å
281	V	91.8	Very high	86	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-69.5	-41.7	175.1	178.6	0	0	0	0	111.3	L46 I261 I277 P278 Q279 I283 L284 L285 I292 Y298	L46-V281 HydrophobicContact CD1-CB 4.19Å; L46-V281 HydrophobicContact CD1-CG1 4.08Å; I261-V281 HydrophobicContact CD1-CG2 3.85Å; I261-V281 HydrophobicContact CG2-CG2 4.43Å; I277-V281 HydrophobicContact CG2-CG2 4.25Å; I277-V281 WeakPolarHBondContact O-CG2 3.38Å; I277-V281 PolarHBondContact O-N 2.81Å; P278-V281 PolarHBondContact O-N 2.87Å; Q279-V281 VanDerWaalsContact C-N 3.32Å; Q279-V281 PolarHBondContact O-N 2.82Å; V281-I283 PolarHBondContact O-N 3.14Å; V281-L284 WeakPolarHBondContact O-CB 3.32Å; V281-L284 PolarHBondContact O-N 3.31Å; V281-L284 VanDerWaalsContact O-N 3.12Å; V281-L285 HydrophobicContact CG1-CD1 3.91Å; V281-L285 HydrophobicContact CG1-CG 4.11Å; V281-L285 VanDerWaalsContact O-CG 3.31Å; V281-L285 WeakPolarHBondContact O-CG 3.41Å; V281-L285 PolarHBondContact O-N 3.44Å; V281-I292 HydrophobicContact CG1-CD1 4.46Å; V281-I292 HydrophobicContact CG2-CD1 4.38Å; V281-Y298 HydrophobicContact CB-CE2 4.25Å; V281-Y298 HydrophobicContact CG1-CE2 4.34Å; V281-Y298 HydrophobicContact CG2-CD2 4.34Å; V281-Y298 HydrophobicContact CG2-CE2 3.78Å
282	S	90.2	Very high	84.9	Confident	26 Å²	26	42.4 Å²	42.4	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-55.4	-48.5	176	-164.3	0	0	0	0	111.9	P278 Q279 L284 L285 E286	P278-S282 WeakPolarHBondContact O-CB 3.07Å; P278-S282 PolarHBondContact O-N 2.89Å; Q279-S282 PolarHBondContact O-N 2.75Å; S282-L284 VanDerWaalsContact C-N 3.26Å; S282-L284 PolarHBondContact O-N 2.71Å; S282-L285 PolarHBondContact O-N 3.02Å; S282-L285 VanDerWaalsContact O-N 3.08Å; S282-E286 WeakPolarHBondContact O-CB 3.49Å; S282-E286 VanDerWaalsContact O-CG 3.31Å; S282-E286 WeakPolarHBondContact O-CG 3.42Å; S282-E286 PolarHBondContact O-N 3.05Å; S282-E286 PolarHBondContact OG-OE1 3.24Å
283	I	90.1	Very high	84	Confident	52 Å²	52	46 Å²	46	27%	0.267	23%	0.225	S	C	.	.	H	α-helix	trans	-57.7	-41.4	178.1	-65.5	163.4	0	0	0	110.9	N101 L102 P103 Q279 V281 Q287	N101-I283 WeakPolarHBondContact O-CG2 3.5Å; L102-I283 HydrophobicContact CD2-CB 3.85Å; L102-I283 HydrophobicContact CD2-CG2 3.7Å; P103-I283 HydrophobicContact CG-CD1 4.49Å; Q279-I283 VanDerWaalsContact O-CG1 3.28Å; Q279-I283 WeakPolarHBondContact O-CG1 3.49Å; Q279-I283 PolarHBondContact O-N 2.78Å; V281-I283 PolarHBondContact O-N 3.14Å; I283-Q287 VanDerWaalsContact O-CG 3.29Å; I283-Q287 WeakPolarHBondContact O-CG 3.27Å; I283-Q287 PolarHBondContact O-N 3.49Å; I283-Q287 VanDerWaalsContact O-N 3.14Å
284	L	87.8	Confident	83.4	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-39.6	177.9	-168.7	70.6	0	0	0	112.1	I100 L102 A257 I261 T280 V281 S282 Q287 A289	I100-L284 HydrophobicContact CD1-CD1 3.57Å; I100-L284 HydrophobicContact CG1-CD1 4.21Å; I100-L284 HydrophobicContact CG2-CD1 3.77Å; L102-L284 HydrophobicContact CD2-CB 4.47Å; A257-L284 HydrophobicContact CB-CD2 3.7Å; I261-L284 HydrophobicContact CD1-CD2 3.6Å; I261-L284 HydrophobicContact CG1-CD2 3.96Å; T280-L284 PolarHBondContact O-N 2.9Å; V281-L284 WeakPolarHBondContact O-CB 3.32Å; V281-L284 PolarHBondContact O-N 3.31Å; V281-L284 VanDerWaalsContact O-N 3.12Å; S282-L284 VanDerWaalsContact C-N 3.26Å; S282-L284 PolarHBondContact O-N 2.71Å; L284-Q287 PolarHBondContact O-N 3.32Å; L284-A289 HydrophobicContact CD1-CB 3.95Å; L284-A289 HydrophobicContact CG-CB 4.47Å; L284-A289 PolarHBondContact O-N 3.32Å
285	L	84.6	Confident	82.9	Confident	15 Å²	15	42.7 Å²	42.7	8%	0.079	21%	0.207	C	C	.	.	H	α-helix	trans	-67.4	-38.2	177.4	-64.9	172.7	0	0	0	111.9	L46 Q50 V281 S282 Q287 Q288	L46-L285 HydrophobicContact CB-CD1 4.12Å; Q50-L285 VanDerWaalsContact NE2-CD2 3.3Å; V281-L285 HydrophobicContact CG1-CD1 3.91Å; V281-L285 HydrophobicContact CG1-CG 4.11Å; V281-L285 VanDerWaalsContact O-CG 3.31Å; V281-L285 WeakPolarHBondContact O-CG 3.41Å; V281-L285 PolarHBondContact O-N 3.44Å; S282-L285 PolarHBondContact O-N 3.02Å; S282-L285 VanDerWaalsContact O-N 3.08Å; L285-Q287 VanDerWaalsContact C-N 3.33Å; L285-Q288 WeakPolarHBondContact O-CA 3.44Å; L285-Q288 PolarHBondContact O-N 2.97Å
286	E	84.2	Confident	82.5	Confident	133 Å²	133	45.8 Å²	45.8	62%	0.621	22%	0.219	S	C	*	.	H	α-helix	trans	-65.2	-34.6	176	-74.8	162.7	-146.5	0	0	112.2	S282 Q288	S282-E286 WeakPolarHBondContact O-CB 3.49Å; S282-E286 VanDerWaalsContact O-CG 3.31Å; S282-E286 WeakPolarHBondContact O-CG 3.42Å; S282-E286 PolarHBondContact O-N 3.05Å; S282-E286 PolarHBondContact OG-OE1 3.24Å; E286-Q288 PolarHBondContact O-N 3.07Å
287	Q	82.1	Confident	82.2	Confident	56 Å²	56	41.8 Å²	41.8	26%	0.262	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	1.1	172.4	-70.8	168.6	13.8	0	0	112.7	N101 I283 L284 L285 A289	N101-Q287 VanDerWaalsContact N-OE1 3.11Å; N101-Q287 PolarHBondContact O-NE2 2.93Å; I283-Q287 VanDerWaalsContact O-CG 3.29Å; I283-Q287 WeakPolarHBondContact O-CG 3.27Å; I283-Q287 PolarHBondContact O-N 3.49Å; I283-Q287 VanDerWaalsContact O-N 3.14Å; L284-Q287 PolarHBondContact O-N 3.32Å; L285-Q287 VanDerWaalsContact C-N 3.33Å; Q287-A289 HydrophobicContact CB-CB 3.62Å; Q287-A289 PolarHBondContact O-N 3.46Å
288	Q	71.2	Confident	81.9	Confident	108 Å²	108	41.8 Å²	41.8	51%	0.505	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	24.5	-170.7	-55.4	-173.1	27.9	0	0	111.9	L285 E286 Y290	L285-Q288 WeakPolarHBondContact O-CA 3.44Å; L285-Q288 PolarHBondContact O-N 2.97Å; E286-Q288 PolarHBondContact O-N 3.07Å; Q288-Y290 PolarHBondContact O-N 2.92Å
289	A	58.7	Low	81.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.193	C	C	.	.			trans	-91.7	39.8	-160.3	0	0	0	0	0	112	N98 I100 L284 Q287	N98-A289 HydrophobicContact CB-CB 3.72Å; N98-A289 WeakPolarHBondContact ND2-CA 3.49Å; I100-A289 HydrophobicContact CD1-CB 3.39Å; L284-A289 HydrophobicContact CD1-CB 3.95Å; L284-A289 HydrophobicContact CG-CB 4.47Å; L284-A289 PolarHBondContact O-N 3.32Å; Q287-A289 HydrophobicContact CB-CB 3.62Å; Q287-A289 PolarHBondContact O-N 3.46Å
290	Y	63.8	Low	81.7	Confident	24 Å²	24	36.5 Å²	36.5	9%	0.094	17%	0.171	C	C	.	.			trans	87.2	157.1	-176.2	-52.6	-76.4	0	0	0	117.8	H96 N98 L111 T112 G252 T253 Q288	H96-Y290 PolarHBondContact O-OH 2.97Å; N98-Y290 HydrophobicContact CB-CD2 4.25Å; N98-Y290 HydrophobicContact CB-CE2 3.95Å; N98-Y290 WeakPolarHBondContact ND2-CD2 3.37Å; N98-Y290 WeakPolarHBondContact ND2-CE2 3.48Å; L111-Y290 HydrophobicContact CB-CD2 3.6Å; L111-Y290 HydrophobicContact CB-CE2 3.57Å; L111-Y290 HydrophobicContact CD2-CD2 4.03Å; L111-Y290 HydrophobicContact CG-CD2 4.44Å; T112-Y290 WeakPolarHBondContact CA-OH 3.15Å; G252-Y290 WeakPolarHBondContact O-CD2 3.35Å; T253-Y290 HydrophobicContact CG2-CD1 3.41Å; T253-Y290 VanDerWaalsContact CG2-CD1 3.41Å; T253-Y290 HydrophobicContact CG2-CE1 4.12Å; T253-Y290 HydrophobicContact CG2-CG 4.23Å; T253-Y290 WeakPolarHBondContact O-CB 3.45Å; Q288-Y290 PolarHBondContact O-N 2.92Å
291	W	63.1	Low	81.6	Confident	74 Å²	74	36.2 Å²	36.2	28%	0.28	17%	0.169	S	C	.	.			trans	-115.7	125.4	-160.1	-56.7	-12.7	0	0	0	111.2	K54 S254 H293	K54-W291 VanDerWaalsContact CE-CZ2 3.42Å; S254-W291 PolarHBondContact OG-O 3.08Å; S254-W291 VanDerWaalsContact OG-O 3.05Å; W291-H293 VanDerWaalsContact C-N 3.32Å; W291-H293 WeakPolarHBondContact CB-NE2 3.32Å; W291-H293 AromaticContact CD2-CE1 3.77Å; W291-H293 AromaticContact CD2-NE2 3.86Å; W291-H293 AromaticContact CE3-CE1 3.05Å; W291-H293 AromaticContact CE3-NE2 3.2Å; W291-H293 AromaticContact CG-NE2 4Å; W291-H293 AromaticContact CZ3-CE1 3.9Å; W291-H293 PolarHBondContact O-N 3.44Å; W291-H293 VanDerWaalsContact O-N 3.14Å
292	I	69.7	Low	81.7	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.015	17%	0.171	C	C	.	.			trans	-78.1	91.4	158.8	-59	-179	0	0	0	106.5	F43 Q47 A257 I261 V281 E294 L297 I301	F43-I292 HydrophobicContact CE2-CG2 4.16Å; F43-I292 WeakPolarHBondContact CE2-O 3.34Å; Q47-I292 PolarHBondContact NE2-O 2.88Å; A257-I292 HydrophobicContact CB-CG1 4.28Å; I261-I292 HydrophobicContact CD1-CD1 3.54Å; I261-I292 HydrophobicContact CD1-CG1 4.46Å; V281-I292 HydrophobicContact CG1-CD1 4.46Å; V281-I292 HydrophobicContact CG2-CD1 4.38Å; I292-E294 WeakPolarHBondContact CG2-O 3.35Å; I292-L297 HydrophobicContact CG2-CB 3.85Å; I292-I301 HydrophobicContact CD1-CD1 3.68Å
293	H	72.2	Confident	81.8	Confident	92 Å²	92	37 Å²	37	43%	0.426	17%	0.168	S	C	.	.			trans	-76.3	-30.6	175.6	-73.9	-65	0	0	0	113.6	F43 W291 P295	F43-H293 WeakPolarHBondContact CZ-O 3.29Å; W291-H293 VanDerWaalsContact C-N 3.32Å; W291-H293 WeakPolarHBondContact CB-NE2 3.32Å; W291-H293 AromaticContact CD2-CE1 3.77Å; W291-H293 AromaticContact CD2-NE2 3.86Å; W291-H293 AromaticContact CE3-CE1 3.05Å; W291-H293 AromaticContact CE3-NE2 3.2Å; W291-H293 AromaticContact CG-NE2 4Å; W291-H293 AromaticContact CZ3-CE1 3.9Å; W291-H293 PolarHBondContact O-N 3.44Å; W291-H293 VanDerWaalsContact O-N 3.14Å; H293-P295 WeakPolarHBondContact O-CD 3.42Å
294	E	80.5	Confident	82	Confident	62 Å²	62	34.6 Å²	34.6	29%	0.29	16%	0.156	S	C	.	.			trans	-93.6	116.2	-168.8	-59.2	-169.5	-156.4	0	0	108.4	E212 I292 R296 L297	E212-E294 VanDerWaalsContact OE2-OE2 3.13Å; I292-E294 WeakPolarHBondContact CG2-O 3.35Å; E294-R296 PolarHBondContact O-N 3.42Å; E294-R296 IonicContact OE2-CZ 2.71Å; E294-R296 IonicContact OE2-NE 3.59Å; E294-R296 PolarHBondContact OE2-NE 3.11Å; E294-R296 IonicContact OE2-NH2 2.76Å; E294-R296 PolarHBondContact OE2-NH2 3.34Å; E294-L297 HydrophobicContact CB-CG 4.37Å; E294-L297 PolarHBondContact O-N 3.25Å; E294-L297 VanDerWaalsContact O-N 3.09Å
295	P	85.7	Confident	82.3	Confident	31 Å²	31	34.4 Å²	34.4	20%	0.201	16%	0.155	C	C	.	.	H	α-helix	trans	-53	-29.2	174.2	-21.6	28.7	0	0	0	111.7	F40 F43 H293 L297 Y298 Y299	F40-P295 HydrophobicContact CD2-CB 4.28Å; F40-P295 HydrophobicContact CE2-CB 4.04Å; F40-P295 HydrophobicContact CE2-CG 4.04Å; F43-P295 HydrophobicContact CD1-CB 4.1Å; F43-P295 HydrophobicContact CD1-CG 4.02Å; F43-P295 HydrophobicContact CE1-CB 4.07Å; F43-P295 HydrophobicContact CE1-CG 3.59Å; F43-P295 HydrophobicContact CZ-CB 4.48Å; F43-P295 HydrophobicContact CZ-CG 4.12Å; H293-P295 WeakPolarHBondContact O-CD 3.42Å; P295-L297 PolarHBondContact O-N 3Å; P295-Y298 WeakPolarHBondContact O-CA 3.3Å; P295-Y298 WeakPolarHBondContact O-CB 3.38Å; P295-Y298 PolarHBondContact O-N 2.6Å; P295-Y298 VanDerWaalsContact O-N 3.11Å; P295-Y299 HydrophobicContact CB-CD2 4.43Å; P295-Y299 HydrophobicContact CB-CE2 4.15Å; P295-Y299 WeakPolarHBondContact O-CD2 3.34Å; P295-Y299 PolarHBondContact O-N 3.32Å
296	R	85.6	Confident	82.8	Confident	66 Å²	66	33.7 Å²	33.7	25%	0.249	15%	0.151	C	C	.	.	H	α-helix	trans	-57.3	-45.1	178.5	-63.4	-174.1	-64.7	-154.7	7.4	113.1	E212 E294 Y298 Y299 Y300 S334 T337	E212-R296 IonicContact OE2-NE 3.45Å; E294-R296 PolarHBondContact O-N 3.42Å; E294-R296 IonicContact OE2-CZ 2.71Å; E294-R296 IonicContact OE2-NE 3.59Å; E294-R296 PolarHBondContact OE2-NE 3.11Å; E294-R296 IonicContact OE2-NH2 2.76Å; E294-R296 PolarHBondContact OE2-NH2 3.34Å; R296-Y298 VanDerWaalsContact C-N 3.3Å; R296-Y298 PolarHBondContact O-N 2.95Å; R296-Y299 PolarHBondContact O-N 3.09Å; R296-Y300 WeakPolarHBondContact O-CB 2.92Å; R296-Y300 PolarHBondContact O-N 3.46Å; R296-S334 WeakPolarHBondContact O-CB 3.43Å; R296-T337 WeakPolarHBondContact CD-OG1 3.08Å; R296-T337 WeakPolarHBondContact CD-OXT 3.35Å; R296-T337 WeakPolarHBondContact CG-OG1 3.47Å; R296-T337 PolarHBondContact NH1-OXT 3.5Å
297	L	87	Confident	83.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.2	-35.8	175.9	-69.5	179.9	0	0	0	111.7	W208 E212 M215 I292 E294 P295 Y300 I301	W208-L297 HydrophobicContact CZ2-CD2 3.76Å; E212-L297 HydrophobicContact CB-CD2 4.49Å; E212-L297 HydrophobicContact CG-CD2 4.2Å; E212-L297 VanDerWaalsContact OE1-CD2 3.31Å; E212-L297 WeakPolarHBondContact OE1-CD2 3.18Å; E212-L297 WeakPolarHBondContact OE1-CG 3.29Å; E212-L297 VanDerWaalsContact OE2-CD2 3.29Å; E212-L297 WeakPolarHBondContact OE2-CD2 3.29Å; E212-L297 VanDerWaalsContact OE2-CG 3.23Å; E212-L297 WeakPolarHBondContact OE2-CG 3.03Å; M215-L297 HydrophobicContact CE-CD2 3.84Å; I292-L297 HydrophobicContact CG2-CB 3.85Å; E294-L297 HydrophobicContact CB-CG 4.37Å; E294-L297 PolarHBondContact O-N 3.25Å; E294-L297 VanDerWaalsContact O-N 3.09Å; P295-L297 PolarHBondContact O-N 3Å; L297-Y300 WeakPolarHBondContact O-CB 3.41Å; L297-Y300 PolarHBondContact O-N 2.79Å; L297-I301 WeakPolarHBondContact O-CG1 3.41Å; L297-I301 PolarHBondContact O-N 3.31Å
298	Y	90.4	Very high	83.9	Confident	1 Å²	1	27.7 Å²	27.7	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-63.6	-47.7	175.1	-161.1	-105.4	0	0	0	111.7	I39 E42 F43 L46 I277 V281 P295 R296 Y300 I301 Y302	I39-Y298 HydrophobicContact CG2-CD1 3.72Å; I39-Y298 HydrophobicContact CG2-CE1 3.96Å; E42-Y298 VanDerWaalsContact CD-OH 3.3Å; E42-Y298 HydrophobicContact CG-CE1 4.4Å; E42-Y298 VanDerWaalsContact OE1-CE1 3.26Å; E42-Y298 WeakPolarHBondContact OE1-CE1 3.36Å; E42-Y298 VanDerWaalsContact OE1-CZ 3.28Å; E42-Y298 PolarHBondContact OE1-OH 3.12Å; F43-Y298 HydrophobicContact CB-CD1 3.73Å; F43-Y298 HydrophobicContact CB-CE1 4.07Å; F43-Y298 HydrophobicContact CB-CG 4.2Å; F43-Y298 HydrophobicContact CD2-CD1 4.07Å; F43-Y298 HydrophobicContact CD2-CD2 4Å; F43-Y298 AromaticContact CD2-CG 3.64Å; F43-Y298 HydrophobicContact CD2-CG 3.64Å; F43-Y298 HydrophobicContact CG-CD1 4.33Å; F43-Y298 HydrophobicContact CG-CG 4.33Å; L46-Y298 HydrophobicContact CD1-CE2 3.77Å; L46-Y298 WeakPolarHBondContact CD1-OH 3.37Å; I277-Y298 HydrophobicContact CG2-CE2 3.98Å; V281-Y298 HydrophobicContact CB-CE2 4.25Å; V281-Y298 HydrophobicContact CG1-CE2 4.34Å; V281-Y298 HydrophobicContact CG2-CD2 4.34Å; V281-Y298 HydrophobicContact CG2-CE2 3.78Å; P295-Y298 WeakPolarHBondContact O-CA 3.3Å; P295-Y298 WeakPolarHBondContact O-CB 3.38Å; P295-Y298 PolarHBondContact O-N 2.6Å; P295-Y298 VanDerWaalsContact O-N 3.11Å; R296-Y298 VanDerWaalsContact C-N 3.3Å; R296-Y298 PolarHBondContact O-N 2.95Å; Y298-Y300 VanDerWaalsContact C-N 3.25Å; Y298-Y300 PolarHBondContact O-N 2.85Å; Y298-I301 PolarHBondContact O-N 3.45Å; Y298-Y302 HydrophobicContact CD1-CD2 4.46Å; Y298-Y302 HydrophobicContact CD1-CE2 4.2Å; Y298-Y302 HydrophobicContact CE1-CD2 4.31Å; Y298-Y302 AromaticContact CE1-CE2 3.61Å; Y298-Y302 HydrophobicContact CE1-CE2 3.61Å; Y298-Y302 AromaticContact CZ-CE2 3.96Å; Y298-Y302 PolarHBondContact O-N 3.03Å
299	Y	91	Very high	85	Confident	12 Å²	12	22.6 Å²	22.6	5%	0.047	10%	0.098	C	C	.	.	H	α-helix	trans	-58.6	-38.4	170.6	-71.7	-65.6	0	0	0	112.3	V36 I39 F40 P295 R296 I301 Y302 Y303 I330 K333	V36-Y299 HydrophobicContact CG1-CE1 3.94Å; V36-Y299 WeakPolarHBondContact O-CE1 3.47Å; V36-Y299 PolarHBondContact O-OH 3.27Å; I39-Y299 HydrophobicContact CB-CD1 4.14Å; I39-Y299 HydrophobicContact CB-CE1 3.89Å; I39-Y299 HydrophobicContact CG2-CD1 3.49Å; I39-Y299 VanDerWaalsContact CG2-CD1 3.49Å; I39-Y299 HydrophobicContact CG2-CE1 3.62Å; I39-Y299 HydrophobicContact CG2-CG 4.36Å; F40-Y299 VanDerWaalsContact CB-OH 3.28Å; F40-Y299 WeakPolarHBondContact CB-OH 3.42Å; F40-Y299 HydrophobicContact CD2-CE2 4.35Å; P295-Y299 HydrophobicContact CB-CD2 4.43Å; P295-Y299 HydrophobicContact CB-CE2 4.15Å; P295-Y299 WeakPolarHBondContact O-CD2 3.34Å; P295-Y299 PolarHBondContact O-N 3.32Å; R296-Y299 PolarHBondContact O-N 3.09Å; Y299-I301 VanDerWaalsContact C-N 3.34Å; Y299-I301 PolarHBondContact O-N 3.29Å; Y299-Y302 PolarHBondContact O-N 3.4Å; Y299-Y303 WeakPolarHBondContact O-CB 3.18Å; Y299-Y303 PolarHBondContact O-N 2.67Å; Y299-I330 HydrophobicContact CD1-CG2 4.09Å; Y299-I330 WeakPolarHBondContact O-CG2 3.41Å; Y299-K333 HydrophobicContact CD1-CB 4.09Å; Y299-K333 HydrophobicContact CD2-CB 3.74Å; Y299-K333 HydrophobicContact CE1-CB 4.01Å; Y299-K333 HydrophobicContact CE1-CG 4.43Å; Y299-K333 HydrophobicContact CE2-CB 3.7Å; Y299-K333 HydrophobicContact CE2-CG 4.5Å; Y299-K333 HydrophobicContact CG-CB 3.94Å
300	Y	90.5	Very high	86.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-39	179	-178.6	-106.5	0	0	0	112.2	M215 T217 L220 T258 L262 R296 L297 Y298 Y302 Y303 A304	M215-Y300 HydrophobicContact CB-CD2 4.41Å; M215-Y300 HydrophobicContact CB-CE1 4.49Å; M215-Y300 HydrophobicContact CB-CE2 3.62Å; M215-Y300 HydrophobicContact CE-CD1 3.48Å; M215-Y300 VanDerWaalsContact CE-CD1 3.48Å; M215-Y300 HydrophobicContact CE-CD2 3.68Å; M215-Y300 HydrophobicContact CE-CE1 3.75Å; M215-Y300 HydrophobicContact CE-CE2 3.93Å; M215-Y300 HydrophobicContact CE-CG 3.42Å; M215-Y300 VanDerWaalsContact CE-CG 3.42Å; M215-Y300 HydrophobicContact SD-CD1 3.98Å; M215-Y300 HydrophobicContact SD-CE1 3.61Å; M215-Y300 HydrophobicContact SD-CE2 4.2Å; M215-Y300 HydrophobicContact SD-CG 4.39Å; T217-Y300 HydrophobicContact CG2-CE2 3.99Å; L220-Y300 HydrophobicContact CD2-CE1 3.66Å; L220-Y300 WeakPolarHBondContact CD2-OH 3.14Å; T258-Y300 HydrophobicContact CG2-CD1 4.02Å; T258-Y300 HydrophobicContact CG2-CE1 4.49Å; L262-Y300 HydrophobicContact CD1-CE1 4.11Å; R296-Y300 WeakPolarHBondContact O-CB 2.92Å; R296-Y300 PolarHBondContact O-N 3.46Å; L297-Y300 WeakPolarHBondContact O-CB 3.41Å; L297-Y300 PolarHBondContact O-N 2.79Å; Y298-Y300 VanDerWaalsContact C-N 3.25Å; Y298-Y300 PolarHBondContact O-N 2.85Å; Y300-Y302 VanDerWaalsContact C-N 3.34Å; Y300-Y302 PolarHBondContact O-N 2.87Å; Y300-Y303 HydrophobicContact CD2-CD1 4.06Å; Y300-Y303 HydrophobicContact CE2-CD1 4.15Å; Y300-Y303 PolarHBondContact O-N 3.17Å; Y300-A304 HydrophobicContact CE1-CB 4.31Å; Y300-A304 WeakPolarHBondContact O-CB 3.44Å; Y300-A304 PolarHBondContact O-N 3.05Å
301	I	93.1	Very high	88	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.5	-47.4	176.6	-66.5	161.7	0	0	0	110.5	T258 I261 L262 L265 I277 I292 L297 Y298 Y299 A304 L305	T258-I301 HydrophobicContact CG2-CD1 4.44Å; T258-I301 HydrophobicContact CG2-CG1 3.92Å; I261-I301 HydrophobicContact CB-CD1 4.49Å; I261-I301 HydrophobicContact CD1-CD1 4.35Å; I261-I301 HydrophobicContact CG2-CD1 3.98Å; I261-I301 HydrophobicContact CG2-CG1 4.5Å; I261-I301 HydrophobicContact CG2-CG2 4.11Å; L262-I301 HydrophobicContact CD2-CG2 4.09Å; L262-I301 HydrophobicContact CG-CG1 4.46Å; L265-I301 HydrophobicContact CD1-CG2 3.84Å; I277-I301 HydrophobicContact CD1-CG2 4.01Å; I277-I301 HydrophobicContact CG1-CG2 4.09Å; I277-I301 HydrophobicContact CG2-CG2 4Å; I292-I301 HydrophobicContact CD1-CD1 3.68Å; L297-I301 WeakPolarHBondContact O-CG1 3.41Å; L297-I301 PolarHBondContact O-N 3.31Å; Y298-I301 PolarHBondContact O-N 3.45Å; Y299-I301 VanDerWaalsContact C-N 3.34Å; Y299-I301 PolarHBondContact O-N 3.29Å; I301-A304 PolarHBondContact O-N 3.38Å; I301-L305 HydrophobicContact CG2-CD1 4.5Å; I301-L305 WeakPolarHBondContact O-CG 3.38Å; I301-L305 PolarHBondContact O-N 2.84Å
302	Y	94.1	Very high	89.3	Confident	15 Å²	15	26.3 Å²	26.3	6%	0.059	14%	0.136	C	C	.	.	H	α-helix	trans	-59.2	-52	174.9	-85.2	-88.2	0	0	0	112.1	W24 T28 I39 E42 I277 Y298 Y299 Y300 A304 L305 I306	W24-Y302 HydrophobicContact CH2-CD1 4.26Å; W24-Y302 HydrophobicContact CZ2-CD1 4.13Å; W24-Y302 HydrophobicContact CZ2-CE1 4.09Å; T28-Y302 HydrophobicContact CG2-CD1 3.85Å; T28-Y302 HydrophobicContact CG2-CE1 4Å; I39-Y302 HydrophobicContact CD1-CD1 3.91Å; I39-Y302 HydrophobicContact CD1-CD2 4.16Å; I39-Y302 HydrophobicContact CD1-CE1 4.35Å; I39-Y302 HydrophobicContact CD1-CG 3.81Å; I39-Y302 HydrophobicContact CG1-CD1 4.18Å; I39-Y302 HydrophobicContact CG1-CD2 4.11Å; I39-Y302 HydrophobicContact CG1-CE1 4.12Å; I39-Y302 HydrophobicContact CG1-CE2 4.07Å; I39-Y302 HydrophobicContact CG1-CG 4.17Å; I39-Y302 HydrophobicContact CG2-CD2 3.77Å; I39-Y302 HydrophobicContact CG2-CE2 3.88Å; I39-Y302 HydrophobicContact CG2-CG 4.48Å; E42-Y302 PolarHBondContact OE1-OH 3.06Å; E42-Y302 PolarHBondContact OE2-OH 3.29Å; I277-Y302 HydrophobicContact CB-CE2 4.18Å; I277-Y302 HydrophobicContact CD1-CD1 3.53Å; I277-Y302 HydrophobicContact CD1-CD2 3.68Å; I277-Y302 HydrophobicContact CD1-CE1 3.56Å; I277-Y302 HydrophobicContact CD1-CE2 3.71Å; I277-Y302 HydrophobicContact CD1-CG 3.59Å; I277-Y302 HydrophobicContact CG2-CD2 4.37Å; I277-Y302 HydrophobicContact CG2-CE2 3.83Å; Y298-Y302 HydrophobicContact CD1-CD2 4.46Å; Y298-Y302 HydrophobicContact CD1-CE2 4.2Å; Y298-Y302 HydrophobicContact CE1-CD2 4.31Å; Y298-Y302 AromaticContact CE1-CE2 3.61Å; Y298-Y302 HydrophobicContact CE1-CE2 3.61Å; Y298-Y302 AromaticContact CZ-CE2 3.96Å; Y298-Y302 PolarHBondContact O-N 3.03Å; Y299-Y302 PolarHBondContact O-N 3.4Å; Y300-Y302 VanDerWaalsContact C-N 3.34Å; Y300-Y302 PolarHBondContact O-N 2.87Å; Y302-A304 VanDerWaalsContact C-N 3.32Å; Y302-A304 PolarHBondContact O-N 3.01Å; Y302-L305 PolarHBondContact O-N 2.9Å; Y302-I306 WeakPolarHBondContact O-CD1 3.49Å; Y302-I306 WeakPolarHBondContact O-CG1 3.23Å; Y302-I306 PolarHBondContact O-N 3.42Å; Y302-I306 VanDerWaalsContact O-N 3.07Å
303	Y	93	Very high	90.3	Very high	31 Å²	31	28.2 Å²	28.2	12%	0.122	14%	0.143	C	C	.	.	H	α-helix	trans	-57.2	-46.1	179.5	170.1	-107.6	0	0	0	111.9	T217 Y299 Y300 I306 K307 A327 R331	T217-Y303 HydrophobicContact CG2-CD1 3.74Å; T217-Y303 HydrophobicContact CG2-CE1 3.45Å; T217-Y303 VanDerWaalsContact CG2-CE1 3.45Å; Y299-Y303 WeakPolarHBondContact O-CB 3.18Å; Y299-Y303 PolarHBondContact O-N 2.67Å; Y300-Y303 HydrophobicContact CD2-CD1 4.06Å; Y300-Y303 HydrophobicContact CE2-CD1 4.15Å; Y300-Y303 PolarHBondContact O-N 3.17Å; Y303-I306 PolarHBondContact O-N 3.17Å; Y303-K307 HydrophobicContact CD2-CG 4.27Å; Y303-K307 HydrophobicContact CE1-CG 4.21Å; Y303-K307 HydrophobicContact CE2-CD 4.24Å; Y303-K307 HydrophobicContact CE2-CG 3.78Å; Y303-K307 WeakPolarHBondContact O-CB 3.49Å; Y303-K307 WeakPolarHBondContact O-CG 3.37Å; Y303-K307 PolarHBondContact O-N 3.33Å; Y303-A327 HydrophobicContact CD2-CB 4.05Å; Y303-A327 WeakPolarHBondContact CD2-O 3.39Å; Y303-A327 HydrophobicContact CE2-CB 4.22Å; Y303-R331 HydrophobicContact CD2-CB 3.83Å; Y303-R331 HydrophobicContact CE1-CG 4.33Å; Y303-R331 HydrophobicContact CE2-CB 3.85Å; Y303-R331 HydrophobicContact CE2-CG 4.22Å; Y303-R331 HydrophobicContact CG-CB 4.24Å
304	A	93.7	Very high	90.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.4	-50.1	179.4	0	0	0	0	0	110.8	T217 F221 L262 Y300 I301 Y302 I306 K307 Y308	T217-A304 HydrophobicContact CG2-CB 3.88Å; F221-A304 HydrophobicContact CE1-CB 4.38Å; F221-A304 HydrophobicContact CZ-CB 3.9Å; F221-A304 WeakPolarHBondContact CZ-O 3.39Å; L262-A304 HydrophobicContact CD1-CB 4.19Å; L262-A304 HydrophobicContact CD2-CB 3.81Å; Y300-A304 HydrophobicContact CE1-CB 4.31Å; Y300-A304 WeakPolarHBondContact O-CB 3.44Å; Y300-A304 PolarHBondContact O-N 3.05Å; I301-A304 PolarHBondContact O-N 3.38Å; Y302-A304 VanDerWaalsContact C-N 3.32Å; Y302-A304 PolarHBondContact O-N 3.01Å; A304-I306 VanDerWaalsContact C-N 3.34Å; A304-I306 PolarHBondContact O-N 3.49Å; A304-K307 CarbonylContact O-C 3.56Å; A304-K307 WeakPolarHBondContact O-CA 3.48Å; A304-K307 WeakPolarHBondContact O-CB 3.39Å; A304-K307 PolarHBondContact O-N 3.11Å; A304-K307 VanDerWaalsContact O-N 3.1Å; A304-Y308 PolarHBondContact O-N 3.46Å
305	L	95	Very high	91.3	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-42.5	179	-74.5	-177.9	0	0	0	113	W24 L262 L265 I266 I269 P275 I277 I301 Y302 K307 Y308 I309	W24-L305 HydrophobicContact CH2-CB 3.91Å; W24-L305 HydrophobicContact CH2-CD1 4.12Å; W24-L305 HydrophobicContact CZ3-CB 4Å; L262-L305 HydrophobicContact CD2-CD2 4.11Å; L262-L305 HydrophobicContact CD2-CG 4.09Å; L265-L305 HydrophobicContact CB-CD1 3.96Å; L265-L305 HydrophobicContact CB-CD2 3.94Å; L265-L305 HydrophobicContact CD1-CD1 3.65Å; L265-L305 HydrophobicContact CD1-CG 4.49Å; L265-L305 HydrophobicContact CD2-CD1 4.49Å; L265-L305 HydrophobicContact CG-CD1 4.25Å; I266-L305 HydrophobicContact CG1-CD2 4.39Å; I269-L305 HydrophobicContact CD1-CD2 3.78Å; P275-L305 HydrophobicContact CB-CD1 4.08Å; I277-L305 HydrophobicContact CD1-CD1 3.72Å; I277-L305 HydrophobicContact CG1-CD1 3.74Å; I301-L305 HydrophobicContact CG2-CD1 4.5Å; I301-L305 WeakPolarHBondContact O-CG 3.38Å; I301-L305 PolarHBondContact O-N 2.84Å; Y302-L305 PolarHBondContact O-N 2.9Å; L305-K307 VanDerWaalsContact C-N 3.3Å; L305-K307 PolarHBondContact O-N 3.43Å; L305-Y308 WeakPolarHBondContact O-CB 3.44Å; L305-Y308 PolarHBondContact O-N 2.91Å; L305-Y308 VanDerWaalsContact O-N 3.16Å; L305-I309 WeakPolarHBondContact O-CD1 3.41Å; L305-I309 WeakPolarHBondContact O-CG1 3.25Å; L305-I309 PolarHBondContact O-N 3.23Å
306	I	94.4	Very high	91.5	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58.2	-46.4	174.8	-70.2	157.9	0	0	0	110.3	W24 T28 L29 Y302 Y303 A304 Y308 I309 M310 A327 I330	W24-I306 HydrophobicContact CH2-CG1 4.4Å; W24-I306 HydrophobicContact CZ3-CG1 4.03Å; T28-I306 HydrophobicContact CG2-CD1 4.5Å; L29-I306 HydrophobicContact CD1-CD1 4.28Å; L29-I306 HydrophobicContact CD1-CG1 4.44Å; L29-I306 HydrophobicContact CD1-CG2 4.01Å; L29-I306 HydrophobicContact CD2-CD1 3.75Å; L29-I306 HydrophobicContact CG-CD1 4.06Å; Y302-I306 WeakPolarHBondContact O-CD1 3.49Å; Y302-I306 WeakPolarHBondContact O-CG1 3.23Å; Y302-I306 PolarHBondContact O-N 3.42Å; Y302-I306 VanDerWaalsContact O-N 3.07Å; Y303-I306 PolarHBondContact O-N 3.17Å; A304-I306 VanDerWaalsContact C-N 3.34Å; A304-I306 PolarHBondContact O-N 3.49Å; I306-Y308 VanDerWaalsContact C-N 3.33Å; I306-Y308 PolarHBondContact O-N 2.82Å; I306-I309 PolarHBondContact O-N 3.28Å; I306-M310 HydrophobicContact CG2-CG 4.47Å; I306-M310 HydrophobicContact CG2-SD 3.73Å; I306-M310 WeakPolarHBondContact O-CG 3.44Å; I306-M310 PolarHBondContact O-N 2.87Å; I306-A327 HydrophobicContact CG2-CB 4.12Å; I306-I330 HydrophobicContact CD1-CD1 3.6Å
307	K	93.6	Very high	91.8	Very high	41 Å²	41	33.9 Å²	33.9	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-39.9	176.1	-78.2	-76.8	-65.2	178.8	0	112.7	T217 E218 F221 Y303 A304 L305 M310 A311	T217-K307 HydrophobicContact CG2-CB 4.23Å; T217-K307 HydrophobicContact CG2-CG 4.36Å; T217-K307 VanDerWaalsContact OG1-CE 3.31Å; T217-K307 WeakPolarHBondContact OG1-CE 3.27Å; E218-K307 WeakPolarHBondContact OE1-CE 3.12Å; E218-K307 IonicContact OE1-NZ 3.97Å; E218-K307 PolarHBondContact OE1-NZ 3.22Å; F221-K307 HydrophobicContact CE2-CB 4.45Å; Y303-K307 HydrophobicContact CD2-CG 4.27Å; Y303-K307 HydrophobicContact CE1-CG 4.21Å; Y303-K307 HydrophobicContact CE2-CD 4.24Å; Y303-K307 HydrophobicContact CE2-CG 3.78Å; Y303-K307 WeakPolarHBondContact O-CB 3.49Å; Y303-K307 WeakPolarHBondContact O-CG 3.37Å; Y303-K307 PolarHBondContact O-N 3.33Å; A304-K307 CarbonylContact O-C 3.56Å; A304-K307 WeakPolarHBondContact O-CA 3.48Å; A304-K307 WeakPolarHBondContact O-CB 3.39Å; A304-K307 PolarHBondContact O-N 3.11Å; A304-K307 VanDerWaalsContact O-N 3.1Å; L305-K307 VanDerWaalsContact C-N 3.3Å; L305-K307 PolarHBondContact O-N 3.43Å; K307-M310 PolarHBondContact O-N 3.05Å; K307-A311 WeakPolarHBondContact O-CB 3.39Å; K307-A311 PolarHBondContact O-N 2.83Å; K307-A311 VanDerWaalsContact O-N 3.13Å
308	Y	94.8	Very high	92	Very high	22 Å²	22	39.3 Å²	39.3	9%	0.086	21%	0.207	C	C	.	.	H	α-helix	trans	-60.4	-49.5	175.1	-179.3	-89.7	0	0	0	111	F221 I266 I269 K270 A304 L305 I306 M310 A311 N312	F221-Y308 HydrophobicContact CD1-CD2 4.02Å; F221-Y308 HydrophobicContact CD2-CD2 4.14Å; F221-Y308 HydrophobicContact CE1-CD2 4.15Å; F221-Y308 HydrophobicContact CE2-CD2 4.25Å; F221-Y308 HydrophobicContact CG-CD2 4.06Å; F221-Y308 HydrophobicContact CZ-CD2 4.29Å; F221-Y308 HydrophobicContact CZ-CG 4.45Å; I266-Y308 HydrophobicContact CD1-CD2 4.01Å; I266-Y308 HydrophobicContact CD1-CE2 4.03Å; I266-Y308 HydrophobicContact CG1-CD1 4.49Å; I266-Y308 HydrophobicContact CG1-CD2 4.03Å; I266-Y308 HydrophobicContact CG1-CE1 4.46Å; I266-Y308 HydrophobicContact CG1-CE2 3.97Å; I266-Y308 HydrophobicContact CG1-CG 4.3Å; I266-Y308 HydrophobicContact CG2-CE1 4.41Å; I266-Y308 HydrophobicContact CG2-CE2 3.94Å; I269-Y308 HydrophobicContact CD1-CD1 4.49Å; I269-Y308 HydrophobicContact CG2-CD1 4.36Å; I269-Y308 HydrophobicContact CG2-CE1 3.94Å; K270-Y308 VanDerWaalsContact CE-OH 3.29Å; K270-Y308 WeakPolarHBondContact CE-OH 3.47Å; A304-Y308 PolarHBondContact O-N 3.46Å; L305-Y308 WeakPolarHBondContact O-CB 3.44Å; L305-Y308 PolarHBondContact O-N 2.91Å; L305-Y308 VanDerWaalsContact O-N 3.16Å; I306-Y308 VanDerWaalsContact C-N 3.33Å; I306-Y308 PolarHBondContact O-N 2.82Å; Y308-M310 VanDerWaalsContact C-N 3.33Å; Y308-M310 PolarHBondContact O-N 3.12Å; Y308-A311 PolarHBondContact O-N 3.13Å; Y308-N312 WeakPolarHBondContact CD2-ND2 3.32Å; Y308-N312 HydrophobicContact CE1-CB 4.45Å; Y308-N312 WeakPolarHBondContact CE2-ND2 3.37Å; Y308-N312 PolarHBondContact O-N 3.46Å; Y308-N312 PolarHBondContact O-ND2 3.46Å
309	I	94.7	Very high	92.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.7	-45.5	-179.8	-63.5	166.3	0	0	0	110.2	A21 V22 W24 A25 I269 L305 I306 A311 N312 W313 W323	A21-I309 HydrophobicContact CB-CD1 4.26Å; A21-I309 HydrophobicContact CB-CG1 4.18Å; A21-I309 HydrophobicContact CB-CG2 4.42Å; V22-I309 HydrophobicContact CG2-CG2 4.39Å; W24-I309 HydrophobicContact CE3-CD1 3.46Å; W24-I309 VanDerWaalsContact CE3-CD1 3.46Å; W24-I309 HydrophobicContact CZ3-CD1 3.6Å; A25-I309 HydrophobicContact CB-CD1 3.91Å; A25-I309 HydrophobicContact CB-CG2 4.27Å; I269-I309 HydrophobicContact CD1-CG1 4.44Å; L305-I309 WeakPolarHBondContact O-CD1 3.41Å; L305-I309 WeakPolarHBondContact O-CG1 3.25Å; L305-I309 PolarHBondContact O-N 3.23Å; I306-I309 PolarHBondContact O-N 3.28Å; I309-A311 VanDerWaalsContact C-N 3.27Å; I309-A311 PolarHBondContact O-N 3.32Å; I309-N312 PolarHBondContact O-N 2.95Å; I309-W313 HydrophobicContact CB-CE3 4.13Å; I309-W313 HydrophobicContact CB-CZ3 4.12Å; I309-W313 HydrophobicContact CG1-CE3 4.46Å; I309-W313 HydrophobicContact CG1-CZ3 3.95Å; I309-W313 HydrophobicContact CG2-CE3 3.67Å; I309-W313 HydrophobicContact CG2-CZ3 3.91Å; I309-W313 PolarHBondContact O-N 3.28Å; I309-W313 VanDerWaalsContact O-N 3.16Å; I309-W323 HydrophobicContact CG2-CZ3 4.04Å
310	M	93.1	Very high	92.1	Very high	11 Å²	11	44.7 Å²	44.7	5%	0.054	23%	0.232	C	C	.	.	H	α-helix	trans	-64.2	-29.9	179.3	-66.9	169.1	84.2	0	0	114	I306 K307 Y308 R320 W323 L324	I306-M310 HydrophobicContact CG2-CG 4.47Å; I306-M310 HydrophobicContact CG2-SD 3.73Å; I306-M310 WeakPolarHBondContact O-CG 3.44Å; I306-M310 PolarHBondContact O-N 2.87Å; K307-M310 PolarHBondContact O-N 3.05Å; Y308-M310 VanDerWaalsContact C-N 3.33Å; Y308-M310 PolarHBondContact O-N 3.12Å; M310-R320 HydrophobicContact CE-CB 4.38Å; M310-R320 HydrophobicContact CE-CG 3.58Å; M310-R320 WeakPolarHBondContact CE-O 3.5Å; M310-R320 PolarHBondContact O-NH2 3.44Å; M310-W323 HydrophobicContact CE-CB 3.75Å; M310-W323 HydrophobicContact CG-CE3 3.6Å; M310-W323 HydrophobicContact CG-CZ3 4.11Å; M310-W323 HydrophobicContact SD-CB 4.04Å; M310-W323 HydrophobicContact SD-CE3 4.17Å; M310-L324 HydrophobicContact CE-CB 4.35Å; M310-L324 HydrophobicContact CE-CD2 3.59Å; M310-L324 HydrophobicContact CE-CG 3.47Å; M310-L324 VanDerWaalsContact CE-CG 3.47Å; M310-L324 HydrophobicContact SD-CD2 4.32Å
311	A	92.1	Very high	92.2	Very high	80 Å²	80	49.6 Å²	49.6	66%	0.661	26%	0.258	S	S	*	.	H	α-helix	trans	-83.8	-29.5	-179.5	0	0	0	0	0	112.9	K307 Y308 I309	K307-A311 WeakPolarHBondContact O-CB 3.39Å; K307-A311 PolarHBondContact O-N 2.83Å; K307-A311 VanDerWaalsContact O-N 3.13Å; Y308-A311 PolarHBondContact O-N 3.13Å; I309-A311 VanDerWaalsContact C-N 3.27Å; I309-A311 PolarHBondContact O-N 3.32Å
312	N	91.8	Very high	92.1	Very high	85 Å²	85	52.6 Å²	52.6	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-95.9	-16.8	-174.7	-74.2	-89.3	0	0	0	113.9	Y308 I309	Y308-N312 WeakPolarHBondContact CD2-ND2 3.32Å; Y308-N312 HydrophobicContact CE1-CB 4.45Å; Y308-N312 WeakPolarHBondContact CE2-ND2 3.37Å; Y308-N312 PolarHBondContact O-N 3.46Å; Y308-N312 PolarHBondContact O-ND2 3.46Å; I309-N312 PolarHBondContact O-N 2.95Å
313	W	89.1	Confident	92	Very high	43 Å²	43	52 Å²	52	16%	0.163	27%	0.272	C	S	.	.	S	Bend	trans	-128.6	150.1	179.8	-65.8	-59.9	0	0	0	113.7	A17 K18 A21 I269 I309 I315 R320	A17-W313 VanDerWaalsContact C-CZ2 3.43Å; A17-W313 HydrophobicContact CB-CH2 4.46Å; A17-W313 HydrophobicContact CB-CZ2 3.77Å; A17-W313 VanDerWaalsContact O-CH2 3.28Å; A17-W313 WeakPolarHBondContact O-CH2 3.47Å; A17-W313 WeakPolarHBondContact O-CZ2 3.49Å; K18-W313 HydrophobicContact CB-CD2 4.37Å; K18-W313 HydrophobicContact CB-CG 4.11Å; K18-W313 HydrophobicContact CD-CB 4.47Å; K18-W313 HydrophobicContact CD-CG 4.44Å; K18-W313 HydrophobicContact CG-CB 4.16Å; K18-W313 HydrophobicContact CG-CD2 4.46Å; K18-W313 HydrophobicContact CG-CG 3.88Å; A21-W313 HydrophobicContact CB-CE3 4.09Å; A21-W313 HydrophobicContact CB-CH2 3.31Å; A21-W313 HydrophobicContact CB-CZ2 4.46Å; A21-W313 HydrophobicContact CB-CZ3 3.13Å; I269-W313 HydrophobicContact CG2-CH2 3.21Å; I269-W313 HydrophobicContact CG2-CZ2 4.23Å; I269-W313 HydrophobicContact CG2-CZ3 3.75Å; I309-W313 HydrophobicContact CB-CE3 4.13Å; I309-W313 HydrophobicContact CB-CZ3 4.12Å; I309-W313 HydrophobicContact CG1-CE3 4.46Å; I309-W313 HydrophobicContact CG1-CZ3 3.95Å; I309-W313 HydrophobicContact CG2-CE3 3.67Å; I309-W313 HydrophobicContact CG2-CZ3 3.91Å; I309-W313 PolarHBondContact O-N 3.28Å; I309-W313 VanDerWaalsContact O-N 3.16Å; W313-I315 HydrophobicContact CB-CD1 4.36Å; W313-I315 PolarHBondContact O-N 2.81Å; W313-R320 PolarHBondContact O-NH2 2.88Å
314	D	86.3	Confident	91.9	Very high	121 Å²	121	53.3 Å²	53.3	65%	0.647	28%	0.281	S	S	*	.			trans	-73.6	111.9	173.7	-170	34.6	0	0	0	110	K18	K18-D314 WeakPolarHBondContact CE-O 3.47Å; K18-D314 PolarHBondContact NZ-O 3.29Å; K18-D314 VanDerWaalsContact NZ-O 3.12Å
315	I	88.2	Confident	91.8	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.021	31%	0.313	C	S	.	.			trans	-116.7	130.2	179.9	-53.3	-58.2	0	0	0	106.6	V22 W313 K317 V319 R320 W323	V22-I315 HydrophobicContact CB-CD1 4.48Å; V22-I315 HydrophobicContact CG1-CD1 4.26Å; V22-I315 HydrophobicContact CG2-CD1 3.41Å; V22-I315 VanDerWaalsContact CG2-CD1 3.41Å; W313-I315 HydrophobicContact CB-CD1 4.36Å; W313-I315 PolarHBondContact O-N 2.81Å; I315-K317 PolarHBondContact O-N 2.82Å; I315-V319 HydrophobicContact CG2-CB 3.82Å; I315-V319 HydrophobicContact CG2-CG1 3.66Å; I315-R320 HydrophobicContact CB-CB 4.38Å; I315-R320 HydrophobicContact CG2-CB 4.18Å; I315-W323 HydrophobicContact CD1-CH2 4.19Å; I315-W323 HydrophobicContact CD1-CZ3 4.21Å; I315-W323 HydrophobicContact CG1-CZ3 4.26Å; I315-W323 HydrophobicContact CG2-CZ3 4.46Å
316	P	90.7	Very high	91.6	Very high	77 Å²	77	62.8 Å²	62.8	50%	0.5	32%	0.322	S	S	.	.			trans	-47.6	138.9	174.9	-28.7	35.6	0	0	0	111.8	D318 V319 R320	P316-D318 VanDerWaalsContact C-N 3.27Å; P316-D318 WeakPolarHBondContact CB-OD1 3.41Å; P316-D318 PolarHBondContact O-N 2.83Å; P316-V319 HydrophobicContact CB-CB 4.39Å; P316-V319 HydrophobicContact CB-CG2 4.12Å; P316-V319 HydrophobicContact CG-CG2 4.44Å; P316-V319 PolarHBondContact O-N 2.86Å; P316-V319 VanDerWaalsContact O-N 3.09Å; P316-R320 WeakPolarHBondContact O-CB 3.5Å; P316-R320 PolarHBondContact O-N 2.83Å
317	K	90.9	Very high	91.4	Very high	169 Å²	169	62.8 Å²	62.8	74%	0.735	32%	0.322	S	S	*	.	H	α-helix	trans	-57.6	-39.7	-170.3	-74.4	-177.9	178.6	175.9	0	112.7	I315 R320 N321	I315-K317 PolarHBondContact O-N 2.82Å; K317-R320 PolarHBondContact O-N 3.39Å; K317-N321 WeakPolarHBondContact O-CB 3.15Å; K317-N321 PolarHBondContact O-N 2.84Å; K317-N321 PolarHBondContact O-ND2 2.86Å
318	D	91.8	Very high	91.1	Very high	114 Å²	114	67 Å²	67	61%	0.61	34%	0.34	S	S	*	.	H	α-helix	trans	-60.7	-49.5	175.7	59.1	-56.2	0	0	0	111.6	P316 N321 D322	P316-D318 VanDerWaalsContact C-N 3.27Å; P316-D318 WeakPolarHBondContact CB-OD1 3.41Å; P316-D318 PolarHBondContact O-N 2.83Å; D318-N321 PolarHBondContact O-N 2.68Å; D318-D322 PolarHBondContact O-N 2.85Å
319	V	91.2	Very high	90.8	Very high	45 Å²	45	69.3 Å²	69.3	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-62.7	-45	176.2	179.6	0	0	0	0	110.9	I315 P316 N321 D322 W323	I315-V319 HydrophobicContact CG2-CB 3.82Å; I315-V319 HydrophobicContact CG2-CG1 3.66Å; P316-V319 HydrophobicContact CB-CB 4.39Å; P316-V319 HydrophobicContact CB-CG2 4.12Å; P316-V319 HydrophobicContact CG-CG2 4.44Å; P316-V319 PolarHBondContact O-N 2.86Å; P316-V319 VanDerWaalsContact O-N 3.09Å; V319-N321 VanDerWaalsContact C-N 3.31Å; V319-N321 PolarHBondContact O-N 2.86Å; V319-D322 PolarHBondContact O-N 2.75Å; V319-W323 HydrophobicContact CG1-CD2 4.21Å; V319-W323 HydrophobicContact CG1-CG 4.41Å; V319-W323 HydrophobicContact CG1-CZ2 3.89Å; V319-W323 WeakPolarHBondContact O-CB 3.45Å; V319-W323 VanDerWaalsContact O-CD1 3.3Å; V319-W323 PolarHBondContact O-N 3.29Å
320	R	92.2	Very high	90.5	Very high	81 Å²	81	69.3 Å²	69.3	31%	0.306	35%	0.354	S	S	.	.	H	α-helix	trans	-59.2	-42.6	177	-179.2	178.4	-84	164.4	-2.4	111.2	M310 W313 I315 P316 K317 W323 L324	M310-R320 HydrophobicContact CE-CB 4.38Å; M310-R320 HydrophobicContact CE-CG 3.58Å; M310-R320 WeakPolarHBondContact CE-O 3.5Å; M310-R320 PolarHBondContact O-NH2 3.44Å; W313-R320 PolarHBondContact O-NH2 2.88Å; I315-R320 HydrophobicContact CB-CB 4.38Å; I315-R320 HydrophobicContact CG2-CB 4.18Å; P316-R320 WeakPolarHBondContact O-CB 3.5Å; P316-R320 PolarHBondContact O-N 2.83Å; K317-R320 PolarHBondContact O-N 3.39Å; R320-W323 PolarHBondContact O-N 3.45Å; R320-L324 WeakPolarHBondContact O-CG 3.33Å; R320-L324 PolarHBondContact O-N 3.16Å
321	N	92	Very high	90.2	Very high	103 Å²	103	70.4 Å²	70.4	55%	0.551	36%	0.357	S	S	*	.	H	α-helix	trans	-66.9	-41.9	179	-73.9	-21.4	0	0	0	112.2	K317 D318 V319 L324 K325	K317-N321 WeakPolarHBondContact O-CB 3.15Å; K317-N321 PolarHBondContact O-N 2.84Å; K317-N321 PolarHBondContact O-ND2 2.86Å; D318-N321 PolarHBondContact O-N 2.68Å; V319-N321 VanDerWaalsContact C-N 3.31Å; V319-N321 PolarHBondContact O-N 2.86Å; N321-L324 PolarHBondContact O-N 3.47Å; N321-K325 PolarHBondContact O-N 3.46Å; N321-K325 VanDerWaalsContact O-N 3.09Å
322	D	91.3	Very high	89.8	Confident	63 Å²	63	74.2 Å²	74.2	34%	0.337	36%	0.355	S	S	.	.	H	α-helix	trans	-61.1	-47.2	173.4	177.7	63.5	0	0	0	111.4	D318 V319 L324 K325 K326	D318-D322 PolarHBondContact O-N 2.85Å; V319-D322 PolarHBondContact O-N 2.75Å; D322-L324 VanDerWaalsContact C-N 3.34Å; D322-L324 PolarHBondContact O-N 2.93Å; D322-K325 WeakPolarHBondContact O-CB 3.3Å; D322-K325 PolarHBondContact O-N 2.83Å; D322-K325 VanDerWaalsContact O-N 3.08Å; D322-K326 PolarHBondContact O-N 3.48Å; D322-K326 WeakPolarHBondContact OD1-CE 3.35Å; D322-K326 IonicContact OD1-NZ 3.69Å; D322-K326 WeakPolarHBondContact OD2-CD 3.35Å; D322-K326 WeakPolarHBondContact OD2-CE 3.39Å; D322-K326 IonicContact OD2-NZ 2.7Å; D322-K326 PolarHBondContact OD2-NZ 3.07Å
323	W	93	Very high	89.4	Confident	2 Å²	2	74.6 Å²	74.6	1%	0.008	35%	0.352	C	S	.	.	H	α-helix	trans	-60.6	-41.9	177	-72.8	13.5	0	0	0	112.3	V22 A25 T26 L29 I309 M310 I315 V319 R320 K325 K326 A327	V22-W323 HydrophobicContact CG1-CH2 4.04Å; V22-W323 HydrophobicContact CG1-CZ2 4.46Å; A25-W323 HydrophobicContact CB-CE3 4.2Å; A25-W323 HydrophobicContact CB-CH2 3.52Å; A25-W323 HydrophobicContact CB-CZ2 4.03Å; A25-W323 HydrophobicContact CB-CZ3 3.61Å; T26-W323 WeakPolarHBondContact OG1-CZ2 3.26Å; L29-W323 HydrophobicContact CD1-CB 3.74Å; L29-W323 HydrophobicContact CD1-CD2 3.8Å; L29-W323 HydrophobicContact CD1-CE3 4.45Å; L29-W323 HydrophobicContact CD1-CG 3.42Å; L29-W323 VanDerWaalsContact CD1-CG 3.42Å; I309-W323 HydrophobicContact CG2-CZ3 4.04Å; M310-W323 HydrophobicContact CE-CB 3.75Å; M310-W323 HydrophobicContact CG-CE3 3.6Å; M310-W323 HydrophobicContact CG-CZ3 4.11Å; M310-W323 HydrophobicContact SD-CB 4.04Å; M310-W323 HydrophobicContact SD-CE3 4.17Å; I315-W323 HydrophobicContact CD1-CH2 4.19Å; I315-W323 HydrophobicContact CD1-CZ3 4.21Å; I315-W323 HydrophobicContact CG1-CZ3 4.26Å; I315-W323 HydrophobicContact CG2-CZ3 4.46Å; V319-W323 HydrophobicContact CG1-CD2 4.21Å; V319-W323 HydrophobicContact CG1-CG 4.41Å; V319-W323 HydrophobicContact CG1-CZ2 3.89Å; V319-W323 WeakPolarHBondContact O-CB 3.45Å; V319-W323 VanDerWaalsContact O-CD1 3.3Å; V319-W323 PolarHBondContact O-N 3.29Å; R320-W323 PolarHBondContact O-N 3.45Å; W323-K325 VanDerWaalsContact C-N 3.29Å; W323-K325 PolarHBondContact O-N 3.37Å; W323-K326 PolarHBondContact O-N 3.23Å; W323-A327 WeakPolarHBondContact O-CB 3.35Å; W323-A327 PolarHBondContact O-N 2.87Å
324	L	90.8	Very high	88.4	Confident	59 Å²	59	72.6 Å²	72.6	31%	0.309	35%	0.345	S	S	.	.	H	α-helix	trans	-59.1	-42.1	174.7	-77.4	177.3	0	0	0	111.4	M310 R320 N321 D322 K328	M310-L324 HydrophobicContact CE-CB 4.35Å; M310-L324 HydrophobicContact CE-CD2 3.59Å; M310-L324 HydrophobicContact CE-CG 3.47Å; M310-L324 VanDerWaalsContact CE-CG 3.47Å; M310-L324 HydrophobicContact SD-CD2 4.32Å; R320-L324 WeakPolarHBondContact O-CG 3.33Å; R320-L324 PolarHBondContact O-N 3.16Å; N321-L324 PolarHBondContact O-N 3.47Å; D322-L324 VanDerWaalsContact C-N 3.34Å; D322-L324 PolarHBondContact O-N 2.93Å; L324-K328 WeakPolarHBondContact O-CB 3.34Å; L324-K328 WeakPolarHBondContact O-CG 2.87Å; L324-K328 PolarHBondContact O-N 2.9Å
325	K	90.2	Very high	87.4	Confident	158 Å²	158	69 Å²	69	69%	0.687	33%	0.327	S	S	*	.	H	α-helix	trans	-63.7	-43.9	178.6	-174.3	-178.6	176.8	-176.3	0	111.3	N321 D322 W323 K328	N321-K325 PolarHBondContact O-N 3.46Å; N321-K325 VanDerWaalsContact O-N 3.09Å; D322-K325 WeakPolarHBondContact O-CB 3.3Å; D322-K325 PolarHBondContact O-N 2.83Å; D322-K325 VanDerWaalsContact O-N 3.08Å; W323-K325 VanDerWaalsContact C-N 3.29Å; W323-K325 PolarHBondContact O-N 3.37Å; K325-K328 WeakPolarHBondContact O-CB 3.44Å
326	K	91.4	Very high	85.8	Confident	40 Å²	40	78.6 Å²	78.6	17%	0.174	36%	0.363	C	S	.	.	H	α-helix	trans	-73.1	-42.7	179.1	-66.5	171.8	173.2	165.3	0	112.5	L29 N30 F35 D322 W323 K328 L329 I330	L29-K326 HydrophobicContact CB-CD 4.01Å; L29-K326 HydrophobicContact CD2-CB 3.79Å; L29-K326 WeakPolarHBondContact O-CD 3.17Å; L29-K326 PolarHBondContact O-NZ 3.26Å; N30-K326 PolarHBondContact OD1-NZ 2.76Å; F35-K326 HydrophobicContact CE1-CB 4.45Å; F35-K326 HydrophobicContact CZ-CB 4.06Å; D322-K326 PolarHBondContact O-N 3.48Å; D322-K326 WeakPolarHBondContact OD1-CE 3.35Å; D322-K326 IonicContact OD1-NZ 3.69Å; D322-K326 WeakPolarHBondContact OD2-CD 3.35Å; D322-K326 WeakPolarHBondContact OD2-CE 3.39Å; D322-K326 IonicContact OD2-NZ 2.7Å; D322-K326 PolarHBondContact OD2-NZ 3.07Å; W323-K326 PolarHBondContact O-N 3.23Å; K326-K328 PolarHBondContact O-N 2.78Å; K326-L329 WeakPolarHBondContact O-CA 3.33Å; K326-L329 VanDerWaalsContact O-CB 3.26Å; K326-L329 WeakPolarHBondContact O-CB 3.32Å; K326-L329 PolarHBondContact O-N 2.87Å; K326-I330 PolarHBondContact O-N 2.67Å
327	A	89.8	Confident	83.9	Confident	1 Å²	1	80.5 Å²	80.5	1%	0.008	37%	0.373	C	S	.	.	H	α-helix	trans	-59.5	-33.9	174.8	0	0	0	0	0	112	Y303 I306 W323 L329 I330 R331	Y303-A327 HydrophobicContact CD2-CB 4.05Å; Y303-A327 WeakPolarHBondContact CD2-O 3.39Å; Y303-A327 HydrophobicContact CE2-CB 4.22Å; I306-A327 HydrophobicContact CG2-CB 4.12Å; W323-A327 WeakPolarHBondContact O-CB 3.35Å; W323-A327 PolarHBondContact O-N 2.87Å; A327-L329 PolarHBondContact O-N 2.84Å; A327-I330 WeakPolarHBondContact O-CB 3.36Å; A327-I330 PolarHBondContact O-N 2.88Å; A327-R331 WeakPolarHBondContact O-CB 3.43Å; A327-R331 PolarHBondContact O-N 2.91Å
328	K	87.7	Confident	83.5	Confident	128 Å²	128	76.1 Å²	76.1	56%	0.557	36%	0.355	S	S	*	.	H	α-helix	trans	-60.2	-29.9	171.1	-78.9	171.1	-177.8	-178.8	0	113	L324 K325 K326 R332	L324-K328 WeakPolarHBondContact O-CB 3.34Å; L324-K328 WeakPolarHBondContact O-CG 2.87Å; L324-K328 PolarHBondContact O-N 2.9Å; K325-K328 WeakPolarHBondContact O-CB 3.44Å; K326-K328 PolarHBondContact O-N 2.78Å; K328-R332 VanDerWaalsContact O-CG 3.29Å; K328-R332 WeakPolarHBondContact O-CG 3.38Å; K328-R332 PolarHBondContact O-N 3Å
329	L	89.1	Confident	83.1	Confident	71 Å²	71	74.1 Å²	74.1	37%	0.372	34%	0.342	S	S	.	.	H	α-helix	trans	-71	-41	175	-57.2	174.6	0	0	0	111.4	F35 V36 K326 A327 R331 R332 K333	F35-L329 HydrophobicContact CE1-CD1 4.23Å; F35-L329 HydrophobicContact CZ-CB 4.01Å; F35-L329 HydrophobicContact CZ-CD1 4Å; V36-L329 HydrophobicContact CG2-CB 4.18Å; K326-L329 WeakPolarHBondContact O-CA 3.33Å; K326-L329 VanDerWaalsContact O-CB 3.26Å; K326-L329 WeakPolarHBondContact O-CB 3.32Å; K326-L329 PolarHBondContact O-N 2.87Å; A327-L329 PolarHBondContact O-N 2.84Å; L329-R331 VanDerWaalsContact C-N 3.34Å; L329-R332 PolarHBondContact O-N 2.68Å; L329-K333 PolarHBondContact O-N 2.67Å
330	I	88.6	Confident	82.6	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.3	-49.5	170.9	-52.6	-178.2	0	0	0	109.5	L29 F35 I39 Y299 I306 K326 A327 R332 K333 S334	L29-I330 HydrophobicContact CD2-CD1 4.26Å; F35-I330 HydrophobicContact CD2-CD1 4.25Å; F35-I330 HydrophobicContact CD2-CG1 4.12Å; F35-I330 HydrophobicContact CE2-CD1 3.9Å; F35-I330 HydrophobicContact CE2-CG1 3.45Å; F35-I330 VanDerWaalsContact CE2-CG1 3.45Å; F35-I330 HydrophobicContact CZ-CG1 4.47Å; I39-I330 HydrophobicContact CD1-CD1 4.12Å; I39-I330 HydrophobicContact CD1-CG1 4.42Å; Y299-I330 HydrophobicContact CD1-CG2 4.09Å; Y299-I330 WeakPolarHBondContact O-CG2 3.41Å; I306-I330 HydrophobicContact CD1-CD1 3.6Å; K326-I330 PolarHBondContact O-N 2.67Å; A327-I330 WeakPolarHBondContact O-CB 3.36Å; A327-I330 PolarHBondContact O-N 2.88Å; I330-R332 VanDerWaalsContact C-N 3.29Å; I330-R332 PolarHBondContact O-N 2.95Å; I330-K333 WeakPolarHBondContact O-CA 3.18Å; I330-K333 WeakPolarHBondContact O-CB 3.37Å; I330-K333 PolarHBondContact O-N 2.75Å; I330-S334 PolarHBondContact O-N 2.69Å
331	R	86.4	Confident	82.1	Confident	34 Å²	34	75.4 Å²	75.4	13%	0.128	35%	0.348	C	S	.	.	H	α-helix	trans	-57.4	-41.8	-179.1	-176.8	49.7	171.5	-168.8	-13	111.9	E212 A213 M215 Y303 A327 L329 K333 S334 V335	E212-R331 PolarHBondContact O-NH1 3.49Å; A213-R331 VanDerWaalsContact C-CZ 3.44Å; A213-R331 VanDerWaalsContact C-NH2 3.26Å; A213-R331 PolarHBondContact O-NE 2.86Å; A213-R331 PolarHBondContact O-NH2 2.83Å; M215-R331 PolarHBondContact O-NH2 3.21Å; Y303-R331 HydrophobicContact CD2-CB 3.83Å; Y303-R331 HydrophobicContact CE1-CG 4.33Å; Y303-R331 HydrophobicContact CE2-CB 3.85Å; Y303-R331 HydrophobicContact CE2-CG 4.22Å; Y303-R331 HydrophobicContact CG-CB 4.24Å; A327-R331 WeakPolarHBondContact O-CB 3.43Å; A327-R331 PolarHBondContact O-N 2.91Å; L329-R331 VanDerWaalsContact C-N 3.34Å; R331-K333 PolarHBondContact O-N 3.03Å; R331-S334 VanDerWaalsContact CD-OG 3.28Å; R331-S334 WeakPolarHBondContact CD-OG 3.4Å; R331-S334 PolarHBondContact NH1-OG 3.17Å; R331-S334 PolarHBondContact O-N 3.42Å; R331-S334 PolarHBondContact O-OG 2.86Å; R331-S334 VanDerWaalsContact O-OG 3.05Å; R331-V335 HydrophobicContact CG-CG2 4.49Å; R331-V335 WeakPolarHBondContact O-CG2 3.47Å; R331-V335 PolarHBondContact O-N 2.64Å; R331-V335 VanDerWaalsContact O-N 3.15Å
332	R	84.3	Confident	81.5	Confident	161 Å²	161	73.7 Å²	73.7	61%	0.608	34%	0.336	S	S	*	.	H	α-helix	trans	-57.9	-34.5	175.5	-77.1	170.5	-178.4	178.6	-0.3	112.8	K328 L329 I330 V335 R336	K328-R332 VanDerWaalsContact O-CG 3.29Å; K328-R332 WeakPolarHBondContact O-CG 3.38Å; K328-R332 PolarHBondContact O-N 3Å; L329-R332 PolarHBondContact O-N 2.68Å; I330-R332 VanDerWaalsContact C-N 3.29Å; I330-R332 PolarHBondContact O-N 2.95Å; R332-V335 PolarHBondContact O-N 3.38Å; R332-R336 PolarHBondContact O-N 3.47Å
333	K	81.6	Confident	80.8	Confident	93 Å²	93	74.4 Å²	74.4	40%	0.404	34%	0.335	S	S	.	.	H	α-helix	trans	-79.2	-26.8	175	-67.5	-59.2	-170.1	170.9	0	113.6	V36 Y299 L329 I330 R331 V335	V36-K333 HydrophobicContact CG1-CB 4.42Å; V36-K333 HydrophobicContact CG1-CD 4.41Å; V36-K333 HydrophobicContact CG1-CG 3.48Å; V36-K333 VanDerWaalsContact CG1-CG 3.48Å; Y299-K333 HydrophobicContact CD1-CB 4.09Å; Y299-K333 HydrophobicContact CD2-CB 3.74Å; Y299-K333 HydrophobicContact CE1-CB 4.01Å; Y299-K333 HydrophobicContact CE1-CG 4.43Å; Y299-K333 HydrophobicContact CE2-CB 3.7Å; Y299-K333 HydrophobicContact CE2-CG 4.5Å; Y299-K333 HydrophobicContact CG-CB 3.94Å; L329-K333 PolarHBondContact O-N 2.67Å; I330-K333 WeakPolarHBondContact O-CA 3.18Å; I330-K333 WeakPolarHBondContact O-CB 3.37Å; I330-K333 PolarHBondContact O-N 2.75Å; R331-K333 PolarHBondContact O-N 3.03Å; K333-V335 PolarHBondContact O-N 3Å
334	S	69	Low	79.9	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.007	36%	0.359	C	S	.	.	H	α-helix	trans	-70.8	-9.1	167.6	94	0	0	0	0	112.8	A213 R296 I330 R331	A213-S334 WeakPolarHBondContact CA-O 3.36Å; A213-S334 PolarHBondContact N-O 3.36Å; R296-S334 WeakPolarHBondContact O-CB 3.43Å; I330-S334 PolarHBondContact O-N 2.69Å; R331-S334 VanDerWaalsContact CD-OG 3.28Å; R331-S334 WeakPolarHBondContact CD-OG 3.4Å; R331-S334 PolarHBondContact NH1-OG 3.17Å; R331-S334 PolarHBondContact O-N 3.42Å; R331-S334 PolarHBondContact O-OG 2.86Å; R331-S334 VanDerWaalsContact O-OG 3.05Å
335	V	65.6	Low	79.1	Confident	46 Å²	46	81.2 Å²	81.2	28%	0.279	36%	0.363	S	S	.	.	H	α-helix	trans	-105.4	-49.2	-179.7	174.3	0	0	0	0	112.1	A213 R331 R332 K333	A213-V335 VanDerWaalsContact CB-CA 3.45Å; A213-V335 HydrophobicContact CB-CB 3.47Å; A213-V335 VanDerWaalsContact CB-CB 3.47Å; A213-V335 HydrophobicContact CB-CG1 3.36Å; A213-V335 HydrophobicContact CB-CG2 3.41Å; A213-V335 VanDerWaalsContact CB-CG2 3.41Å; A213-V335 VanDerWaalsContact O-CG2 3.29Å; A213-V335 WeakPolarHBondContact O-CG2 3.48Å; R331-V335 HydrophobicContact CG-CG2 4.49Å; R331-V335 WeakPolarHBondContact O-CG2 3.47Å; R331-V335 PolarHBondContact O-N 2.64Å; R331-V335 VanDerWaalsContact O-N 3.15Å; R332-V335 PolarHBondContact O-N 3.38Å; K333-V335 PolarHBondContact O-N 3Å
336	R	55.4	Low	78.2	Confident	205 Å²	205	74.8 Å²	74.8	77%	0.774	34%	0.336	S	S	*	.			trans	-106.1	92.3	-173.2	-68.5	-175	178.1	178	-2.6	111.5	R332	R332-R336 PolarHBondContact O-N 3.47Å
337	T	49.1	Very low	76.9	Confident	117 Å²	117	77.9 Å²	77.9	72%	0.718	35%	0.35	S	S	*	.			trans	-160.2	0	149.8	50.5	0	0	0	0	105.9	R296	R296-T337 WeakPolarHBondContact CD-OG1 3.08Å; R296-T337 WeakPolarHBondContact CD-OXT 3.35Å; R296-T337 WeakPolarHBondContact CG-OG1 3.47Å; R296-T337 PolarHBondContact NH1-OXT 3.5Å

Retrieved 337 of 337 residues in 493.8 ms (Link to these results)

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