A0AA82MT47_SCHMA Loading...

TPR_REGION domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82MT47, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 127 aa.

						>A0AA82MT47_SCHMA|A0AA82MT47
MVSKVNSKTQFVSNYEIFLKALKMESVFDDKNDFLDVVYWFRQVFAIIVGVVWGVASFTGFMAILMFFVTNICFVYAYAAIYQRVDEDEYGGYGEIIKEGLMTAFACFMVSWILTYDCAHGVNSTTW
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	38.5	Very low	62.3	Low	240 Å²	240	132.4 Å²	132.4	100%	1.182	70%	0.695	S	S	*	*				0	104.7	0	-76.4	175	-172.7	0	0	107.3	S3	M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 3.3Å
2	V	52.6	Low	63.2	Low	149 Å²	149	128.5 Å²	128.5	90%	0.903	68%	0.68	S	S	*	*			trans	-73.9	98	167.4	178.6	0	0	0	0	104.9	K4	V2-K4 PolarHBondContact O-N 2.79Å
3	S	55.2	Low	64.5	Low	89 Å²	89	123.1 Å²	123.1	62%	0.622	66%	0.659	S	S	*	*			trans	-54	116.4	172.4	-179.5	0	0	0	0	106.6	M1 V5	M1-S3 VanDerWaalsContact C-N 3.32Å; M1-S3 PolarHBondContact O-N 3.3Å; S3-V5 PolarHBondContact O-N 3.48Å
4	K	57.3	Low	65.4	Low	203 Å²	203	120.9 Å²	120.9	88%	0.883	65%	0.647	S	S	*	*			trans	-69.5	80	171.9	-159.6	177	-170.4	178.1	0	105.1	V2 N6	V2-K4 PolarHBondContact O-N 2.79Å; K4-N6 PolarHBondContact O-N 2.66Å
5	V	60.5	Low	66.4	Low	85 Å²	85	121.9 Å²	121.9	52%	0.515	64%	0.64	S	S	.	*			trans	-53.6	113.3	-180	-179.9	0	0	0	0	105.9	S3 S7 Q10	S3-V5 PolarHBondContact O-N 3.48Å; V5-S7 PolarHBondContact O-N 3.28Å; V5-Q10 HydrophobicContact CB-CG 4.39Å; V5-Q10 HydrophobicContact CG1-CG 3.4Å
6	N	69.2	Low	67.4	Low	93 Å²	93	122.5 Å²	122.5	50%	0.497	64%	0.638	S	S	.	*			trans	-59.9	125.3	-175.3	-179.5	3.8	0	0	0	107.8	K4 K8 T9 Q10	K4-N6 PolarHBondContact O-N 2.66Å; N6-K8 PolarHBondContact O-N 2.73Å; N6-K8 VanDerWaalsContact O-N 3.09Å; N6-T9 WeakPolarHBondContact O-CA 3.26Å; N6-T9 WeakPolarHBondContact O-CB 3.16Å; N6-T9 PolarHBondContact O-N 3.47Å; N6-Q10 PolarHBondContact O-N 3.12Å
7	S	67.9	Low	68.3	Low	94 Å²	94	116.7 Å²	116.7	66%	0.657	61%	0.608	S	S	*	*	H	α-helix	trans	-55.9	-31.5	-174.9	55.8	0	0	0	0	112.7	V5 T9 Q10 F11	V5-S7 PolarHBondContact O-N 3.28Å; S7-T9 VanDerWaalsContact C-N 3.34Å; S7-T9 PolarHBondContact O-N 2.97Å; S7-Q10 PolarHBondContact O-N 3.42Å; S7-F11 PolarHBondContact O-N 3.41Å
8	K	69.7	Low	69.1	Low	157 Å²	157	114.3 Å²	114.3	68%	0.683	59%	0.592	S	S	*	*	H	α-helix	trans	-61	-41.4	172	-70	-168.9	177.4	-170.4	0	112.2	N6 F11 V12	N6-K8 PolarHBondContact O-N 2.73Å; N6-K8 VanDerWaalsContact O-N 3.09Å; K8-F11 PolarHBondContact O-N 2.9Å; K8-V12 VanDerWaalsContact O-CG2 3.23Å; K8-V12 WeakPolarHBondContact O-CG2 3.18Å; K8-V12 PolarHBondContact O-N 2.97Å; K8-V12 VanDerWaalsContact O-N 3.08Å
9	T	72.6	Confident	69.7	Low	86 Å²	86	112.2 Å²	112.2	53%	0.528	58%	0.581	S	S	.	*	H	α-helix	trans	-68.5	-39.9	-179.7	-48.7	0	0	0	0	111.4	N6 S7 S13	N6-T9 WeakPolarHBondContact O-CA 3.26Å; N6-T9 WeakPolarHBondContact O-CB 3.16Å; N6-T9 PolarHBondContact O-N 3.47Å; S7-T9 VanDerWaalsContact C-N 3.34Å; S7-T9 PolarHBondContact O-N 2.97Å; T9-S13 WeakPolarHBondContact O-CB 3.25Å; T9-S13 PolarHBondContact O-N 3.49Å
10	Q	69.3	Low	70.4	Confident	112 Å²	112	110.3 Å²	110.3	52%	0.523	57%	0.568	S	S	.	*	H	α-helix	trans	-65.2	-44.7	174	-77.2	-131.4	-81.6	0	0	112.6	V5 N6 S7 V12 S13 N14	V5-Q10 HydrophobicContact CB-CG 4.39Å; V5-Q10 HydrophobicContact CG1-CG 3.4Å; N6-Q10 PolarHBondContact O-N 3.12Å; S7-Q10 PolarHBondContact O-N 3.42Å; Q10-V12 VanDerWaalsContact C-N 3.33Å; Q10-V12 PolarHBondContact O-N 3.06Å; Q10-S13 WeakPolarHBondContact O-CB 3.33Å; Q10-S13 PolarHBondContact O-N 3.26Å; Q10-N14 VanDerWaalsContact O-CG 3.3Å; Q10-N14 PolarHBondContact O-N 3.31Å; Q10-N14 PolarHBondContact O-OD1 3.29Å
11	F	72	Confident	70.9	Confident	148 Å²	148	105 Å²	105	65%	0.649	54%	0.541	S	S	*	.	H	α-helix	trans	-60.9	-44	178.6	-179.7	-92.9	0	0	0	112	S7 K8 S13 N14 Y15	S7-F11 PolarHBondContact O-N 3.41Å; K8-F11 PolarHBondContact O-N 2.9Å; F11-S13 VanDerWaalsContact C-N 3.33Å; F11-S13 PolarHBondContact O-N 3.37Å; F11-N14 PolarHBondContact O-N 3.06Å; F11-Y15 PolarHBondContact O-N 3.37Å
12	V	73.5	Confident	72.9	Confident	86 Å²	86	97.5 Å²	97.5	52%	0.521	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-44.1	175.9	173	0	0	0	0	110.6	K8 Q10 N14 Y15 E16	K8-V12 VanDerWaalsContact O-CG2 3.23Å; K8-V12 WeakPolarHBondContact O-CG2 3.18Å; K8-V12 PolarHBondContact O-N 2.97Å; K8-V12 VanDerWaalsContact O-N 3.08Å; Q10-V12 VanDerWaalsContact C-N 3.33Å; Q10-V12 PolarHBondContact O-N 3.06Å; V12-N14 PolarHBondContact O-N 2.98Å; V12-Y15 PolarHBondContact O-N 3.28Å; V12-E16 HydrophobicContact CG1-CG 4.48Å; V12-E16 VanDerWaalsContact O-CG 3.23Å; V12-E16 WeakPolarHBondContact O-CG 3.31Å; V12-E16 PolarHBondContact O-N 3.35Å
13	S	79.6	Confident	74.1	Confident	58 Å²	58	97.8 Å²	97.8	41%	0.406	50%	0.495	S	S	.	.	H	α-helix	trans	-57.4	-48.7	175.8	-169.3	0	0	0	0	112.2	T9 Q10 F11 Y15 E16 I17	T9-S13 WeakPolarHBondContact O-CB 3.25Å; T9-S13 PolarHBondContact O-N 3.49Å; Q10-S13 WeakPolarHBondContact O-CB 3.33Å; Q10-S13 PolarHBondContact O-N 3.26Å; F11-S13 VanDerWaalsContact C-N 3.33Å; F11-S13 PolarHBondContact O-N 3.37Å; S13-Y15 VanDerWaalsContact C-N 3.3Å; S13-Y15 PolarHBondContact O-N 3.28Å; S13-E16 WeakPolarHBondContact O-CB 2.91Å; S13-E16 PolarHBondContact O-N 2.78Å; S13-I17 VanDerWaalsContact O-CG1 3.3Å; S13-I17 WeakPolarHBondContact O-CG1 3.48Å; S13-I17 PolarHBondContact O-N 3.31Å
14	N	78.2	Confident	74.8	Confident	92 Å²	92	99.4 Å²	99.4	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-36.7	-178.2	-66.5	6.2	0	0	0	111.8	Q10 F11 V12 I17 F18	Q10-N14 VanDerWaalsContact O-CG 3.3Å; Q10-N14 PolarHBondContact O-N 3.31Å; Q10-N14 PolarHBondContact O-OD1 3.29Å; F11-N14 PolarHBondContact O-N 3.06Å; V12-N14 PolarHBondContact O-N 2.98Å; N14-I17 PolarHBondContact O-N 2.86Å; N14-F18 WeakPolarHBondContact O-CB 3.23Å; N14-F18 PolarHBondContact O-N 3.01Å
15	Y	79.7	Confident	75.6	Confident	136 Å²	136	94.7 Å²	94.7	53%	0.533	48%	0.475	S	S	.	.	H	α-helix	trans	-65.9	-41.4	175.4	-169.4	-104.9	0	0	0	111.6	F11 V12 S13 I17 F18 L19	F11-Y15 PolarHBondContact O-N 3.37Å; V12-Y15 PolarHBondContact O-N 3.28Å; S13-Y15 VanDerWaalsContact C-N 3.3Å; S13-Y15 PolarHBondContact O-N 3.28Å; Y15-I17 VanDerWaalsContact C-N 3.35Å; Y15-I17 PolarHBondContact O-N 3.34Å; Y15-F18 PolarHBondContact O-N 3.3Å; Y15-L19 HydrophobicContact CD1-CD1 3.71Å; Y15-L19 HydrophobicContact CD1-CG 4.08Å; Y15-L19 HydrophobicContact CE1-CD1 3.41Å; Y15-L19 VanDerWaalsContact CE1-CD1 3.41Å; Y15-L19 HydrophobicContact CE1-CD2 4.21Å; Y15-L19 HydrophobicContact CE1-CG 3.83Å; Y15-L19 WeakPolarHBondContact O-CB 3.48Å; Y15-L19 WeakPolarHBondContact O-CG 3.47Å; Y15-L19 PolarHBondContact O-N 2.95Å
16	E	82.5	Confident	76.1	Confident	132 Å²	132	91.5 Å²	91.5	62%	0.617	46%	0.456	S	S	*	.	H	α-helix	trans	-62.4	-41.8	174.7	-63.1	-116.1	135.5	0	0	111.6	V12 S13 F18 L19 K20	V12-E16 HydrophobicContact CG1-CG 4.48Å; V12-E16 VanDerWaalsContact O-CG 3.23Å; V12-E16 WeakPolarHBondContact O-CG 3.31Å; V12-E16 PolarHBondContact O-N 3.35Å; S13-E16 WeakPolarHBondContact O-CB 2.91Å; S13-E16 PolarHBondContact O-N 2.78Å; E16-F18 VanDerWaalsContact C-N 3.33Å; E16-F18 PolarHBondContact O-N 3.32Å; E16-L19 PolarHBondContact O-N 3.49Å; E16-K20 VanDerWaalsContact O-CB 3.23Å; E16-K20 WeakPolarHBondContact O-CB 3.32Å; E16-K20 PolarHBondContact O-N 2.82Å
17	I	83.7	Confident	76.2	Confident	24 Å²	24	92.6 Å²	92.6	12%	0.123	47%	0.466	C	S	.	.	H	α-helix	trans	-61.6	-42.5	174.6	-66.3	162.5	0	0	0	110.5	S13 N14 Y15 K20 A21 F28 D33 V37	S13-I17 VanDerWaalsContact O-CG1 3.3Å; S13-I17 WeakPolarHBondContact O-CG1 3.48Å; S13-I17 PolarHBondContact O-N 3.31Å; N14-I17 PolarHBondContact O-N 2.86Å; Y15-I17 VanDerWaalsContact C-N 3.35Å; Y15-I17 PolarHBondContact O-N 3.34Å; I17-K20 WeakPolarHBondContact O-CB 3.5Å; I17-K20 PolarHBondContact O-N 3.28Å; I17-A21 WeakPolarHBondContact O-CB 3.27Å; I17-A21 PolarHBondContact O-N 2.88Å; I17-F28 HydrophobicContact CG2-CD1 4.46Å; I17-F28 HydrophobicContact CG2-CE1 4.02Å; I17-D33 HydrophobicContact CD1-CB 4.33Å; I17-D33 WeakPolarHBondContact CD1-OD2 3.22Å; I17-D33 HydrophobicContact CG2-CB 4.02Å; I17-V37 HydrophobicContact CG2-CG2 3.75Å
18	F	81.4	Confident	76.5	Confident	73 Å²	73	89.1 Å²	89.1	32%	0.32	44%	0.439	S	S	.	.	H	α-helix	trans	-67.1	-40.2	178	-159.4	-90.8	0	0	0	112.3	N14 Y15 E16 K20 A21 L22 V37 F41	N14-F18 WeakPolarHBondContact O-CB 3.23Å; N14-F18 PolarHBondContact O-N 3.01Å; Y15-F18 PolarHBondContact O-N 3.3Å; E16-F18 VanDerWaalsContact C-N 3.33Å; E16-F18 PolarHBondContact O-N 3.32Å; F18-K20 VanDerWaalsContact C-N 3.34Å; F18-A21 WeakPolarHBondContact O-CB 3.4Å; F18-A21 PolarHBondContact O-N 3.5Å; F18-L22 HydrophobicContact CD1-CD1 4.17Å; F18-L22 HydrophobicContact CE1-CD1 4.22Å; F18-L22 PolarHBondContact O-N 3.4Å; F18-V37 HydrophobicContact CD2-CG1 3.94Å; F18-V37 HydrophobicContact CD2-CG2 4.37Å; F18-V37 HydrophobicContact CE2-CG1 4.07Å; F18-F41 HydrophobicContact CD2-CE2 4.5Å; F18-F41 AromaticContact CE1-CE2 3.82Å; F18-F41 HydrophobicContact CE1-CE2 3.82Å; F18-F41 HydrophobicContact CE1-CZ 4.31Å; F18-F41 AromaticContact CE2-CD2 3.78Å; F18-F41 HydrophobicContact CE2-CD2 3.78Å; F18-F41 AromaticContact CE2-CE2 3.65Å; F18-F41 HydrophobicContact CE2-CE2 3.65Å; F18-F41 AromaticContact CZ-CD2 3.74Å; F18-F41 HydrophobicContact CZ-CD2 3.74Å; F18-F41 AromaticContact CZ-CE2 3.24Å; F18-F41 HydrophobicContact CZ-CE2 3.24Å; F18-F41 AromaticContact CZ-CZ 3.99Å; F18-F41 HydrophobicContact CZ-CZ 3.99Å
19	L	81.9	Confident	76.7	Confident	75 Å²	75	89 Å²	89	39%	0.393	45%	0.446	S	S	.	.	H	α-helix	trans	-66	-37.6	172.7	-72.1	-179.7	0	0	0	112	Y15 E16 A21 L22 K23	Y15-L19 HydrophobicContact CD1-CD1 3.71Å; Y15-L19 HydrophobicContact CD1-CG 4.08Å; Y15-L19 HydrophobicContact CE1-CD1 3.41Å; Y15-L19 VanDerWaalsContact CE1-CD1 3.41Å; Y15-L19 HydrophobicContact CE1-CD2 4.21Å; Y15-L19 HydrophobicContact CE1-CG 3.83Å; Y15-L19 WeakPolarHBondContact O-CB 3.48Å; Y15-L19 WeakPolarHBondContact O-CG 3.47Å; Y15-L19 PolarHBondContact O-N 2.95Å; E16-L19 PolarHBondContact O-N 3.49Å; L19-A21 VanDerWaalsContact C-N 3.31Å; L19-L22 HydrophobicContact CD2-CD1 4.48Å; L19-L22 PolarHBondContact O-N 2.91Å; L19-K23 PolarHBondContact O-N 3.34Å
20	K	82	Confident	77	Confident	73 Å²	73	88.1 Å²	88.1	32%	0.317	44%	0.438	S	S	.	.	H	α-helix	trans	-62.9	-41.7	173.3	-175	174.4	179.2	-173	0	110	E16 I17 F18 L22 K23 S26 V27 D29	E16-K20 VanDerWaalsContact O-CB 3.23Å; E16-K20 WeakPolarHBondContact O-CB 3.32Å; E16-K20 PolarHBondContact O-N 2.82Å; I17-K20 WeakPolarHBondContact O-CB 3.5Å; I17-K20 PolarHBondContact O-N 3.28Å; F18-K20 VanDerWaalsContact C-N 3.34Å; K20-L22 VanDerWaalsContact C-N 3.31Å; K20-L22 PolarHBondContact O-N 3.37Å; K20-K23 WeakPolarHBondContact O-CA 3.23Å; K20-K23 WeakPolarHBondContact O-CB 3.35Å; K20-K23 PolarHBondContact O-N 2.84Å; K20-S26 VanDerWaalsContact O-CB 3.25Å; K20-S26 WeakPolarHBondContact O-CB 3.23Å; K20-S26 PolarHBondContact O-OG 2.84Å; K20-S26 VanDerWaalsContact O-OG 3.12Å; K20-V27 WeakPolarHBondContact CE-O 3.45Å; K20-V27 PolarHBondContact NZ-O 3.41Å; K20-D29 IonicContact NZ-OD2 3.58Å
21	A	81.9	Confident	77.5	Confident	0 Å²	0	86.7 Å²	86.7	0%	0	43%	0.43	C	S	.	.	H	α-helix	trans	-65.8	-31.7	176.2	0	0	0	0	0	114.1	I17 F18 L19 K23 F28 V37 Y78 Q83	I17-A21 WeakPolarHBondContact O-CB 3.27Å; I17-A21 PolarHBondContact O-N 2.88Å; F18-A21 WeakPolarHBondContact O-CB 3.4Å; F18-A21 PolarHBondContact O-N 3.5Å; L19-A21 VanDerWaalsContact C-N 3.31Å; A21-K23 PolarHBondContact O-N 3.38Å; A21-F28 HydrophobicContact CB-CE1 4.21Å; A21-F28 HydrophobicContact CB-CZ 3.64Å; A21-V37 HydrophobicContact CB-CB 4.09Å; A21-V37 HydrophobicContact CB-CG1 3.4Å; A21-V37 VanDerWaalsContact CB-CG1 3.4Å; A21-V37 HydrophobicContact CB-CG2 4.07Å; A21-Y78 PolarHBondContact O-OH 3.41Å; A21-Q83 PolarHBondContact O-NE2 3.35Å
22	L	79.6	Confident	78.1	Confident	82 Å²	82	84.3 Å²	84.3	43%	0.429	42%	0.424	S	S	.	.	H	α-helix	trans	-70.1	-17.5	170.9	-77.8	170.1	0	0	0	112.8	F18 L19 K20 F41 Y82	F18-L22 HydrophobicContact CD1-CD1 4.17Å; F18-L22 HydrophobicContact CE1-CD1 4.22Å; F18-L22 PolarHBondContact O-N 3.4Å; L19-L22 HydrophobicContact CD2-CD1 4.48Å; L19-L22 PolarHBondContact O-N 2.91Å; K20-L22 VanDerWaalsContact C-N 3.31Å; K20-L22 PolarHBondContact O-N 3.37Å; L22-F41 HydrophobicContact CD2-CZ 3.75Å; L22-F41 HydrophobicContact CG-CZ 4.44Å; L22-Y82 PolarHBondContact O-OH 3.47Å
23	K	78.4	Confident	78.6	Confident	156 Å²	156	82.9 Å²	82.9	68%	0.678	41%	0.413	S	S	*	.	S	Bend	trans	-81.8	131.1	169.6	-87.7	-179.5	170.1	179.1	0	110.2	L19 K20 A21	L19-K23 PolarHBondContact O-N 3.34Å; K20-K23 WeakPolarHBondContact O-CA 3.23Å; K20-K23 WeakPolarHBondContact O-CB 3.35Å; K20-K23 PolarHBondContact O-N 2.84Å; A21-K23 PolarHBondContact O-N 3.38Å
24	M	70.6	Confident	78.7	Confident	123 Å²	123	80.1 Å²	80.1	61%	0.606	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	142.1	176.5	-151.5	171.6	76.4	0	0	110.8	S26 Y82	M24-S26 VanDerWaalsContact C-N 3.29Å; M24-S26 PolarHBondContact O-N 2.89Å; M24-Y82 HydrophobicContact CG-CD2 4.23Å; M24-Y82 HydrophobicContact CG-CE2 4.19Å; M24-Y82 WeakPolarHBondContact CG-O 3.5Å; M24-Y82 HydrophobicContact SD-CE2 4.48Å
25	E	73.7	Confident	79	Confident	103 Å²	103	76.2 Å²	76.2	48%	0.481	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	36.7	-179.9	-63.7	-177.8	149.8	0	0	114.4	V27 Y82 R84	E25-V27 PolarHBondContact O-N 2.81Å; E25-Y82 PolarHBondContact N-O 3.49Å; E25-R84 HydrophobicContact CG-CG 4.41Å; E25-R84 VanDerWaalsContact OE1-CD 3.26Å; E25-R84 WeakPolarHBondContact OE1-CD 3.42Å; E25-R84 IonicContact OE1-CZ 3.52Å; E25-R84 IonicContact OE1-NE 3.62Å; E25-R84 IonicContact OE1-NH1 2.79Å; E25-R84 PolarHBondContact OE1-NH1 3.49Å
26	S	71.4	Confident	79.4	Confident	18 Å²	18	74.4 Å²	74.4	13%	0.126	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-77.2	122.2	175	73.1	0	0	0	0	111.7	K20 M24 F28 Q83	K20-S26 VanDerWaalsContact O-CB 3.25Å; K20-S26 WeakPolarHBondContact O-CB 3.23Å; K20-S26 PolarHBondContact O-OG 2.84Å; K20-S26 VanDerWaalsContact O-OG 3.12Å; M24-S26 VanDerWaalsContact C-N 3.29Å; M24-S26 PolarHBondContact O-N 2.89Å; S26-F28 VanDerWaalsContact O-CD2 3.31Å; S26-F28 WeakPolarHBondContact O-CD2 3.49Å; S26-F28 PolarHBondContact O-N 3.17Å; S26-F28 WeakPolarHBondContact OG-CE2 3.37Å; S26-Q83 PolarHBondContact OG-NE2 3.43Å
27	V	71.3	Confident	79.6	Confident	116 Å²	116	68.4 Å²	68.4	70%	0.703	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-72.4	119.2	172.1	-178.3	0	0	0	0	109.5	K20 E25	K20-V27 WeakPolarHBondContact CE-O 3.45Å; K20-V27 PolarHBondContact NZ-O 3.41Å; E25-V27 PolarHBondContact O-N 2.81Å
28	F	74.2	Confident	79.7	Confident	22 Å²	22	67.6 Å²	67.6	10%	0.096	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-88.2	132.4	171.6	-68.5	-93	0	0	0	109.6	I17 A21 S26 D30 D33 F34 Q83	I17-F28 HydrophobicContact CG2-CD1 4.46Å; I17-F28 HydrophobicContact CG2-CE1 4.02Å; A21-F28 HydrophobicContact CB-CE1 4.21Å; A21-F28 HydrophobicContact CB-CZ 3.64Å; S26-F28 VanDerWaalsContact O-CD2 3.31Å; S26-F28 WeakPolarHBondContact O-CD2 3.49Å; S26-F28 PolarHBondContact O-N 3.17Å; S26-F28 WeakPolarHBondContact OG-CE2 3.37Å; F28-D30 VanDerWaalsContact C-N 3.34Å; F28-D33 HydrophobicContact CD1-CB 4.42Å; F28-F34 HydrophobicContact CB-CB 4.12Å; F28-F34 HydrophobicContact CD1-CB 4.16Å; F28-F34 HydrophobicContact CD2-CB 3.92Å; F28-F34 AromaticContact CD2-CD2 3.63Å; F28-F34 HydrophobicContact CD2-CD2 3.63Å; F28-F34 HydrophobicContact CD2-CG 4.12Å; F28-F34 HydrophobicContact CE2-CB 4.37Å; F28-F34 AromaticContact CE2-CD2 3.4Å; F28-F34 HydrophobicContact CE2-CD2 3.4Å; F28-F34 VanDerWaalsContact CE2-CD2 3.4Å; F28-F34 HydrophobicContact CE2-CE2 4.13Å; F28-F34 HydrophobicContact CE2-CG 4.3Å; F28-F34 HydrophobicContact CG-CB 3.8Å; F28-F34 HydrophobicContact CG-CD2 4.34Å; F28-F34 HydrophobicContact CG-CG 4.49Å; F28-F34 AromaticContact CZ-CD2 3.93Å; F28-F34 HydrophobicContact CZ-CD2 3.93Å; F28-Q83 HydrophobicContact CE2-CG 4.04Å
29	D	73.7	Confident	80	Confident	153 Å²	153	67.8 Å²	67.8	82%	0.818	34%	0.341	S	S	*	.	S	Bend	trans	-77.5	-25	178.1	-64.5	-65.9	0	0	0	111.7	K20	K20-D29 IonicContact NZ-OD2 3.58Å
30	D	78.6	Confident	80.3	Confident	69 Å²	69	71.6 Å²	71.6	37%	0.369	35%	0.35	S	S	.	.			trans	-123.2	128.1	175.6	-164.4	-30.5	0	0	0	110.2	F28 N32 D33 F34	F28-D30 VanDerWaalsContact C-N 3.34Å; D30-N32 PolarHBondContact O-N 2.76Å; D30-N32 WeakPolarHBondContact OD1-CB 3.42Å; D30-N32 PolarHBondContact OD1-N 3.36Å; D30-N32 PolarHBondContact OD1-ND2 3.49Å; D30-D33 HydrophobicContact CB-CB 4.34Å; D30-D33 PolarHBondContact O-N 3.24Å; D30-F34 PolarHBondContact O-N 3.05Å
31	K	80.7	Confident	80.6	Confident	82 Å²	82	70.3 Å²	70.3	36%	0.357	35%	0.345	S	S	.	.	H	α-helix	trans	-58.5	-36.3	173.8	155	171.8	167.1	178.1	0	111.6	D33 F34 L35 Y90	K31-D33 VanDerWaalsContact C-N 3.34Å; K31-D33 PolarHBondContact O-N 3.48Å; K31-F34 PolarHBondContact O-N 3.03Å; K31-L35 HydrophobicContact CD-CD1 4.31Å; K31-L35 HydrophobicContact CG-CD1 3.66Å; K31-L35 HydrophobicContact CG-CG 4.25Å; K31-L35 VanDerWaalsContact O-CG 3.26Å; K31-L35 WeakPolarHBondContact O-CG 3.34Å; K31-L35 PolarHBondContact O-N 3.43Å; K31-Y90 HydrophobicContact CB-CD1 4.39Å; K31-Y90 HydrophobicContact CB-CE1 3.77Å; K31-Y90 HydrophobicContact CD-CD1 3.8Å; K31-Y90 HydrophobicContact CD-CE1 4.07Å; K31-Y90 HydrophobicContact CD-CG 4.5Å; K31-Y90 HydrophobicContact CG-CD1 3.72Å; K31-Y90 HydrophobicContact CG-CE1 3.53Å
32	N	83	Confident	80.9	Confident	98 Å²	98	70.3 Å²	70.3	52%	0.524	35%	0.345	S	S	.	.	H	α-helix	trans	-66.2	-37.2	-179.4	-59.4	-61.6	0	0	0	111.7	D30 F34 L35 D36	D30-N32 PolarHBondContact O-N 2.76Å; D30-N32 WeakPolarHBondContact OD1-CB 3.42Å; D30-N32 PolarHBondContact OD1-N 3.36Å; D30-N32 PolarHBondContact OD1-ND2 3.49Å; N32-F34 VanDerWaalsContact C-N 3.34Å; N32-F34 PolarHBondContact O-N 3.32Å; N32-L35 PolarHBondContact O-N 3.24Å; N32-D36 WeakPolarHBondContact O-CB 3.37Å; N32-D36 PolarHBondContact O-N 2.92Å
33	D	84.2	Confident	81.5	Confident	55 Å²	55	67.3 Å²	67.3	29%	0.294	33%	0.328	S	S	.	.	H	α-helix	trans	-63.4	-42.4	176.6	-75.1	-9.4	0	0	0	111.1	I17 F28 D30 K31 V37	I17-D33 HydrophobicContact CD1-CB 4.33Å; I17-D33 WeakPolarHBondContact CD1-OD2 3.22Å; I17-D33 HydrophobicContact CG2-CB 4.02Å; F28-D33 HydrophobicContact CD1-CB 4.42Å; D30-D33 HydrophobicContact CB-CB 4.34Å; D30-D33 PolarHBondContact O-N 3.24Å; K31-D33 VanDerWaalsContact C-N 3.34Å; K31-D33 PolarHBondContact O-N 3.48Å; D33-V37 WeakPolarHBondContact O-CG2 2.94Å; D33-V37 PolarHBondContact O-N 3.19Å; D33-V37 VanDerWaalsContact O-N 3.16Å
34	F	82.9	Confident	82.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.4	-47.4	174.5	175.6	-110.4	0	0	0	111.5	F28 D30 K31 N32 D36 V37 V38 Y78 A79 Q83 V85 Y90	F28-F34 HydrophobicContact CB-CB 4.12Å; F28-F34 HydrophobicContact CD1-CB 4.16Å; F28-F34 HydrophobicContact CD2-CB 3.92Å; F28-F34 AromaticContact CD2-CD2 3.63Å; F28-F34 HydrophobicContact CD2-CD2 3.63Å; F28-F34 HydrophobicContact CD2-CG 4.12Å; F28-F34 HydrophobicContact CE2-CB 4.37Å; F28-F34 AromaticContact CE2-CD2 3.4Å; F28-F34 HydrophobicContact CE2-CD2 3.4Å; F28-F34 VanDerWaalsContact CE2-CD2 3.4Å; F28-F34 HydrophobicContact CE2-CE2 4.13Å; F28-F34 HydrophobicContact CE2-CG 4.3Å; F28-F34 HydrophobicContact CG-CB 3.8Å; F28-F34 HydrophobicContact CG-CD2 4.34Å; F28-F34 HydrophobicContact CG-CG 4.49Å; F28-F34 AromaticContact CZ-CD2 3.93Å; F28-F34 HydrophobicContact CZ-CD2 3.93Å; D30-F34 PolarHBondContact O-N 3.05Å; K31-F34 PolarHBondContact O-N 3.03Å; N32-F34 VanDerWaalsContact C-N 3.34Å; N32-F34 PolarHBondContact O-N 3.32Å; F34-D36 VanDerWaalsContact C-N 3.34Å; F34-D36 PolarHBondContact O-N 3.08Å; F34-V37 PolarHBondContact O-N 3.38Å; F34-V38 HydrophobicContact CD1-CG2 4.18Å; F34-V38 HydrophobicContact CD2-CG2 4.15Å; F34-V38 HydrophobicContact CE1-CG2 3.73Å; F34-V38 HydrophobicContact CE2-CG2 3.68Å; F34-V38 HydrophobicContact CG-CG2 4.4Å; F34-V38 HydrophobicContact CZ-CG2 3.45Å; F34-V38 VanDerWaalsContact CZ-CG2 3.45Å; F34-V38 WeakPolarHBondContact O-CG2 3.33Å; F34-V38 PolarHBondContact O-N 3.38Å; F34-Y78 HydrophobicContact CE2-CD1 4.44Å; F34-Y78 AromaticContact CE2-CE1 3.78Å; F34-Y78 HydrophobicContact CE2-CE1 3.78Å; F34-Y78 HydrophobicContact CZ-CD1 4.46Å; F34-Y78 HydrophobicContact CZ-CE1 4.22Å; F34-A79 HydrophobicContact CZ-CB 4.46Å; F34-Q83 HydrophobicContact CE2-CB 4.19Å; F34-Q83 HydrophobicContact CE2-CG 3.93Å; F34-V85 HydrophobicContact CE1-CG2 3.94Å; F34-V85 HydrophobicContact CE2-CG2 4Å; F34-V85 HydrophobicContact CZ-CG2 3.49Å; F34-V85 VanDerWaalsContact CZ-CG2 3.49Å; F34-Y90 HydrophobicContact CB-CE1 4.3Å; F34-Y90 HydrophobicContact CD1-CD1 4.14Å; F34-Y90 AromaticContact CD1-CE1 3.44Å; F34-Y90 HydrophobicContact CD1-CE1 3.44Å; F34-Y90 VanDerWaalsContact CD1-CE1 3.44Å; F34-Y90 AromaticContact CD1-CZ 3.84Å; F34-Y90 HydrophobicContact CE1-CE1 4.18Å; F34-Y90 HydrophobicContact CG-CE1 4.23Å
35	L	84.3	Confident	83.3	Confident	11 Å²	11	60 Å²	60	6%	0.058	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-39.5	179.9	-70.2	171	0	0	0	112.2	K31 N32 V37 V38 Y39 Y90 E99	K31-L35 HydrophobicContact CD-CD1 4.31Å; K31-L35 HydrophobicContact CG-CD1 3.66Å; K31-L35 HydrophobicContact CG-CG 4.25Å; K31-L35 VanDerWaalsContact O-CG 3.26Å; K31-L35 WeakPolarHBondContact O-CG 3.34Å; K31-L35 PolarHBondContact O-N 3.43Å; N32-L35 PolarHBondContact O-N 3.24Å; L35-V37 VanDerWaalsContact C-N 3.35Å; L35-V37 PolarHBondContact O-N 2.91Å; L35-V38 PolarHBondContact O-N 3.27Å; L35-Y39 WeakPolarHBondContact O-CB 3.23Å; L35-Y39 PolarHBondContact O-N 3.39Å; L35-Y90 HydrophobicContact CD2-CD1 4.44Å; L35-E99 VanDerWaalsContact CD1-OE2 3.28Å; L35-E99 WeakPolarHBondContact CD1-OE2 3.14Å; L35-E99 WeakPolarHBondContact CD2-OE2 3.24Å
36	D	87.2	Confident	84.2	Confident	97 Å²	97	55.1 Å²	55.1	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-61.2	-42.9	174.5	-91.7	-6.5	0	0	0	111.4	N32 F34 Y39 W40	N32-D36 WeakPolarHBondContact O-CB 3.37Å; N32-D36 PolarHBondContact O-N 2.92Å; F34-D36 VanDerWaalsContact C-N 3.34Å; F34-D36 PolarHBondContact O-N 3.08Å; D36-Y39 WeakPolarHBondContact O-CB 3.32Å; D36-Y39 PolarHBondContact O-N 2.89Å; D36-W40 VanDerWaalsContact O-CD1 3.24Å; D36-W40 PolarHBondContact O-N 3.2Å
37	V	86.3	Confident	85.3	Confident	7 Å²	7	57.9 Å²	57.9	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-67.8	-45	177.6	-179.4	0	0	0	0	111.6	I17 F18 A21 D33 F34 L35 Y39 W40 F41	I17-V37 HydrophobicContact CG2-CG2 3.75Å; F18-V37 HydrophobicContact CD2-CG1 3.94Å; F18-V37 HydrophobicContact CD2-CG2 4.37Å; F18-V37 HydrophobicContact CE2-CG1 4.07Å; A21-V37 HydrophobicContact CB-CB 4.09Å; A21-V37 HydrophobicContact CB-CG1 3.4Å; A21-V37 VanDerWaalsContact CB-CG1 3.4Å; A21-V37 HydrophobicContact CB-CG2 4.07Å; D33-V37 WeakPolarHBondContact O-CG2 2.94Å; D33-V37 PolarHBondContact O-N 3.19Å; D33-V37 VanDerWaalsContact O-N 3.16Å; F34-V37 PolarHBondContact O-N 3.38Å; L35-V37 VanDerWaalsContact C-N 3.35Å; L35-V37 PolarHBondContact O-N 2.91Å; V37-Y39 VanDerWaalsContact C-N 3.27Å; V37-Y39 PolarHBondContact O-N 2.99Å; V37-W40 PolarHBondContact O-N 3.2Å; V37-F41 HydrophobicContact CG1-CD2 3.71Å; V37-F41 HydrophobicContact CG1-CE2 4.01Å; V37-F41 WeakPolarHBondContact O-CB 3.3Å; V37-F41 PolarHBondContact O-N 2.95Å
38	V	86	Confident	86.5	Confident	7 Å²	7	56.9 Å²	56.9	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-58.5	-43.1	175.6	173.4	0	0	0	0	110.5	F34 L35 F41 R42 V75 Y78	F34-V38 HydrophobicContact CD1-CG2 4.18Å; F34-V38 HydrophobicContact CD2-CG2 4.15Å; F34-V38 HydrophobicContact CE1-CG2 3.73Å; F34-V38 HydrophobicContact CE2-CG2 3.68Å; F34-V38 HydrophobicContact CG-CG2 4.4Å; F34-V38 HydrophobicContact CZ-CG2 3.45Å; F34-V38 VanDerWaalsContact CZ-CG2 3.45Å; F34-V38 WeakPolarHBondContact O-CG2 3.33Å; F34-V38 PolarHBondContact O-N 3.38Å; L35-V38 PolarHBondContact O-N 3.27Å; V38-F41 PolarHBondContact O-N 3.45Å; V38-R42 VanDerWaalsContact O-CB 3.28Å; V38-R42 WeakPolarHBondContact O-CB 3.39Å; V38-R42 PolarHBondContact O-N 2.84Å; V38-V75 HydrophobicContact CG1-CG1 4.43Å; V38-Y78 HydrophobicContact CG2-CD1 3.81Å; V38-Y78 HydrophobicContact CG2-CE1 3.6Å
39	Y	87.9	Confident	87.3	Confident	76 Å²	76	56.6 Å²	56.6	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-58	-51.6	176.7	176.5	-86	0	0	0	111.1	L35 D36 V37 R42 Q43 T103	L35-Y39 WeakPolarHBondContact O-CB 3.23Å; L35-Y39 PolarHBondContact O-N 3.39Å; D36-Y39 WeakPolarHBondContact O-CB 3.32Å; D36-Y39 PolarHBondContact O-N 2.89Å; V37-Y39 VanDerWaalsContact C-N 3.27Å; V37-Y39 PolarHBondContact O-N 2.99Å; Y39-R42 WeakPolarHBondContact O-CB 3.37Å; Y39-R42 PolarHBondContact O-N 3.29Å; Y39-Q43 PolarHBondContact O-N 3.45Å; Y39-T103 HydrophobicContact CE2-CG2 4.19Å; Y39-T103 WeakPolarHBondContact CE2-OG1 3.42Å; Y39-T103 WeakPolarHBondContact OH-CB 3.43Å
40	W	89	Confident	88.3	Confident	155 Å²	155	49.3 Å²	49.3	59%	0.587	24%	0.24	S	C	*	.	H	α-helix	trans	-64.7	-42.3	179.7	-86.1	105.6	0	0	0	112.8	D36 V37 R42 Q43 V44	D36-W40 VanDerWaalsContact O-CD1 3.24Å; D36-W40 PolarHBondContact O-N 3.2Å; V37-W40 PolarHBondContact O-N 3.2Å; W40-R42 VanDerWaalsContact C-N 3.31Å; W40-R42 PolarHBondContact O-N 3.48Å; W40-Q43 PolarHBondContact O-N 3.16Å; W40-V44 WeakPolarHBondContact O-CG2 3.4Å; W40-V44 PolarHBondContact O-N 3.44Å
41	F	88.7	Confident	89	Confident	47 Å²	47	48.8 Å²	48.8	21%	0.206	24%	0.239	C	C	.	.	H	α-helix	trans	-58.6	-44.9	174.5	-103.7	-92.2	0	0	0	111.6	F18 L22 V37 V38 Q43 V44 F45 F74	F18-F41 HydrophobicContact CD2-CE2 4.5Å; F18-F41 AromaticContact CE1-CE2 3.82Å; F18-F41 HydrophobicContact CE1-CE2 3.82Å; F18-F41 HydrophobicContact CE1-CZ 4.31Å; F18-F41 AromaticContact CE2-CD2 3.78Å; F18-F41 HydrophobicContact CE2-CD2 3.78Å; F18-F41 AromaticContact CE2-CE2 3.65Å; F18-F41 HydrophobicContact CE2-CE2 3.65Å; F18-F41 AromaticContact CZ-CD2 3.74Å; F18-F41 HydrophobicContact CZ-CD2 3.74Å; F18-F41 AromaticContact CZ-CE2 3.24Å; F18-F41 HydrophobicContact CZ-CE2 3.24Å; F18-F41 AromaticContact CZ-CZ 3.99Å; F18-F41 HydrophobicContact CZ-CZ 3.99Å; L22-F41 HydrophobicContact CD2-CZ 3.75Å; L22-F41 HydrophobicContact CG-CZ 4.44Å; V37-F41 HydrophobicContact CG1-CD2 3.71Å; V37-F41 HydrophobicContact CG1-CE2 4.01Å; V37-F41 WeakPolarHBondContact O-CB 3.3Å; V37-F41 PolarHBondContact O-N 2.95Å; V38-F41 PolarHBondContact O-N 3.45Å; F41-Q43 VanDerWaalsContact C-N 3.31Å; F41-Q43 PolarHBondContact O-N 2.84Å; F41-V44 PolarHBondContact O-N 3.43Å; F41-F45 WeakPolarHBondContact O-CB 3.45Å; F41-F45 PolarHBondContact O-N 2.91Å; F41-F74 HydrophobicContact CB-CE1 4.34Å; F41-F74 HydrophobicContact CD1-CZ 4.09Å
42	R	88	Confident	89.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-40.1	177.1	-168.2	-170.1	-63	-130	19.4	111.4	V38 Y39 W40 F45 A46 N71 V75 I96 I97 E99 A104	V38-R42 VanDerWaalsContact O-CB 3.28Å; V38-R42 WeakPolarHBondContact O-CB 3.39Å; V38-R42 PolarHBondContact O-N 2.84Å; Y39-R42 WeakPolarHBondContact O-CB 3.37Å; Y39-R42 PolarHBondContact O-N 3.29Å; W40-R42 VanDerWaalsContact C-N 3.31Å; W40-R42 PolarHBondContact O-N 3.48Å; R42-F45 PolarHBondContact O-N 3.34Å; R42-A46 WeakPolarHBondContact O-CB 3.39Å; R42-A46 PolarHBondContact O-N 3.45Å; R42-N71 VanDerWaalsContact CG-ND2 3.29Å; R42-N71 WeakPolarHBondContact CG-ND2 3.33Å; R42-N71 PolarHBondContact NH1-OD1 3.17Å; R42-V75 HydrophobicContact CG-CG2 4.4Å; R42-V75 VanDerWaalsContact NE-CG2 3.34Å; R42-I96 PolarHBondContact NH2-O 3.49Å; R42-I97 PolarHBondContact NH1-O 2.98Å; R42-I97 PolarHBondContact NH2-O 3.33Å; R42-E99 PolarHBondContact NH2-O 3.48Å; R42-A104 HydrophobicContact CG-CB 3.73Å
43	Q	92.2	Very high	90	Very high	18 Å²	18	46.1 Å²	46.1	8%	0.084	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-44.7	179.6	-142.2	65.9	13.2	0	0	111.7	Y39 W40 F41 A46 I47 T103 C107	Y39-Q43 PolarHBondContact O-N 3.45Å; W40-Q43 PolarHBondContact O-N 3.16Å; F41-Q43 VanDerWaalsContact C-N 3.31Å; F41-Q43 PolarHBondContact O-N 2.84Å; Q43-A46 PolarHBondContact O-N 3.1Å; Q43-I47 WeakPolarHBondContact O-CG1 3.42Å; Q43-I47 PolarHBondContact O-N 3.06Å; Q43-I47 VanDerWaalsContact O-N 3.1Å; Q43-T103 VanDerWaalsContact NE2-C 3.32Å; Q43-T103 PolarHBondContact NE2-O 3.09Å; Q43-C107 HydrophobicContact CG-CB 4.45Å; Q43-C107 PolarHBondContact NE2-SG 3.39Å
44	V	92.7	Very high	90.3	Very high	78 Å²	78	43.5 Å²	43.5	47%	0.473	21%	0.214	S	C	.	.	H	α-helix	trans	-61.8	-45.6	174.7	173.5	0	0	0	0	110.6	W40 F41 A46 I47 I48	W40-V44 WeakPolarHBondContact O-CG2 3.4Å; W40-V44 PolarHBondContact O-N 3.44Å; F41-V44 PolarHBondContact O-N 3.43Å; V44-A46 PolarHBondContact O-N 2.92Å; V44-I47 PolarHBondContact O-N 2.82Å; V44-I48 HydrophobicContact CG1-CD1 3.88Å; V44-I48 WeakPolarHBondContact O-CG1 3.23Å; V44-I48 PolarHBondContact O-N 2.98Å
45	F	92.4	Very high	90.6	Very high	48 Å²	48	47.6 Å²	47.6	21%	0.211	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-44.1	176.9	-177.7	-101	0	0	0	112.3	F41 R42 I47 I48 V49 F74	F41-F45 WeakPolarHBondContact O-CB 3.45Å; F41-F45 PolarHBondContact O-N 2.91Å; R42-F45 PolarHBondContact O-N 3.34Å; F45-I47 VanDerWaalsContact C-N 3.33Å; F45-I47 PolarHBondContact O-N 3.43Å; F45-I48 PolarHBondContact O-N 3.45Å; F45-V49 HydrophobicContact CD1-CG2 4.04Å; F45-V49 HydrophobicContact CD2-CG2 4.37Å; F45-V49 HydrophobicContact CE1-CG2 3.61Å; F45-V49 HydrophobicContact CE2-CG2 3.96Å; F45-V49 HydrophobicContact CG-CG2 4.4Å; F45-V49 HydrophobicContact CZ-CG2 3.57Å; F45-V49 WeakPolarHBondContact O-CG2 3.22Å; F45-V49 PolarHBondContact O-N 3.45Å; F45-F74 HydrophobicContact CB-CD1 4.47Å; F45-F74 HydrophobicContact CB-CE1 4.28Å; F45-F74 HydrophobicContact CB-CZ 4.44Å; F45-F74 HydrophobicContact CD1-CB 4.38Å; F45-F74 HydrophobicContact CD1-CD1 4.39Å; F45-F74 HydrophobicContact CD1-CG 4.21Å; F45-F74 AromaticContact CD2-CD2 3.95Å; F45-F74 HydrophobicContact CD2-CD2 3.95Å; F45-F74 HydrophobicContact CD2-CE2 4.06Å; F45-F74 HydrophobicContact CD2-CG 4.32Å; F45-F74 HydrophobicContact CE1-CB 4.12Å; F45-F74 HydrophobicContact CE1-CG 4.34Å; F45-F74 HydrophobicContact CE2-CD2 4.01Å; F45-F74 HydrophobicContact CE2-CE2 4.48Å; F45-F74 HydrophobicContact CE2-CG 4.45Å; F45-F74 HydrophobicContact CG-CD1 4.3Å; F45-F74 HydrophobicContact CG-CD2 4.27Å; F45-F74 HydrophobicContact CG-CE1 4.48Å; F45-F74 HydrophobicContact CG-CE2 4.45Å; F45-F74 HydrophobicContact CG-CG 4.19Å; F45-F74 HydrophobicContact CZ-CB 4.32Å; F45-F74 HydrophobicContact CZ-CD2 4.38Å; F45-F74 HydrophobicContact CZ-CG 4.45Å
46	A	94.4	Very high	90.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-40.4	178.4	0	0	0	0	0	112.5	R42 Q43 V44 G50 F67 A104 F108	R42-A46 WeakPolarHBondContact O-CB 3.39Å; R42-A46 PolarHBondContact O-N 3.45Å; Q43-A46 PolarHBondContact O-N 3.1Å; V44-A46 PolarHBondContact O-N 2.92Å; A46-G50 PolarHBondContact O-N 2.79Å; A46-F67 HydrophobicContact CB-CE2 3.85Å; A46-F67 HydrophobicContact CB-CZ 4.35Å; A46-A104 HydrophobicContact CB-CB 4.16Å; A46-A104 WeakPolarHBondContact CB-O 3.35Å; A46-F108 HydrophobicContact CB-CB 4.24Å
47	I	94.4	Very high	90.6	Very high	76 Å²	76	47.5 Å²	47.5	39%	0.39	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-46.4	175.5	-66.9	165.6	0	0	0	110.4	Q43 V44 F45 V49 G50 V51 C107	Q43-I47 WeakPolarHBondContact O-CG1 3.42Å; Q43-I47 PolarHBondContact O-N 3.06Å; Q43-I47 VanDerWaalsContact O-N 3.1Å; V44-I47 PolarHBondContact O-N 2.82Å; F45-I47 VanDerWaalsContact C-N 3.33Å; F45-I47 PolarHBondContact O-N 3.43Å; I47-V49 PolarHBondContact O-N 3.5Å; I47-G50 PolarHBondContact O-N 3.05Å; I47-V51 HydrophobicContact CG2-CG2 4.44Å; I47-V51 VanDerWaalsContact O-CG2 3.28Å; I47-V51 WeakPolarHBondContact O-CG2 3.26Å; I47-V51 PolarHBondContact O-N 3.09Å; I47-C107 HydrophobicContact CG1-CB 4.32Å
48	I	94.7	Very high	90.3	Very high	95 Å²	95	51.2 Å²	51.2	49%	0.487	27%	0.265	S	S	.	.	H	α-helix	trans	-59.7	-49.5	178.7	-67.3	166.6	0	0	0	110.4	V44 F45 G50 V51 V52	V44-I48 HydrophobicContact CG1-CD1 3.88Å; V44-I48 WeakPolarHBondContact O-CG1 3.23Å; V44-I48 PolarHBondContact O-N 2.98Å; F45-I48 PolarHBondContact O-N 3.45Å; I48-G50 PolarHBondContact O-N 3.49Å; I48-V51 PolarHBondContact O-N 3.24Å; I48-V52 HydrophobicContact CG2-CG2 4.44Å; I48-V52 VanDerWaalsContact O-CG2 3.28Å; I48-V52 WeakPolarHBondContact O-CG2 3.46Å; I48-V52 PolarHBondContact O-N 3.36Å
49	V	93	Very high	90.1	Very high	16 Å²	16	54.9 Å²	54.9	10%	0.097	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-43.3	178.9	173	0	0	0	0	111.1	F45 I47 V51 V52 W53 F108	F45-V49 HydrophobicContact CD1-CG2 4.04Å; F45-V49 HydrophobicContact CD2-CG2 4.37Å; F45-V49 HydrophobicContact CE1-CG2 3.61Å; F45-V49 HydrophobicContact CE2-CG2 3.96Å; F45-V49 HydrophobicContact CG-CG2 4.4Å; F45-V49 HydrophobicContact CZ-CG2 3.57Å; F45-V49 WeakPolarHBondContact O-CG2 3.22Å; F45-V49 PolarHBondContact O-N 3.45Å; I47-V49 PolarHBondContact O-N 3.5Å; V49-V51 PolarHBondContact O-N 2.93Å; V49-V52 PolarHBondContact O-N 2.93Å; V49-W53 HydrophobicContact CG1-CD2 4.46Å; V49-W53 HydrophobicContact CG1-CE3 4.36Å; V49-W53 WeakPolarHBondContact O-CB 3.39Å; V49-W53 PolarHBondContact O-N 3.46Å; V49-F108 HydrophobicContact CG1-CD2 4.28Å; V49-F108 HydrophobicContact CG1-CE2 4.15Å
50	G	93.3	Very high	89.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-42.9	178	0	0	0	0	0	112.6	A46 I47 I48 W53 G54 S111 W112	A46-G50 PolarHBondContact O-N 2.79Å; I47-G50 PolarHBondContact O-N 3.05Å; I48-G50 PolarHBondContact O-N 3.49Å; G50-W53 PolarHBondContact O-N 3.03Å; G50-G54 PolarHBondContact O-N 3Å; G50-S111 WeakPolarHBondContact CA-OG 3.39Å; G50-W112 WeakPolarHBondContact O-CA 3.13Å
51	V	93.9	Very high	90	Very high	59 Å²	59	53 Å²	53	36%	0.358	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-49.3	173.8	172.3	0	0	0	0	110.7	I47 I48 V49 W53 G54 V55 T115	I47-V51 HydrophobicContact CG2-CG2 4.44Å; I47-V51 VanDerWaalsContact O-CG2 3.28Å; I47-V51 WeakPolarHBondContact O-CG2 3.26Å; I47-V51 PolarHBondContact O-N 3.09Å; I48-V51 PolarHBondContact O-N 3.24Å; V49-V51 PolarHBondContact O-N 2.93Å; V51-W53 VanDerWaalsContact C-N 3.34Å; V51-W53 PolarHBondContact O-N 3.18Å; V51-G54 PolarHBondContact O-N 2.77Å; V51-V55 WeakPolarHBondContact O-CG2 3.35Å; V51-V55 PolarHBondContact O-N 3.05Å; V51-T115 HydrophobicContact CG1-CG2 4.16Å; V51-T115 WeakPolarHBondContact O-CG2 3.28Å
52	V	93.5	Very high	90	Very high	74 Å²	74	56.3 Å²	56.3	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-43.4	-179.7	175	0	0	0	0	111.2	I48 V49 V55 A56	I48-V52 HydrophobicContact CG2-CG2 4.44Å; I48-V52 VanDerWaalsContact O-CG2 3.28Å; I48-V52 WeakPolarHBondContact O-CG2 3.46Å; I48-V52 PolarHBondContact O-N 3.36Å; V49-V52 PolarHBondContact O-N 2.93Å; V52-V55 PolarHBondContact O-N 3.31Å; V52-A56 WeakPolarHBondContact O-CB 3.41Å; V52-A56 PolarHBondContact O-N 3.19Å
53	W	90.6	Very high	90.1	Very high	49 Å²	49	56.3 Å²	56.3	19%	0.186	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-35	178.8	-99.6	-131.1	0	0	0	112.6	V49 G50 V51 A56 S57 F58 M66	V49-W53 HydrophobicContact CG1-CD2 4.46Å; V49-W53 HydrophobicContact CG1-CE3 4.36Å; V49-W53 WeakPolarHBondContact O-CB 3.39Å; V49-W53 PolarHBondContact O-N 3.46Å; G50-W53 PolarHBondContact O-N 3.03Å; V51-W53 VanDerWaalsContact C-N 3.34Å; V51-W53 PolarHBondContact O-N 3.18Å; W53-A56 PolarHBondContact O-N 3.44Å; W53-S57 PolarHBondContact O-N 2.83Å; W53-F58 HydrophobicContact CB-CB 4.45Å; W53-F58 AromaticContact CD1-CD2 3.99Å; W53-F58 AromaticContact CD1-CG 3.95Å; W53-F58 AromaticContact CD2-CD2 3.93Å; W53-F58 HydrophobicContact CD2-CD2 3.93Å; W53-F58 AromaticContact CE2-CD2 3.81Å; W53-F58 HydrophobicContact CG-CB 4.07Å; W53-F58 HydrophobicContact CG-CD2 4.04Å; W53-F58 HydrophobicContact CG-CG 4.38Å; W53-F58 HydrophobicContact CZ2-CD2 4.32Å; W53-F58 HydrophobicContact CZ2-CE2 4.2Å; W53-F58 AromaticContact NE1-CD2 3.87Å; W53-F58 AromaticContact NE1-CG 3.93Å; W53-F58 PolarHBondContact O-N 3.41Å; W53-M66 HydrophobicContact CZ2-CB 4.21Å; W53-M66 HydrophobicContact CZ2-CE 4.02Å; W53-M66 HydrophobicContact CZ2-SD 3.73Å
54	G	90.3	Very high	90.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-66.2	-41.9	175.7	0	0	0	0	0	112.3	G50 V51 H120	G50-G54 PolarHBondContact O-N 3Å; V51-G54 PolarHBondContact O-N 2.77Å; G54-H120 PolarHBondContact O-CE1 3.34Å; G54-H120 VanDerWaalsContact O-CE1 3.27Å
55	V	90.1	Very high	90.1	Very high	87 Å²	87	57 Å²	57	53%	0.527	32%	0.317	S	S	.	.	H	α-helix	trans	-69	-41.3	173.9	177.8	0	0	0	0	111.3	V51 V52 S57 T115	V51-V55 WeakPolarHBondContact O-CG2 3.35Å; V51-V55 PolarHBondContact O-N 3.05Å; V52-V55 PolarHBondContact O-N 3.31Å; V55-S57 PolarHBondContact O-N 3.41Å; V55-S57 VanDerWaalsContact O-N 3.1Å; V55-T115 HydrophobicContact CG2-CG2 3.57Å
56	A	88.3	Confident	90.1	Very high	51 Å²	51	57 Å²	57	42%	0.421	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	5.2	-179.6	0	0	0	0	0	114.4	V52 W53 F58	V52-A56 WeakPolarHBondContact O-CB 3.41Å; V52-A56 PolarHBondContact O-N 3.19Å; W53-A56 PolarHBondContact O-N 3.44Å; A56-F58 HydrophobicContact CB-CD2 3.86Å; A56-F58 HydrophobicContact CB-CE2 4.2Å; A56-F58 PolarHBondContact O-N 2.89Å
57	S	82.8	Confident	90	Very high	54 Å²	54	57 Å²	57	38%	0.378	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	23.7	178.2	-25.3	0	0	0	0	114	W53 V55 T59 H120	W53-S57 PolarHBondContact O-N 2.83Å; V55-S57 PolarHBondContact O-N 3.41Å; V55-S57 VanDerWaalsContact O-N 3.1Å; S57-T59 PolarHBondContact O-N 3.36Å; S57-H120 WeakPolarHBondContact CB-NE2 3.11Å; S57-H120 PolarHBondContact OG-CE1 3.37Å; S57-H120 PolarHBondContact OG-NE2 3.05Å
58	F	80.2	Confident	90	Very high	85 Å²	85	56.6 Å²	56.6	37%	0.373	31%	0.314	S	S	.	.			trans	-64.5	127.4	175.9	-89.6	-67.7	0	0	0	108.5	W53 A56 A63 M66 W112	W53-F58 HydrophobicContact CB-CB 4.45Å; W53-F58 AromaticContact CD1-CD2 3.99Å; W53-F58 AromaticContact CD1-CG 3.95Å; W53-F58 AromaticContact CD2-CD2 3.93Å; W53-F58 HydrophobicContact CD2-CD2 3.93Å; W53-F58 AromaticContact CE2-CD2 3.81Å; W53-F58 HydrophobicContact CG-CB 4.07Å; W53-F58 HydrophobicContact CG-CD2 4.04Å; W53-F58 HydrophobicContact CG-CG 4.38Å; W53-F58 HydrophobicContact CZ2-CD2 4.32Å; W53-F58 HydrophobicContact CZ2-CE2 4.2Å; W53-F58 AromaticContact NE1-CD2 3.87Å; W53-F58 AromaticContact NE1-CG 3.93Å; W53-F58 PolarHBondContact O-N 3.41Å; A56-F58 HydrophobicContact CB-CD2 3.86Å; A56-F58 HydrophobicContact CB-CE2 4.2Å; A56-F58 PolarHBondContact O-N 2.89Å; F58-A63 HydrophobicContact CB-CB 4.29Å; F58-M66 HydrophobicContact CD1-CE 3.76Å; F58-M66 HydrophobicContact CE1-CE 3.65Å; F58-M66 HydrophobicContact CG-CE 4.29Å; F58-M66 HydrophobicContact CZ-CE 4.08Å; F58-W112 WeakPolarHBondContact O-CZ2 3.14Å; F58-W112 PolarHBondContact O-NE1 3.28Å; F58-W112 VanDerWaalsContact O-NE1 3.16Å
59	T	81.3	Confident	89.9	Confident	85 Å²	85	56.8 Å²	56.8	52%	0.521	32%	0.32	S	S	.	.			trans	-125.1	156.1	-177.5	51.9	0	0	0	0	111.7	S57 Y116	S57-T59 PolarHBondContact O-N 3.36Å; T59-Y116 HydrophobicContact CG2-CE2 3.61Å; T59-Y116 WeakPolarHBondContact CG2-OH 3.3Å
60	G	85.1	Confident	89.9	Confident	48 Å²	48	58.5 Å²	58.5	50%	0.495	33%	0.33	S	S	.	.	S	Bend	trans	77.5	-166.5	173.1	0	0	0	0	0	115	M62 A63	G60-M62 PolarHBondContact O-N 3.45Å; G60-A63 PolarHBondContact O-N 3.29Å
61	F	89.3	Confident	89.8	Confident	142 Å²	142	58.5 Å²	58.5	62%	0.623	33%	0.33	S	S	*	.	H	α-helix	trans	-62.8	-26	-172.7	-177	-116.3	0	0	0	113.8	A63 I64 L65	F61-A63 VanDerWaalsContact C-N 3.3Å; F61-A63 PolarHBondContact O-N 2.91Å; F61-I64 PolarHBondContact O-N 3.42Å; F61-I64 VanDerWaalsContact O-N 3.16Å; F61-L65 HydrophobicContact CD1-CD1 3.65Å; F61-L65 HydrophobicContact CD1-CG 3.94Å; F61-L65 HydrophobicContact CE1-CD1 3.32Å; F61-L65 HydrophobicContact CE1-CD2 3.93Å; F61-L65 HydrophobicContact CE1-CG 3.5Å; F61-L65 VanDerWaalsContact CE1-CG 3.5Å; F61-L65 HydrophobicContact CE2-CG 4.4Å; F61-L65 HydrophobicContact CZ-CD1 4.08Å; F61-L65 HydrophobicContact CZ-CD2 3.82Å; F61-L65 HydrophobicContact CZ-CG 3.74Å; F61-L65 PolarHBondContact O-N 2.81Å
62	M	90.2	Very high	89.6	Confident	117 Å²	117	59.1 Å²	59.1	58%	0.576	33%	0.331	S	S	*	.	H	α-helix	trans	-65.5	-34.2	-177.4	-157.8	64.3	-175.2	0	0	112.5	G60 I64 L65 M66	G60-M62 PolarHBondContact O-N 3.45Å; M62-I64 VanDerWaalsContact C-N 3.34Å; M62-L65 PolarHBondContact O-N 2.94Å; M62-L65 HydrophobicContact SD-CD1 4.25Å; M62-M66 HydrophobicContact CG-CE 4.08Å; M62-M66 WeakPolarHBondContact O-CB 3.18Å; M62-M66 WeakPolarHBondContact O-CG 3.35Å; M62-M66 PolarHBondContact O-N 2.67Å
63	A	90.1	Very high	89.6	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.008	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-43.6	173.6	0	0	0	0	0	111.9	F58 G60 F61 M66 F67 W112	F58-A63 HydrophobicContact CB-CB 4.29Å; G60-A63 PolarHBondContact O-N 3.29Å; F61-A63 VanDerWaalsContact C-N 3.3Å; F61-A63 PolarHBondContact O-N 2.91Å; A63-M66 PolarHBondContact O-N 3.46Å; A63-F67 PolarHBondContact O-N 2.97Å; A63-W112 HydrophobicContact CB-CH2 3.31Å; A63-W112 HydrophobicContact CB-CZ2 3.31Å; A63-W112 HydrophobicContact CB-CZ3 3.97Å
64	I	92.2	Very high	89.6	Confident	39 Å²	39	60 Å²	60	20%	0.2	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-45.4	179.3	-62.2	171.2	0	0	0	110.5	F61 M62 M66 F67 F68 F105 W112	F61-I64 PolarHBondContact O-N 3.42Å; F61-I64 VanDerWaalsContact O-N 3.16Å; M62-I64 VanDerWaalsContact C-N 3.34Å; I64-M66 VanDerWaalsContact C-N 3.34Å; I64-M66 PolarHBondContact O-N 3.4Å; I64-F67 WeakPolarHBondContact O-CB 3.39Å; I64-F67 PolarHBondContact O-N 2.93Å; I64-F68 HydrophobicContact CG2-CD2 3.92Å; I64-F68 HydrophobicContact CG2-CE2 3.64Å; I64-F68 VanDerWaalsContact O-CD2 3.27Å; I64-F68 WeakPolarHBondContact O-CD2 3.46Å; I64-F68 PolarHBondContact O-N 3.48Å; I64-F68 VanDerWaalsContact O-N 3.1Å; I64-F105 HydrophobicContact CG2-CE2 4.01Å; I64-W112 HydrophobicContact CD1-CZ3 4.47Å; I64-W112 HydrophobicContact CG1-CH2 4.39Å; I64-W112 HydrophobicContact CG1-CZ3 3.86Å
65	L	93	Very high	89.5	Confident	70 Å²	70	60.1 Å²	60.1	37%	0.366	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-45	175.6	-80.3	177.3	0	0	0	112	F61 M62 F67 F68 V69	F61-L65 HydrophobicContact CD1-CD1 3.65Å; F61-L65 HydrophobicContact CD1-CG 3.94Å; F61-L65 HydrophobicContact CE1-CD1 3.32Å; F61-L65 HydrophobicContact CE1-CD2 3.93Å; F61-L65 HydrophobicContact CE1-CG 3.5Å; F61-L65 VanDerWaalsContact CE1-CG 3.5Å; F61-L65 HydrophobicContact CE2-CG 4.4Å; F61-L65 HydrophobicContact CZ-CD1 4.08Å; F61-L65 HydrophobicContact CZ-CD2 3.82Å; F61-L65 HydrophobicContact CZ-CG 3.74Å; F61-L65 PolarHBondContact O-N 2.81Å; M62-L65 PolarHBondContact O-N 2.94Å; M62-L65 HydrophobicContact SD-CD1 4.25Å; L65-F67 VanDerWaalsContact C-N 3.27Å; L65-F67 PolarHBondContact O-N 3.38Å; L65-F68 PolarHBondContact O-N 3.15Å; L65-V69 WeakPolarHBondContact O-CG2 3.28Å; L65-V69 PolarHBondContact O-N 3.47Å
66	M	92.1	Very high	89.4	Confident	49 Å²	49	61.5 Å²	61.5	24%	0.241	34%	0.337	C	S	.	.	H	α-helix	trans	-62.3	-36.2	178	-76.1	-167.4	-81.2	0	0	112	W53 F58 M62 A63 I64 T70	W53-M66 HydrophobicContact CZ2-CB 4.21Å; W53-M66 HydrophobicContact CZ2-CE 4.02Å; W53-M66 HydrophobicContact CZ2-SD 3.73Å; F58-M66 HydrophobicContact CD1-CE 3.76Å; F58-M66 HydrophobicContact CE1-CE 3.65Å; F58-M66 HydrophobicContact CG-CE 4.29Å; F58-M66 HydrophobicContact CZ-CE 4.08Å; M62-M66 HydrophobicContact CG-CE 4.08Å; M62-M66 WeakPolarHBondContact O-CB 3.18Å; M62-M66 WeakPolarHBondContact O-CG 3.35Å; M62-M66 PolarHBondContact O-N 2.67Å; A63-M66 PolarHBondContact O-N 3.46Å; I64-M66 VanDerWaalsContact C-N 3.34Å; I64-M66 PolarHBondContact O-N 3.4Å; M66-T70 WeakPolarHBondContact O-CB 3.33Å; M66-T70 WeakPolarHBondContact O-CG2 3.37Å; M66-T70 PolarHBondContact O-N 2.87Å; M66-T70 PolarHBondContact O-OG1 3.31Å
67	F	92.5	Very high	89.4	Confident	1 Å²	1	60.8 Å²	60.8	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-60.4	-50.3	171.9	171.6	-98.1	0	0	0	111.7	A46 A63 I64 L65 V69 T70 N71 A104 F105 F108	A46-F67 HydrophobicContact CB-CE2 3.85Å; A46-F67 HydrophobicContact CB-CZ 4.35Å; A63-F67 PolarHBondContact O-N 2.97Å; I64-F67 WeakPolarHBondContact O-CB 3.39Å; I64-F67 PolarHBondContact O-N 2.93Å; L65-F67 VanDerWaalsContact C-N 3.27Å; L65-F67 PolarHBondContact O-N 3.38Å; F67-V69 VanDerWaalsContact C-N 3.34Å; F67-V69 PolarHBondContact O-N 2.83Å; F67-T70 PolarHBondContact O-N 3.06Å; F67-T70 PolarHBondContact O-OG1 3.02Å; F67-N71 HydrophobicContact CE1-CB 4.42Å; F67-N71 HydrophobicContact CE2-CB 4.36Å; F67-N71 HydrophobicContact CZ-CB 4.23Å; F67-N71 WeakPolarHBondContact O-CB 3.18Å; F67-N71 PolarHBondContact O-N 2.68Å; F67-A104 HydrophobicContact CZ-CB 4.12Å; F67-F105 AromaticContact CD1-CD2 3.98Å; F67-F105 HydrophobicContact CD1-CD2 3.98Å; F67-F105 HydrophobicContact CE1-CB 3.89Å; F67-F105 AromaticContact CE1-CD2 3.94Å; F67-F105 HydrophobicContact CE1-CD2 3.94Å; F67-F105 HydrophobicContact CE1-CG 4.43Å; F67-F105 HydrophobicContact CZ-CB 4.47Å; F67-F108 HydrophobicContact CB-CD1 4.02Å; F67-F108 HydrophobicContact CB-CD2 4.31Å; F67-F108 HydrophobicContact CB-CE1 3.84Å; F67-F108 HydrophobicContact CB-CE2 4.14Å; F67-F108 HydrophobicContact CB-CG 4.25Å; F67-F108 HydrophobicContact CB-CZ 3.91Å; F67-F108 HydrophobicContact CD1-CD1 4.12Å; F67-F108 HydrophobicContact CD1-CG 4.37Å; F67-F108 HydrophobicContact CD2-CB 3.67Å; F67-F108 AromaticContact CD2-CD1 3.93Å; F67-F108 HydrophobicContact CD2-CD1 3.93Å; F67-F108 AromaticContact CD2-CD2 3.57Å; F67-F108 HydrophobicContact CD2-CD2 3.57Å; F67-F108 HydrophobicContact CD2-CE2 4.21Å; F67-F108 AromaticContact CD2-CG 3.41Å; F67-F108 HydrophobicContact CD2-CG 3.41Å; F67-F108 VanDerWaalsContact CD2-CG 3.41Å; F67-F108 HydrophobicContact CE1-CB 4.46Å; F67-F108 HydrophobicContact CE2-CB 3.46Å; F67-F108 VanDerWaalsContact CE2-CB 3.46Å; F67-F108 HydrophobicContact CE2-CD1 4.48Å; F67-F108 HydrophobicContact CE2-CD2 4.21Å; F67-F108 AromaticContact CE2-CG 3.8Å; F67-F108 HydrophobicContact CE2-CG 3.8Å; F67-F108 HydrophobicContact CG-CB 4.25Å; F67-F108 AromaticContact CG-CD1 3.73Å; F67-F108 HydrophobicContact CG-CD1 3.73Å; F67-F108 HydrophobicContact CG-CD2 4.1Å; F67-F108 HydrophobicContact CG-CE1 4.09Å; F67-F108 HydrophobicContact CG-CE2 4.43Å; F67-F108 AromaticContact CG-CG 3.73Å; F67-F108 HydrophobicContact CG-CG 3.73Å; F67-F108 HydrophobicContact CG-CZ 4.43Å; F67-F108 HydrophobicContact CZ-CB 3.9Å; F67-F108 HydrophobicContact CZ-CG 4.42Å
68	F	93.2	Very high	89.6	Confident	66 Å²	66	59.1 Å²	59.1	29%	0.289	32%	0.317	S	S	.	.	H	α-helix	trans	-60.2	-43.7	179.3	-79.4	-71.6	0	0	0	112.4	I64 L65 N71 I72 L101 F105	I64-F68 HydrophobicContact CG2-CD2 3.92Å; I64-F68 HydrophobicContact CG2-CE2 3.64Å; I64-F68 VanDerWaalsContact O-CD2 3.27Å; I64-F68 WeakPolarHBondContact O-CD2 3.46Å; I64-F68 PolarHBondContact O-N 3.48Å; I64-F68 VanDerWaalsContact O-N 3.1Å; L65-F68 PolarHBondContact O-N 3.15Å; F68-N71 PolarHBondContact O-N 3.2Å; F68-I72 WeakPolarHBondContact O-CB 3.28Å; F68-I72 WeakPolarHBondContact O-CD1 3.18Å; F68-I72 VanDerWaalsContact O-CG1 3.23Å; F68-I72 WeakPolarHBondContact O-CG1 3.47Å; F68-I72 PolarHBondContact O-N 3.17Å; F68-L101 HydrophobicContact CD1-CD1 4.06Å; F68-L101 HydrophobicContact CD1-CD2 4.48Å; F68-L101 HydrophobicContact CE1-CD1 4.02Å; F68-L101 HydrophobicContact CE1-CD2 4.11Å; F68-L101 HydrophobicContact CE1-CG 4.17Å; F68-F105 HydrophobicContact CE2-CD2 4.3Å; F68-F105 HydrophobicContact CE2-CE2 4.28Å; F68-F105 HydrophobicContact CZ-CD2 4.1Å; F68-F105 HydrophobicContact CZ-CE2 4.4Å; F68-F105 HydrophobicContact CZ-CG 4.43Å
69	V	93.1	Very high	89.9	Confident	100 Å²	100	55.1 Å²	55.1	61%	0.606	30%	0.299	S	S	*	.	H	α-helix	trans	-63.6	-50	179	173.4	0	0	0	0	111.1	L65 F67 N71 C73	L65-V69 WeakPolarHBondContact O-CG2 3.28Å; L65-V69 PolarHBondContact O-N 3.47Å; F67-V69 VanDerWaalsContact C-N 3.34Å; F67-V69 PolarHBondContact O-N 2.83Å; V69-N71 VanDerWaalsContact C-N 3.34Å; V69-N71 PolarHBondContact O-N 3Å; V69-C73 VanDerWaalsContact O-CB 3.23Å; V69-C73 WeakPolarHBondContact O-CB 3.47Å; V69-C73 PolarHBondContact O-N 3.24Å
70	T	91.9	Very high	90	Very high	51 Å²	51	52 Å²	52	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-66.2	-36.8	179.8	46.8	0	0	0	0	112.2	M66 F67 C73 F74	M66-T70 WeakPolarHBondContact O-CB 3.33Å; M66-T70 WeakPolarHBondContact O-CG2 3.37Å; M66-T70 PolarHBondContact O-N 2.87Å; M66-T70 PolarHBondContact O-OG1 3.31Å; F67-T70 PolarHBondContact O-N 3.06Å; F67-T70 PolarHBondContact O-OG1 3.02Å; T70-C73 PolarHBondContact O-N 3Å; T70-F74 WeakPolarHBondContact O-CB 3.42Å; T70-F74 PolarHBondContact O-N 3.3Å
71	N	91.4	Very high	89.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.7	-45.8	179	-169	-92.4	0	0	0	112.2	R42 F67 F68 V69 F74 V75 L101	R42-N71 VanDerWaalsContact CG-ND2 3.29Å; R42-N71 WeakPolarHBondContact CG-ND2 3.33Å; R42-N71 PolarHBondContact NH1-OD1 3.17Å; F67-N71 HydrophobicContact CE1-CB 4.42Å; F67-N71 HydrophobicContact CE2-CB 4.36Å; F67-N71 HydrophobicContact CZ-CB 4.23Å; F67-N71 WeakPolarHBondContact O-CB 3.18Å; F67-N71 PolarHBondContact O-N 2.68Å; F68-N71 PolarHBondContact O-N 3.2Å; V69-N71 VanDerWaalsContact C-N 3.34Å; V69-N71 PolarHBondContact O-N 3Å; N71-F74 PolarHBondContact O-N 2.93Å; N71-V75 WeakPolarHBondContact O-CG2 3.38Å; N71-V75 PolarHBondContact O-N 3.03Å; N71-V75 VanDerWaalsContact O-N 3.09Å; N71-L101 WeakPolarHBondContact OD1-CD1 3.49Å
72	I	91.3	Very high	89.6	Confident	73 Å²	73	52.5 Å²	52.5	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-62.3	-46.7	174.5	-67.7	167.3	0	0	0	110.1	F68 F74 V75 Y76 I97	F68-I72 WeakPolarHBondContact O-CB 3.28Å; F68-I72 WeakPolarHBondContact O-CD1 3.18Å; F68-I72 VanDerWaalsContact O-CG1 3.23Å; F68-I72 WeakPolarHBondContact O-CG1 3.47Å; F68-I72 PolarHBondContact O-N 3.17Å; I72-F74 VanDerWaalsContact C-N 3.33Å; I72-F74 PolarHBondContact O-N 3.26Å; I72-V75 PolarHBondContact O-N 3.46Å; I72-Y76 VanDerWaalsContact O-CB 3.24Å; I72-Y76 WeakPolarHBondContact O-CB 3.5Å; I72-Y76 PolarHBondContact O-N 2.89Å; I72-I97 HydrophobicContact CG1-CG2 3.92Å; I72-I97 HydrophobicContact CG2-CD1 4.1Å
73	C	91.7	Very high	89.1	Confident	83 Å²	83	47.4 Å²	47.4	56%	0.561	25%	0.248	S	C	*	.	H	α-helix	trans	-61.4	-42.2	-179.9	-164.8	0	0	0	0	111.7	V69 T70 A77	V69-C73 VanDerWaalsContact O-CB 3.23Å; V69-C73 WeakPolarHBondContact O-CB 3.47Å; V69-C73 PolarHBondContact O-N 3.24Å; T70-C73 PolarHBondContact O-N 3Å; C73-A77 WeakPolarHBondContact O-CB 3.04Å; C73-A77 PolarHBondContact O-N 3.45Å
74	F	91.2	Very high	88.6	Confident	58 Å²	58	55.4 Å²	55.4	25%	0.254	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-48.4	178.2	-179.9	-98.7	0	0	0	112	F41 F45 T70 N71 I72 A77 Y78	F41-F74 HydrophobicContact CB-CE1 4.34Å; F41-F74 HydrophobicContact CD1-CZ 4.09Å; F45-F74 HydrophobicContact CB-CD1 4.47Å; F45-F74 HydrophobicContact CB-CE1 4.28Å; F45-F74 HydrophobicContact CB-CZ 4.44Å; F45-F74 HydrophobicContact CD1-CB 4.38Å; F45-F74 HydrophobicContact CD1-CD1 4.39Å; F45-F74 HydrophobicContact CD1-CG 4.21Å; F45-F74 AromaticContact CD2-CD2 3.95Å; F45-F74 HydrophobicContact CD2-CD2 3.95Å; F45-F74 HydrophobicContact CD2-CE2 4.06Å; F45-F74 HydrophobicContact CD2-CG 4.32Å; F45-F74 HydrophobicContact CE1-CB 4.12Å; F45-F74 HydrophobicContact CE1-CG 4.34Å; F45-F74 HydrophobicContact CE2-CD2 4.01Å; F45-F74 HydrophobicContact CE2-CE2 4.48Å; F45-F74 HydrophobicContact CE2-CG 4.45Å; F45-F74 HydrophobicContact CG-CD1 4.3Å; F45-F74 HydrophobicContact CG-CD2 4.27Å; F45-F74 HydrophobicContact CG-CE1 4.48Å; F45-F74 HydrophobicContact CG-CE2 4.45Å; F45-F74 HydrophobicContact CG-CG 4.19Å; F45-F74 HydrophobicContact CZ-CB 4.32Å; F45-F74 HydrophobicContact CZ-CD2 4.38Å; F45-F74 HydrophobicContact CZ-CG 4.45Å; T70-F74 WeakPolarHBondContact O-CB 3.42Å; T70-F74 PolarHBondContact O-N 3.3Å; N71-F74 PolarHBondContact O-N 2.93Å; I72-F74 VanDerWaalsContact C-N 3.33Å; I72-F74 PolarHBondContact O-N 3.26Å; F74-A77 PolarHBondContact O-N 3.29Å; F74-Y78 WeakPolarHBondContact O-CB 3.36Å; F74-Y78 PolarHBondContact O-N 2.95Å
75	V	88.5	Confident	87.8	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.012	27%	0.274	C	S	.	.	H	α-helix	trans	-68.7	-39.9	-179.3	170.8	0	0	0	0	111.4	V38 R42 N71 I72 Y78 A79 I96 I97	V38-V75 HydrophobicContact CG1-CG1 4.43Å; R42-V75 HydrophobicContact CG-CG2 4.4Å; R42-V75 VanDerWaalsContact NE-CG2 3.34Å; N71-V75 WeakPolarHBondContact O-CG2 3.38Å; N71-V75 PolarHBondContact O-N 3.03Å; N71-V75 VanDerWaalsContact O-N 3.09Å; I72-V75 PolarHBondContact O-N 3.46Å; V75-Y78 PolarHBondContact O-N 2.96Å; V75-A79 WeakPolarHBondContact O-CB 3.29Å; V75-A79 PolarHBondContact O-N 3.4Å; V75-I96 HydrophobicContact CG1-CG2 3.88Å; V75-I97 HydrophobicContact CG1-CG1 4.23Å
76	Y	87.3	Confident	87.1	Confident	116 Å²	116	56 Å²	56	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-46.5	174.4	-175	-97.8	0	0	0	111.3	I72 Y78 A79 A80 Y93	I72-Y76 VanDerWaalsContact O-CB 3.24Å; I72-Y76 WeakPolarHBondContact O-CB 3.5Å; I72-Y76 PolarHBondContact O-N 2.89Å; Y76-Y78 VanDerWaalsContact C-N 3.32Å; Y76-Y78 PolarHBondContact O-N 3.24Å; Y76-A79 PolarHBondContact O-N 3.35Å; Y76-A80 HydrophobicContact CD1-CB 4.38Å; Y76-A80 HydrophobicContact CD2-CB 4.26Å; Y76-A80 HydrophobicContact CE1-CB 4.1Å; Y76-A80 HydrophobicContact CE2-CB 3.97Å; Y76-A80 HydrophobicContact CG-CB 4.46Å; Y76-A80 WeakPolarHBondContact O-CA 3.41Å; Y76-A80 WeakPolarHBondContact O-CB 3.42Å; Y76-A80 PolarHBondContact O-N 3.48Å; Y76-Y93 HydrophobicContact CD2-CD1 4.24Å; Y76-Y93 HydrophobicContact CD2-CG 4.29Å; Y76-Y93 HydrophobicContact CE2-CD1 4.37Å; Y76-Y93 HydrophobicContact CE2-CD2 4.09Å; Y76-Y93 HydrophobicContact CE2-CE1 4.44Å; Y76-Y93 HydrophobicContact CE2-CE2 4.2Å; Y76-Y93 HydrophobicContact CE2-CG 4.21Å
77	A	88.9	Confident	86.2	Confident	37 Å²	37	57.5 Å²	57.5	31%	0.306	29%	0.289	S	S	.	.	I	π-helix	trans	-60.9	-41.6	176.2	0	0	0	0	0	111.6	C73 F74 I81 Y82	C73-A77 WeakPolarHBondContact O-CB 3.04Å; C73-A77 PolarHBondContact O-N 3.45Å; F74-A77 PolarHBondContact O-N 3.29Å; A77-I81 HydrophobicContact CB-CD1 4.39Å; A77-I81 WeakPolarHBondContact O-CA 3.23Å; A77-I81 VanDerWaalsContact O-CB 3.23Å; A77-I81 WeakPolarHBondContact O-CB 3.46Å; A77-I81 PolarHBondContact O-N 3.47Å; A77-Y82 PolarHBondContact O-N 3.22Å
78	Y	87.7	Confident	85.5	Confident	18 Å²	18	64 Å²	64	7%	0.071	32%	0.323	C	S	.	.	I	π-helix	trans	-67.3	-51.2	178.2	-174.1	-96.3	0	0	0	112.3	A21 F34 V38 F74 V75 Y76 Y82 Q83	A21-Y78 PolarHBondContact O-OH 3.41Å; F34-Y78 HydrophobicContact CE2-CD1 4.44Å; F34-Y78 AromaticContact CE2-CE1 3.78Å; F34-Y78 HydrophobicContact CE2-CE1 3.78Å; F34-Y78 HydrophobicContact CZ-CD1 4.46Å; F34-Y78 HydrophobicContact CZ-CE1 4.22Å; V38-Y78 HydrophobicContact CG2-CD1 3.81Å; V38-Y78 HydrophobicContact CG2-CE1 3.6Å; F74-Y78 WeakPolarHBondContact O-CB 3.36Å; F74-Y78 PolarHBondContact O-N 2.95Å; V75-Y78 PolarHBondContact O-N 2.96Å; Y76-Y78 VanDerWaalsContact C-N 3.32Å; Y76-Y78 PolarHBondContact O-N 3.24Å; Y78-Y82 HydrophobicContact CD2-CD1 4.02Å; Y78-Y82 HydrophobicContact CD2-CG 4.45Å; Y78-Y82 AromaticContact CE2-CD1 3.77Å; Y78-Y82 HydrophobicContact CE2-CD1 3.77Å; Y78-Y82 HydrophobicContact CE2-CE1 4.29Å; Y78-Y82 VanDerWaalsContact O-CB 3.32Å; Y78-Y82 WeakPolarHBondContact O-CB 3.33Å; Y78-Y82 PolarHBondContact O-N 3.32Å; Y78-Q83 PolarHBondContact O-N 2.86Å
79	A	85.3	Confident	84.7	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.008	34%	0.341	C	S	.	.	I	π-helix	trans	-71.3	-49.3	-177.6	0	0	0	0	0	112.5	F34 V75 Y76 R84 V85 Y93 I96	F34-A79 HydrophobicContact CZ-CB 4.46Å; V75-A79 WeakPolarHBondContact O-CB 3.29Å; V75-A79 PolarHBondContact O-N 3.4Å; Y76-A79 PolarHBondContact O-N 3.35Å; A79-R84 PolarHBondContact O-N 2.9Å; A79-V85 WeakPolarHBondContact O-CG2 3.36Å; A79-V85 PolarHBondContact O-N 2.93Å; A79-Y93 HydrophobicContact CB-CD1 4.48Å; A79-Y93 HydrophobicContact CB-CE1 4.25Å; A79-I96 HydrophobicContact CB-CD1 4.5Å
80	A	83.9	Confident	83.9	Confident	19 Å²	19	63.2 Å²	63.2	16%	0.157	31%	0.314	C	S	.	.	I	π-helix	trans	-82.1	-40.6	-173.2	0	0	0	0	0	113.1	Y76 R84 Y93	Y76-A80 HydrophobicContact CD1-CB 4.38Å; Y76-A80 HydrophobicContact CD2-CB 4.26Å; Y76-A80 HydrophobicContact CE1-CB 4.1Å; Y76-A80 HydrophobicContact CE2-CB 3.97Å; Y76-A80 HydrophobicContact CG-CB 4.46Å; Y76-A80 WeakPolarHBondContact O-CA 3.41Å; Y76-A80 WeakPolarHBondContact O-CB 3.42Å; Y76-A80 PolarHBondContact O-N 3.48Å; A80-R84 WeakPolarHBondContact O-CA 3.49Å; A80-Y93 HydrophobicContact CB-CE1 3.75Å; A80-Y93 WeakPolarHBondContact CB-OH 3.28Å
81	I	82.3	Confident	83.2	Confident	116 Å²	116	63.5 Å²	63.5	60%	0.595	33%	0.326	S	S	*	.	I	π-helix	trans	-96	-48	-172.6	-53.2	176.6	0	0	0	111.2	A77	A77-I81 HydrophobicContact CB-CD1 4.39Å; A77-I81 WeakPolarHBondContact O-CA 3.23Å; A77-I81 VanDerWaalsContact O-CB 3.23Å; A77-I81 WeakPolarHBondContact O-CB 3.46Å; A77-I81 PolarHBondContact O-N 3.47Å
82	Y	82.9	Confident	82.8	Confident	86 Å²	86	64.3 Å²	64.3	34%	0.337	34%	0.335	S	S	.	.	I	π-helix	trans	-79.8	-50.4	-172.7	-165.8	-104.1	0	0	0	112.4	L22 M24 E25 A77 Y78	L22-Y82 PolarHBondContact O-OH 3.47Å; M24-Y82 HydrophobicContact CG-CD2 4.23Å; M24-Y82 HydrophobicContact CG-CE2 4.19Å; M24-Y82 WeakPolarHBondContact CG-O 3.5Å; M24-Y82 HydrophobicContact SD-CE2 4.48Å; E25-Y82 PolarHBondContact N-O 3.49Å; A77-Y82 PolarHBondContact O-N 3.22Å; Y78-Y82 HydrophobicContact CD2-CD1 4.02Å; Y78-Y82 HydrophobicContact CD2-CG 4.45Å; Y78-Y82 AromaticContact CE2-CD1 3.77Å; Y78-Y82 HydrophobicContact CE2-CD1 3.77Å; Y78-Y82 HydrophobicContact CE2-CE1 4.29Å; Y78-Y82 VanDerWaalsContact O-CB 3.32Å; Y78-Y82 WeakPolarHBondContact O-CB 3.33Å; Y78-Y82 PolarHBondContact O-N 3.32Å
83	Q	80.9	Confident	82.2	Confident	9 Å²	9	63.1 Å²	63.1	4%	0.042	33%	0.326	C	S	.	.	S	Bend	trans	-94.2	-15.9	-178.5	-128.8	71.3	-29.6	0	0	113.7	A21 S26 F28 F34 Y78 V85	A21-Q83 PolarHBondContact O-NE2 3.35Å; S26-Q83 PolarHBondContact OG-NE2 3.43Å; F28-Q83 HydrophobicContact CE2-CG 4.04Å; F34-Q83 HydrophobicContact CE2-CB 4.19Å; F34-Q83 HydrophobicContact CE2-CG 3.93Å; Y78-Q83 PolarHBondContact O-N 2.86Å; Q83-V85 HydrophobicContact CB-CG2 3.64Å; Q83-V85 HydrophobicContact CG-CG2 4.3Å; Q83-V85 PolarHBondContact O-N 3.1Å
84	R	79.3	Confident	81.8	Confident	170 Å²	170	61 Å²	61	64%	0.642	32%	0.319	S	S	*	.			trans	48.1	44.7	-177	-63.5	-157.4	177	157.7	-14.8	113.1	E25 A79 A80	E25-R84 HydrophobicContact CG-CG 4.41Å; E25-R84 VanDerWaalsContact OE1-CD 3.26Å; E25-R84 WeakPolarHBondContact OE1-CD 3.42Å; E25-R84 IonicContact OE1-CZ 3.52Å; E25-R84 IonicContact OE1-NE 3.62Å; E25-R84 IonicContact OE1-NH1 2.79Å; E25-R84 PolarHBondContact OE1-NH1 3.49Å; A79-R84 PolarHBondContact O-N 2.9Å; A80-R84 WeakPolarHBondContact O-CA 3.49Å
85	V	76.5	Confident	81.5	Confident	18 Å²	18	63.1 Å²	63.1	11%	0.109	33%	0.329	C	S	.	.			trans	-68.7	134.8	-179.2	-161.2	0	0	0	0	109.5	F34 A79 Q83 E87 Y90	F34-V85 HydrophobicContact CE1-CG2 3.94Å; F34-V85 HydrophobicContact CE2-CG2 4Å; F34-V85 HydrophobicContact CZ-CG2 3.49Å; F34-V85 VanDerWaalsContact CZ-CG2 3.49Å; A79-V85 WeakPolarHBondContact O-CG2 3.36Å; A79-V85 PolarHBondContact O-N 2.93Å; Q83-V85 HydrophobicContact CB-CG2 3.64Å; Q83-V85 HydrophobicContact CG-CG2 4.3Å; Q83-V85 PolarHBondContact O-N 3.1Å; V85-E87 PolarHBondContact O-N 3.38Å; V85-Y90 HydrophobicContact CB-CE2 4.49Å; V85-Y90 HydrophobicContact CG1-CD2 3.33Å; V85-Y90 HydrophobicContact CG1-CE2 3Å; V85-Y90 HydrophobicContact CG1-CG 4.32Å
86	D	76.7	Confident	81.3	Confident	102 Å²	102	63.1 Å²	63.1	55%	0.545	33%	0.329	S	S	.	.			trans	-70	121.2	172.4	-159.3	-20.2	0	0	0	109.1	D88 E89	D86-D88 PolarHBondContact O-N 2.99Å; D86-D88 PolarHBondContact OD1-N 2.9Å; D86-E89 PolarHBondContact O-N 3.01Å
87	E	74.4	Confident	81.2	Confident	82 Å²	82	59.1 Å²	59.1	38%	0.383	32%	0.315	S	S	.	.	H	α-helix	trans	-65.9	-28.8	-173.3	63.9	179.6	142.8	0	0	111.9	V85 E89 Y90 G91 G92 Y93	V85-E87 PolarHBondContact O-N 3.38Å; E87-E89 PolarHBondContact O-N 3.23Å; E87-Y90 PolarHBondContact O-N 3.39Å; E87-G91 PolarHBondContact O-N 2.87Å; E87-G92 WeakPolarHBondContact O-CA 3.2Å; E87-G92 PolarHBondContact O-N 3.49Å; E87-Y93 HydrophobicContact CB-CD2 3.8Å; E87-Y93 HydrophobicContact CB-CE1 4.42Å; E87-Y93 HydrophobicContact CB-CE2 3.6Å; E87-Y93 HydrophobicContact CB-CG 4.26Å; E87-Y93 VanDerWaalsContact CD-CE2 3.49Å; E87-Y93 HydrophobicContact CG-CD2 4.34Å; E87-Y93 HydrophobicContact CG-CE2 4.02Å; E87-Y93 WeakPolarHBondContact OE2-CD2 3.45Å; E87-Y93 VanDerWaalsContact OE2-CE2 3.27Å; E87-Y93 WeakPolarHBondContact OE2-CE2 3.41Å
88	D	77.2	Confident	81	Confident	137 Å²	137	64.5 Å²	64.5	73%	0.733	33%	0.332	S	S	*	.	H	α-helix	trans	-64.7	-29.7	-179.8	-72.8	-22.3	0	0	0	112.3	D86 Y90	D86-D88 PolarHBondContact O-N 2.99Å; D86-D88 PolarHBondContact OD1-N 2.9Å; D88-Y90 VanDerWaalsContact C-N 3.28Å; D88-Y90 PolarHBondContact O-N 3.47Å
89	E	77.3	Confident	80.8	Confident	139 Å²	139	68 Å²	68	65%	0.65	35%	0.349	S	S	*	.	H	α-helix	trans	-74	-22.6	180	-169.5	167.6	-154.2	0	0	112.4	D86 E87	D86-E89 PolarHBondContact O-N 3.01Å; E87-E89 PolarHBondContact O-N 3.23Å
90	Y	74.8	Confident	80.8	Confident	11 Å²	11	68.5 Å²	68.5	4%	0.043	35%	0.354	C	S	.	.	H	α-helix	trans	-108.7	0.6	-175.5	-68.8	-99.1	0	0	0	113.7	K31 F34 L35 V85 E87 D88 I96	K31-Y90 HydrophobicContact CB-CD1 4.39Å; K31-Y90 HydrophobicContact CB-CE1 3.77Å; K31-Y90 HydrophobicContact CD-CD1 3.8Å; K31-Y90 HydrophobicContact CD-CE1 4.07Å; K31-Y90 HydrophobicContact CD-CG 4.5Å; K31-Y90 HydrophobicContact CG-CD1 3.72Å; K31-Y90 HydrophobicContact CG-CE1 3.53Å; F34-Y90 HydrophobicContact CB-CE1 4.3Å; F34-Y90 HydrophobicContact CD1-CD1 4.14Å; F34-Y90 AromaticContact CD1-CE1 3.44Å; F34-Y90 HydrophobicContact CD1-CE1 3.44Å; F34-Y90 VanDerWaalsContact CD1-CE1 3.44Å; F34-Y90 AromaticContact CD1-CZ 3.84Å; F34-Y90 HydrophobicContact CE1-CE1 4.18Å; F34-Y90 HydrophobicContact CG-CE1 4.23Å; L35-Y90 HydrophobicContact CD2-CD1 4.44Å; V85-Y90 HydrophobicContact CB-CE2 4.49Å; V85-Y90 HydrophobicContact CG1-CD2 3.33Å; V85-Y90 HydrophobicContact CG1-CE2 3Å; V85-Y90 HydrophobicContact CG1-CG 4.32Å; E87-Y90 PolarHBondContact O-N 3.39Å; D88-Y90 VanDerWaalsContact C-N 3.28Å; D88-Y90 PolarHBondContact O-N 3.47Å; Y90-I96 HydrophobicContact CG-CD1 4.09Å; Y90-I96 HydrophobicContact CG-CG1 4.43Å
91	G	77.6	Confident	81.1	Confident	56 Å²	56	69.4 Å²	69.4	58%	0.577	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.5	19.1	-177.3	0	0	0	0	0	113.8	E87	E87-G91 PolarHBondContact O-N 2.87Å
92	G	82.9	Confident	81.6	Confident	18 Å²	18	70.9 Å²	70.9	19%	0.186	36%	0.363	C	S	.	.			trans	93.6	158.3	-176.9	0	0	0	0	0	113	E87 G94 E95	E87-G92 WeakPolarHBondContact O-CA 3.2Å; E87-G92 PolarHBondContact O-N 3.49Å; G92-G94 PolarHBondContact O-N 2.95Å; G92-E95 PolarHBondContact O-N 3.09Å; G92-E95 VanDerWaalsContact O-N 3.1Å
93	Y	79.1	Confident	82.1	Confident	47 Å²	47	69.4 Å²	69.4	18%	0.184	36%	0.363	C	S	.	.	H	α-helix	trans	-56.9	-26.3	176.1	-70.3	-66.9	0	0	0	113.4	Y76 A79 A80 E87 E95 I96 I97	Y76-Y93 HydrophobicContact CD2-CD1 4.24Å; Y76-Y93 HydrophobicContact CD2-CG 4.29Å; Y76-Y93 HydrophobicContact CE2-CD1 4.37Å; Y76-Y93 HydrophobicContact CE2-CD2 4.09Å; Y76-Y93 HydrophobicContact CE2-CE1 4.44Å; Y76-Y93 HydrophobicContact CE2-CE2 4.2Å; Y76-Y93 HydrophobicContact CE2-CG 4.21Å; A79-Y93 HydrophobicContact CB-CD1 4.48Å; A79-Y93 HydrophobicContact CB-CE1 4.25Å; A80-Y93 HydrophobicContact CB-CE1 3.75Å; A80-Y93 WeakPolarHBondContact CB-OH 3.28Å; E87-Y93 HydrophobicContact CB-CD2 3.8Å; E87-Y93 HydrophobicContact CB-CE1 4.42Å; E87-Y93 HydrophobicContact CB-CE2 3.6Å; E87-Y93 HydrophobicContact CB-CG 4.26Å; E87-Y93 VanDerWaalsContact CD-CE2 3.49Å; E87-Y93 HydrophobicContact CG-CD2 4.34Å; E87-Y93 HydrophobicContact CG-CE2 4.02Å; E87-Y93 WeakPolarHBondContact OE2-CD2 3.45Å; E87-Y93 VanDerWaalsContact OE2-CE2 3.27Å; E87-Y93 WeakPolarHBondContact OE2-CE2 3.41Å; Y93-E95 VanDerWaalsContact C-N 3.32Å; Y93-E95 PolarHBondContact O-N 3.48Å; Y93-I96 PolarHBondContact O-N 3.42Å; Y93-I97 WeakPolarHBondContact O-CB 3.46Å; Y93-I97 WeakPolarHBondContact O-CD1 3.13Å; Y93-I97 WeakPolarHBondContact O-CG1 3.47Å; Y93-I97 PolarHBondContact O-N 2.98Å
94	G	83.7	Confident	82.6	Confident	39 Å²	39	69 Å²	69	40%	0.402	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-36	178	0	0	0	0	0	113.6	G92 K98	G92-G94 PolarHBondContact O-N 2.95Å; G94-K98 WeakPolarHBondContact O-CB 3.34Å; G94-K98 WeakPolarHBondContact O-CD 3.5Å; G94-K98 WeakPolarHBondContact O-CG 3.43Å; G94-K98 PolarHBondContact O-N 3.16Å; G94-K98 VanDerWaalsContact O-N 3.17Å
95	E	85.1	Confident	83.3	Confident	103 Å²	103	63.2 Å²	63.2	48%	0.481	34%	0.34	S	S	.	.	H	α-helix	trans	-67.9	-50.9	178.2	-151	87.7	173.8	0	0	109.6	G92 Y93 I97 K98 E99	G92-E95 PolarHBondContact O-N 3.09Å; G92-E95 VanDerWaalsContact O-N 3.1Å; Y93-E95 VanDerWaalsContact C-N 3.32Å; Y93-E95 PolarHBondContact O-N 3.48Å; E95-I97 VanDerWaalsContact C-N 3.31Å; E95-I97 PolarHBondContact O-N 3.46Å; E95-K98 PolarHBondContact O-N 3.37Å; E95-K98 VanDerWaalsContact O-N 3.17Å; E95-E99 WeakPolarHBondContact O-CB 3.43Å; E95-E99 PolarHBondContact O-N 3.35Å
96	I	82.9	Confident	84.2	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-59.7	-41.5	178.8	-54.9	171.9	0	0	0	111.2	R42 V75 A79 Y90 Y93 E99	R42-I96 PolarHBondContact NH2-O 3.49Å; V75-I96 HydrophobicContact CG1-CG2 3.88Å; A79-I96 HydrophobicContact CB-CD1 4.5Å; Y90-I96 HydrophobicContact CG-CD1 4.09Å; Y90-I96 HydrophobicContact CG-CG1 4.43Å; Y93-I96 PolarHBondContact O-N 3.42Å; I96-E99 PolarHBondContact O-N 2.96Å
97	I	85.3	Confident	85	Confident	32 Å²	32	62 Å²	62	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-65	-42.3	179.8	-74	164.7	0	0	0	110.9	R42 I72 V75 Y93 E95	R42-I97 PolarHBondContact NH1-O 2.98Å; R42-I97 PolarHBondContact NH2-O 3.33Å; I72-I97 HydrophobicContact CG1-CG2 3.92Å; I72-I97 HydrophobicContact CG2-CD1 4.1Å; V75-I97 HydrophobicContact CG1-CG1 4.23Å; Y93-I97 WeakPolarHBondContact O-CB 3.46Å; Y93-I97 WeakPolarHBondContact O-CD1 3.13Å; Y93-I97 WeakPolarHBondContact O-CG1 3.47Å; Y93-I97 PolarHBondContact O-N 2.98Å; E95-I97 VanDerWaalsContact C-N 3.31Å; E95-I97 PolarHBondContact O-N 3.46Å
98	K	85.8	Confident	86	Confident	150 Å²	150	58.1 Å²	58.1	65%	0.652	33%	0.325	S	S	*	.	H	α-helix	trans	-70.2	-34.8	179.7	-73	169.8	-173.1	172.6	0	111.8	G94 E95 G100 L101	G94-K98 WeakPolarHBondContact O-CB 3.34Å; G94-K98 WeakPolarHBondContact O-CD 3.5Å; G94-K98 WeakPolarHBondContact O-CG 3.43Å; G94-K98 PolarHBondContact O-N 3.16Å; G94-K98 VanDerWaalsContact O-N 3.17Å; E95-K98 PolarHBondContact O-N 3.37Å; E95-K98 VanDerWaalsContact O-N 3.17Å; K98-G100 PolarHBondContact O-N 3.1Å; K98-L101 WeakPolarHBondContact O-CB 3.43Å; K98-L101 PolarHBondContact O-N 2.67Å; K98-L101 VanDerWaalsContact O-N 3.09Å
99	E	83.6	Confident	86.8	Confident	90 Å²	90	54 Å²	54	42%	0.421	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	122.3	179.3	-164.7	160.9	-174.9	0	0	111	L35 R42 E95 I96 L101	L35-E99 VanDerWaalsContact CD1-OE2 3.28Å; L35-E99 WeakPolarHBondContact CD1-OE2 3.14Å; L35-E99 WeakPolarHBondContact CD2-OE2 3.24Å; R42-E99 PolarHBondContact NH2-O 3.48Å; E95-E99 WeakPolarHBondContact O-CB 3.43Å; E95-E99 PolarHBondContact O-N 3.35Å; I96-E99 PolarHBondContact O-N 2.96Å; E99-L101 PolarHBondContact O-N 3.47Å
100	G	85.1	Confident	87.6	Confident	12 Å²	12	51.6 Å²	51.6	12%	0.124	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	0.8	-174.2	0	0	0	0	0	115.7	K98 T103 A104	K98-G100 PolarHBondContact O-N 3.1Å; G100-T103 WeakPolarHBondContact CA-OG1 3.31Å; G100-T103 PolarHBondContact O-OG1 3.02Å; G100-A104 WeakPolarHBondContact O-CB 3.37Å; G100-A104 PolarHBondContact O-N 3.2Å
101	L	89.7	Confident	88.6	Confident	38 Å²	38	51.7 Å²	51.7	20%	0.199	30%	0.299	C	S	.	.	H	α-helix	trans	-63.7	-46.9	179.9	-177.7	64.4	0	0	0	111.9	F68 N71 K98 E99 A104 F105	F68-L101 HydrophobicContact CD1-CD1 4.06Å; F68-L101 HydrophobicContact CD1-CD2 4.48Å; F68-L101 HydrophobicContact CE1-CD1 4.02Å; F68-L101 HydrophobicContact CE1-CD2 4.11Å; F68-L101 HydrophobicContact CE1-CG 4.17Å; N71-L101 WeakPolarHBondContact OD1-CD1 3.49Å; K98-L101 WeakPolarHBondContact O-CB 3.43Å; K98-L101 PolarHBondContact O-N 2.67Å; K98-L101 VanDerWaalsContact O-N 3.09Å; E99-L101 PolarHBondContact O-N 3.47Å; L101-A104 PolarHBondContact O-N 3.27Å; L101-F105 VanDerWaalsContact O-CB 3.31Å; L101-F105 WeakPolarHBondContact O-CB 3.17Å; L101-F105 PolarHBondContact O-N 2.66Å
102	M	92.2	Very high	89.2	Confident	148 Å²	148	50.1 Å²	50.1	73%	0.729	28%	0.276	S	S	*	.	H	α-helix	trans	-68.5	-39.2	-175.7	-168.6	63.7	-177.9	0	0	112	F105 A106	M102-F105 PolarHBondContact O-N 2.98Å; M102-F105 HydrophobicContact SD-CD1 4.44Å; M102-A106 PolarHBondContact O-N 3.19Å
103	T	93.3	Very high	89.6	Confident	55 Å²	55	53.3 Å²	53.3	34%	0.337	29%	0.287	S	S	.	.	H	α-helix	trans	-69.6	-41.9	175.9	46.6	0	0	0	0	111.2	Y39 Q43 G100 F105 A106 C107	Y39-T103 HydrophobicContact CE2-CG2 4.19Å; Y39-T103 WeakPolarHBondContact CE2-OG1 3.42Å; Y39-T103 WeakPolarHBondContact OH-CB 3.43Å; Q43-T103 VanDerWaalsContact NE2-C 3.32Å; Q43-T103 PolarHBondContact NE2-O 3.09Å; G100-T103 WeakPolarHBondContact CA-OG1 3.31Å; G100-T103 PolarHBondContact O-OG1 3.02Å; T103-F105 VanDerWaalsContact C-N 3.32Å; T103-F105 PolarHBondContact O-N 3.07Å; T103-A106 PolarHBondContact O-N 3.26Å; T103-C107 PolarHBondContact O-N 3.16Å
104	A	92.1	Very high	90.3	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-40.9	174.6	0	0	0	0	0	111.4	R42 A46 F67 G100 L101 A106 C107 F108	R42-A104 HydrophobicContact CG-CB 3.73Å; A46-A104 HydrophobicContact CB-CB 4.16Å; A46-A104 WeakPolarHBondContact CB-O 3.35Å; F67-A104 HydrophobicContact CZ-CB 4.12Å; G100-A104 WeakPolarHBondContact O-CB 3.37Å; G100-A104 PolarHBondContact O-N 3.2Å; L101-A104 PolarHBondContact O-N 3.27Å; A104-A106 VanDerWaalsContact C-N 3.35Å; A104-A106 PolarHBondContact O-N 3.1Å; A104-C107 PolarHBondContact O-N 2.9Å; A104-F108 WeakPolarHBondContact O-CB 3.39Å; A104-F108 PolarHBondContact O-N 2.83Å
105	F	93.5	Very high	90.7	Very high	49 Å²	49	55.3 Å²	55.3	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-44.4	174.6	176.8	-115.2	0	0	0	111.9	I64 F67 F68 L101 M102 T103 F108 M109	I64-F105 HydrophobicContact CG2-CE2 4.01Å; F67-F105 AromaticContact CD1-CD2 3.98Å; F67-F105 HydrophobicContact CD1-CD2 3.98Å; F67-F105 HydrophobicContact CE1-CB 3.89Å; F67-F105 AromaticContact CE1-CD2 3.94Å; F67-F105 HydrophobicContact CE1-CD2 3.94Å; F67-F105 HydrophobicContact CE1-CG 4.43Å; F67-F105 HydrophobicContact CZ-CB 4.47Å; F68-F105 HydrophobicContact CE2-CD2 4.3Å; F68-F105 HydrophobicContact CE2-CE2 4.28Å; F68-F105 HydrophobicContact CZ-CD2 4.1Å; F68-F105 HydrophobicContact CZ-CE2 4.4Å; F68-F105 HydrophobicContact CZ-CG 4.43Å; L101-F105 VanDerWaalsContact O-CB 3.31Å; L101-F105 WeakPolarHBondContact O-CB 3.17Å; L101-F105 PolarHBondContact O-N 2.66Å; M102-F105 PolarHBondContact O-N 2.98Å; M102-F105 HydrophobicContact SD-CD1 4.44Å; T103-F105 VanDerWaalsContact C-N 3.32Å; T103-F105 PolarHBondContact O-N 3.07Å; F105-F108 HydrophobicContact CD2-CD1 4.4Å; F105-F108 PolarHBondContact O-N 3.48Å; F105-M109 HydrophobicContact CD2-CG 4.21Å; F105-M109 HydrophobicContact CE1-CG 4.15Å; F105-M109 HydrophobicContact CE2-CG 3.74Å; F105-M109 HydrophobicContact CE2-SD 3.97Å; F105-M109 HydrophobicContact CZ-CG 3.71Å; F105-M109 HydrophobicContact CZ-SD 3.98Å; F105-M109 WeakPolarHBondContact O-CG 3.39Å; F105-M109 PolarHBondContact O-N 2.97Å
106	A	95.7	Very high	90.9	Very high	52 Å²	52	54 Å²	54	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-61.2	-45.7	175.5	0	0	0	0	0	112.1	M102 T103 A104 F108 M109 V110	M102-A106 PolarHBondContact O-N 3.19Å; T103-A106 PolarHBondContact O-N 3.26Å; A104-A106 VanDerWaalsContact C-N 3.35Å; A104-A106 PolarHBondContact O-N 3.1Å; A106-F108 PolarHBondContact O-N 3.04Å; A106-M109 PolarHBondContact O-N 3.28Å; A106-V110 WeakPolarHBondContact O-CG2 3.27Å; A106-V110 PolarHBondContact O-N 2.98Å
107	C	94.5	Very high	91.2	Very high	42 Å²	42	58.1 Å²	58.1	28%	0.284	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-37.9	177.3	-90.2	0	0	0	0	113.2	Q43 I47 T103 A104 S111	Q43-C107 HydrophobicContact CG-CB 4.45Å; Q43-C107 PolarHBondContact NE2-SG 3.39Å; I47-C107 HydrophobicContact CG1-CB 4.32Å; T103-C107 PolarHBondContact O-N 3.16Å; A104-C107 PolarHBondContact O-N 2.9Å; C107-S111 WeakPolarHBondContact O-CB 3.23Å; C107-S111 PolarHBondContact O-N 3.49Å; C107-S111 PolarHBondContact O-OG 2.86Å
108	F	94.3	Very high	91.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-50.1	171.7	163.7	-102.4	0	0	0	111	A46 V49 F67 A104 F105 A106 V110 S111 W112	A46-F108 HydrophobicContact CB-CB 4.24Å; V49-F108 HydrophobicContact CG1-CD2 4.28Å; V49-F108 HydrophobicContact CG1-CE2 4.15Å; F67-F108 HydrophobicContact CB-CD1 4.02Å; F67-F108 HydrophobicContact CB-CD2 4.31Å; F67-F108 HydrophobicContact CB-CE1 3.84Å; F67-F108 HydrophobicContact CB-CE2 4.14Å; F67-F108 HydrophobicContact CB-CG 4.25Å; F67-F108 HydrophobicContact CB-CZ 3.91Å; F67-F108 HydrophobicContact CD1-CD1 4.12Å; F67-F108 HydrophobicContact CD1-CG 4.37Å; F67-F108 HydrophobicContact CD2-CB 3.67Å; F67-F108 AromaticContact CD2-CD1 3.93Å; F67-F108 HydrophobicContact CD2-CD1 3.93Å; F67-F108 AromaticContact CD2-CD2 3.57Å; F67-F108 HydrophobicContact CD2-CD2 3.57Å; F67-F108 HydrophobicContact CD2-CE2 4.21Å; F67-F108 AromaticContact CD2-CG 3.41Å; F67-F108 HydrophobicContact CD2-CG 3.41Å; F67-F108 VanDerWaalsContact CD2-CG 3.41Å; F67-F108 HydrophobicContact CE1-CB 4.46Å; F67-F108 HydrophobicContact CE2-CB 3.46Å; F67-F108 VanDerWaalsContact CE2-CB 3.46Å; F67-F108 HydrophobicContact CE2-CD1 4.48Å; F67-F108 HydrophobicContact CE2-CD2 4.21Å; F67-F108 AromaticContact CE2-CG 3.8Å; F67-F108 HydrophobicContact CE2-CG 3.8Å; F67-F108 HydrophobicContact CG-CB 4.25Å; F67-F108 AromaticContact CG-CD1 3.73Å; F67-F108 HydrophobicContact CG-CD1 3.73Å; F67-F108 HydrophobicContact CG-CD2 4.1Å; F67-F108 HydrophobicContact CG-CE1 4.09Å; F67-F108 HydrophobicContact CG-CE2 4.43Å; F67-F108 AromaticContact CG-CG 3.73Å; F67-F108 HydrophobicContact CG-CG 3.73Å; F67-F108 HydrophobicContact CG-CZ 4.43Å; F67-F108 HydrophobicContact CZ-CB 3.9Å; F67-F108 HydrophobicContact CZ-CG 4.42Å; A104-F108 WeakPolarHBondContact O-CB 3.39Å; A104-F108 PolarHBondContact O-N 2.83Å; F105-F108 HydrophobicContact CD2-CD1 4.4Å; F105-F108 PolarHBondContact O-N 3.48Å; A106-F108 PolarHBondContact O-N 3.04Å; F108-V110 PolarHBondContact O-N 3.37Å; F108-S111 PolarHBondContact O-N 3.39Å; F108-S111 PolarHBondContact O-OG 2.75Å; F108-W112 HydrophobicContact CE1-CD2 4.34Å; F108-W112 AromaticContact CE1-CE3 3.58Å; F108-W112 HydrophobicContact CE1-CE3 3.58Å; F108-W112 HydrophobicContact CE1-CZ3 4.11Å; F108-W112 HydrophobicContact CE2-CB 4.23Å; F108-W112 HydrophobicContact CE2-CG 4.43Å; F108-W112 HydrophobicContact CZ-CB 4.32Å; F108-W112 AromaticContact CZ-CD2 3.9Å; F108-W112 HydrophobicContact CZ-CD2 3.9Å; F108-W112 AromaticContact CZ-CE3 3.58Å; F108-W112 HydrophobicContact CZ-CE3 3.58Å; F108-W112 HydrophobicContact CZ-CG 4.23Å; F108-W112 HydrophobicContact CZ-CZ3 4.24Å; F108-W112 WeakPolarHBondContact O-CB 3.34Å; F108-W112 PolarHBondContact O-N 3.29Å
109	M	94	Very high	91.4	Very high	52 Å²	52	55.6 Å²	55.6	26%	0.256	31%	0.311	S	S	.	.	H	α-helix	trans	-59	-45.9	179.8	-73.7	-67.5	-69	0	0	112	F105 A106 W112 I113	F105-M109 HydrophobicContact CD2-CG 4.21Å; F105-M109 HydrophobicContact CE1-CG 4.15Å; F105-M109 HydrophobicContact CE2-CG 3.74Å; F105-M109 HydrophobicContact CE2-SD 3.97Å; F105-M109 HydrophobicContact CZ-CG 3.71Å; F105-M109 HydrophobicContact CZ-SD 3.98Å; F105-M109 WeakPolarHBondContact O-CG 3.39Å; F105-M109 PolarHBondContact O-N 2.97Å; A106-M109 PolarHBondContact O-N 3.28Å; M109-W112 HydrophobicContact SD-CE3 3.99Å; M109-W112 HydrophobicContact SD-CZ3 4.06Å; M109-I113 HydrophobicContact CE-CD1 4.18Å; M109-I113 WeakPolarHBondContact O-CB 3.32Å; M109-I113 WeakPolarHBondContact O-CD1 3.22Å; M109-I113 VanDerWaalsContact O-CG1 3.24Å; M109-I113 WeakPolarHBondContact O-CG1 3.31Å; M109-I113 PolarHBondContact O-N 2.92Å
110	V	95.1	Very high	91.2	Very high	87 Å²	87	53.9 Å²	53.9	53%	0.527	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-50	179.3	171.8	0	0	0	0	111.1	A106 F108 W112 L114	A106-V110 WeakPolarHBondContact O-CG2 3.27Å; A106-V110 PolarHBondContact O-N 2.98Å; F108-V110 PolarHBondContact O-N 3.37Å; V110-W112 PolarHBondContact O-N 3.03Å; V110-L114 HydrophobicContact CG1-CD1 3.72Å; V110-L114 HydrophobicContact CG1-CG 4.41Å; V110-L114 VanDerWaalsContact O-CB 3.3Å; V110-L114 WeakPolarHBondContact O-CB 3.34Å; V110-L114 WeakPolarHBondContact O-CG 3.22Å; V110-L114 PolarHBondContact O-N 3.3Å
111	S	94.1	Very high	90.5	Very high	14 Å²	14	54.8 Å²	54.8	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-65.4	-38.6	-179.8	54	0	0	0	0	112.4	G50 C107 F108 T115	G50-S111 WeakPolarHBondContact CA-OG 3.39Å; C107-S111 WeakPolarHBondContact O-CB 3.23Å; C107-S111 PolarHBondContact O-N 3.49Å; C107-S111 PolarHBondContact O-OG 2.86Å; F108-S111 PolarHBondContact O-N 3.39Å; F108-S111 PolarHBondContact O-OG 2.75Å; S111-T115 WeakPolarHBondContact O-CB 3.2Å; S111-T115 PolarHBondContact O-N 3.36Å; S111-T115 PolarHBondContact O-OG1 3.12Å
112	W	92.2	Very high	89.2	Confident	23 Å²	23	57.6 Å²	57.6	9%	0.087	33%	0.331	C	S	.	.	H	α-helix	trans	-65.3	-51.5	178	178.7	29.3	0	0	0	112.2	G50 F58 A63 I64 F108 M109 V110 T115 Y116	G50-W112 WeakPolarHBondContact O-CA 3.13Å; F58-W112 WeakPolarHBondContact O-CZ2 3.14Å; F58-W112 PolarHBondContact O-NE1 3.28Å; F58-W112 VanDerWaalsContact O-NE1 3.16Å; A63-W112 HydrophobicContact CB-CH2 3.31Å; A63-W112 HydrophobicContact CB-CZ2 3.31Å; A63-W112 HydrophobicContact CB-CZ3 3.97Å; I64-W112 HydrophobicContact CD1-CZ3 4.47Å; I64-W112 HydrophobicContact CG1-CH2 4.39Å; I64-W112 HydrophobicContact CG1-CZ3 3.86Å; F108-W112 HydrophobicContact CE1-CD2 4.34Å; F108-W112 AromaticContact CE1-CE3 3.58Å; F108-W112 HydrophobicContact CE1-CE3 3.58Å; F108-W112 HydrophobicContact CE1-CZ3 4.11Å; F108-W112 HydrophobicContact CE2-CB 4.23Å; F108-W112 HydrophobicContact CE2-CG 4.43Å; F108-W112 HydrophobicContact CZ-CB 4.32Å; F108-W112 AromaticContact CZ-CD2 3.9Å; F108-W112 HydrophobicContact CZ-CD2 3.9Å; F108-W112 AromaticContact CZ-CE3 3.58Å; F108-W112 HydrophobicContact CZ-CE3 3.58Å; F108-W112 HydrophobicContact CZ-CG 4.23Å; F108-W112 HydrophobicContact CZ-CZ3 4.24Å; F108-W112 WeakPolarHBondContact O-CB 3.34Å; F108-W112 PolarHBondContact O-N 3.29Å; M109-W112 HydrophobicContact SD-CE3 3.99Å; M109-W112 HydrophobicContact SD-CZ3 4.06Å; V110-W112 PolarHBondContact O-N 3.03Å; W112-T115 PolarHBondContact O-N 3.03Å; W112-Y116 VanDerWaalsContact O-CB 3.23Å; W112-Y116 WeakPolarHBondContact O-CB 3.34Å; W112-Y116 PolarHBondContact O-N 3.49Å
113	I	91.2	Very high	87.6	Confident	84 Å²	84	56.1 Å²	56.1	43%	0.431	33%	0.326	S	S	.	.	H	α-helix	trans	-62.1	-49.1	179.7	-66.1	165.8	0	0	0	110.2	M109 T115 Y116 D117	M109-I113 HydrophobicContact CE-CD1 4.18Å; M109-I113 WeakPolarHBondContact O-CB 3.32Å; M109-I113 WeakPolarHBondContact O-CD1 3.22Å; M109-I113 VanDerWaalsContact O-CG1 3.24Å; M109-I113 WeakPolarHBondContact O-CG1 3.31Å; M109-I113 PolarHBondContact O-N 2.92Å; I113-T115 VanDerWaalsContact C-N 3.31Å; I113-T115 PolarHBondContact O-N 3.2Å; I113-Y116 PolarHBondContact O-N 3.14Å; I113-D117 WeakPolarHBondContact O-CB 3.47Å; I113-D117 VanDerWaalsContact O-CG 3.27Å; I113-D117 PolarHBondContact O-N 2.87Å
114	L	92.9	Very high	85.9	Confident	102 Å²	102	57.8 Å²	57.8	53%	0.534	34%	0.339	S	S	.	.	H	α-helix	trans	-58.9	-43.8	179.5	-72.9	174.9	0	0	0	112	V110 C118	V110-L114 HydrophobicContact CG1-CD1 3.72Å; V110-L114 HydrophobicContact CG1-CG 4.41Å; V110-L114 VanDerWaalsContact O-CB 3.3Å; V110-L114 WeakPolarHBondContact O-CB 3.34Å; V110-L114 WeakPolarHBondContact O-CG 3.22Å; V110-L114 PolarHBondContact O-N 3.3Å; L114-C118 VanDerWaalsContact O-CB 3.31Å; L114-C118 WeakPolarHBondContact O-CB 3.24Å; L114-C118 PolarHBondContact O-N 3.36Å; L114-C118 PolarHBondContact O-SG 3.42Å
115	T	91.6	Very high	84.3	Confident	26 Å²	26	63.1 Å²	63.1	16%	0.16	37%	0.372	C	S	.	.	H	α-helix	trans	-72.6	-37.9	-178.4	-52.4	0	0	0	0	111.5	V51 V55 S111 W112 I113 C118 A119	V51-T115 HydrophobicContact CG1-CG2 4.16Å; V51-T115 WeakPolarHBondContact O-CG2 3.28Å; V55-T115 HydrophobicContact CG2-CG2 3.57Å; S111-T115 WeakPolarHBondContact O-CB 3.2Å; S111-T115 PolarHBondContact O-N 3.36Å; S111-T115 PolarHBondContact O-OG1 3.12Å; W112-T115 PolarHBondContact O-N 3.03Å; I113-T115 VanDerWaalsContact C-N 3.31Å; I113-T115 PolarHBondContact O-N 3.2Å; T115-C118 PolarHBondContact O-N 2.88Å; T115-A119 VanDerWaalsContact O-CB 3.22Å; T115-A119 WeakPolarHBondContact O-CB 3.43Å; T115-A119 PolarHBondContact O-N 2.96Å
116	Y	88.9	Confident	82.3	Confident	76 Å²	76	65.8 Å²	65.8	30%	0.298	39%	0.393	S	S	.	.	H	α-helix	trans	-62.2	-47.3	175.3	-174.8	-90.7	0	0	0	111.2	T59 W112 I113 C118 A119 H120	T59-Y116 HydrophobicContact CG2-CE2 3.61Å; T59-Y116 WeakPolarHBondContact CG2-OH 3.3Å; W112-Y116 VanDerWaalsContact O-CB 3.23Å; W112-Y116 WeakPolarHBondContact O-CB 3.34Å; W112-Y116 PolarHBondContact O-N 3.49Å; I113-Y116 PolarHBondContact O-N 3.14Å; Y116-C118 PolarHBondContact O-N 3.49Å; Y116-A119 PolarHBondContact O-N 2.9Å; Y116-H120 AromaticContact CD2-ND1 3.67Å; Y116-H120 HydrophobicContact CE1-CB 4.44Å; Y116-H120 AromaticContact CE2-ND1 3.85Å; Y116-H120 WeakPolarHBondContact O-CB 3.47Å; Y116-H120 PolarHBondContact O-N 2.84Å; Y116-H120 PolarHBondContact O-ND1 3.28Å; Y116-H120 VanDerWaalsContact O-ND1 3.14Å
117	D	89.6	Confident	80.1	Confident	89 Å²	89	78.2 Å²	78.2	48%	0.476	43%	0.429	S	S	.	.	I	π-helix	trans	-63.6	-40.7	177.4	-70.6	-13.3	0	0	0	111.5	I113 G121	I113-D117 WeakPolarHBondContact O-CB 3.47Å; I113-D117 VanDerWaalsContact O-CG 3.27Å; I113-D117 PolarHBondContact O-N 2.87Å; D117-G121 WeakPolarHBondContact O-CA 3.41Å; D117-G121 PolarHBondContact O-N 2.97Å
118	C	88.6	Confident	79.4	Confident	90 Å²	90	80.1 Å²	80.1	61%	0.608	44%	0.436	S	S	*	.	I	π-helix	trans	-67.7	-41.5	176.9	-72.1	0	0	0	0	112.5	L114 T115 Y116	L114-C118 VanDerWaalsContact O-CB 3.31Å; L114-C118 WeakPolarHBondContact O-CB 3.24Å; L114-C118 PolarHBondContact O-N 3.36Å; L114-C118 PolarHBondContact O-SG 3.42Å; T115-C118 PolarHBondContact O-N 2.88Å; Y116-C118 PolarHBondContact O-N 3.49Å
119	A	86.5	Confident	78.6	Confident	38 Å²	38	84.3 Å²	84.3	31%	0.314	46%	0.459	S	S	.	.	I	π-helix	trans	-77.6	-33.7	-177.1	0	0	0	0	0	113.1	T115 Y116 N123	T115-A119 VanDerWaalsContact O-CB 3.22Å; T115-A119 WeakPolarHBondContact O-CB 3.43Å; T115-A119 PolarHBondContact O-N 2.96Å; Y116-A119 PolarHBondContact O-N 2.9Å; A119-N123 PolarHBondContact O-ND2 2.7Å
120	H	81	Confident	77.8	Confident	54 Å²	54	86.1 Å²	86.1	25%	0.25	47%	0.47	C	S	.	.	I	π-helix	trans	-114.1	-28.4	-172.5	-58	88.1	0	0	0	113.6	G54 S57 Y116 N123	G54-H120 PolarHBondContact O-CE1 3.34Å; G54-H120 VanDerWaalsContact O-CE1 3.27Å; S57-H120 WeakPolarHBondContact CB-NE2 3.11Å; S57-H120 PolarHBondContact OG-CE1 3.37Å; S57-H120 PolarHBondContact OG-NE2 3.05Å; Y116-H120 AromaticContact CD2-ND1 3.67Å; Y116-H120 HydrophobicContact CE1-CB 4.44Å; Y116-H120 AromaticContact CE2-ND1 3.85Å; Y116-H120 WeakPolarHBondContact O-CB 3.47Å; Y116-H120 PolarHBondContact O-N 2.84Å; Y116-H120 PolarHBondContact O-ND1 3.28Å; Y116-H120 VanDerWaalsContact O-ND1 3.14Å; H120-N123 PolarHBondContact O-N 3.28Å
121	G	69.7	Low	76.8	Confident	31 Å²	31	86 Å²	86	32%	0.32	47%	0.467	S	S	.	.	I	π-helix	trans	-67.4	-34.9	179.6	0	0	0	0	0	112.9	D117 N123 S124	D117-G121 WeakPolarHBondContact O-CA 3.41Å; D117-G121 PolarHBondContact O-N 2.97Å; G121-N123 PolarHBondContact O-N 3.12Å; G121-S124 PolarHBondContact O-N 2.79Å; G121-S124 VanDerWaalsContact O-N 3.12Å; G121-S124 PolarHBondContact O-OG 3.29Å
122	V	63	Low	75.7	Confident	97 Å²	97	90.5 Å²	90.5	59%	0.588	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-64.2	-27.6	176.6	176.7	0	0	0	0	112.3	S124 T125	V122-S124 PolarHBondContact O-N 3.31Å; V122-T125 PolarHBondContact O-OG1 3.19Å
123	N	57.5	Low	74.6	Confident	118 Å²	118	95 Å²	95	63%	0.631	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-74.3	-9.8	178.1	-66.8	-31.4	0	0	0	113.3	A119 H120 G121	A119-N123 PolarHBondContact O-ND2 2.7Å; H120-N123 PolarHBondContact O-N 3.28Å; G121-N123 PolarHBondContact O-N 3.12Å
124	S	58.6	Low	73.4	Confident	89 Å²	89	95.8 Å²	95.8	62%	0.622	52%	0.523	S	S	*	.	G	3₁₀ helix	trans	-91.9	-6.4	-179	65.9	0	0	0	0	114.7	G121 V122	G121-S124 PolarHBondContact O-N 2.79Å; G121-S124 VanDerWaalsContact O-N 3.12Å; G121-S124 PolarHBondContact O-OG 3.29Å; V122-S124 PolarHBondContact O-N 3.31Å
125	T	57.1	Low	71.9	Confident	112 Å²	112	95.3 Å²	95.3	69%	0.687	52%	0.522	S	S	*	.			trans	-104.2	19.9	-176.2	41.7	0	0	0	0	115.3	V122 W127	V122-T125 PolarHBondContact O-OG1 3.19Å; T125-W127 PolarHBondContact O-N 3.29Å
126	T	51.3	Low	70.3	Confident	106 Å²	106	101.1 Å²	101.1	65%	0.65	55%	0.553	S	S	*	*			trans	-90.1	46.6	176.6	57.9	0	0	0	0	114.9
127	W	51.2	Low	68.6	Low	313 Å²	313	103.4 Å²	103.4	100%	1.186	58%	0.576	S	S	*	*			trans	-135.3	0	166.1	-58.4	101.7	0	0	0	111.7	T125	T125-W127 PolarHBondContact O-N 3.29Å

Retrieved 127 of 127 residues in 79.4 ms (Link to these results)

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