A0A060VRB8_ONCMY Loading...

S100 calcium binding protein V2

AlphaFold DB , UniProt , Accession A0A060VRB8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110488270, Length 103 aa.

						>A0A060VRB8_ONCMY|A0A060VRB8|LOC110488270
MAEQHSDLEKAINTLVTKFHAAAANKGPTLQTKEFKDLLASQLPNLVKTGGSEQGLGKMMKQMGVSDGEGITFKHFWGLIQSLATTQHDLISKKVSKSSCVLL
					

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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)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.6	Very low	80.2	Confident	241 Å²	241	123 Å²	123	100%	1.187	65%	0.653	S	S	*	*				0	124.8	0	-69.5	-173.7	159.4	0	106.6	E3	M1-E3 PolarHBondContact O-N 2.74Å
2	A	52.2	Low	81.3	Confident	103 Å²	103	120.8 Å²	120.8	85%	0.851	64%	0.64	S	S	*	*			trans	-74	115.2	173.1	0	0	0	0	106.9	Q4	A2-Q4 PolarHBondContact O-N 3.5Å
3	E	60.6	Low	82.2	Confident	170 Å²	170	118.1 Å²	118.1	79%	0.794	63%	0.626	S	S	*	*			trans	-58.9	124.7	176.4	-65.9	-158.9	115.1	0	108.9	M1 H5	M1-E3 PolarHBondContact O-N 2.74Å; E3-H5 PolarHBondContact O-CD2 2.73Å; E3-H5 PolarHBondContact O-N 3.06Å; E3-H5 VanDerWaalsContact O-N 3.13Å
4	Q	81.3	Confident	83.1	Confident	187 Å²	187	114.5 Å²	114.5	87%	0.874	61%	0.611	S	S	*	*			trans	-83	95	-176.8	-159.9	176	18.9	0	108	A2	A2-Q4 PolarHBondContact O-N 3.5Å
5	H	83.4	Confident	83.9	Confident	83 Å²	83	109.5 Å²	109.5	38%	0.384	58%	0.584	S	S	.	*			trans	-64.9	142.1	-179.2	-65.7	-164.3	0	0	111	E3 E9 K10	E3-H5 PolarHBondContact O-CD2 2.73Å; E3-H5 PolarHBondContact O-N 3.06Å; E3-H5 VanDerWaalsContact O-N 3.13Å; H5-E9 HydrophobicContact CB-CB 3.95Å; H5-K10 HydrophobicContact CB-CG 3.91Å; H5-K10 WeakPolarHBondContact O-CE 3.5Å; H5-K10 PolarHBondContact O-NZ 3.11Å
6	S	93.3	Very high	84.5	Confident	58 Å²	58	106.8 Å²	106.8	41%	0.406	57%	0.573	S	S	.	*			trans	-63.1	164.7	170.5	67	0	0	0	111.7	L8 E9 K10	S6-L8 VanDerWaalsContact C-N 3.26Å; S6-L8 PolarHBondContact O-N 3.37Å; S6-E9 VanDerWaalsContact CB-OE2 3.29Å; S6-E9 WeakPolarHBondContact CB-OE2 3.42Å; S6-E9 PolarHBondContact N-OE2 3.32Å; S6-E9 PolarHBondContact O-N 3.09Å; S6-E9 VanDerWaalsContact OG-CD 3.3Å; S6-E9 WeakPolarHBondContact OG-CG 3.07Å; S6-E9 PolarHBondContact OG-N 3.31Å; S6-E9 PolarHBondContact OG-OE2 2.75Å; S6-K10 WeakPolarHBondContact O-CG 3.39Å; S6-K10 PolarHBondContact O-N 3.23Å
7	D	94.1	Very high	85.1	Confident	131 Å²	131	104.6 Å²	104.6	70%	0.701	56%	0.564	S	S	*	*	H	α-helix	trans	-61.6	-34.3	-178.3	-62.9	-49	0	0	112.8	A11	D7-A11 WeakPolarHBondContact O-CB 3.35Å; D7-A11 PolarHBondContact O-N 2.92Å
8	L	94.4	Very high	85.6	Confident	137 Å²	137	103.9 Å²	103.9	72%	0.717	56%	0.555	S	S	*	*	H	α-helix	trans	-71.5	-41.8	177.3	-61.7	-177.1	0	0	111.9	S6 K10 A11 I12	S6-L8 VanDerWaalsContact C-N 3.26Å; S6-L8 PolarHBondContact O-N 3.37Å; L8-K10 VanDerWaalsContact C-N 3.32Å; L8-K10 PolarHBondContact O-N 2.93Å; L8-A11 WeakPolarHBondContact O-CB 3.2Å; L8-A11 PolarHBondContact O-N 3.39Å; L8-I12 VanDerWaalsContact O-CG1 3.31Å; L8-I12 WeakPolarHBondContact O-CG1 3.5Å; L8-I12 PolarHBondContact O-N 2.94Å
9	E	92.6	Very high	86	Confident	103 Å²	103	98.8 Å²	98.8	48%	0.481	53%	0.528	S	S	.	.	H	α-helix	trans	-63	-40.3	174.6	-70.8	165.9	132.8	0	111.3	H5 S6 I12 N13	H5-E9 HydrophobicContact CB-CB 3.95Å; S6-E9 VanDerWaalsContact CB-OE2 3.29Å; S6-E9 WeakPolarHBondContact CB-OE2 3.42Å; S6-E9 PolarHBondContact N-OE2 3.32Å; S6-E9 PolarHBondContact O-N 3.09Å; S6-E9 VanDerWaalsContact OG-CD 3.3Å; S6-E9 WeakPolarHBondContact OG-CG 3.07Å; S6-E9 PolarHBondContact OG-N 3.31Å; S6-E9 PolarHBondContact OG-OE2 2.75Å; E9-I12 PolarHBondContact O-N 3.46Å; E9-N13 VanDerWaalsContact O-CB 3.32Å; E9-N13 WeakPolarHBondContact O-CB 3.43Å; E9-N13 PolarHBondContact O-N 3.21Å
10	K	93.3	Very high	86.4	Confident	93 Å²	93	98.8 Å²	98.8	40%	0.404	52%	0.524	S	S	.	.	H	α-helix	trans	-63.5	-40	173	-72.5	171.9	-178.8	147.3	112	H5 S6 L8 N13 T14	H5-K10 HydrophobicContact CB-CG 3.91Å; H5-K10 WeakPolarHBondContact O-CE 3.5Å; H5-K10 PolarHBondContact O-NZ 3.11Å; S6-K10 WeakPolarHBondContact O-CG 3.39Å; S6-K10 PolarHBondContact O-N 3.23Å; L8-K10 VanDerWaalsContact C-N 3.32Å; L8-K10 PolarHBondContact O-N 2.93Å; K10-N13 PolarHBondContact O-N 2.98Å; K10-T14 WeakPolarHBondContact O-CB 3.41Å; K10-T14 PolarHBondContact O-N 3.41Å; K10-T14 PolarHBondContact O-OG1 3.13Å
11	A	93	Very high	86.7	Confident	47 Å²	47	97.8 Å²	97.8	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-47.1	177.2	0	0	0	0	111.2	D7 L8 N13 T14 L15	D7-A11 WeakPolarHBondContact O-CB 3.35Å; D7-A11 PolarHBondContact O-N 2.92Å; L8-A11 WeakPolarHBondContact O-CB 3.2Å; L8-A11 PolarHBondContact O-N 3.39Å; A11-N13 PolarHBondContact O-N 3.02Å; A11-T14 WeakPolarHBondContact O-CB 3.49Å; A11-T14 PolarHBondContact O-N 2.95Å; A11-L15 WeakPolarHBondContact O-CG 3.35Å; A11-L15 PolarHBondContact O-N 3.08Å
12	I	93.8	Very high	89	Confident	96 Å²	96	87.5 Å²	87.5	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-58.9	-49.3	175.3	-66.1	164.4	0	0	110.4	L8 E9 T14 L15 V16	L8-I12 VanDerWaalsContact O-CG1 3.31Å; L8-I12 WeakPolarHBondContact O-CG1 3.5Å; L8-I12 PolarHBondContact O-N 2.94Å; E9-I12 PolarHBondContact O-N 3.46Å; I12-T14 VanDerWaalsContact C-N 3.26Å; I12-T14 PolarHBondContact O-N 3.07Å; I12-L15 PolarHBondContact O-N 3.4Å; I12-L15 VanDerWaalsContact O-N 3.15Å; I12-V16 WeakPolarHBondContact O-CG2 3.45Å; I12-V16 PolarHBondContact O-N 3.47Å
13	N	93.6	Very high	90.9	Very high	86 Å²	86	82.9 Å²	82.9	46%	0.46	44%	0.444	S	S	.	.	H	α-helix	trans	-59.4	-39.1	177.6	-176.1	45.2	0	0	112	E9 K10 A11 V16 T17	E9-N13 VanDerWaalsContact O-CB 3.32Å; E9-N13 WeakPolarHBondContact O-CB 3.43Å; E9-N13 PolarHBondContact O-N 3.21Å; K10-N13 PolarHBondContact O-N 2.98Å; A11-N13 PolarHBondContact O-N 3.02Å; N13-V16 PolarHBondContact O-N 3.42Å; N13-T17 WeakPolarHBondContact O-CB 3.33Å; N13-T17 PolarHBondContact O-N 2.78Å; N13-T17 PolarHBondContact O-OG1 3.1Å; N13-T17 PolarHBondContact OD1-OG1 2.83Å
14	T	94.8	Very high	92	Very high	68 Å²	68	78.7 Å²	78.7	42%	0.417	44%	0.439	S	S	.	.	H	α-helix	trans	-62.6	-46.7	176	-60.9	0	0	0	110.7	K10 A11 I12 V16 T17 K18	K10-T14 WeakPolarHBondContact O-CB 3.41Å; K10-T14 PolarHBondContact O-N 3.41Å; K10-T14 PolarHBondContact O-OG1 3.13Å; A11-T14 WeakPolarHBondContact O-CB 3.49Å; A11-T14 PolarHBondContact O-N 2.95Å; I12-T14 VanDerWaalsContact C-N 3.26Å; I12-T14 PolarHBondContact O-N 3.07Å; T14-V16 PolarHBondContact O-N 3.08Å; T14-T17 PolarHBondContact O-N 3.28Å; T14-K18 HydrophobicContact CG2-CG 3.93Å; T14-K18 VanDerWaalsContact O-CB 3.27Å; T14-K18 WeakPolarHBondContact O-CB 3.33Å; T14-K18 WeakPolarHBondContact O-CG 3.44Å; T14-K18 PolarHBondContact O-N 2.78Å
15	L	94.3	Very high	92.2	Very high	39 Å²	39	76.9 Å²	76.9	20%	0.204	44%	0.436	C	S	.	.	H	α-helix	trans	-60.4	-46.2	179.4	-68.7	169.8	0	0	111.7	A11 I12 F19 F76 W77 I80	A11-L15 WeakPolarHBondContact O-CG 3.35Å; A11-L15 PolarHBondContact O-N 3.08Å; I12-L15 PolarHBondContact O-N 3.4Å; I12-L15 VanDerWaalsContact O-N 3.15Å; L15-F19 VanDerWaalsContact O-CB 3.29Å; L15-F19 WeakPolarHBondContact O-CB 3.36Å; L15-F19 PolarHBondContact O-N 3.5Å; L15-F19 VanDerWaalsContact O-N 3.13Å; L15-F76 HydrophobicContact CB-CE1 4.37Å; L15-F76 HydrophobicContact CD2-CE1 4.1Å; L15-F76 HydrophobicContact CD2-CZ 3.98Å; L15-W77 HydrophobicContact CD1-CE3 4.24Å; L15-W77 HydrophobicContact CD1-CH2 4.25Å; L15-W77 HydrophobicContact CD1-CZ3 3.45Å; L15-W77 VanDerWaalsContact CD1-CZ3 3.45Å; L15-I80 HydrophobicContact CD1-CG2 4.13Å; L15-I80 HydrophobicContact CD2-CD1 4.07Å; L15-I80 HydrophobicContact CD2-CG1 4.11Å; L15-I80 HydrophobicContact CD2-CG2 4.49Å
16	V	94.1	Very high	92.1	Very high	66 Å²	66	80.6 Å²	80.6	40%	0.4	45%	0.45	S	S	.	.	H	α-helix	trans	-64.6	-49.5	177.7	176.3	0	0	0	111	I12 N13 T14 K18 F19 H20 F73	I12-V16 WeakPolarHBondContact O-CG2 3.45Å; I12-V16 PolarHBondContact O-N 3.47Å; N13-V16 PolarHBondContact O-N 3.42Å; T14-V16 PolarHBondContact O-N 3.08Å; V16-K18 PolarHBondContact O-N 3.44Å; V16-F19 PolarHBondContact O-N 3.39Å; V16-H20 WeakPolarHBondContact O-CB 3.45Å; V16-H20 PolarHBondContact O-N 3.07Å; V16-F73 HydrophobicContact CG2-CE1 4.48Å; V16-F73 HydrophobicContact CG2-CE2 4.09Å; V16-F73 HydrophobicContact CG2-CZ 3.77Å
17	T	93.8	Very high	91.8	Very high	70 Å²	70	78.8 Å²	78.8	43%	0.429	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-42.9	-175.9	-60.2	0	0	0	111.6	N13 T14 H20 A21	N13-T17 WeakPolarHBondContact O-CB 3.33Å; N13-T17 PolarHBondContact O-N 2.78Å; N13-T17 PolarHBondContact O-OG1 3.1Å; N13-T17 PolarHBondContact OD1-OG1 2.83Å; T14-T17 PolarHBondContact O-N 3.28Å; T17-H20 PolarHBondContact O-N 3.45Å; T17-A21 WeakPolarHBondContact O-CB 3.36Å; T17-A21 PolarHBondContact O-N 2.99Å
18	K	94.9	Very high	91.6	Very high	92 Å²	92	77.7 Å²	77.7	40%	0.4	44%	0.441	S	S	.	.	H	α-helix	trans	-67.9	-40.8	179.8	-66.8	-61.5	-175.8	-175.9	111.8	T14 V16 A21 A22 L38 Q42	T14-K18 HydrophobicContact CG2-CG 3.93Å; T14-K18 VanDerWaalsContact O-CB 3.27Å; T14-K18 WeakPolarHBondContact O-CB 3.33Å; T14-K18 WeakPolarHBondContact O-CG 3.44Å; T14-K18 PolarHBondContact O-N 2.78Å; V16-K18 PolarHBondContact O-N 3.44Å; K18-A21 PolarHBondContact O-N 2.86Å; K18-A22 PolarHBondContact O-N 3.29Å; K18-A22 VanDerWaalsContact O-N 3.14Å; K18-L38 HydrophobicContact CB-CD1 4.18Å; K18-Q42 HydrophobicContact CB-CG 4.41Å; K18-Q42 VanDerWaalsContact CE-OE1 3.31Å; K18-Q42 HydrophobicContact CG-CG 4.43Å
19	F	93.9	Very high	91.5	Very high	8 Å²	8	73.5 Å²	73.5	4%	0.035	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-49.6	174.4	-178	-88.3	0	0	111.2	L15 V16 A21 A22 L30 L38 I71 F73 F76	L15-F19 VanDerWaalsContact O-CB 3.29Å; L15-F19 WeakPolarHBondContact O-CB 3.36Å; L15-F19 PolarHBondContact O-N 3.5Å; L15-F19 VanDerWaalsContact O-N 3.13Å; V16-F19 PolarHBondContact O-N 3.39Å; F19-A21 VanDerWaalsContact C-N 3.31Å; F19-A21 PolarHBondContact O-N 3Å; F19-A22 WeakPolarHBondContact O-CB 3.4Å; F19-A22 PolarHBondContact O-N 3.39Å; F19-A22 VanDerWaalsContact O-N 3.15Å; F19-L30 HydrophobicContact CD2-CD1 3.64Å; F19-L30 HydrophobicContact CD2-CG 4.34Å; F19-L30 HydrophobicContact CE1-CG 4.3Å; F19-L30 HydrophobicContact CE2-CD1 3.41Å; F19-L30 VanDerWaalsContact CE2-CD1 3.41Å; F19-L30 HydrophobicContact CE2-CG 3.78Å; F19-L30 HydrophobicContact CG-CD1 4.34Å; F19-L30 HydrophobicContact CZ-CD1 3.93Å; F19-L30 HydrophobicContact CZ-CG 3.75Å; F19-L38 HydrophobicContact CD2-CD2 4.17Å; F19-I71 WeakPolarHBondContact CZ-O 3.47Å; F19-F73 HydrophobicContact CB-CD2 3.89Å; F19-F73 HydrophobicContact CB-CE2 4.19Å; F19-F73 HydrophobicContact CD1-CB 4.1Å; F19-F73 AromaticContact CD1-CD2 3.79Å; F19-F73 HydrophobicContact CD1-CD2 3.79Å; F19-F73 HydrophobicContact CD1-CG 4.44Å; F19-F73 HydrophobicContact CD2-CD2 4.19Å; F19-F73 HydrophobicContact CE1-CB 3.87Å; F19-F73 HydrophobicContact CE1-CD2 4.38Å; F19-F73 AromaticContact CG-CD2 3.68Å; F19-F73 HydrophobicContact CG-CD2 3.68Å; F19-F73 HydrophobicContact CG-CE2 4.44Å; F19-F73 HydrophobicContact CZ-CB 4.17Å; F19-F76 HydrophobicContact CB-CD1 4.15Å; F19-F76 HydrophobicContact CB-CE1 4.2Å; F19-F76 HydrophobicContact CD2-CB 3.68Å; F19-F76 AromaticContact CD2-CD1 3.59Å; F19-F76 HydrophobicContact CD2-CD1 3.59Å; F19-F76 HydrophobicContact CD2-CD2 4.47Å; F19-F76 HydrophobicContact CD2-CE1 4.33Å; F19-F76 AromaticContact CD2-CG 3.65Å; F19-F76 HydrophobicContact CD2-CG 3.65Å; F19-F76 HydrophobicContact CE2-CB 3.61Å; F19-F76 HydrophobicContact CE2-CD1 4.39Å; F19-F76 HydrophobicContact CE2-CG 4.12Å; F19-F76 HydrophobicContact CG-CD1 4.17Å
20	H	92.6	Very high	91.5	Very high	98 Å²	98	68.6 Å²	68.6	45%	0.454	40%	0.398	S	S	.	.	H	α-helix	trans	-63.7	-36.4	179.8	-170.9	-76.4	0	0	112.5	V16 T17 A22 A23	V16-H20 WeakPolarHBondContact O-CB 3.45Å; V16-H20 PolarHBondContact O-N 3.07Å; T17-H20 PolarHBondContact O-N 3.45Å; H20-A22 VanDerWaalsContact C-N 3.28Å; H20-A22 PolarHBondContact O-N 3.29Å; H20-A23 PolarHBondContact O-N 2.98Å
21	A	92.9	Very high	91.4	Very high	77 Å²	77	69.6 Å²	69.6	64%	0.636	41%	0.405	S	S	*	.	H	α-helix	trans	-71	-21.5	177.4	0	0	0	0	113.5	T17 K18 F19 A23	T17-A21 WeakPolarHBondContact O-CB 3.36Å; T17-A21 PolarHBondContact O-N 2.99Å; K18-A21 PolarHBondContact O-N 2.86Å; F19-A21 VanDerWaalsContact C-N 3.31Å; F19-A21 PolarHBondContact O-N 3Å; A21-A23 VanDerWaalsContact C-N 3.33Å
22	A	93.2	Very high	91.2	Very high	26 Å²	26	70.9 Å²	70.9	22%	0.215	41%	0.408	C	S	.	.	H	α-helix	trans	-77	-20.9	176.9	0	0	0	0	112.9	K18 F19 H20 A24 L30 L38	K18-A22 PolarHBondContact O-N 3.29Å; K18-A22 VanDerWaalsContact O-N 3.14Å; F19-A22 WeakPolarHBondContact O-CB 3.4Å; F19-A22 PolarHBondContact O-N 3.39Å; F19-A22 VanDerWaalsContact O-N 3.15Å; H20-A22 VanDerWaalsContact C-N 3.28Å; H20-A22 PolarHBondContact O-N 3.29Å; A22-A24 PolarHBondContact O-N 3.44Å; A22-L30 VanDerWaalsContact C-CD2 3.43Å; A22-L30 HydrophobicContact CB-CD1 4.03Å; A22-L30 HydrophobicContact CB-CD2 3.83Å; A22-L38 HydrophobicContact CB-CB 3.95Å; A22-L38 HydrophobicContact CB-CD1 4.11Å; A22-L38 HydrophobicContact CB-CD2 4.28Å; A22-L38 HydrophobicContact CB-CG 4.33Å
23	A	90.8	Very high	91	Very high	5 Å²	5	73.1 Å²	73.1	4%	0.041	41%	0.414	C	S	.	.			trans	-75.8	112.3	176.6	0	0	0	0	109.3	H20 A21 N25 K26 L30	H20-A23 PolarHBondContact O-N 2.98Å; A21-A23 VanDerWaalsContact C-N 3.33Å; A23-N25 PolarHBondContact O-N 3.14Å; A23-K26 PolarHBondContact O-N 3.15Å; A23-L30 HydrophobicContact CB-CD2 3.56Å
24	A	84.4	Confident	90.9	Very high	83 Å²	83	70.6 Å²	70.6	69%	0.686	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-36.2	-179.5	0	0	0	0	111.7	A22 K26 E34	A22-A24 PolarHBondContact O-N 3.44Å; A24-K26 VanDerWaalsContact C-N 3.31Å; A24-K26 PolarHBondContact O-N 2.87Å; A24-E34 WeakPolarHBondContact CA-OE1 3.2Å; A24-E34 WeakPolarHBondContact CB-OE1 3.46Å; A24-E34 PolarHBondContact N-OE1 3.45Å
25	N	86.1	Confident	90.7	Very high	149 Å²	149	67.3 Å²	67.3	80%	0.797	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	7	177.8	-65.8	-38.4	0	0	113.6	A23 G27	A23-N25 PolarHBondContact O-N 3.14Å; N25-G27 PolarHBondContact O-N 3.38Å
26	K	80.6	Confident	90.5	Very high	160 Å²	160	69.1 Å²	69.1	70%	0.696	39%	0.385	S	S	*	.			trans	50.6	29.3	-169.7	-58.3	-176.1	179.9	-176	112.7	A23 A24	A23-K26 PolarHBondContact O-N 3.15Å; A24-K26 VanDerWaalsContact C-N 3.31Å; A24-K26 PolarHBondContact O-N 2.87Å
27	G	86.1	Confident	90.3	Very high	20 Å²	20	69.6 Å²	69.6	21%	0.206	39%	0.386	C	S	.	.			trans	-79.6	170.8	-179.6	0	0	0	0	112.1	N25 T29	N25-G27 PolarHBondContact O-N 3.38Å; G27-T29 PolarHBondContact O-N 3.46Å
28	P	89.8	Confident	90.3	Very high	109 Å²	109	66.9 Å²	66.9	71%	0.708	37%	0.368	S	S	*	.	S	Bend	trans	-74.4	-7.2	179.3	31	-35.6	0	0	113.8
29	T	93.1	Very high	90.1	Very high	48 Å²	48	62.7 Å²	62.7	29%	0.294	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.3	-175.2	58.8	0	0	0	111.8	G27 I71 T72	G27-T29 PolarHBondContact O-N 3.46Å; T29-I71 CarbonylContact C-O 3.56Å; T29-I71 WeakPolarHBondContact CA-O 3.48Å; T29-T72 HydrophobicContact CG2-CG2 3.85Å
30	L	93.3	Very high	89.8	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	140.1	173.3	-58.6	179.7	0	0	110.5	F19 A22 A23 E34 F35 L38 I71	F19-L30 HydrophobicContact CD2-CD1 3.64Å; F19-L30 HydrophobicContact CD2-CG 4.34Å; F19-L30 HydrophobicContact CE1-CG 4.3Å; F19-L30 HydrophobicContact CE2-CD1 3.41Å; F19-L30 VanDerWaalsContact CE2-CD1 3.41Å; F19-L30 HydrophobicContact CE2-CG 3.78Å; F19-L30 HydrophobicContact CG-CD1 4.34Å; F19-L30 HydrophobicContact CZ-CD1 3.93Å; F19-L30 HydrophobicContact CZ-CG 3.75Å; A22-L30 VanDerWaalsContact C-CD2 3.43Å; A22-L30 HydrophobicContact CB-CD1 4.03Å; A22-L30 HydrophobicContact CB-CD2 3.83Å; A23-L30 HydrophobicContact CB-CD2 3.56Å; L30-E34 WeakPolarHBondContact CA-OE2 2.98Å; L30-E34 HydrophobicContact CB-CB 4.18Å; L30-E34 HydrophobicContact CD2-CB 4.15Å; L30-F35 HydrophobicContact CB-CB 4.23Å; L30-F35 HydrophobicContact CD1-CB 4.36Å; L30-F35 HydrophobicContact CD1-CD2 4.17Å; L30-L38 HydrophobicContact CD1-CD2 3.83Å; L30-I71 HydrophobicContact CB-CB 4.29Å; L30-I71 PolarHBondContact N-O 3.47Å; L30-I71 WeakPolarHBondContact O-CB 3.33Å; L30-I71 PolarHBondContact O-N 3.2Å
31	Q	91.1	Very high	89.7	Confident	115 Å²	115	63.8 Å²	63.8	54%	0.537	37%	0.373	S	S	.	.			trans	-72	158.4	163.5	-58.2	-59.1	-34.8	0	109.9	K33 E34 F35	Q31-K33 PolarHBondContact O-N 3.3Å; Q31-K33 VanDerWaalsContact O-N 3.11Å; Q31-E34 HydrophobicContact CB-CG 4.27Å; Q31-E34 WeakPolarHBondContact CB-OE2 3.35Å; Q31-E34 WeakPolarHBondContact CG-OE2 3.29Å; Q31-E34 PolarHBondContact N-OE2 3.3Å; Q31-E34 PolarHBondContact O-N 3.32Å; Q31-F35 PolarHBondContact O-N 2.74Å
32	T	88.1	Confident	89.7	Confident	74 Å²	74	63.9 Å²	63.9	45%	0.454	36%	0.361	S	S	.	.	H	α-helix	trans	-49.6	-42.1	178.9	-55.6	0	0	0	113	K36 M60	T32-K36 WeakPolarHBondContact O-CB 3.42Å; T32-K36 PolarHBondContact O-N 2.94Å; T32-M60 HydrophobicContact CG2-CE 4.2Å; T32-M60 HydrophobicContact CG2-SD 3.78Å
33	K	88.7	Confident	89.5	Confident	142 Å²	142	65 Å²	65	62%	0.617	36%	0.363	S	S	*	.	H	α-helix	trans	-66.1	-47.3	178.6	-173.3	-176.3	177	-61.5	111.9	Q31 F35 K36 D37	Q31-K33 PolarHBondContact O-N 3.3Å; Q31-K33 VanDerWaalsContact O-N 3.11Å; K33-F35 VanDerWaalsContact C-N 3.3Å; K33-F35 PolarHBondContact O-N 3.4Å; K33-K36 WeakPolarHBondContact O-CB 3.24Å; K33-K36 PolarHBondContact O-N 3.42Å; K33-D37 IonicContact NZ-OD2 2.74Å; K33-D37 PolarHBondContact NZ-OD2 2.91Å; K33-D37 VanDerWaalsContact O-CG 3.25Å; K33-D37 PolarHBondContact O-N 3.13Å
34	E	92.8	Very high	89.3	Confident	33 Å²	33	67.3 Å²	67.3	15%	0.154	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-40.4	-179.8	-63.6	172.2	136.1	0	111.2	A24 L30 Q31 D37 L38	A24-E34 WeakPolarHBondContact CA-OE1 3.2Å; A24-E34 WeakPolarHBondContact CB-OE1 3.46Å; A24-E34 PolarHBondContact N-OE1 3.45Å; L30-E34 WeakPolarHBondContact CA-OE2 2.98Å; L30-E34 HydrophobicContact CB-CB 4.18Å; L30-E34 HydrophobicContact CD2-CB 4.15Å; Q31-E34 HydrophobicContact CB-CG 4.27Å; Q31-E34 WeakPolarHBondContact CB-OE2 3.35Å; Q31-E34 WeakPolarHBondContact CG-OE2 3.29Å; Q31-E34 PolarHBondContact N-OE2 3.3Å; Q31-E34 PolarHBondContact O-N 3.32Å; E34-D37 PolarHBondContact O-N 2.96Å; E34-L38 WeakPolarHBondContact O-CB 3.46Å; E34-L38 PolarHBondContact O-N 2.85Å
35	F	91.1	Very high	89.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-66.6	-41.5	175.1	-177.7	-106.9	0	0	112.7	L30 Q31 K33 D37 L38 L39 L56 M63 I71 F76 L79	L30-F35 HydrophobicContact CB-CB 4.23Å; L30-F35 HydrophobicContact CD1-CB 4.36Å; L30-F35 HydrophobicContact CD1-CD2 4.17Å; Q31-F35 PolarHBondContact O-N 2.74Å; K33-F35 VanDerWaalsContact C-N 3.3Å; K33-F35 PolarHBondContact O-N 3.4Å; F35-D37 VanDerWaalsContact C-N 3.32Å; F35-D37 PolarHBondContact O-N 2.91Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 3.4Å; F35-L39 HydrophobicContact CD1-CD1 4.06Å; F35-L39 HydrophobicContact CD1-CG 4.36Å; F35-L39 HydrophobicContact CE1-CD1 3.41Å; F35-L39 VanDerWaalsContact CE1-CD1 3.41Å; F35-L39 HydrophobicContact CE1-CD2 4.49Å; F35-L39 HydrophobicContact CE1-CG 3.95Å; F35-L39 HydrophobicContact CE2-CD2 4.29Å; F35-L39 HydrophobicContact CE2-CG 4.35Å; F35-L39 HydrophobicContact CZ-CD1 3.73Å; F35-L39 HydrophobicContact CZ-CD2 4Å; F35-L39 HydrophobicContact CZ-CG 3.95Å; F35-L39 WeakPolarHBondContact O-CG 3.49Å; F35-L39 PolarHBondContact O-N 3.32Å; F35-L56 HydrophobicContact CD1-CD1 4.1Å; F35-L56 HydrophobicContact CE1-CD1 4Å; F35-M63 HydrophobicContact CE1-CE 3.58Å; F35-M63 HydrophobicContact CE1-SD 4.5Å; F35-M63 HydrophobicContact CZ-CE 3.58Å; F35-M63 HydrophobicContact CZ-SD 3.92Å; F35-I71 HydrophobicContact CB-CD1 3.28Å; F35-I71 HydrophobicContact CD1-CD1 3.83Å; F35-I71 HydrophobicContact CD2-CD1 4.26Å; F35-I71 HydrophobicContact CD2-CG2 3.92Å; F35-I71 HydrophobicContact CE2-CG2 4.15Å; F35-I71 HydrophobicContact CG-CD1 3.54Å; F35-I71 HydrophobicContact CG-CG2 4.31Å; F35-F76 HydrophobicContact CE2-CB 4.36Å; F35-F76 AromaticContact CE2-CD2 3.91Å; F35-F76 HydrophobicContact CE2-CD2 3.91Å; F35-L79 HydrophobicContact CZ-CD2 4.09Å
36	K	88.7	Confident	88.9	Confident	77 Å²	77	64 Å²	64	34%	0.335	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-46	173.5	-174.5	176.3	179.8	-180	111.1	T32 K33 L39 A40 L56	T32-K36 WeakPolarHBondContact O-CB 3.42Å; T32-K36 PolarHBondContact O-N 2.94Å; K33-K36 WeakPolarHBondContact O-CB 3.24Å; K33-K36 PolarHBondContact O-N 3.42Å; K36-L39 PolarHBondContact O-N 3.14Å; K36-A40 WeakPolarHBondContact O-CB 3.39Å; K36-A40 PolarHBondContact O-N 3.21Å; K36-L56 HydrophobicContact CB-CD2 3.67Å; K36-L56 HydrophobicContact CD-CD2 3.94Å; K36-L56 HydrophobicContact CG-CD2 3.77Å
37	D	91	Very high	88.6	Confident	76 Å²	76	58.3 Å²	58.3	41%	0.406	33%	0.326	S	S	.	.	H	α-helix	trans	-64.9	-39.9	179.7	-66.9	-20.4	0	0	110.9	K33 E34 F35 A40 S41	K33-D37 IonicContact NZ-OD2 2.74Å; K33-D37 PolarHBondContact NZ-OD2 2.91Å; K33-D37 VanDerWaalsContact O-CG 3.25Å; K33-D37 PolarHBondContact O-N 3.13Å; E34-D37 PolarHBondContact O-N 2.96Å; F35-D37 VanDerWaalsContact C-N 3.32Å; F35-D37 PolarHBondContact O-N 2.91Å; D37-A40 PolarHBondContact O-N 2.86Å; D37-S41 WeakPolarHBondContact O-CB 3.35Å; D37-S41 PolarHBondContact O-N 2.91Å
38	L	92.6	Very high	87.8	Confident	12 Å²	12	65.1 Å²	65.1	6%	0.063	35%	0.35	C	S	.	.	H	α-helix	trans	-59	-49.9	172.8	175.9	65.7	0	0	111.8	K18 F19 A22 L30 E34 F35 S41 Q42 F76	K18-L38 HydrophobicContact CB-CD1 4.18Å; F19-L38 HydrophobicContact CD2-CD2 4.17Å; A22-L38 HydrophobicContact CB-CB 3.95Å; A22-L38 HydrophobicContact CB-CD1 4.11Å; A22-L38 HydrophobicContact CB-CD2 4.28Å; A22-L38 HydrophobicContact CB-CG 4.33Å; L30-L38 HydrophobicContact CD1-CD2 3.83Å; E34-L38 WeakPolarHBondContact O-CB 3.46Å; E34-L38 PolarHBondContact O-N 2.85Å; F35-L38 WeakPolarHBondContact O-CB 3.47Å; F35-L38 PolarHBondContact O-N 3.4Å; L38-S41 PolarHBondContact O-N 3.2Å; L38-Q42 HydrophobicContact CD1-CB 4.45Å; L38-Q42 HydrophobicContact CD1-CG 3.69Å; L38-Q42 WeakPolarHBondContact O-CB 3.35Å; L38-Q42 PolarHBondContact O-N 3.25Å; L38-F76 HydrophobicContact CD2-CD2 4.44Å; L38-F76 HydrophobicContact CD2-CE2 4.2Å
39	L	90.3	Very high	86.5	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.021	36%	0.355	C	S	.	.	H	α-helix	trans	-64	-41.3	179.1	-67.3	-173.3	0	0	111.6	F35 K36 S41 L43 L46 V47 L56 M59 L79	F35-L39 HydrophobicContact CD1-CD1 4.06Å; F35-L39 HydrophobicContact CD1-CG 4.36Å; F35-L39 HydrophobicContact CE1-CD1 3.41Å; F35-L39 VanDerWaalsContact CE1-CD1 3.41Å; F35-L39 HydrophobicContact CE1-CD2 4.49Å; F35-L39 HydrophobicContact CE1-CG 3.95Å; F35-L39 HydrophobicContact CE2-CD2 4.29Å; F35-L39 HydrophobicContact CE2-CG 4.35Å; F35-L39 HydrophobicContact CZ-CD1 3.73Å; F35-L39 HydrophobicContact CZ-CD2 4Å; F35-L39 HydrophobicContact CZ-CG 3.95Å; F35-L39 WeakPolarHBondContact O-CG 3.49Å; F35-L39 PolarHBondContact O-N 3.32Å; K36-L39 PolarHBondContact O-N 3.14Å; L39-S41 VanDerWaalsContact C-N 3.28Å; L39-S41 PolarHBondContact O-N 3.18Å; L39-L43 HydrophobicContact CD2-CD1 3.79Å; L39-L43 CarbonylContact O-C 2.98Å; L39-L43 WeakPolarHBondContact O-CA 3.48Å; L39-L43 PolarHBondContact O-N 2.89Å; L39-L46 HydrophobicContact CD2-CD2 4.49Å; L39-V47 HydrophobicContact CB-CG2 3.65Å; L39-L56 HydrophobicContact CD1-CD1 3.84Å; L39-M59 HydrophobicContact CD1-CE 4.33Å; L39-M59 HydrophobicContact CD1-SD 4.42Å; L39-L79 HydrophobicContact CD1-CD2 4.47Å; L39-L79 HydrophobicContact CD2-CD2 3.75Å
40	A	88.9	Confident	84.8	Confident	49 Å²	49	66.1 Å²	66.1	41%	0.405	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-36.7	177.6	0	0	0	0	112	K36 D37	K36-A40 WeakPolarHBondContact O-CB 3.39Å; K36-A40 PolarHBondContact O-N 3.21Å; D37-A40 PolarHBondContact O-N 2.86Å
41	S	90.6	Very high	83	Confident	81 Å²	81	67.8 Å²	67.8	57%	0.566	38%	0.381	S	S	*	.	H	α-helix	trans	-78.6	-48.1	179.9	179.8	0	0	0	113.4	D37 L38 L39	D37-S41 WeakPolarHBondContact O-CB 3.35Å; D37-S41 PolarHBondContact O-N 2.91Å; L38-S41 PolarHBondContact O-N 3.2Å; L39-S41 VanDerWaalsContact C-N 3.28Å; L39-S41 PolarHBondContact O-N 3.18Å
42	Q	92.6	Very high	81.6	Confident	79 Å²	79	66.5 Å²	66.5	37%	0.369	39%	0.385	S	S	.	.	H	α-helix	trans	-97.8	-24.1	-169.9	-57.9	-58.4	-74.2	0	113.2	K18 L38 P44	K18-Q42 HydrophobicContact CB-CG 4.41Å; K18-Q42 VanDerWaalsContact CE-OE1 3.31Å; K18-Q42 HydrophobicContact CG-CG 4.43Å; L38-Q42 HydrophobicContact CD1-CB 4.45Å; L38-Q42 HydrophobicContact CD1-CG 3.69Å; L38-Q42 WeakPolarHBondContact O-CB 3.35Å; L38-Q42 PolarHBondContact O-N 3.25Å; Q42-P44 VanDerWaalsContact C-CD 3.42Å
43	L	89.4	Confident	80.5	Confident	49 Å²	49	70.4 Å²	70.4	26%	0.257	40%	0.398	S	S	.	.			trans	-131.6	53.2	-178.2	-62.3	171.8	0	0	111.4	L39 N45 L46 V47 I80 L83	L39-L43 HydrophobicContact CD2-CD1 3.79Å; L39-L43 CarbonylContact O-C 2.98Å; L39-L43 WeakPolarHBondContact O-CA 3.48Å; L39-L43 PolarHBondContact O-N 2.89Å; L43-N45 VanDerWaalsContact C-N 3.25Å; L43-N45 PolarHBondContact O-N 3.44Å; L43-N45 VanDerWaalsContact O-N 3.14Å; L43-L46 HydrophobicContact CB-CB 4.02Å; L43-L46 HydrophobicContact CB-CD2 4.25Å; L43-L46 HydrophobicContact CD1-CD2 4.1Å; L43-L46 VanDerWaalsContact O-CB 3.27Å; L43-L46 WeakPolarHBondContact O-CB 3.18Å; L43-L46 PolarHBondContact O-N 2.83Å; L43-V47 PolarHBondContact O-N 3.37Å; L43-I80 HydrophobicContact CD1-CD1 4Å; L43-L83 HydrophobicContact CD1-CD1 4.21Å
44	P	86.1	Confident	79.5	Confident	53 Å²	53	71.9 Å²	71.9	34%	0.344	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-32	-170.6	23.7	-34.7	0	0	113.4	Q42 V47 K48	Q42-P44 VanDerWaalsContact C-CD 3.42Å; P44-V47 PolarHBondContact O-N 3.28Å; P44-K48 VanDerWaalsContact O-CG 3.24Å; P44-K48 WeakPolarHBondContact O-CG 3.24Å; P44-K48 PolarHBondContact O-N 3Å
45	N	83	Confident	78.7	Confident	112 Å²	112	71.4 Å²	71.4	60%	0.599	41%	0.411	S	S	*	.	H	α-helix	trans	-71.9	-31.9	178.9	-64.3	-32.3	0	0	112.2	L43 V47 K48 T49	L43-N45 VanDerWaalsContact C-N 3.25Å; L43-N45 PolarHBondContact O-N 3.44Å; L43-N45 VanDerWaalsContact O-N 3.14Å; N45-V47 VanDerWaalsContact C-N 3.35Å; N45-K48 PolarHBondContact O-N 2.98Å; N45-T49 PolarHBondContact O-N 3.26Å; N45-T49 VanDerWaalsContact O-N 3.13Å; N45-T49 PolarHBondContact O-OG1 3.38Å; N45-T49 VanDerWaalsContact O-OG1 3.12Å
46	L	78.8	Confident	78.1	Confident	50 Å²	50	72.4 Å²	72.4	26%	0.262	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-44.7	174	-174	69.1	0	0	110.8	L39 L43 K48 T49 G50 M59 L79 L83	L39-L46 HydrophobicContact CD2-CD2 4.49Å; L43-L46 HydrophobicContact CB-CB 4.02Å; L43-L46 HydrophobicContact CB-CD2 4.25Å; L43-L46 HydrophobicContact CD1-CD2 4.1Å; L43-L46 VanDerWaalsContact O-CB 3.27Å; L43-L46 WeakPolarHBondContact O-CB 3.18Å; L43-L46 PolarHBondContact O-N 2.83Å; L46-K48 VanDerWaalsContact C-N 3.35Å; L46-T49 PolarHBondContact O-N 3.44Å; L46-G50 PolarHBondContact O-N 3.44Å; L46-M59 HydrophobicContact CD2-CE 3.63Å; L46-M59 HydrophobicContact CG-CE 4.32Å; L46-L79 HydrophobicContact CD2-CD1 4.36Å; L46-L79 HydrophobicContact CD2-CD2 4.18Å; L46-L83 HydrophobicContact CD1-CD1 4.28Å; L46-L83 HydrophobicContact CD1-CD2 3.49Å; L46-L83 VanDerWaalsContact CD1-CD2 3.49Å; L46-L83 HydrophobicContact CD2-CD1 3.76Å; L46-L83 HydrophobicContact CD2-CD2 4.44Å
47	V	73.8	Confident	77.6	Confident	42 Å²	42	70.3 Å²	70.3	26%	0.255	42%	0.417	S	S	.	.	H	α-helix	trans	-67.6	-35.1	177.2	-177.1	0	0	0	111.2	L39 L43 P44 N45 T49 G51	L39-V47 HydrophobicContact CB-CG2 3.65Å; L43-V47 PolarHBondContact O-N 3.37Å; P44-V47 PolarHBondContact O-N 3.28Å; N45-V47 VanDerWaalsContact C-N 3.35Å; V47-T49 VanDerWaalsContact C-N 3.33Å; V47-T49 PolarHBondContact O-N 3.17Å; V47-G51 WeakPolarHBondContact O-CA 3.15Å; V47-G51 PolarHBondContact O-N 3.14Å
48	K	70.2	Confident	77.2	Confident	163 Å²	163	73.3 Å²	73.3	71%	0.709	43%	0.426	S	S	*	.	H	α-helix	trans	-65.5	-35.4	175.3	-73.2	168.6	-174.1	178.3	113.1	P44 N45 L46	P44-K48 VanDerWaalsContact O-CG 3.24Å; P44-K48 WeakPolarHBondContact O-CG 3.24Å; P44-K48 PolarHBondContact O-N 3Å; N45-K48 PolarHBondContact O-N 2.98Å; L46-K48 VanDerWaalsContact C-N 3.35Å
49	T	63.3	Low	76.7	Confident	132 Å²	132	74.4 Å²	74.4	81%	0.81	43%	0.431	S	S	*	.	H	α-helix	trans	-87.7	-21	-176.5	-52.6	0	0	0	113.3	N45 L46 V47	N45-T49 PolarHBondContact O-N 3.26Å; N45-T49 VanDerWaalsContact O-N 3.13Å; N45-T49 PolarHBondContact O-OG1 3.38Å; N45-T49 VanDerWaalsContact O-OG1 3.12Å; L46-T49 PolarHBondContact O-N 3.44Å; V47-T49 VanDerWaalsContact C-N 3.33Å; V47-T49 PolarHBondContact O-N 3.17Å
50	G	57.5	Low	76.4	Confident	45 Å²	45	75.1 Å²	75.1	46%	0.464	44%	0.435	S	S	.	.	H	α-helix	trans	-136.3	5.4	-177.6	0	0	0	0	116.5	L46 S52 G55	L46-G50 PolarHBondContact O-N 3.44Å; G50-S52 PolarHBondContact O-N 3.44Å; G50-G55 WeakPolarHBondContact O-CA 3.27Å
51	G	54.7	Low	76.2	Confident	36 Å²	36	79.7 Å²	79.7	37%	0.371	45%	0.446	S	S	.	.			trans	-93.4	34.5	-162.1	0	0	0	0	117.1	V47	V47-G51 WeakPolarHBondContact O-CA 3.15Å; V47-G51 PolarHBondContact O-N 3.14Å
52	S	62.4	Low	75.9	Confident	88 Å²	88	82.9 Å²	82.9	62%	0.615	45%	0.451	S	S	*	.	S	Bend	trans	-63.5	147.1	153.6	-54.9	0	0	0	108.2	G50 Q54 G55 L56	G50-S52 PolarHBondContact O-N 3.44Å; S52-Q54 PolarHBondContact O-N 2.86Å; S52-Q54 VanDerWaalsContact O-N 3.08Å; S52-G55 WeakPolarHBondContact O-CA 3.27Å; S52-G55 PolarHBondContact O-N 2.97Å; S52-L56 PolarHBondContact O-N 3.34Å; S52-L56 VanDerWaalsContact O-N 3.08Å
53	E	64.5	Low	75.5	Confident	156 Å²	156	80.4 Å²	80.4	73%	0.729	44%	0.44	S	S	*	.	H	α-helix	trans	-51.9	-35.3	175.7	-88.3	179.4	72.4	0	112.3	G55 L56 G57	E53-G55 VanDerWaalsContact C-N 3.34Å; E53-G55 PolarHBondContact O-N 2.78Å; E53-L56 PolarHBondContact O-N 3.48Å; E53-G57 PolarHBondContact O-N 3.44Å
54	Q	66.6	Low	75.4	Confident	172 Å²	172	80.3 Å²	80.3	80%	0.804	45%	0.451	S	S	*	.	H	α-helix	trans	-65.3	-33.9	174.1	-159.1	-179.9	-6.7	0	113.3	S52 K58	S52-Q54 PolarHBondContact O-N 2.86Å; S52-Q54 VanDerWaalsContact O-N 3.08Å; Q54-K58 WeakPolarHBondContact O-CB 3.22Å; Q54-K58 PolarHBondContact O-N 2.85Å; Q54-K58 VanDerWaalsContact O-N 3.13Å
55	G	76.6	Confident	75.5	Confident	24 Å²	24	78.3 Å²	78.3	25%	0.247	44%	0.437	C	S	.	.	H	α-helix	trans	-71.2	-40.4	175.9	0	0	0	0	112.3	G50 S52 E53 K58 M59	G50-G55 WeakPolarHBondContact O-CA 3.27Å; S52-G55 WeakPolarHBondContact O-CA 3.27Å; S52-G55 PolarHBondContact O-N 2.97Å; E53-G55 VanDerWaalsContact C-N 3.34Å; E53-G55 PolarHBondContact O-N 2.78Å; G55-K58 PolarHBondContact O-N 3.31Å; G55-M59 VanDerWaalsContact O-CB 3.24Å; G55-M59 WeakPolarHBondContact O-CB 3.39Å; G55-M59 PolarHBondContact O-N 3.01Å
56	L	78.3	Confident	75.5	Confident	20 Å²	20	76.5 Å²	76.5	11%	0.105	43%	0.434	C	S	.	.	H	α-helix	trans	-63.8	-44.9	174.1	-176.7	66.1	0	0	111.8	F35 K36 L39 S52 E53 K58 M59 M60	F35-L56 HydrophobicContact CD1-CD1 4.1Å; F35-L56 HydrophobicContact CE1-CD1 4Å; K36-L56 HydrophobicContact CB-CD2 3.67Å; K36-L56 HydrophobicContact CD-CD2 3.94Å; K36-L56 HydrophobicContact CG-CD2 3.77Å; L39-L56 HydrophobicContact CD1-CD1 3.84Å; S52-L56 PolarHBondContact O-N 3.34Å; S52-L56 VanDerWaalsContact O-N 3.08Å; E53-L56 PolarHBondContact O-N 3.48Å; L56-K58 VanDerWaalsContact C-N 3.34Å; L56-K58 PolarHBondContact O-N 2.85Å; L56-M59 WeakPolarHBondContact O-CB 3.42Å; L56-M59 PolarHBondContact O-N 3.05Å; L56-M60 HydrophobicContact CG-SD 4.28Å; L56-M60 WeakPolarHBondContact O-CG 3.32Å; L56-M60 PolarHBondContact O-N 2.79Å
57	G	79.4	Confident	75.5	Confident	34 Å²	34	81.5 Å²	81.5	35%	0.351	46%	0.461	S	S	.	.	H	α-helix	trans	-61.2	-41.6	176.8	0	0	0	0	112.6	E53 M59 M60 K61	E53-G57 PolarHBondContact O-N 3.44Å; G57-M59 VanDerWaalsContact C-N 3.34Å; G57-M59 PolarHBondContact O-N 3.34Å; G57-M60 PolarHBondContact O-N 3.13Å; G57-K61 PolarHBondContact O-N 3.34Å; G57-K61 VanDerWaalsContact O-N 3.07Å
58	K	81.1	Confident	75.7	Confident	139 Å²	139	83.7 Å²	83.7	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-62.5	-42.6	173.9	-173.1	178.5	179.9	-179.1	111.7	Q54 G55 L56 K61 Q62	Q54-K58 WeakPolarHBondContact O-CB 3.22Å; Q54-K58 PolarHBondContact O-N 2.85Å; Q54-K58 VanDerWaalsContact O-N 3.13Å; G55-K58 PolarHBondContact O-N 3.31Å; L56-K58 VanDerWaalsContact C-N 3.34Å; L56-K58 PolarHBondContact O-N 2.85Å; K58-K61 PolarHBondContact O-N 3.4Å; K58-Q62 WeakPolarHBondContact O-CG 3.34Å; K58-Q62 PolarHBondContact O-N 3.5Å
59	M	82.4	Confident	76.5	Confident	35 Å²	35	79.7 Å²	79.7	17%	0.172	48%	0.475	C	S	.	.	H	α-helix	trans	-63.8	-40.8	178.2	-174.3	176.4	-176.5	0	112	L39 L46 G55 L56 G57 Q62 M63 L79	L39-M59 HydrophobicContact CD1-CE 4.33Å; L39-M59 HydrophobicContact CD1-SD 4.42Å; L46-M59 HydrophobicContact CD2-CE 3.63Å; L46-M59 HydrophobicContact CG-CE 4.32Å; G55-M59 VanDerWaalsContact O-CB 3.24Å; G55-M59 WeakPolarHBondContact O-CB 3.39Å; G55-M59 PolarHBondContact O-N 3.01Å; L56-M59 WeakPolarHBondContact O-CB 3.42Å; L56-M59 PolarHBondContact O-N 3.05Å; G57-M59 VanDerWaalsContact C-N 3.34Å; G57-M59 PolarHBondContact O-N 3.34Å; M59-Q62 WeakPolarHBondContact O-CB 3.32Å; M59-Q62 PolarHBondContact O-N 3.45Å; M59-M63 HydrophobicContact CG-CE 4.43Å; M59-M63 WeakPolarHBondContact O-CG 3.35Å; M59-M63 PolarHBondContact O-N 3.03Å; M59-L79 HydrophobicContact CE-CD1 3.03Å; M59-L79 HydrophobicContact CE-CD2 3.27Å; M59-L79 HydrophobicContact CE-CG 3.72Å
60	M	84.9	Confident	77.8	Confident	18 Å²	18	74.1 Å²	74.1	9%	0.089	45%	0.445	C	S	.	.	H	α-helix	trans	-60.7	-44.5	172.8	-71.7	176.3	62.4	0	112.3	T32 L56 G57 Q62 M63 G64 V65 I71	T32-M60 HydrophobicContact CG2-CE 4.2Å; T32-M60 HydrophobicContact CG2-SD 3.78Å; L56-M60 HydrophobicContact CG-SD 4.28Å; L56-M60 WeakPolarHBondContact O-CG 3.32Å; L56-M60 PolarHBondContact O-N 2.79Å; G57-M60 PolarHBondContact O-N 3.13Å; M60-Q62 VanDerWaalsContact C-N 3.33Å; M60-Q62 PolarHBondContact O-N 3.4Å; M60-M63 HydrophobicContact CB-CE 4.25Å; M60-M63 HydrophobicContact CG-CE 3.84Å; M60-M63 PolarHBondContact O-N 3.46Å; M60-M63 VanDerWaalsContact O-N 3.17Å; M60-G64 PolarHBondContact O-N 3.09Å; M60-V65 HydrophobicContact CB-CB 4.3Å; M60-V65 HydrophobicContact CE-CG1 4Å; M60-V65 WeakPolarHBondContact O-CB 3.4Å; M60-V65 PolarHBondContact O-N 3.22Å; M60-I71 HydrophobicContact CE-CD1 3.55Å; M60-I71 HydrophobicContact CE-CG1 3.83Å; M60-I71 HydrophobicContact SD-CD1 4.2Å
61	K	84.4	Confident	79.5	Confident	146 Å²	146	72 Å²	72	64%	0.635	42%	0.423	S	S	*	.	H	α-helix	trans	-61.8	-39.7	173	-71.4	-173	177.6	-171.7	112.4	G57 K58 M63 G64	G57-K61 PolarHBondContact O-N 3.34Å; G57-K61 VanDerWaalsContact O-N 3.07Å; K58-K61 PolarHBondContact O-N 3.4Å; K61-M63 VanDerWaalsContact C-N 3.29Å; K61-M63 PolarHBondContact O-N 3.4Å; K61-G64 WeakPolarHBondContact O-CA 3.45Å; K61-G64 PolarHBondContact O-N 3.13Å
62	Q	83.3	Confident	81.4	Confident	148 Å²	148	72.3 Å²	72.3	69%	0.692	42%	0.417	S	S	*	.	H	α-helix	trans	-65.8	-31.2	175.5	-72.9	178.9	-66.4	0	112.9	K58 M59 M60 G64	K58-Q62 WeakPolarHBondContact O-CG 3.34Å; K58-Q62 PolarHBondContact O-N 3.5Å; M59-Q62 WeakPolarHBondContact O-CB 3.32Å; M59-Q62 PolarHBondContact O-N 3.45Å; M60-Q62 VanDerWaalsContact C-N 3.33Å; M60-Q62 PolarHBondContact O-N 3.4Å; Q62-G64 PolarHBondContact O-N 3.23Å
63	M	85.3	Confident	82.9	Confident	27 Å²	27	71.3 Å²	71.3	13%	0.133	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-3.3	171.3	-67.6	-178	-63.1	0	113	F35 M59 M60 K61 V65 H75 L79	F35-M63 HydrophobicContact CE1-CE 3.58Å; F35-M63 HydrophobicContact CE1-SD 4.5Å; F35-M63 HydrophobicContact CZ-CE 3.58Å; F35-M63 HydrophobicContact CZ-SD 3.92Å; M59-M63 HydrophobicContact CG-CE 4.43Å; M59-M63 WeakPolarHBondContact O-CG 3.35Å; M59-M63 PolarHBondContact O-N 3.03Å; M60-M63 HydrophobicContact CB-CE 4.25Å; M60-M63 HydrophobicContact CG-CE 3.84Å; M60-M63 PolarHBondContact O-N 3.46Å; M60-M63 VanDerWaalsContact O-N 3.17Å; K61-M63 VanDerWaalsContact C-N 3.29Å; K61-M63 PolarHBondContact O-N 3.4Å; M63-V65 HydrophobicContact CB-CG2 4.23Å; M63-H75 HydrophobicContact CB-CB 4.28Å; M63-H75 PolarHBondContact O-ND1 3.06Å; M63-L79 HydrophobicContact CG-CB 4.29Å; M63-L79 HydrophobicContact SD-CB 3.61Å; M63-L79 HydrophobicContact SD-CD2 4.31Å; M63-L79 HydrophobicContact SD-CG 4.49Å
64	G	86.1	Confident	84.3	Confident	46 Å²	46	72 Å²	72	47%	0.474	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	24	-178.9	0	0	0	0	114	M60 K61 Q62 H75	M60-G64 PolarHBondContact O-N 3.09Å; K61-G64 WeakPolarHBondContact O-CA 3.45Å; K61-G64 PolarHBondContact O-N 3.13Å; Q62-G64 PolarHBondContact O-N 3.23Å; G64-H75 PolarHBondContact O-CE1 3.33Å; G64-H75 VanDerWaalsContact O-CE1 3.29Å
65	V	88.4	Confident	85.6	Confident	11 Å²	11	65.2 Å²	65.2	7%	0.067	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-80	124.2	174.2	-176.1	0	0	0	108.8	M60 M63 E69 I71 H75	M60-V65 HydrophobicContact CB-CB 4.3Å; M60-V65 HydrophobicContact CE-CG1 4Å; M60-V65 WeakPolarHBondContact O-CB 3.4Å; M60-V65 PolarHBondContact O-N 3.22Å; M63-V65 HydrophobicContact CB-CG2 4.23Å; V65-E69 HydrophobicContact CG1-CB 4.35Å; V65-I71 HydrophobicContact CG1-CG1 4Å; V65-I71 HydrophobicContact CG2-CG1 4.18Å; V65-I71 HydrophobicContact CG2-CG2 4.45Å; V65-H75 HydrophobicContact CG2-CB 3.84Å
66	S	84.6	Confident	86.3	Confident	74 Å²	74	64.5 Å²	64.5	52%	0.517	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-78.8	160.1	177.7	-45.4	0	0	0	111.8	G68 E69	S66-G68 PolarHBondContact O-N 3.01Å; S66-E69 WeakPolarHBondContact CB-OE2 3.41Å; S66-E69 PolarHBondContact N-OE2 2.84Å; S66-E69 WeakPolarHBondContact O-CB 3.48Å; S66-E69 PolarHBondContact O-N 2.73Å; S66-E69 VanDerWaalsContact O-N 3.09Å; S66-E69 PolarHBondContact OG-OE2 3.32Å
67	D	78.6	Confident	87	Confident	155 Å²	155	68.6 Å²	68.6	83%	0.829	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	125.9	175.7	-114.8	-80.4	0	0	110.5	E69	D67-E69 PolarHBondContact O-N 3.12Å
68	G	77.9	Confident	87.6	Confident	88 Å²	88	68.4 Å²	68.4	91%	0.907	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	-1.7	-176	0	0	0	0	115.5	S66	S66-G68 PolarHBondContact O-N 3.01Å
69	E	86.8	Confident	88.1	Confident	79 Å²	79	62.4 Å²	62.4	37%	0.369	35%	0.347	S	S	.	.			trans	-81	139.1	175.1	-171.6	179.2	-175.2	0	111.2	V65 S66 D67 H75	V65-E69 HydrophobicContact CG1-CB 4.35Å; S66-E69 WeakPolarHBondContact CB-OE2 3.41Å; S66-E69 PolarHBondContact N-OE2 2.84Å; S66-E69 WeakPolarHBondContact O-CB 3.48Å; S66-E69 PolarHBondContact O-N 2.73Å; S66-E69 VanDerWaalsContact O-N 3.09Å; S66-E69 PolarHBondContact OG-OE2 3.32Å; D67-E69 PolarHBondContact O-N 3.12Å; E69-H75 IonicContact OE1-NE2 3.8Å
70	G	89.9	Confident	88.5	Confident	16 Å²	16	62.1 Å²	62.1	17%	0.165	35%	0.346	C	S	.	.			trans	-71.6	138.8	171.6	0	0	0	0	111.5	T72	G70-T72 PolarHBondContact O-N 2.89Å; G70-T72 VanDerWaalsContact O-N 3.1Å
71	I	93.8	Very high	88.8	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	105.3	-179.2	-56.1	153.5	0	0	108.1	F19 T29 L30 F35 M60 V65 H75	F19-I71 WeakPolarHBondContact CZ-O 3.47Å; T29-I71 CarbonylContact C-O 3.56Å; T29-I71 WeakPolarHBondContact CA-O 3.48Å; L30-I71 HydrophobicContact CB-CB 4.29Å; L30-I71 PolarHBondContact N-O 3.47Å; L30-I71 WeakPolarHBondContact O-CB 3.33Å; L30-I71 PolarHBondContact O-N 3.2Å; F35-I71 HydrophobicContact CB-CD1 3.28Å; F35-I71 HydrophobicContact CD1-CD1 3.83Å; F35-I71 HydrophobicContact CD2-CD1 4.26Å; F35-I71 HydrophobicContact CD2-CG2 3.92Å; F35-I71 HydrophobicContact CE2-CG2 4.15Å; F35-I71 HydrophobicContact CG-CD1 3.54Å; F35-I71 HydrophobicContact CG-CG2 4.31Å; M60-I71 HydrophobicContact CE-CD1 3.55Å; M60-I71 HydrophobicContact CE-CG1 3.83Å; M60-I71 HydrophobicContact SD-CD1 4.2Å; V65-I71 HydrophobicContact CG1-CG1 4Å; V65-I71 HydrophobicContact CG2-CG1 4.18Å; V65-I71 HydrophobicContact CG2-CG2 4.45Å; I71-H75 HydrophobicContact CG2-CB 4.03Å
72	T	94.6	Very high	89	Confident	42 Å²	42	63 Å²	63	26%	0.258	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	162.7	173.4	72.4	0	0	0	112.9	T29 G70 K74 H75 F76	T29-T72 HydrophobicContact CG2-CG2 3.85Å; G70-T72 PolarHBondContact O-N 2.89Å; G70-T72 VanDerWaalsContact O-N 3.1Å; T72-K74 PolarHBondContact O-N 3.15Å; T72-K74 PolarHBondContact OG1-N 2.91Å; T72-H75 PolarHBondContact N-CD2 3.49Å; T72-H75 PolarHBondContact O-N 2.94Å; T72-H75 VanDerWaalsContact O-N 3.14Å; T72-H75 PolarHBondContact OG1-CD2 3.11Å; T72-H75 PolarHBondContact OG1-N 3.46Å; T72-F76 PolarHBondContact O-N 3.05Å
73	F	94	Very high	89.3	Confident	68 Å²	68	58.5 Å²	58.5	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-57.4	-31.9	172.9	-176.1	-102.1	0	0	112.4	V16 F19 F76 W77	V16-F73 HydrophobicContact CG2-CE1 4.48Å; V16-F73 HydrophobicContact CG2-CE2 4.09Å; V16-F73 HydrophobicContact CG2-CZ 3.77Å; F19-F73 HydrophobicContact CB-CD2 3.89Å; F19-F73 HydrophobicContact CB-CE2 4.19Å; F19-F73 HydrophobicContact CD1-CB 4.1Å; F19-F73 AromaticContact CD1-CD2 3.79Å; F19-F73 HydrophobicContact CD1-CD2 3.79Å; F19-F73 HydrophobicContact CD1-CG 4.44Å; F19-F73 HydrophobicContact CD2-CD2 4.19Å; F19-F73 HydrophobicContact CE1-CB 3.87Å; F19-F73 HydrophobicContact CE1-CD2 4.38Å; F19-F73 AromaticContact CG-CD2 3.68Å; F19-F73 HydrophobicContact CG-CD2 3.68Å; F19-F73 HydrophobicContact CG-CE2 4.44Å; F19-F73 HydrophobicContact CZ-CB 4.17Å; F73-F76 AromaticContact CD2-CD1 3.98Å; F73-F76 HydrophobicContact CD2-CD1 3.98Å; F73-F76 AromaticContact CE2-CD1 3.88Å; F73-F76 HydrophobicContact CE2-CD1 3.88Å; F73-F76 HydrophobicContact CE2-CE1 4.19Å; F73-F76 PolarHBondContact O-N 2.85Å; F73-W77 HydrophobicContact CE1-CB 4.39Å; F73-W77 HydrophobicContact CE1-CE3 4.37Å; F73-W77 HydrophobicContact CZ-CE3 4.13Å; F73-W77 WeakPolarHBondContact O-CB 3Å; F73-W77 PolarHBondContact O-N 3.33Å
74	K	93.1	Very high	89.5	Confident	171 Å²	171	59.8 Å²	59.8	74%	0.743	36%	0.355	S	S	*	.	H	α-helix	trans	-63.4	-42.2	177.7	-174.2	-179.8	178.3	-176.1	111.8	T72 W77 G78	T72-K74 PolarHBondContact O-N 3.15Å; T72-K74 PolarHBondContact OG1-N 2.91Å; K74-W77 PolarHBondContact O-N 2.88Å; K74-G78 PolarHBondContact O-N 2.96Å
75	H	93.4	Very high	89.7	Confident	28 Å²	28	60.9 Å²	60.9	13%	0.13	35%	0.353	C	S	.	.	H	α-helix	trans	-63.4	-46	175.3	-63.3	-64.3	0	0	111.1	M63 G64 V65 E69 I71 T72 W77 G78 L79	M63-H75 HydrophobicContact CB-CB 4.28Å; M63-H75 PolarHBondContact O-ND1 3.06Å; G64-H75 PolarHBondContact O-CE1 3.33Å; G64-H75 VanDerWaalsContact O-CE1 3.29Å; V65-H75 HydrophobicContact CG2-CB 3.84Å; E69-H75 IonicContact OE1-NE2 3.8Å; I71-H75 HydrophobicContact CG2-CB 4.03Å; T72-H75 PolarHBondContact N-CD2 3.49Å; T72-H75 PolarHBondContact O-N 2.94Å; T72-H75 VanDerWaalsContact O-N 3.14Å; T72-H75 PolarHBondContact OG1-CD2 3.11Å; T72-H75 PolarHBondContact OG1-N 3.46Å; H75-W77 PolarHBondContact O-N 3.33Å; H75-G78 PolarHBondContact O-N 2.82Å; H75-L79 PolarHBondContact O-N 3.32Å
76	F	92.7	Very high	89.6	Confident	9 Å²	9	63.8 Å²	63.8	4%	0.039	37%	0.371	C	S	.	.	H	α-helix	trans	-60	-43.8	175.6	170.6	-115.4	0	0	112.4	L15 F19 F35 L38 T72 F73 G78 L79 I80	L15-F76 HydrophobicContact CB-CE1 4.37Å; L15-F76 HydrophobicContact CD2-CE1 4.1Å; L15-F76 HydrophobicContact CD2-CZ 3.98Å; F19-F76 HydrophobicContact CB-CD1 4.15Å; F19-F76 HydrophobicContact CB-CE1 4.2Å; F19-F76 HydrophobicContact CD2-CB 3.68Å; F19-F76 AromaticContact CD2-CD1 3.59Å; F19-F76 HydrophobicContact CD2-CD1 3.59Å; F19-F76 HydrophobicContact CD2-CD2 4.47Å; F19-F76 HydrophobicContact CD2-CE1 4.33Å; F19-F76 AromaticContact CD2-CG 3.65Å; F19-F76 HydrophobicContact CD2-CG 3.65Å; F19-F76 HydrophobicContact CE2-CB 3.61Å; F19-F76 HydrophobicContact CE2-CD1 4.39Å; F19-F76 HydrophobicContact CE2-CG 4.12Å; F19-F76 HydrophobicContact CG-CD1 4.17Å; F35-F76 HydrophobicContact CE2-CB 4.36Å; F35-F76 AromaticContact CE2-CD2 3.91Å; F35-F76 HydrophobicContact CE2-CD2 3.91Å; L38-F76 HydrophobicContact CD2-CD2 4.44Å; L38-F76 HydrophobicContact CD2-CE2 4.2Å; T72-F76 PolarHBondContact O-N 3.05Å; F73-F76 AromaticContact CD2-CD1 3.98Å; F73-F76 HydrophobicContact CD2-CD1 3.98Å; F73-F76 AromaticContact CE2-CD1 3.88Å; F73-F76 HydrophobicContact CE2-CD1 3.88Å; F73-F76 HydrophobicContact CE2-CE1 4.19Å; F73-F76 PolarHBondContact O-N 2.85Å; F76-G78 VanDerWaalsContact C-N 3.3Å; F76-G78 PolarHBondContact O-N 3.23Å; F76-L79 WeakPolarHBondContact O-CB 3.39Å; F76-L79 PolarHBondContact O-N 3.08Å; F76-L79 VanDerWaalsContact O-N 3.13Å; F76-I80 HydrophobicContact CD2-CG1 4.35Å; F76-I80 HydrophobicContact CE1-CG1 4.12Å; F76-I80 HydrophobicContact CE2-CD1 3.8Å; F76-I80 HydrophobicContact CE2-CG1 3.91Å; F76-I80 HydrophobicContact CZ-CD1 3.8Å; F76-I80 HydrophobicContact CZ-CG1 3.79Å; F76-I80 PolarHBondContact O-N 3.36Å; F76-I80 VanDerWaalsContact O-N 3.09Å
77	W	93.3	Very high	89.6	Confident	107 Å²	107	66.5 Å²	66.5	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-61.7	-39	176.6	-174.8	-101.4	0	0	112.1	L15 F73 K74 H75 L79 I80 Q81	L15-W77 HydrophobicContact CD1-CE3 4.24Å; L15-W77 HydrophobicContact CD1-CH2 4.25Å; L15-W77 HydrophobicContact CD1-CZ3 3.45Å; L15-W77 VanDerWaalsContact CD1-CZ3 3.45Å; F73-W77 HydrophobicContact CE1-CB 4.39Å; F73-W77 HydrophobicContact CE1-CE3 4.37Å; F73-W77 HydrophobicContact CZ-CE3 4.13Å; F73-W77 WeakPolarHBondContact O-CB 3Å; F73-W77 PolarHBondContact O-N 3.33Å; K74-W77 PolarHBondContact O-N 2.88Å; H75-W77 PolarHBondContact O-N 3.33Å; W77-L79 VanDerWaalsContact C-N 3.25Å; W77-L79 PolarHBondContact O-N 3.17Å; W77-I80 PolarHBondContact O-N 2.95Å; W77-I80 VanDerWaalsContact O-N 3.11Å; W77-Q81 WeakPolarHBondContact O-CB 3.38Å; W77-Q81 PolarHBondContact O-N 2.78Å
78	G	91.9	Very high	90	Very high	30 Å²	30	65.3 Å²	65.3	31%	0.309	36%	0.364	S	S	.	.	H	α-helix	trans	-57.7	-37.8	174.1	0	0	0	0	112.9	K74 H75 F76 S82	K74-G78 PolarHBondContact O-N 2.96Å; H75-G78 PolarHBondContact O-N 2.82Å; F76-G78 VanDerWaalsContact C-N 3.3Å; F76-G78 PolarHBondContact O-N 3.23Å; G78-S82 PolarHBondContact O-N 2.84Å
79	L	90.2	Very high	90.6	Very high	12 Å²	12	64.4 Å²	64.4	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-64	-51.2	170.8	169	60.1	0	0	112.1	F35 L39 L46 M59 M63 H75 F76 W77 Q81 S82 L83	F35-L79 HydrophobicContact CZ-CD2 4.09Å; L39-L79 HydrophobicContact CD1-CD2 4.47Å; L39-L79 HydrophobicContact CD2-CD2 3.75Å; L46-L79 HydrophobicContact CD2-CD1 4.36Å; L46-L79 HydrophobicContact CD2-CD2 4.18Å; M59-L79 HydrophobicContact CE-CD1 3.03Å; M59-L79 HydrophobicContact CE-CD2 3.27Å; M59-L79 HydrophobicContact CE-CG 3.72Å; M63-L79 HydrophobicContact CG-CB 4.29Å; M63-L79 HydrophobicContact SD-CB 3.61Å; M63-L79 HydrophobicContact SD-CD2 4.31Å; M63-L79 HydrophobicContact SD-CG 4.49Å; H75-L79 PolarHBondContact O-N 3.32Å; F76-L79 WeakPolarHBondContact O-CB 3.39Å; F76-L79 PolarHBondContact O-N 3.08Å; F76-L79 VanDerWaalsContact O-N 3.13Å; W77-L79 VanDerWaalsContact C-N 3.25Å; W77-L79 PolarHBondContact O-N 3.17Å; L79-Q81 VanDerWaalsContact C-N 3.25Å; L79-Q81 PolarHBondContact O-N 3.47Å; L79-S82 WeakPolarHBondContact O-CB 3.49Å; L79-S82 PolarHBondContact O-N 3.31Å; L79-L83 HydrophobicContact CD1-CD1 3.89Å; L79-L83 HydrophobicContact CD1-CD2 4.36Å; L79-L83 HydrophobicContact CD1-CG 3.88Å; L79-L83 HydrophobicContact CG-CD1 4.01Å; L79-L83 HydrophobicContact CG-CG 4.41Å; L79-L83 WeakPolarHBondContact O-CG 3.35Å; L79-L83 PolarHBondContact O-N 3.13Å
80	I	91.4	Very high	90.5	Very high	29 Å²	29	66 Å²	66	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-58.2	-42.7	-178.9	-61.8	-60	0	0	110.7	L15 L43 F76 W77 L83 A84	L15-I80 HydrophobicContact CD1-CG2 4.13Å; L15-I80 HydrophobicContact CD2-CD1 4.07Å; L15-I80 HydrophobicContact CD2-CG1 4.11Å; L15-I80 HydrophobicContact CD2-CG2 4.49Å; L43-I80 HydrophobicContact CD1-CD1 4Å; F76-I80 HydrophobicContact CD2-CG1 4.35Å; F76-I80 HydrophobicContact CE1-CG1 4.12Å; F76-I80 HydrophobicContact CE2-CD1 3.8Å; F76-I80 HydrophobicContact CE2-CG1 3.91Å; F76-I80 HydrophobicContact CZ-CD1 3.8Å; F76-I80 HydrophobicContact CZ-CG1 3.79Å; F76-I80 PolarHBondContact O-N 3.36Å; F76-I80 VanDerWaalsContact O-N 3.09Å; W77-I80 PolarHBondContact O-N 2.95Å; W77-I80 VanDerWaalsContact O-N 3.11Å; I80-L83 PolarHBondContact O-N 3.23Å; I80-A84 WeakPolarHBondContact O-CB 3.38Å; I80-A84 PolarHBondContact O-N 2.94Å
81	Q	92.1	Very high	90.2	Very high	115 Å²	115	69.9 Å²	69.9	54%	0.537	37%	0.365	S	S	.	.	H	α-helix	trans	-55.9	-51.8	172.9	-176.7	-161.1	-47.8	0	111	W77 L79 L83 A84 T85	W77-Q81 WeakPolarHBondContact O-CB 3.38Å; W77-Q81 PolarHBondContact O-N 2.78Å; L79-Q81 VanDerWaalsContact C-N 3.25Å; L79-Q81 PolarHBondContact O-N 3.47Å; Q81-L83 VanDerWaalsContact C-N 3.31Å; Q81-L83 PolarHBondContact O-N 3.43Å; Q81-A84 PolarHBondContact O-N 3.26Å; Q81-T85 WeakPolarHBondContact O-CB 3.31Å; Q81-T85 PolarHBondContact O-N 3.2Å; Q81-T85 PolarHBondContact O-OG1 2.91Å; Q81-T85 VanDerWaalsContact O-OG1 3.08Å
82	S	88.4	Confident	89.3	Confident	67 Å²	67	72.5 Å²	72.5	47%	0.469	38%	0.384	S	S	.	.	H	α-helix	trans	-58.5	-41.8	179.8	-179.3	0	0	0	112.6	G78 L79 T86	G78-S82 PolarHBondContact O-N 2.84Å; L79-S82 WeakPolarHBondContact O-CB 3.49Å; L79-S82 PolarHBondContact O-N 3.31Å; S82-T86 WeakPolarHBondContact O-CB 3.36Å; S82-T86 PolarHBondContact O-N 3.43Å; S82-T86 PolarHBondContact O-OG1 2.87Å
83	L	87.9	Confident	88.1	Confident	54 Å²	54	76.9 Å²	76.9	28%	0.283	40%	0.399	S	S	.	.	H	α-helix	trans	-65.6	-45.6	176.3	-64.9	174.5	0	0	112.1	L43 L46 L79 I80 Q81 T86 Q87	L43-L83 HydrophobicContact CD1-CD1 4.21Å; L46-L83 HydrophobicContact CD1-CD1 4.28Å; L46-L83 HydrophobicContact CD1-CD2 3.49Å; L46-L83 VanDerWaalsContact CD1-CD2 3.49Å; L46-L83 HydrophobicContact CD2-CD1 3.76Å; L46-L83 HydrophobicContact CD2-CD2 4.44Å; L79-L83 HydrophobicContact CD1-CD1 3.89Å; L79-L83 HydrophobicContact CD1-CD2 4.36Å; L79-L83 HydrophobicContact CD1-CG 3.88Å; L79-L83 HydrophobicContact CG-CD1 4.01Å; L79-L83 HydrophobicContact CG-CG 4.41Å; L79-L83 WeakPolarHBondContact O-CG 3.35Å; L79-L83 PolarHBondContact O-N 3.13Å; I80-L83 PolarHBondContact O-N 3.23Å; Q81-L83 VanDerWaalsContact C-N 3.31Å; Q81-L83 PolarHBondContact O-N 3.43Å; L83-T86 PolarHBondContact O-N 3.27Å; L83-Q87 WeakPolarHBondContact O-CB 3.32Å; L83-Q87 PolarHBondContact O-N 2.76Å
84	A	90.6	Very high	86.1	Confident	54 Å²	54	81.4 Å²	81.4	45%	0.446	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-44.8	178.9	0	0	0	0	111.4	I80 Q81 Q87 H88	I80-A84 WeakPolarHBondContact O-CB 3.38Å; I80-A84 PolarHBondContact O-N 2.94Å; Q81-A84 PolarHBondContact O-N 3.26Å; A84-Q87 PolarHBondContact O-N 3.38Å; A84-H88 WeakPolarHBondContact O-CB 3.48Å; A84-H88 PolarHBondContact O-N 2.96Å
85	T	89.4	Confident	84.1	Confident	69 Å²	69	78.1 Å²	78.1	42%	0.423	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-45.8	174.6	-59.4	0	0	0	111.1	Q81 Q87 H88 D89	Q81-T85 WeakPolarHBondContact O-CB 3.31Å; Q81-T85 PolarHBondContact O-N 3.2Å; Q81-T85 PolarHBondContact O-OG1 2.91Å; Q81-T85 VanDerWaalsContact O-OG1 3.08Å; T85-Q87 VanDerWaalsContact C-N 3.34Å; T85-Q87 PolarHBondContact O-N 3.29Å; T85-H88 PolarHBondContact O-N 3.35Å; T85-D89 WeakPolarHBondContact O-CB 3.29Å; T85-D89 PolarHBondContact O-N 2.89Å
86	T	86.9	Confident	81.9	Confident	73 Å²	73	81.7 Å²	81.7	45%	0.448	44%	0.441	S	S	.	.	H	α-helix	trans	-60.8	-44.7	177.5	-58	0	0	0	111.2	S82 L83 D89 L90	S82-T86 WeakPolarHBondContact O-CB 3.36Å; S82-T86 PolarHBondContact O-N 3.43Å; S82-T86 PolarHBondContact O-OG1 2.87Å; L83-T86 PolarHBondContact O-N 3.27Å; T86-D89 PolarHBondContact O-N 2.93Å; T86-L90 HydrophobicContact CG2-CD1 4.25Å; T86-L90 VanDerWaalsContact O-CG 3.27Å; T86-L90 WeakPolarHBondContact O-CG 3.48Å; T86-L90 PolarHBondContact O-N 2.67Å
87	Q	84.1	Confident	79.5	Confident	131 Å²	131	90.3 Å²	90.3	61%	0.612	48%	0.478	S	S	*	.	H	α-helix	trans	-63.8	-43.1	178	-176.3	175.6	79.2	0	111.5	L83 A84 T85 L90 I91	L83-Q87 WeakPolarHBondContact O-CB 3.32Å; L83-Q87 PolarHBondContact O-N 2.76Å; A84-Q87 PolarHBondContact O-N 3.38Å; T85-Q87 VanDerWaalsContact C-N 3.34Å; T85-Q87 PolarHBondContact O-N 3.29Å; Q87-L90 PolarHBondContact O-N 2.98Å; Q87-I91 HydrophobicContact CG-CD1 4.01Å; Q87-I91 VanDerWaalsContact O-CG1 3.3Å; Q87-I91 WeakPolarHBondContact O-CG1 3.16Å; Q87-I91 PolarHBondContact O-N 2.93Å
88	H	88.2	Confident	77.2	Confident	129 Å²	129	90.4 Å²	90.4	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-60.1	-45.6	175.7	-175.9	73.8	0	0	111.6	A84 T85 L90 I91 S92	A84-H88 WeakPolarHBondContact O-CB 3.48Å; A84-H88 PolarHBondContact O-N 2.96Å; T85-H88 PolarHBondContact O-N 3.35Å; H88-L90 VanDerWaalsContact C-N 3.33Å; H88-L90 PolarHBondContact O-N 3.22Å; H88-I91 PolarHBondContact O-N 2.98Å; H88-S92 WeakPolarHBondContact O-CB 3.3Å; H88-S92 PolarHBondContact O-N 3.28Å; H88-S92 PolarHBondContact O-OG 2.89Å
89	D	90.4	Very high	74.9	Confident	70 Å²	70	94 Å²	94	37%	0.374	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-38.6	176.2	-78.5	-0.5	0	0	112.7	T85 T86 S92 K93	T85-D89 WeakPolarHBondContact O-CB 3.29Å; T85-D89 PolarHBondContact O-N 2.89Å; T86-D89 PolarHBondContact O-N 2.93Å; D89-S92 WeakPolarHBondContact CA-OG 3.27Å; D89-S92 PolarHBondContact O-OG 3.35Å; D89-K93 VanDerWaalsContact O-CB 3.23Å; D89-K93 WeakPolarHBondContact O-CB 3.33Å; D89-K93 WeakPolarHBondContact O-CD 3.45Å; D89-K93 WeakPolarHBondContact O-CG 3.38Å; D89-K93 PolarHBondContact O-N 2.83Å
90	L	84.9	Confident	72.6	Confident	111 Å²	111	99 Å²	99	58%	0.581	55%	0.55	S	S	*	.	H	α-helix	trans	-67.6	-38.5	176.5	-72.2	174.7	0	0	111.7	T86 Q87 H88 K94	T86-L90 HydrophobicContact CG2-CD1 4.25Å; T86-L90 VanDerWaalsContact O-CG 3.27Å; T86-L90 WeakPolarHBondContact O-CG 3.48Å; T86-L90 PolarHBondContact O-N 2.67Å; Q87-L90 PolarHBondContact O-N 2.98Å; H88-L90 VanDerWaalsContact C-N 3.33Å; H88-L90 PolarHBondContact O-N 3.22Å; L90-K94 WeakPolarHBondContact O-CB 3.46Å; L90-K94 PolarHBondContact O-N 3.43Å
91	I	82	Confident	70.4	Confident	98 Å²	98	104.5 Å²	104.5	50%	0.503	59%	0.585	S	S	.	*	H	α-helix	trans	-68	-47.3	176.1	-68.4	166.8	0	0	109.9	Q87 H88 K93 K94 V95	Q87-I91 HydrophobicContact CG-CD1 4.01Å; Q87-I91 VanDerWaalsContact O-CG1 3.3Å; Q87-I91 WeakPolarHBondContact O-CG1 3.16Å; Q87-I91 PolarHBondContact O-N 2.93Å; H88-I91 PolarHBondContact O-N 2.98Å; I91-K93 VanDerWaalsContact C-N 3.3Å; I91-K93 PolarHBondContact O-N 2.96Å; I91-K94 PolarHBondContact O-N 3.43Å; I91-K94 VanDerWaalsContact O-N 3.16Å; I91-V95 WeakPolarHBondContact O-CG2 3.42Å; I91-V95 PolarHBondContact O-N 3.1Å
92	S	76.8	Confident	68	Low	56 Å²	56	106.8 Å²	106.8	39%	0.392	60%	0.6	S	S	.	*	H	α-helix	trans	-62.1	-37.6	178.6	70.4	0	0	0	112	H88 D89 S96	H88-S92 WeakPolarHBondContact O-CB 3.3Å; H88-S92 PolarHBondContact O-N 3.28Å; H88-S92 PolarHBondContact O-OG 2.89Å; D89-S92 WeakPolarHBondContact CA-OG 3.27Å; D89-S92 PolarHBondContact O-OG 3.35Å; S92-S96 PolarHBondContact O-N 3.16Å
93	K	67.6	Low	65.6	Low	134 Å²	134	115.2 Å²	115.2	58%	0.583	64%	0.639	S	S	*	*	H	α-helix	trans	-74.1	-31.5	174.2	-71	172.1	-176.1	174.3	113.6	D89 I91 S96 K97	D89-K93 VanDerWaalsContact O-CB 3.23Å; D89-K93 WeakPolarHBondContact O-CB 3.33Å; D89-K93 WeakPolarHBondContact O-CD 3.45Å; D89-K93 WeakPolarHBondContact O-CG 3.38Å; D89-K93 PolarHBondContact O-N 2.83Å; I91-K93 VanDerWaalsContact C-N 3.3Å; I91-K93 PolarHBondContact O-N 2.96Å; K93-S96 WeakPolarHBondContact O-CB 3.23Å; K93-S96 PolarHBondContact O-N 3.37Å; K93-K97 PolarHBondContact O-N 3.2Å
94	K	53.3	Low	64.5	Low	163 Å²	163	118.3 Å²	118.3	71%	0.709	66%	0.656	S	S	*	*	H	α-helix	trans	-67.7	-36.7	172	-93.4	-171.4	174.6	-174.9	111.9	L90 I91 S96 K97	L90-K94 WeakPolarHBondContact O-CB 3.46Å; L90-K94 PolarHBondContact O-N 3.43Å; I91-K94 PolarHBondContact O-N 3.43Å; I91-K94 VanDerWaalsContact O-N 3.16Å; K94-S96 PolarHBondContact O-N 3.36Å; K94-K97 PolarHBondContact O-N 3.29Å; K94-K97 VanDerWaalsContact O-N 3.1Å
95	V	50.1	Low	63.1	Low	101 Å²	101	121.7 Å²	121.7	61%	0.612	67%	0.667	S	S	*	*	H	α-helix	trans	-59.2	-32.3	170.5	171.5	0	0	0	110.8	I91 K97	I91-V95 WeakPolarHBondContact O-CG2 3.42Å; I91-V95 PolarHBondContact O-N 3.1Å; V95-K97 PolarHBondContact O-N 3.44Å
96	S	46.7	Very low	61.7	Low	103 Å²	103	124.6 Å²	124.6	72%	0.72	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-7.7	177.3	-155.3	0	0	0	115.5	S92 K93 K94	S92-S96 PolarHBondContact O-N 3.16Å; K93-S96 WeakPolarHBondContact O-CB 3.23Å; K93-S96 PolarHBondContact O-N 3.37Å; K94-S96 PolarHBondContact O-N 3.36Å
97	K	43.8	Very low	60.2	Low	191 Å²	191	127.6 Å²	127.6	83%	0.83	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	1.1	178.6	-79.9	-172.9	177.7	176	114.7	K93 K94 V95	K93-K97 PolarHBondContact O-N 3.2Å; K94-K97 PolarHBondContact O-N 3.29Å; K94-K97 VanDerWaalsContact O-N 3.1Å; V95-K97 PolarHBondContact O-N 3.44Å
98	S	43.7	Very low	58.7	Low	108 Å²	108	127.4 Å²	127.4	76%	0.755	70%	0.7	S	S	*	*	S	Bend	trans	-116.2	30.2	177.7	-78	0	0	0	113.9
99	S	43.2	Very low	56.7	Low	106 Å²	106	127.3 Å²	127.3	74%	0.741	71%	0.707	S	S	*	*	S	Bend	trans	-132.3	26.6	175.5	-58.7	0	0	0	115
100	C	42.4	Very low	54.3	Low	116 Å²	116	131.4 Å²	131.4	78%	0.784	73%	0.73	S	S	*	*			trans	-160.2	69.2	162.1	-140.1	0	0	0	113
101	V	45.8	Very low	52	Low	146 Å²	146	133 Å²	133	89%	0.885	74%	0.742	S	S	*	*	S	Bend	trans	-134.8	79	143.9	180	0	0	0	104.7
102	L	42	Very low	49.5	Very low	162 Å²	162	135.9 Å²	135.9	85%	0.848	76%	0.762	S	S	*	*			trans	-173.5	81.7	156.7	-95.6	178.7	0	0	106.9
103	L	37.9	Very low	47	Very low	245 Å²	245	143.2 Å²	143.2	100%	1.283	80%	0.795	S	S	*	*			trans	158.7	0	140.3	-84.7	167	0	0	109.4

Retrieved 103 of 103 residues in 125.4 ms (Link to these results)

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