A0A087Y5M1_POEFO Loading...

Calmodulin 3

Calmodulin acts as part of a calcium signal transduction pathway by mediating the control of a large number of enzymes, ion channels, aquaporins and other proteins through calcium-binding. Calcium-binding is required for the activation of calmodulin. Among the enzymes to be stimulated by the calmodulin-calcium complex are a number of protein kinases, such as myosin light-chain kinases and calmodulin-dependent protein kinase type II (CaMK2), and phosphatases.

AlphaFold DB (K7G387), UniProt , Accession A0A087Y5M1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 148 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	A	39.7	Very low	68.7	Low	135 Å²	135	110.8 Å²	110.8	100%	1.116	60%	0.604	S	S	*	*				0	92.7	0	0	0	0	0	0	105.7	Q3	A1-Q3 PolarHBondContact O-N 2.7Å
2	D	45.5	Very low	69.8	Low	161 Å²	161	102.3 Å²	102.3	86%	0.861	56%	0.556	S	S	*	*			trans	-63.4	107	176	-66.3	-66.2	0	0	0	107.5	L4	D2-L4 PolarHBondContact O-N 3.01Å
3	Q	56.8	Low	70.9	Confident	180 Å²	180	104.8 Å²	104.8	84%	0.841	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-79.5	116.9	176.9	-71	177.9	22.1	0	0	107	A1	A1-Q3 PolarHBondContact O-N 2.7Å
4	L	67	Low	71.9	Confident	49 Å²	49	107.5 Å²	107.5	26%	0.257	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-54.2	137.6	170.9	-64.3	171.4	0	0	0	109.3	D2 Q8 I9 F12 L69	D2-L4 PolarHBondContact O-N 3.01Å; L4-Q8 HydrophobicContact CB-CB 4.33Å; L4-I9 HydrophobicContact CB-CD1 4.48Å; L4-I9 HydrophobicContact CB-CG1 3.98Å; L4-F12 HydrophobicContact CD1-CD2 4Å; L4-F12 HydrophobicContact CD1-CE2 3.74Å; L4-F12 HydrophobicContact CD2-CE2 3.9Å; L4-F12 HydrophobicContact CG-CE2 4.36Å; L4-L69 HydrophobicContact CD1-CD2 4.03Å
5	T	78.6	Confident	72.7	Confident	73 Å²	73	102 Å²	102	45%	0.448	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-69.1	159.9	177.6	68.6	0	0	0	0	110.8	E7 Q8 I9	T5-E7 PolarHBondContact O-N 2.88Å; T5-Q8 PolarHBondContact O-N 2.76Å; T5-Q8 VanDerWaalsContact O-N 3.14Å; T5-Q8 WeakPolarHBondContact OG1-CG 3.47Å; T5-Q8 PolarHBondContact OG1-N 3.48Å; T5-Q8 PolarHBondContact OG1-OE1 3.06Å; T5-I9 WeakPolarHBondContact O-CG1 3.27Å; T5-I9 PolarHBondContact O-N 3.28Å
6	E	77.3	Confident	73.5	Confident	175 Å²	175	96.4 Å²	96.4	82%	0.818	51%	0.512	S	S	*	.	H	α-helix	trans	-57.4	-32.3	176	-68.3	-174	161.3	0	0	112.5	A10	E6-A10 WeakPolarHBondContact O-CB 3.37Å; E6-A10 PolarHBondContact O-N 3.08Å
7	E	77.9	Confident	74.3	Confident	145 Å²	145	94.8 Å²	94.8	68%	0.678	51%	0.51	S	S	*	.	H	α-helix	trans	-68.5	-46.4	176	-170.1	169.9	-160.8	0	0	111.5	T5 I9 A10 E11	T5-E7 PolarHBondContact O-N 2.88Å; E7-I9 VanDerWaalsContact C-N 3.33Å; E7-I9 PolarHBondContact O-N 3.37Å; E7-A10 WeakPolarHBondContact O-CB 3.32Å; E7-A10 PolarHBondContact O-N 2.91Å; E7-A10 VanDerWaalsContact O-N 3.11Å; E7-E11 PolarHBondContact O-N 2.86Å
8	Q	71.2	Confident	74.9	Confident	71 Å²	71	95.3 Å²	95.3	33%	0.332	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-41	174.5	-71.6	175.4	-50.4	0	0	111.7	L4 T5 A10 E11 F12	L4-Q8 HydrophobicContact CB-CB 4.33Å; T5-Q8 PolarHBondContact O-N 2.76Å; T5-Q8 VanDerWaalsContact O-N 3.14Å; T5-Q8 WeakPolarHBondContact OG1-CG 3.47Å; T5-Q8 PolarHBondContact OG1-N 3.48Å; T5-Q8 PolarHBondContact OG1-OE1 3.06Å; Q8-A10 VanDerWaalsContact C-N 3.28Å; Q8-A10 PolarHBondContact O-N 3.17Å; Q8-E11 PolarHBondContact O-N 2.96Å; Q8-F12 HydrophobicContact CB-CD2 4.44Å; Q8-F12 HydrophobicContact CB-CE2 4.11Å; Q8-F12 WeakPolarHBondContact O-CD2 3.13Å; Q8-F12 WeakPolarHBondContact O-CG 3.35Å; Q8-F12 PolarHBondContact O-N 2.74Å
9	I	78.9	Confident	75.5	Confident	63 Å²	63	91.8 Å²	91.8	32%	0.323	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-38.7	175.7	-66.5	167.5	0	0	0	110.6	L4 T5 E7 K13 F65	L4-I9 HydrophobicContact CB-CD1 4.48Å; L4-I9 HydrophobicContact CB-CG1 3.98Å; T5-I9 WeakPolarHBondContact O-CG1 3.27Å; T5-I9 PolarHBondContact O-N 3.28Å; E7-I9 VanDerWaalsContact C-N 3.33Å; E7-I9 PolarHBondContact O-N 3.37Å; I9-K13 VanDerWaalsContact O-CB 3.3Å; I9-K13 WeakPolarHBondContact O-CB 3.3Å; I9-K13 PolarHBondContact O-N 3.12Å; I9-F65 HydrophobicContact CG2-CE1 4.28Å; I9-F65 HydrophobicContact CG2-CZ 4.18Å
10	A	81.9	Confident	76.2	Confident	52 Å²	52	88.1 Å²	88.1	43%	0.43	47%	0.472	S	S	.	.	H	α-helix	trans	-65.8	-44.9	176.3	0	0	0	0	0	111.8	E6 E7 Q8 F12 K13 E14	E6-A10 WeakPolarHBondContact O-CB 3.37Å; E6-A10 PolarHBondContact O-N 3.08Å; E7-A10 WeakPolarHBondContact O-CB 3.32Å; E7-A10 PolarHBondContact O-N 2.91Å; E7-A10 VanDerWaalsContact O-N 3.11Å; Q8-A10 VanDerWaalsContact C-N 3.28Å; Q8-A10 PolarHBondContact O-N 3.17Å; A10-F12 PolarHBondContact O-N 2.84Å; A10-K13 WeakPolarHBondContact O-CB 3.39Å; A10-K13 PolarHBondContact O-N 3.49Å; A10-K13 VanDerWaalsContact O-N 3.14Å; A10-E14 PolarHBondContact O-N 2.83Å
11	E	81.1	Confident	76.6	Confident	115 Å²	115	90.1 Å²	90.1	54%	0.537	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-44.7	174.8	-70.9	-176.3	170.3	0	0	111.9	E7 Q8 K13 E14 A15	E7-E11 PolarHBondContact O-N 2.86Å; Q8-E11 PolarHBondContact O-N 2.96Å; E11-K13 VanDerWaalsContact C-N 3.25Å; E11-K13 PolarHBondContact O-N 3.04Å; E11-E14 PolarHBondContact O-N 3.02Å; E11-A15 PolarHBondContact O-N 3.34Å
12	F	81.4	Confident	78.8	Confident	8 Å²	8	89 Å²	89	4%	0.035	45%	0.451	C	S	.	.	H	α-helix	trans	-65.4	-30.5	175.9	-69.1	-50.2	0	0	0	112.7	L4 Q8 A10 A15 F16 F68 L69 M72 M76	L4-F12 HydrophobicContact CD1-CD2 4Å; L4-F12 HydrophobicContact CD1-CE2 3.74Å; L4-F12 HydrophobicContact CD2-CE2 3.9Å; L4-F12 HydrophobicContact CG-CE2 4.36Å; Q8-F12 HydrophobicContact CB-CD2 4.44Å; Q8-F12 HydrophobicContact CB-CE2 4.11Å; Q8-F12 WeakPolarHBondContact O-CD2 3.13Å; Q8-F12 WeakPolarHBondContact O-CG 3.35Å; Q8-F12 PolarHBondContact O-N 2.74Å; A10-F12 PolarHBondContact O-N 2.84Å; F12-A15 PolarHBondContact O-N 2.96Å; F12-F16 VanDerWaalsContact O-CB 3.25Å; F12-F16 WeakPolarHBondContact O-CB 3.3Å; F12-F16 PolarHBondContact O-N 3.02Å; F12-F68 HydrophobicContact CB-CE1 4.45Å; F12-F68 WeakPolarHBondContact O-CE1 3.46Å; F12-L69 HydrophobicContact CB-CD2 3.52Å; F12-L69 HydrophobicContact CD2-CD2 3.55Å; F12-L69 HydrophobicContact CG-CD2 3.76Å; F12-M72 HydrophobicContact CD1-CB 3.93Å; F12-M72 HydrophobicContact CD1-CE 3.97Å; F12-M72 HydrophobicContact CD1-CG 4.1Å; F12-M72 HydrophobicContact CE1-CB 3.68Å; F12-M72 HydrophobicContact CE1-CE 3.83Å; F12-M72 HydrophobicContact CE1-CG 4.23Å; F12-M72 HydrophobicContact CZ-CB 4.25Å; F12-M76 HydrophobicContact CE1-CE 4.04Å; F12-M76 HydrophobicContact CE1-SD 4.09Å; F12-M76 HydrophobicContact CZ-CE 3.93Å; F12-M76 HydrophobicContact CZ-SD 3.55Å; F12-M76 VanDerWaalsContact CZ-SD 3.55Å
13	K	83.9	Confident	80.9	Confident	135 Å²	135	84.1 Å²	84.1	59%	0.587	44%	0.439	S	S	*	.	H	α-helix	trans	-71.7	-38.6	175.6	-166.5	168.1	-176	173	0	112	I9 A10 E11 F16 S17 F65	I9-K13 VanDerWaalsContact O-CB 3.3Å; I9-K13 WeakPolarHBondContact O-CB 3.3Å; I9-K13 PolarHBondContact O-N 3.12Å; A10-K13 WeakPolarHBondContact O-CB 3.39Å; A10-K13 PolarHBondContact O-N 3.49Å; A10-K13 VanDerWaalsContact O-N 3.14Å; E11-K13 VanDerWaalsContact C-N 3.25Å; E11-K13 PolarHBondContact O-N 3.04Å; K13-F16 PolarHBondContact O-N 3.21Å; K13-S17 PolarHBondContact O-N 3.13Å; K13-F65 HydrophobicContact CB-CE2 3.91Å; K13-F65 HydrophobicContact CB-CZ 3.85Å; K13-F65 HydrophobicContact CG-CE2 4.21Å; K13-F65 HydrophobicContact CG-CZ 4.23Å
14	E	85	Confident	82.4	Confident	143 Å²	143	80 Å²	80	67%	0.668	42%	0.424	S	S	*	.	H	α-helix	trans	-62.8	-45.7	170.1	-70.7	-169.2	174.9	0	0	110.7	A10 E11 F16 S17 L18	A10-E14 PolarHBondContact O-N 2.83Å; E11-E14 PolarHBondContact O-N 3.02Å; E14-F16 PolarHBondContact O-N 2.78Å; E14-S17 PolarHBondContact O-N 3.3Å; E14-S17 PolarHBondContact O-OG 3.15Å; E14-L18 PolarHBondContact O-N 2.96Å
15	A	83.9	Confident	83.4	Confident	25 Å²	25	79.3 Å²	79.3	21%	0.207	43%	0.428	C	S	.	.	H	α-helix	trans	-59.5	-45.8	175.1	0	0	0	0	0	111.7	E11 F12 S17 L18 F19 F68	E11-A15 PolarHBondContact O-N 3.34Å; F12-A15 PolarHBondContact O-N 2.96Å; A15-S17 VanDerWaalsContact C-N 3.29Å; A15-S17 PolarHBondContact O-N 3.44Å; A15-L18 WeakPolarHBondContact O-CA 3.14Å; A15-L18 VanDerWaalsContact O-CB 3.23Å; A15-L18 WeakPolarHBondContact O-CB 3.3Å; A15-L18 PolarHBondContact O-N 3.03Å; A15-F19 WeakPolarHBondContact O-CD2 3.48Å; A15-F68 HydrophobicContact CB-CE1 4.4Å; A15-F68 HydrophobicContact CB-CZ 4.27Å
16	F	86.3	Confident	84	Confident	13 Å²	13	77.4 Å²	77.4	6%	0.057	42%	0.416	C	S	.	.	H	α-helix	trans	-55.8	-43.5	177.1	-174.8	-91.5	0	0	0	111.5	F12 K13 E14 L18 F19 D20 G25 I27 F65 F68	F12-F16 VanDerWaalsContact O-CB 3.25Å; F12-F16 WeakPolarHBondContact O-CB 3.3Å; F12-F16 PolarHBondContact O-N 3.02Å; K13-F16 PolarHBondContact O-N 3.21Å; E14-F16 PolarHBondContact O-N 2.78Å; F16-L18 PolarHBondContact O-N 2.98Å; F16-F19 WeakPolarHBondContact O-CA 3.34Å; F16-F19 WeakPolarHBondContact O-CB 3.46Å; F16-F19 PolarHBondContact O-N 3.18Å; F16-D20 HydrophobicContact CD1-CB 4.02Å; F16-D20 HydrophobicContact CE1-CB 3.68Å; F16-D20 HydrophobicContact CZ-CB 4.35Å; F16-D20 PolarHBondContact O-N 2.95Å; F16-G25 WeakPolarHBondContact CZ-O 3.43Å; F16-I27 HydrophobicContact CD2-CD1 3.48Å; F16-I27 VanDerWaalsContact CD2-CD1 3.48Å; F16-I27 HydrophobicContact CD2-CG1 4.17Å; F16-I27 HydrophobicContact CE2-CD1 3.34Å; F16-I27 HydrophobicContact CE2-CG1 3.64Å; F16-I27 HydrophobicContact CG-CD1 4.32Å; F16-I27 HydrophobicContact CZ-CD1 4.07Å; F16-I27 HydrophobicContact CZ-CG1 3.85Å; F16-F65 HydrophobicContact CB-CD2 3.9Å; F16-F65 HydrophobicContact CB-CE2 4.09Å; F16-F65 HydrophobicContact CD1-CD2 4.24Å; F16-F65 HydrophobicContact CD2-CB 4.44Å; F16-F65 AromaticContact CD2-CD2 3.81Å; F16-F65 HydrophobicContact CD2-CD2 3.81Å; F16-F65 HydrophobicContact CE2-CB 4.19Å; F16-F65 HydrophobicContact CE2-CD2 4.39Å; F16-F65 AromaticContact CG-CD2 3.72Å; F16-F65 HydrophobicContact CG-CD2 3.72Å; F16-F65 HydrophobicContact CG-CE2 4.4Å; F16-F65 HydrophobicContact CZ-CB 4.26Å; F16-F68 HydrophobicContact CB-CD1 4.1Å; F16-F68 HydrophobicContact CB-CE1 4.03Å; F16-F68 HydrophobicContact CD2-CB 3.63Å; F16-F68 AromaticContact CD2-CD1 3.76Å; F16-F68 HydrophobicContact CD2-CD1 3.76Å; F16-F68 AromaticContact CD2-CD2 3.99Å; F16-F68 HydrophobicContact CD2-CD2 3.99Å; F16-F68 HydrophobicContact CD2-CE1 4.39Å; F16-F68 AromaticContact CD2-CG 3.54Å; F16-F68 HydrophobicContact CD2-CG 3.54Å; F16-F68 HydrophobicContact CE2-CB 3.85Å; F16-F68 HydrophobicContact CE2-CG 4.21Å; F16-F68 HydrophobicContact CG-CD1 4.44Å
17	S	86.8	Confident	84.7	Confident	69 Å²	69	69.1 Å²	69.1	48%	0.483	38%	0.377	S	S	.	.	H	α-helix	trans	-65.9	-15.5	176.3	76.8	0	0	0	0	114.4	K13 E14 A15	K13-S17 PolarHBondContact O-N 3.13Å; E14-S17 PolarHBondContact O-N 3.3Å; E14-S17 PolarHBondContact O-OG 3.15Å; A15-S17 VanDerWaalsContact C-N 3.29Å; A15-S17 PolarHBondContact O-N 3.44Å
18	L	85.2	Confident	85.3	Confident	103 Å²	103	64.1 Å²	64.1	54%	0.539	36%	0.357	S	S	.	.	H	α-helix	trans	-75.1	-29.8	169.7	-61.3	174.7	0	0	0	111.5	E14 A15 F16 K21 V35	E14-L18 PolarHBondContact O-N 2.96Å; A15-L18 WeakPolarHBondContact O-CA 3.14Å; A15-L18 VanDerWaalsContact O-CB 3.23Å; A15-L18 WeakPolarHBondContact O-CB 3.3Å; A15-L18 PolarHBondContact O-N 3.03Å; F16-L18 PolarHBondContact O-N 2.98Å; L18-K21 WeakPolarHBondContact O-CE 3.08Å; L18-K21 PolarHBondContact O-NZ 3.19Å; L18-V35 VanDerWaalsContact O-CG2 3.22Å; L18-V35 WeakPolarHBondContact O-CG2 3.49Å
19	F	85.8	Confident	86.2	Confident	30 Å²	30	61.8 Å²	61.8	13%	0.132	35%	0.348	C	S	.	.	H	α-helix	trans	-84.3	-56	176.6	-63.2	-87.9	0	0	0	111.5	A15 F16 K21 I27 E31 L32 V35 F68	A15-F19 WeakPolarHBondContact O-CD2 3.48Å; F16-F19 WeakPolarHBondContact O-CA 3.34Å; F16-F19 WeakPolarHBondContact O-CB 3.46Å; F16-F19 PolarHBondContact O-N 3.18Å; F19-K21 PolarHBondContact O-N 3.38Å; F19-I27 HydrophobicContact CB-CD1 3.43Å; F19-I27 VanDerWaalsContact CB-CD1 3.43Å; F19-I27 HydrophobicContact CB-CG1 3.72Å; F19-I27 HydrophobicContact CB-CG2 3.99Å; F19-I27 HydrophobicContact CD2-CD1 4.49Å; F19-I27 HydrophobicContact CG-CD1 4.08Å; F19-E31 WeakPolarHBondContact O-CB 3.23Å; F19-L32 HydrophobicContact CD1-CD1 4Å; F19-L32 HydrophobicContact CE1-CD1 3.92Å; F19-V35 HydrophobicContact CB-CG2 4.38Å; F19-V35 HydrophobicContact CD1-CB 3.59Å; F19-V35 HydrophobicContact CD1-CG1 3.77Å; F19-V35 HydrophobicContact CD1-CG2 3.64Å; F19-V35 HydrophobicContact CE1-CB 3.64Å; F19-V35 HydrophobicContact CE1-CG1 3.38Å; F19-V35 HydrophobicContact CE1-CG2 4.17Å; F19-V35 HydrophobicContact CG-CB 4.48Å; F19-V35 HydrophobicContact CG-CG2 4.11Å; F19-V35 HydrophobicContact CZ-CG1 3.83Å; F19-F68 AromaticContact CD2-CE2 3.74Å; F19-F68 HydrophobicContact CD2-CE2 3.74Å; F19-F68 AromaticContact CD2-CZ 3.95Å; F19-F68 HydrophobicContact CD2-CZ 3.95Å; F19-F68 AromaticContact CE2-CE2 3.79Å; F19-F68 HydrophobicContact CE2-CE2 3.79Å; F19-F68 AromaticContact CE2-CZ 3.85Å; F19-F68 HydrophobicContact CE2-CZ 3.85Å; F19-F68 HydrophobicContact CG-CE2 4.46Å
20	D	89.4	Confident	86.7	Confident	16 Å²	16	66.1 Å²	66.1	9%	0.086	36%	0.364	C	S	.	.			trans	-69.5	96.8	176.4	176.8	7.3	0	0	0	110.1	F16 G23 D24 G25 I27	F16-D20 HydrophobicContact CD1-CB 4.02Å; F16-D20 HydrophobicContact CE1-CB 3.68Å; F16-D20 HydrophobicContact CZ-CB 4.35Å; F16-D20 PolarHBondContact O-N 2.95Å; D20-G23 WeakPolarHBondContact OD1-CA 3.37Å; D20-G23 PolarHBondContact OD1-N 3.29Å; D20-G23 WeakPolarHBondContact OD2-CA 3.36Å; D20-D24 PolarHBondContact OD1-N 2.99Å; D20-G25 WeakPolarHBondContact OD2-CA 3.34Å; D20-G25 PolarHBondContact OD2-N 2.98Å; D20-I27 HydrophobicContact CB-CG1 4.32Å
21	K	84.9	Confident	87.2	Confident	131 Å²	131	64.3 Å²	64.3	57%	0.57	35%	0.347	S	S	*	.	S	Bend	trans	-86.6	-30.1	-173.4	-73.1	-50.6	-168.1	-158.7	0	112.5	L18 F19 E31	L18-K21 WeakPolarHBondContact O-CE 3.08Å; L18-K21 PolarHBondContact O-NZ 3.19Å; F19-K21 PolarHBondContact O-N 3.38Å; K21-E31 PolarHBondContact N-OE1 2.66Å
22	D	87	Confident	87.5	Confident	111 Å²	111	59.1 Å²	59.1	59%	0.594	32%	0.322	S	S	*	.	S	Bend	trans	-93.2	-9.8	-179.8	64.6	21.8	0	0	0	113.3	D24	D22-D24 VanDerWaalsContact C-N 3.34Å; D22-D24 WeakPolarHBondContact OD1-CB 3.4Å; D22-D24 VanDerWaalsContact OD1-CG 3.31Å; D22-D24 PolarHBondContact OD1-N 3.41Å; D22-D24 VanDerWaalsContact OD1-N 3.15Å
23	G	87.7	Confident	87.8	Confident	59 Å²	59	58.7 Å²	58.7	61%	0.608	32%	0.321	S	S	*	.			trans	75.6	24	174.1	0	0	0	0	0	112.5	D20 G25	D20-G23 WeakPolarHBondContact OD1-CA 3.37Å; D20-G23 PolarHBondContact OD1-N 3.29Å; D20-G23 WeakPolarHBondContact OD2-CA 3.36Å; G23-G25 PolarHBondContact O-N 3.1Å
24	D	89.4	Confident	88.1	Confident	95 Å²	95	55 Å²	55	51%	0.508	31%	0.31	S	S	.	.	S	Bend	trans	-78.3	-7.8	-179	83.8	0.9	0	0	0	113.3	D20 D22 T26	D20-D24 PolarHBondContact OD1-N 2.99Å; D22-D24 VanDerWaalsContact C-N 3.34Å; D22-D24 WeakPolarHBondContact OD1-CB 3.4Å; D22-D24 VanDerWaalsContact OD1-CG 3.31Å; D22-D24 PolarHBondContact OD1-N 3.41Å; D22-D24 VanDerWaalsContact OD1-N 3.15Å; D24-T26 WeakPolarHBondContact OD1-CA 3.46Å; D24-T26 WeakPolarHBondContact OD1-CB 3.43Å; D24-T26 PolarHBondContact OD1-N 3.38Å; D24-T26 PolarHBondContact OD1-OG1 2.96Å; D24-T26 PolarHBondContact OD2-OG1 3.43Å
25	G	88.4	Confident	88.1	Confident	34 Å²	34	49 Å²	49	35%	0.351	28%	0.283	S	S	.	.	S	Bend	trans	87.9	8	178.4	0	0	0	0	0	114	F16 D20 G23	F16-G25 WeakPolarHBondContact CZ-O 3.43Å; D20-G25 WeakPolarHBondContact OD2-CA 3.34Å; D20-G25 PolarHBondContact OD2-N 2.98Å; G23-G25 PolarHBondContact O-N 3.1Å
26	T	91.3	Very high	88	Confident	32 Å²	32	48.8 Å²	48.8	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	154	176.2	66.7	0	0	0	0	110.6	D24 I63	D24-T26 WeakPolarHBondContact OD1-CA 3.46Å; D24-T26 WeakPolarHBondContact OD1-CB 3.43Å; D24-T26 PolarHBondContact OD1-N 3.38Å; D24-T26 PolarHBondContact OD1-OG1 2.96Å; D24-T26 PolarHBondContact OD2-OG1 3.43Å; T26-I63 CarbonylContact C-O 3.54Å; T26-I63 WeakPolarHBondContact CA-O 3.41Å
27	I	90.6	Very high	88	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.6	174.7	-58.8	163.5	0	0	0	108.4	F16 F19 D20 E31 L32 T62 I63 F68	F16-I27 HydrophobicContact CD2-CD1 3.48Å; F16-I27 VanDerWaalsContact CD2-CD1 3.48Å; F16-I27 HydrophobicContact CD2-CG1 4.17Å; F16-I27 HydrophobicContact CE2-CD1 3.34Å; F16-I27 HydrophobicContact CE2-CG1 3.64Å; F16-I27 HydrophobicContact CG-CD1 4.32Å; F16-I27 HydrophobicContact CZ-CD1 4.07Å; F16-I27 HydrophobicContact CZ-CG1 3.85Å; F19-I27 HydrophobicContact CB-CD1 3.43Å; F19-I27 VanDerWaalsContact CB-CD1 3.43Å; F19-I27 HydrophobicContact CB-CG1 3.72Å; F19-I27 HydrophobicContact CB-CG2 3.99Å; F19-I27 HydrophobicContact CD2-CD1 4.49Å; F19-I27 HydrophobicContact CG-CD1 4.08Å; D20-I27 HydrophobicContact CB-CG1 4.32Å; I27-E31 HydrophobicContact CG2-CB 4.05Å; I27-L32 HydrophobicContact CG2-CB 4.04Å; I27-T62 WeakPolarHBondContact O-CA 3.29Å; I27-I63 HydrophobicContact CB-CB 4.23Å; I27-I63 PolarHBondContact N-O 3.3Å; I27-I63 PolarHBondContact O-N 3.21Å; I27-F68 HydrophobicContact CD1-CD2 3.68Å; I27-F68 HydrophobicContact CD1-CE2 4.1Å; I27-F68 HydrophobicContact CD1-CG 4.39Å
28	T	91.8	Very high	87.6	Confident	41 Å²	41	54.8 Å²	54.8	25%	0.252	31%	0.305	S	S	.	.			trans	-83.6	163	174.5	62	0	0	0	0	112.2	K30 E31 L32 T62	T28-K30 PolarHBondContact O-N 3.4Å; T28-K30 VanDerWaalsContact O-N 3.13Å; T28-E31 PolarHBondContact N-OE2 2.8Å; T28-E31 PolarHBondContact O-N 2.79Å; T28-E31 VanDerWaalsContact O-N 3.08Å; T28-E31 WeakPolarHBondContact OG1-CG 3.46Å; T28-E31 PolarHBondContact OG1-N 3.29Å; T28-E31 PolarHBondContact OG1-OE2 2.89Å; T28-L32 PolarHBondContact O-N 3.49Å; T28-T62 HydrophobicContact CG2-CG2 4.13Å
29	T	90	Very high	87.1	Confident	22 Å²	22	56.2 Å²	56.2	14%	0.135	31%	0.312	C	S	.	.	H	α-helix	trans	-53.7	-36.9	173.8	58.5	0	0	0	0	111.7	G33 E45 I52	T29-G33 PolarHBondContact O-N 2.95Å; T29-E45 VanDerWaalsContact CB-OE1 3.31Å; T29-E45 WeakPolarHBondContact CB-OE1 3.46Å; T29-E45 PolarHBondContact OG1-OE1 3.31Å; T29-I52 HydrophobicContact CG2-CD1 3.45Å; T29-I52 VanDerWaalsContact CG2-CD1 3.45Å; T29-I52 HydrophobicContact CG2-CG1 4.31Å
30	K	89.9	Confident	86.8	Confident	154 Å²	154	58.1 Å²	58.1	67%	0.67	34%	0.34	S	S	*	.	H	α-helix	trans	-65.8	-41.9	-179.9	-172.3	-178	178.2	-171.1	0	112.3	T28 T34	T28-K30 PolarHBondContact O-N 3.4Å; T28-K30 VanDerWaalsContact O-N 3.13Å; K30-T34 WeakPolarHBondContact O-CB 3.34Å; K30-T34 PolarHBondContact O-N 3.04Å; K30-T34 PolarHBondContact O-OG1 3.19Å
31	E	91.1	Very high	86.4	Confident	14 Å²	14	63 Å²	63	7%	0.065	36%	0.362	C	S	.	.	H	α-helix	trans	-70	-47.7	178.1	-78.8	170.5	129.1	0	0	111.5	F19 K21 I27 T28 G33 T34 V35	F19-E31 WeakPolarHBondContact O-CB 3.23Å; K21-E31 PolarHBondContact N-OE1 2.66Å; I27-E31 HydrophobicContact CG2-CB 4.05Å; T28-E31 PolarHBondContact N-OE2 2.8Å; T28-E31 PolarHBondContact O-N 2.79Å; T28-E31 VanDerWaalsContact O-N 3.08Å; T28-E31 WeakPolarHBondContact OG1-CG 3.46Å; T28-E31 PolarHBondContact OG1-N 3.29Å; T28-E31 PolarHBondContact OG1-OE2 2.89Å; E31-G33 VanDerWaalsContact C-N 3.32Å; E31-G33 PolarHBondContact O-N 2.88Å; E31-T34 WeakPolarHBondContact O-CB 3.37Å; E31-T34 PolarHBondContact O-N 3Å; E31-T34 VanDerWaalsContact O-N 3.08Å; E31-V35 PolarHBondContact O-N 2.92Å; E31-V35 VanDerWaalsContact O-N 3.08Å
32	L	87.6	Confident	86.4	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-53.8	-50.1	172.9	-178.2	61.2	0	0	0	111.1	F19 I27 T28 T34 V35 M36 L48 M51 I52	F19-L32 HydrophobicContact CD1-CD1 4Å; F19-L32 HydrophobicContact CE1-CD1 3.92Å; I27-L32 HydrophobicContact CG2-CB 4.04Å; T28-L32 PolarHBondContact O-N 3.49Å; L32-T34 VanDerWaalsContact C-N 3.3Å; L32-T34 PolarHBondContact O-N 3.36Å; L32-V35 PolarHBondContact O-N 2.94Å; L32-M36 HydrophobicContact CD1-CG 4.32Å; L32-M36 HydrophobicContact CD1-SD 4.15Å; L32-M36 HydrophobicContact CG-SD 4.03Å; L32-M36 WeakPolarHBondContact O-CG 3.36Å; L32-M36 PolarHBondContact O-N 2.92Å; L32-L48 HydrophobicContact CB-CD2 4.23Å; L32-L48 HydrophobicContact CD2-CD2 3.85Å; L32-L48 HydrophobicContact CG-CD2 3.73Å; L32-M51 HydrophobicContact CD2-CB 4.18Å; L32-M51 HydrophobicContact CD2-CE 4.32Å; L32-I52 HydrophobicContact CD2-CG1 4.17Å
33	G	88.5	Confident	86.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-63.3	-32.8	178.5	0	0	0	0	0	113.7	T29 E31 R37	T29-G33 PolarHBondContact O-N 2.95Å; E31-G33 VanDerWaalsContact C-N 3.32Å; E31-G33 PolarHBondContact O-N 2.88Å; G33-R37 WeakPolarHBondContact O-CB 3.34Å; G33-R37 VanDerWaalsContact O-CG 3.31Å; G33-R37 WeakPolarHBondContact O-CG 3.43Å; G33-R37 PolarHBondContact O-N 2.91Å; G33-R37 PolarHBondContact O-NE 2.96Å; G33-R37 PolarHBondContact O-NH2 3.13Å
34	T	89.1	Confident	86.6	Confident	58 Å²	58	59.6 Å²	59.6	36%	0.356	34%	0.34	S	S	.	.	H	α-helix	trans	-67.1	-41.9	176.7	-62	0	0	0	0	111.2	K30 E31 L32 S38	K30-T34 WeakPolarHBondContact O-CB 3.34Å; K30-T34 PolarHBondContact O-N 3.04Å; K30-T34 PolarHBondContact O-OG1 3.19Å; E31-T34 WeakPolarHBondContact O-CB 3.37Å; E31-T34 PolarHBondContact O-N 3Å; E31-T34 VanDerWaalsContact O-N 3.08Å; L32-T34 VanDerWaalsContact C-N 3.3Å; L32-T34 PolarHBondContact O-N 3.36Å; T34-S38 PolarHBondContact O-N 3.07Å; T34-S38 VanDerWaalsContact O-N 3.11Å; T34-S38 PolarHBondContact O-OG 3.39Å
35	V	85.8	Confident	86.6	Confident	16 Å²	16	60.3 Å²	60.3	10%	0.097	34%	0.341	C	S	.	.	H	α-helix	trans	-69.7	-47.6	176.7	178.7	0	0	0	0	111.2	L18 F19 E31 L32 R37 S38 L39	L18-V35 VanDerWaalsContact O-CG2 3.22Å; L18-V35 WeakPolarHBondContact O-CG2 3.49Å; F19-V35 HydrophobicContact CB-CG2 4.38Å; F19-V35 HydrophobicContact CD1-CB 3.59Å; F19-V35 HydrophobicContact CD1-CG1 3.77Å; F19-V35 HydrophobicContact CD1-CG2 3.64Å; F19-V35 HydrophobicContact CE1-CB 3.64Å; F19-V35 HydrophobicContact CE1-CG1 3.38Å; F19-V35 HydrophobicContact CE1-CG2 4.17Å; F19-V35 HydrophobicContact CG-CB 4.48Å; F19-V35 HydrophobicContact CG-CG2 4.11Å; F19-V35 HydrophobicContact CZ-CG1 3.83Å; E31-V35 PolarHBondContact O-N 2.92Å; E31-V35 VanDerWaalsContact O-N 3.08Å; L32-V35 PolarHBondContact O-N 2.94Å; V35-R37 VanDerWaalsContact C-N 3.26Å; V35-R37 PolarHBondContact O-N 2.81Å; V35-S38 CarbonylContact O-C 3.58Å; V35-S38 WeakPolarHBondContact O-CA 3.38Å; V35-S38 WeakPolarHBondContact O-CB 3.45Å; V35-S38 PolarHBondContact O-N 3.4Å; V35-L39 HydrophobicContact CG1-CD1 4.09Å; V35-L39 HydrophobicContact CG1-CG 4.4Å; V35-L39 WeakPolarHBondContact O-CG 3.38Å; V35-L39 PolarHBondContact O-N 3.37Å
36	M	81.4	Confident	86.6	Confident	20 Å²	20	61.7 Å²	61.7	10%	0.099	35%	0.349	C	S	.	.	H	α-helix	trans	-58.5	-39.1	179.3	-69.5	-175.2	81	0	0	112.2	L32 L39 G40 Q41 P43 L48 M51	L32-M36 HydrophobicContact CD1-CG 4.32Å; L32-M36 HydrophobicContact CD1-SD 4.15Å; L32-M36 HydrophobicContact CG-SD 4.03Å; L32-M36 WeakPolarHBondContact O-CG 3.36Å; L32-M36 PolarHBondContact O-N 2.92Å; M36-L39 CarbonylContact O-C 3.54Å; M36-L39 PolarHBondContact O-N 3.42Å; M36-G40 PolarHBondContact O-N 2.86Å; M36-Q41 CarbonylContact C-O 3.1Å; M36-Q41 HydrophobicContact CB-CB 4.44Å; M36-Q41 PolarHBondContact O-N 2.95Å; M36-P43 HydrophobicContact CB-CG 3.84Å; M36-P43 HydrophobicContact CE-CB 4.36Å; M36-P43 HydrophobicContact CE-CG 4.11Å; M36-P43 HydrophobicContact CG-CG 4.47Å; M36-P43 HydrophobicContact SD-CB 4.44Å; M36-P43 HydrophobicContact SD-CG 3.83Å; M36-L48 HydrophobicContact SD-CD2 3.69Å; M36-M51 HydrophobicContact CE-CE 3.82Å; M36-M51 HydrophobicContact CE-SD 3.76Å; M36-M51 HydrophobicContact SD-CE 3.76Å; M36-M51 HydrophobicContact SD-SD 3.79Å
37	R	85.5	Confident	86.4	Confident	109 Å²	109	64.9 Å²	64.9	41%	0.411	36%	0.362	S	S	.	.	H	α-helix	trans	-64.8	-36.1	171.5	-73.9	-174.9	-67	-92.8	-1.9	114	G33 V35 L39 G40 Q41	G33-R37 WeakPolarHBondContact O-CB 3.34Å; G33-R37 VanDerWaalsContact O-CG 3.31Å; G33-R37 WeakPolarHBondContact O-CG 3.43Å; G33-R37 PolarHBondContact O-N 2.91Å; G33-R37 PolarHBondContact O-NE 2.96Å; G33-R37 PolarHBondContact O-NH2 3.13Å; V35-R37 VanDerWaalsContact C-N 3.26Å; V35-R37 PolarHBondContact O-N 2.81Å; R37-L39 VanDerWaalsContact C-N 3.25Å; R37-L39 PolarHBondContact O-N 3.39Å; R37-G40 PolarHBondContact O-N 3.25Å; R37-G40 VanDerWaalsContact O-N 3.15Å; R37-Q41 WeakPolarHBondContact CA-O 3.49Å
38	S	78.7	Confident	86.2	Confident	100 Å²	100	64.9 Å²	64.9	70%	0.699	36%	0.362	S	S	*	.	H	α-helix	trans	-69.3	-25.8	175	-57	0	0	0	0	112.6	T34 V35 G40	T34-S38 PolarHBondContact O-N 3.07Å; T34-S38 VanDerWaalsContact O-N 3.11Å; T34-S38 PolarHBondContact O-OG 3.39Å; V35-S38 CarbonylContact O-C 3.58Å; V35-S38 WeakPolarHBondContact O-CA 3.38Å; V35-S38 WeakPolarHBondContact O-CB 3.45Å; V35-S38 PolarHBondContact O-N 3.4Å; S38-G40 VanDerWaalsContact C-N 3.27Å
39	L	75.4	Confident	86.1	Confident	132 Å²	132	66 Å²	66	69%	0.691	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	4.4	172.9	-62.4	174.6	0	0	0	113.3	V35 M36 R37	V35-L39 HydrophobicContact CG1-CD1 4.09Å; V35-L39 HydrophobicContact CG1-CG 4.4Å; V35-L39 WeakPolarHBondContact O-CG 3.38Å; V35-L39 PolarHBondContact O-N 3.37Å; M36-L39 CarbonylContact O-C 3.54Å; M36-L39 PolarHBondContact O-N 3.42Å; R37-L39 VanDerWaalsContact C-N 3.25Å; R37-L39 PolarHBondContact O-N 3.39Å
40	G	79.7	Confident	86	Confident	70 Å²	70	69.5 Å²	69.5	72%	0.722	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	5.1	176.9	0	0	0	0	0	115.1	M36 R37 S38	M36-G40 PolarHBondContact O-N 2.86Å; R37-G40 PolarHBondContact O-N 3.25Å; R37-G40 VanDerWaalsContact O-N 3.15Å; S38-G40 VanDerWaalsContact C-N 3.27Å
41	Q	80.2	Confident	85.6	Confident	118 Å²	118	64.2 Å²	64.2	55%	0.551	36%	0.36	S	S	*	.			trans	-87.8	155.1	170.3	-61.1	-162.5	-22.8	0	0	110.7	M36 R37 P43	M36-Q41 CarbonylContact C-O 3.1Å; M36-Q41 HydrophobicContact CB-CB 4.44Å; M36-Q41 PolarHBondContact O-N 2.95Å; R37-Q41 WeakPolarHBondContact CA-O 3.49Å; Q41-P43 VanDerWaalsContact C-CD 3.49Å
42	N	85.9	Confident	85.5	Confident	135 Å²	135	63.6 Å²	63.6	72%	0.722	36%	0.357	S	S	*	.			trans	-131.9	66.8	178.5	-162.2	52.7	0	0	0	111.7
43	P	87.9	Confident	85.4	Confident	18 Å²	18	67.3 Å²	67.3	12%	0.117	38%	0.377	C	S	.	.			trans	-68.4	147.8	-179.2	31.4	-37.3	0	0	0	111.3	M36 Q41 E47 L48	M36-P43 HydrophobicContact CB-CG 3.84Å; M36-P43 HydrophobicContact CE-CB 4.36Å; M36-P43 HydrophobicContact CE-CG 4.11Å; M36-P43 HydrophobicContact CG-CG 4.47Å; M36-P43 HydrophobicContact SD-CB 4.44Å; M36-P43 HydrophobicContact SD-CG 3.83Å; Q41-P43 VanDerWaalsContact C-CD 3.49Å; P43-E47 WeakPolarHBondContact CA-OE2 3.27Å; P43-E47 HydrophobicContact CB-CB 4.33Å; P43-L48 HydrophobicContact CB-CD2 4.08Å; P43-L48 HydrophobicContact CB-CG 4.07Å; P43-L48 HydrophobicContact CG-CD1 4.33Å; P43-L48 HydrophobicContact CG-CD2 3.69Å; P43-L48 HydrophobicContact CG-CG 4.01Å
44	T	90.6	Very high	85.2	Confident	77 Å²	77	73.9 Å²	73.9	47%	0.472	41%	0.408	S	S	.	.			trans	-77.1	161.5	170.6	63.2	0	0	0	0	111.1	A46 E47 L48	T44-A46 PolarHBondContact O-N 3.12Å; T44-E47 WeakPolarHBondContact CB-OE2 3.44Å; T44-E47 WeakPolarHBondContact CG2-OE2 3.5Å; T44-E47 PolarHBondContact N-OE2 2.77Å; T44-E47 PolarHBondContact O-N 3.1Å; T44-E47 VanDerWaalsContact OG1-CG 3.31Å; T44-E47 WeakPolarHBondContact OG1-CG 3.35Å; T44-E47 PolarHBondContact OG1-N 2.8Å; T44-E47 PolarHBondContact OG1-OE2 3.49Å; T44-L48 WeakPolarHBondContact O-CG 3.18Å; T44-L48 PolarHBondContact O-N 2.96Å
45	E	88.4	Confident	84.9	Confident	110 Å²	110	72.1 Å²	72.1	51%	0.514	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-34	176.8	-164.7	66	-160.6	0	0	112.1	T29 L48 Q49	T29-E45 VanDerWaalsContact CB-OE1 3.31Å; T29-E45 WeakPolarHBondContact CB-OE1 3.46Å; T29-E45 PolarHBondContact OG1-OE1 3.31Å; E45-L48 PolarHBondContact O-N 2.84Å; E45-Q49 WeakPolarHBondContact O-CB 3.4Å; E45-Q49 PolarHBondContact O-N 3.24Å
46	A	89.5	Confident	85	Confident	63 Å²	63	72.5 Å²	72.5	52%	0.521	40%	0.398	S	S	.	.	H	α-helix	trans	-65.6	-46	176.4	0	0	0	0	0	111.3	T44 L48 Q49 D50	T44-A46 PolarHBondContact O-N 3.12Å; A46-L48 VanDerWaalsContact C-N 3.33Å; A46-L48 PolarHBondContact O-N 2.92Å; A46-Q49 PolarHBondContact O-N 3.31Å; A46-D50 WeakPolarHBondContact O-CB 3.49Å; A46-D50 VanDerWaalsContact O-CG 3.26Å; A46-D50 PolarHBondContact O-N 3.2Å
47	E	86.2	Confident	85.2	Confident	100 Å²	100	75.9 Å²	75.9	47%	0.467	43%	0.43	S	S	.	.	H	α-helix	trans	-62.8	-40.2	175.9	-71.1	163.6	139	0	0	111.6	P43 T44 D50 M51	P43-E47 WeakPolarHBondContact CA-OE2 3.27Å; P43-E47 HydrophobicContact CB-CB 4.33Å; T44-E47 WeakPolarHBondContact CB-OE2 3.44Å; T44-E47 WeakPolarHBondContact CG2-OE2 3.5Å; T44-E47 PolarHBondContact N-OE2 2.77Å; T44-E47 PolarHBondContact O-N 3.1Å; T44-E47 VanDerWaalsContact OG1-CG 3.31Å; T44-E47 WeakPolarHBondContact OG1-CG 3.35Å; T44-E47 PolarHBondContact OG1-N 2.8Å; T44-E47 PolarHBondContact OG1-OE2 3.49Å; E47-D50 PolarHBondContact O-N 3.05Å; E47-M51 WeakPolarHBondContact O-CB 3.26Å; E47-M51 WeakPolarHBondContact O-CG 3.49Å; E47-M51 PolarHBondContact O-N 3.19Å
48	L	87.9	Confident	85.2	Confident	1 Å²	1	75.6 Å²	75.6	1%	0.005	44%	0.436	C	S	.	.	H	α-helix	trans	-63.7	-42.9	175.5	-69.1	169.5	0	0	0	111.7	L32 M36 P43 T44 E45 A46 M51 I52	L32-L48 HydrophobicContact CB-CD2 4.23Å; L32-L48 HydrophobicContact CD2-CD2 3.85Å; L32-L48 HydrophobicContact CG-CD2 3.73Å; M36-L48 HydrophobicContact SD-CD2 3.69Å; P43-L48 HydrophobicContact CB-CD2 4.08Å; P43-L48 HydrophobicContact CB-CG 4.07Å; P43-L48 HydrophobicContact CG-CD1 4.33Å; P43-L48 HydrophobicContact CG-CD2 3.69Å; P43-L48 HydrophobicContact CG-CG 4.01Å; T44-L48 WeakPolarHBondContact O-CG 3.18Å; T44-L48 PolarHBondContact O-N 2.96Å; E45-L48 PolarHBondContact O-N 2.84Å; A46-L48 VanDerWaalsContact C-N 3.33Å; A46-L48 PolarHBondContact O-N 2.92Å; L48-M51 PolarHBondContact O-N 3.49Å; L48-I52 WeakPolarHBondContact O-CG1 3.33Å; L48-I52 PolarHBondContact O-N 3.48Å
49	Q	88.1	Confident	85.6	Confident	65 Å²	65	73.7 Å²	73.7	30%	0.304	43%	0.432	S	S	.	.	H	α-helix	trans	-66.1	-41.2	177.6	-170.6	64	62.6	0	0	111.4	E45 A46 M51 I52 N53	E45-Q49 WeakPolarHBondContact O-CB 3.4Å; E45-Q49 PolarHBondContact O-N 3.24Å; A46-Q49 PolarHBondContact O-N 3.31Å; Q49-M51 VanDerWaalsContact C-N 3.34Å; Q49-I52 PolarHBondContact O-N 2.81Å; Q49-N53 PolarHBondContact NE2-OD1 2.86Å; Q49-N53 WeakPolarHBondContact O-CB 3.33Å; Q49-N53 PolarHBondContact O-N 2.64Å; Q49-N53 PolarHBondContact O-ND2 3.47Å; Q49-N53 PolarHBondContact O-OD1 3.37Å
50	D	87.7	Confident	86.2	Confident	95 Å²	95	70.9 Å²	70.9	51%	0.508	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-43.2	175.9	-71.8	-20.1	0	0	0	110.6	A46 E47 I52 N53 E54	A46-D50 WeakPolarHBondContact O-CB 3.49Å; A46-D50 VanDerWaalsContact O-CG 3.26Å; A46-D50 PolarHBondContact O-N 3.2Å; E47-D50 PolarHBondContact O-N 3.05Å; D50-I52 VanDerWaalsContact C-N 3.32Å; D50-I52 PolarHBondContact O-N 3.38Å; D50-N53 PolarHBondContact O-N 3.45Å; D50-E54 WeakPolarHBondContact O-CG 3.32Å; D50-E54 PolarHBondContact O-N 3.23Å
51	M	83.4	Confident	86.5	Confident	43 Å²	43	68.8 Å²	68.8	21%	0.212	40%	0.396	C	S	.	.	H	α-helix	trans	-60.4	-38.4	174.8	-73	176.3	68.9	0	0	113.1	L32 M36 E47 L48 Q49	L32-M51 HydrophobicContact CD2-CB 4.18Å; L32-M51 HydrophobicContact CD2-CE 4.32Å; M36-M51 HydrophobicContact CE-CE 3.82Å; M36-M51 HydrophobicContact CE-SD 3.76Å; M36-M51 HydrophobicContact SD-CE 3.76Å; M36-M51 HydrophobicContact SD-SD 3.79Å; E47-M51 WeakPolarHBondContact O-CB 3.26Å; E47-M51 WeakPolarHBondContact O-CG 3.49Å; E47-M51 PolarHBondContact O-N 3.19Å; L48-M51 PolarHBondContact O-N 3.49Å; Q49-M51 VanDerWaalsContact C-N 3.34Å
52	I	87.3	Confident	87	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-67.8	-50.4	173.8	-67.9	-167.6	0	0	0	110.1	T29 L32 L48 Q49 D50 E54 V55 D56 I63	T29-I52 HydrophobicContact CG2-CD1 3.45Å; T29-I52 VanDerWaalsContact CG2-CD1 3.45Å; T29-I52 HydrophobicContact CG2-CG1 4.31Å; L32-I52 HydrophobicContact CD2-CG1 4.17Å; L48-I52 WeakPolarHBondContact O-CG1 3.33Å; L48-I52 PolarHBondContact O-N 3.48Å; Q49-I52 PolarHBondContact O-N 2.81Å; D50-I52 VanDerWaalsContact C-N 3.32Å; D50-I52 PolarHBondContact O-N 3.38Å; I52-E54 PolarHBondContact O-N 2.96Å; I52-E54 VanDerWaalsContact O-N 3.11Å; I52-V55 WeakPolarHBondContact O-CG2 3.12Å; I52-V55 PolarHBondContact O-N 3.33Å; I52-D56 HydrophobicContact CG2-CB 3.98Å; I52-D56 WeakPolarHBondContact O-CB 3.33Å; I52-D56 PolarHBondContact O-N 3.12Å; I52-I63 HydrophobicContact CB-CG1 4.3Å; I52-I63 HydrophobicContact CD1-CG1 4.46Å; I52-I63 HydrophobicContact CG1-CD1 3.91Å; I52-I63 HydrophobicContact CG1-CG1 3.94Å; I52-I63 HydrophobicContact CG2-CG1 4.1Å
53	N	87.2	Confident	87.2	Confident	83 Å²	83	58 Å²	58	44%	0.444	34%	0.344	S	S	.	.	H	α-helix	trans	-60.4	-25.3	-177	-66	-17.4	0	0	0	113.4	Q49 D50 V55	Q49-N53 PolarHBondContact NE2-OD1 2.86Å; Q49-N53 WeakPolarHBondContact O-CB 3.33Å; Q49-N53 PolarHBondContact O-N 2.64Å; Q49-N53 PolarHBondContact O-ND2 3.47Å; Q49-N53 PolarHBondContact O-OD1 3.37Å; D50-N53 PolarHBondContact O-N 3.45Å; N53-V55 PolarHBondContact O-N 3.41Å
54	E	83.3	Confident	87.4	Confident	139 Å²	139	59.3 Å²	59.3	65%	0.65	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.4	176	-81.3	-177.5	-179.1	0	0	113.6	D50 I52	D50-E54 WeakPolarHBondContact O-CG 3.32Å; D50-E54 PolarHBondContact O-N 3.23Å; I52-E54 PolarHBondContact O-N 2.96Å; I52-E54 VanDerWaalsContact O-N 3.11Å
55	V	82.8	Confident	87.2	Confident	21 Å²	21	57.9 Å²	57.9	13%	0.127	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-16.7	-172.7	-58.8	0	0	0	0	114.2	I52 N53 A57 I63 E67 M71	I52-V55 WeakPolarHBondContact O-CG2 3.12Å; I52-V55 PolarHBondContact O-N 3.33Å; N53-V55 PolarHBondContact O-N 3.41Å; V55-A57 PolarHBondContact O-N 3.37Å; V55-I63 HydrophobicContact CG2-CD1 3.77Å; V55-I63 HydrophobicContact CG2-CG1 3.86Å; V55-I63 HydrophobicContact CG2-CG2 4.21Å; V55-E67 WeakPolarHBondContact O-CG 3.48Å; V55-M71 HydrophobicContact CB-CB 4.35Å; V55-M71 HydrophobicContact CG1-CB 3.78Å; V55-M71 HydrophobicContact CG1-CG 3.93Å; V55-M71 HydrophobicContact CG2-CB 4.39Å
56	D	87.9	Confident	87.1	Confident	23 Å²	23	56.3 Å²	56.3	12%	0.123	34%	0.336	C	S	.	.			trans	-65.1	93.8	172	178	11	0	0	0	110.1	I52 G59 N60 G61	I52-D56 HydrophobicContact CG2-CB 3.98Å; I52-D56 WeakPolarHBondContact O-CB 3.33Å; I52-D56 PolarHBondContact O-N 3.12Å; D56-G59 WeakPolarHBondContact OD1-CA 3.34Å; D56-G59 PolarHBondContact OD1-N 3.35Å; D56-G59 VanDerWaalsContact OD2-C 3.29Å; D56-G59 VanDerWaalsContact OD2-CA 3.31Å; D56-G59 WeakPolarHBondContact OD2-CA 3.37Å; D56-N60 PolarHBondContact OD1-N 3.27Å; D56-N60 VanDerWaalsContact OD1-N 3.08Å; D56-N60 PolarHBondContact OD2-N 3.14Å; D56-G61 VanDerWaalsContact OD2-CA 3.31Å; D56-G61 WeakPolarHBondContact OD2-CA 3.43Å; D56-G61 PolarHBondContact OD2-N 3.35Å
57	A	84.7	Confident	87	Confident	92 Å²	92	53.9 Å²	53.9	76%	0.76	31%	0.314	S	S	*	.	S	Bend	trans	-84.4	-26.1	-175.1	0	0	0	0	0	111.8	V55 E67	V55-A57 PolarHBondContact O-N 3.37Å; A57-E67 PolarHBondContact N-OE1 3.46Å
58	D	86.4	Confident	86.9	Confident	102 Å²	102	49.1 Å²	49.1	55%	0.545	29%	0.292	S	S	.	.	S	Bend	trans	-92.8	-11.4	179.4	80.1	0.4	0	0	0	113.5	N60 E67	D58-N60 WeakPolarHBondContact OD1-CB 3.23Å; D58-N60 PolarHBondContact OD1-N 3.23Å; D58-N60 PolarHBondContact OD1-ND2 2.98Å; D58-N60 PolarHBondContact OD2-ND2 2.92Å; D58-E67 PolarHBondContact N-OE1 3.05Å
59	G	86.5	Confident	86.7	Confident	60 Å²	60	50.5 Å²	50.5	62%	0.619	30%	0.299	S	S	*	.			trans	74.9	23.2	177	0	0	0	0	0	113.4	D56 G61	D56-G59 WeakPolarHBondContact OD1-CA 3.34Å; D56-G59 PolarHBondContact OD1-N 3.35Å; D56-G59 VanDerWaalsContact OD2-C 3.29Å; D56-G59 VanDerWaalsContact OD2-CA 3.31Å; D56-G59 WeakPolarHBondContact OD2-CA 3.37Å; G59-G61 VanDerWaalsContact C-N 3.29Å
60	N	88.4	Confident	86.3	Confident	74 Å²	74	51.7 Å²	51.7	40%	0.396	31%	0.311	S	S	.	.	S	Bend	trans	-81.4	-8.4	-177.3	73.8	27.2	0	0	0	113.2	D56 D58 T62	D56-N60 PolarHBondContact OD1-N 3.27Å; D56-N60 VanDerWaalsContact OD1-N 3.08Å; D56-N60 PolarHBondContact OD2-N 3.14Å; D58-N60 WeakPolarHBondContact OD1-CB 3.23Å; D58-N60 PolarHBondContact OD1-N 3.23Å; D58-N60 PolarHBondContact OD1-ND2 2.98Å; D58-N60 PolarHBondContact OD2-ND2 2.92Å; N60-T62 PolarHBondContact ND2-OG1 3.22Å; N60-T62 WeakPolarHBondContact OD1-CA 3.43Å; N60-T62 WeakPolarHBondContact OD1-CB 3.1Å; N60-T62 PolarHBondContact OD1-N 3.34Å; N60-T62 PolarHBondContact OD1-O 2.83Å; N60-T62 PolarHBondContact OD1-OG1 2.88Å
61	G	86.8	Confident	85.8	Confident	26 Å²	26	48.1 Å²	48.1	27%	0.268	29%	0.291	S	S	.	.	S	Bend	trans	79.1	15.8	179.3	0	0	0	0	0	114.4	D56 G59	D56-G61 VanDerWaalsContact OD2-CA 3.31Å; D56-G61 WeakPolarHBondContact OD2-CA 3.43Å; D56-G61 PolarHBondContact OD2-N 3.35Å; G59-G61 VanDerWaalsContact C-N 3.29Å
62	T	89.9	Confident	85.3	Confident	26 Å²	26	48.1 Å²	48.1	16%	0.16	29%	0.291	C	S	.	.	S	Bend	trans	-133.3	168.8	176.3	68.2	0	0	0	0	109.6	I27 T28 N60	I27-T62 WeakPolarHBondContact O-CA 3.29Å; T28-T62 HydrophobicContact CG2-CG2 4.13Å; N60-T62 PolarHBondContact ND2-OG1 3.22Å; N60-T62 WeakPolarHBondContact OD1-CA 3.43Å; N60-T62 WeakPolarHBondContact OD1-CB 3.1Å; N60-T62 PolarHBondContact OD1-N 3.34Å; N60-T62 PolarHBondContact OD1-O 2.83Å; N60-T62 PolarHBondContact OD1-OG1 2.88Å
63	I	90.1	Very high	84.5	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	114.9	175	-54.5	175.6	0	0	0	108.4	T26 I27 I52 V55 E67 F68 M71	T26-I63 CarbonylContact C-O 3.54Å; T26-I63 WeakPolarHBondContact CA-O 3.41Å; I27-I63 HydrophobicContact CB-CB 4.23Å; I27-I63 PolarHBondContact N-O 3.3Å; I27-I63 PolarHBondContact O-N 3.21Å; I52-I63 HydrophobicContact CB-CG1 4.3Å; I52-I63 HydrophobicContact CD1-CG1 4.46Å; I52-I63 HydrophobicContact CG1-CD1 3.91Å; I52-I63 HydrophobicContact CG1-CG1 3.94Å; I52-I63 HydrophobicContact CG2-CG1 4.1Å; V55-I63 HydrophobicContact CG2-CD1 3.77Å; V55-I63 HydrophobicContact CG2-CG1 3.86Å; V55-I63 HydrophobicContact CG2-CG2 4.21Å; I63-E67 HydrophobicContact CG2-CB 3.79Å; I63-F68 HydrophobicContact CG2-CB 3.83Å; I63-M71 HydrophobicContact CD1-SD 4.28Å
64	D	91.4	Very high	83.5	Confident	44 Å²	44	53.5 Å²	53.5	24%	0.235	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	171	170.7	79.1	16.2	0	0	0	112.2	P66 E67 F68	D64-P66 WeakPolarHBondContact OD1-CB 3.44Å; D64-P66 WeakPolarHBondContact OD1-CD 3.45Å; D64-E67 PolarHBondContact N-OE2 2.92Å; D64-E67 PolarHBondContact O-N 2.66Å; D64-E67 WeakPolarHBondContact OD1-CB 3.2Å; D64-E67 WeakPolarHBondContact OD1-CG 3.09Å; D64-E67 PolarHBondContact OD1-N 2.86Å; D64-F68 WeakPolarHBondContact O-CB 3.22Å; D64-F68 PolarHBondContact O-N 2.81Å
65	F	86.3	Confident	82.6	Confident	47 Å²	47	52.1 Å²	52.1	21%	0.206	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-45.8	-178.6	-177.4	-112.4	0	0	0	113.6	I9 K13 F16 E67 F68 L69	I9-F65 HydrophobicContact CG2-CE1 4.28Å; I9-F65 HydrophobicContact CG2-CZ 4.18Å; K13-F65 HydrophobicContact CB-CE2 3.91Å; K13-F65 HydrophobicContact CB-CZ 3.85Å; K13-F65 HydrophobicContact CG-CE2 4.21Å; K13-F65 HydrophobicContact CG-CZ 4.23Å; F16-F65 HydrophobicContact CB-CD2 3.9Å; F16-F65 HydrophobicContact CB-CE2 4.09Å; F16-F65 HydrophobicContact CD1-CD2 4.24Å; F16-F65 HydrophobicContact CD2-CB 4.44Å; F16-F65 AromaticContact CD2-CD2 3.81Å; F16-F65 HydrophobicContact CD2-CD2 3.81Å; F16-F65 HydrophobicContact CE2-CB 4.19Å; F16-F65 HydrophobicContact CE2-CD2 4.39Å; F16-F65 AromaticContact CG-CD2 3.72Å; F16-F65 HydrophobicContact CG-CD2 3.72Å; F16-F65 HydrophobicContact CG-CE2 4.4Å; F16-F65 HydrophobicContact CZ-CB 4.26Å; F65-E67 PolarHBondContact O-N 3.36Å; F65-F68 PolarHBondContact O-N 3.46Å; F65-L69 HydrophobicContact CD1-CD1 4.18Å; F65-L69 HydrophobicContact CE1-CD1 3.74Å; F65-L69 HydrophobicContact CE1-CG 4.23Å; F65-L69 HydrophobicContact CE2-CD2 4.29Å; F65-L69 HydrophobicContact CE2-CG 4.31Å; F65-L69 HydrophobicContact CZ-CD1 4.01Å; F65-L69 HydrophobicContact CZ-CD2 4.04Å; F65-L69 HydrophobicContact CZ-CG 4.08Å; F65-L69 WeakPolarHBondContact O-CG 3.18Å; F65-L69 PolarHBondContact O-N 3.45Å
66	P	86.3	Confident	81.2	Confident	77 Å²	77	54.8 Å²	54.8	50%	0.5	32%	0.318	S	S	.	.	H	α-helix	trans	-53.3	-43.6	169.5	-27.4	31.5	0	0	0	115.5	D64 L69 T70	D64-P66 WeakPolarHBondContact OD1-CB 3.44Å; D64-P66 WeakPolarHBondContact OD1-CD 3.45Å; P66-L69 PolarHBondContact O-N 3.48Å; P66-T70 PolarHBondContact O-N 3.47Å; P66-T70 PolarHBondContact O-OG1 2.82Å
67	E	87.6	Confident	79.7	Confident	12 Å²	12	61.1 Å²	61.1	6%	0.056	34%	0.344	C	S	.	.	H	α-helix	trans	-68.4	-39.7	178.2	-69.3	168.9	152.4	0	0	110.8	V55 A57 D58 I63 D64 F65 L69 T70 M71	V55-E67 WeakPolarHBondContact O-CG 3.48Å; A57-E67 PolarHBondContact N-OE1 3.46Å; D58-E67 PolarHBondContact N-OE1 3.05Å; I63-E67 HydrophobicContact CG2-CB 3.79Å; D64-E67 PolarHBondContact N-OE2 2.92Å; D64-E67 PolarHBondContact O-N 2.66Å; D64-E67 WeakPolarHBondContact OD1-CB 3.2Å; D64-E67 WeakPolarHBondContact OD1-CG 3.09Å; D64-E67 PolarHBondContact OD1-N 2.86Å; F65-E67 PolarHBondContact O-N 3.36Å; E67-L69 PolarHBondContact O-N 3.48Å; E67-T70 WeakPolarHBondContact O-CB 2.95Å; E67-T70 PolarHBondContact O-N 3.09Å; E67-T70 VanDerWaalsContact O-N 3.13Å; E67-M71 PolarHBondContact O-N 2.92Å
68	F	85.1	Confident	78.2	Confident	1 Å²	1	61.3 Å²	61.3	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-41.3	173.1	-178.4	-97.5	0	0	0	112.1	F12 A15 F16 F19 I27 I63 D64 F65 T70 M71 M72	F12-F68 HydrophobicContact CB-CE1 4.45Å; F12-F68 WeakPolarHBondContact O-CE1 3.46Å; A15-F68 HydrophobicContact CB-CE1 4.4Å; A15-F68 HydrophobicContact CB-CZ 4.27Å; F16-F68 HydrophobicContact CB-CD1 4.1Å; F16-F68 HydrophobicContact CB-CE1 4.03Å; F16-F68 HydrophobicContact CD2-CB 3.63Å; F16-F68 AromaticContact CD2-CD1 3.76Å; F16-F68 HydrophobicContact CD2-CD1 3.76Å; F16-F68 AromaticContact CD2-CD2 3.99Å; F16-F68 HydrophobicContact CD2-CD2 3.99Å; F16-F68 HydrophobicContact CD2-CE1 4.39Å; F16-F68 AromaticContact CD2-CG 3.54Å; F16-F68 HydrophobicContact CD2-CG 3.54Å; F16-F68 HydrophobicContact CE2-CB 3.85Å; F16-F68 HydrophobicContact CE2-CG 4.21Å; F16-F68 HydrophobicContact CG-CD1 4.44Å; F19-F68 AromaticContact CD2-CE2 3.74Å; F19-F68 HydrophobicContact CD2-CE2 3.74Å; F19-F68 AromaticContact CD2-CZ 3.95Å; F19-F68 HydrophobicContact CD2-CZ 3.95Å; F19-F68 AromaticContact CE2-CE2 3.79Å; F19-F68 HydrophobicContact CE2-CE2 3.79Å; F19-F68 AromaticContact CE2-CZ 3.85Å; F19-F68 HydrophobicContact CE2-CZ 3.85Å; F19-F68 HydrophobicContact CG-CE2 4.46Å; I27-F68 HydrophobicContact CD1-CD2 3.68Å; I27-F68 HydrophobicContact CD1-CE2 4.1Å; I27-F68 HydrophobicContact CD1-CG 4.39Å; I63-F68 HydrophobicContact CG2-CB 3.83Å; D64-F68 WeakPolarHBondContact O-CB 3.22Å; D64-F68 PolarHBondContact O-N 2.81Å; F65-F68 PolarHBondContact O-N 3.46Å; F68-T70 VanDerWaalsContact C-N 3.29Å; F68-T70 PolarHBondContact O-N 3.22Å; F68-M71 HydrophobicContact CD2-CE 3.64Å; F68-M71 HydrophobicContact CE2-CE 3.67Å; F68-M71 WeakPolarHBondContact O-CB 3.16Å; F68-M71 PolarHBondContact O-N 3.41Å; F68-M72 HydrophobicContact CD1-CG 3.93Å; F68-M72 HydrophobicContact CD2-CG 4.46Å; F68-M72 HydrophobicContact CE1-CG 3.57Å; F68-M72 HydrophobicContact CE1-SD 4.41Å; F68-M72 HydrophobicContact CE2-CG 4.14Å; F68-M72 HydrophobicContact CE2-SD 4.33Å; F68-M72 HydrophobicContact CG-CG 4.37Å; F68-M72 HydrophobicContact CZ-CE 4.45Å; F68-M72 HydrophobicContact CZ-CG 3.68Å; F68-M72 HydrophobicContact CZ-SD 3.96Å; F68-M72 WeakPolarHBondContact O-CB 3.27Å; F68-M72 VanDerWaalsContact O-CG 3.27Å; F68-M72 WeakPolarHBondContact O-CG 3.42Å; F68-M72 PolarHBondContact O-N 3.41Å
69	L	82.7	Confident	76.4	Confident	30 Å²	30	60.1 Å²	60.1	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-62.3	-39.6	173.7	-72.2	176	0	0	0	111.4	L4 F12 F65 P66 E67 M72 A73	L4-L69 HydrophobicContact CD1-CD2 4.03Å; F12-L69 HydrophobicContact CB-CD2 3.52Å; F12-L69 HydrophobicContact CD2-CD2 3.55Å; F12-L69 HydrophobicContact CG-CD2 3.76Å; F65-L69 HydrophobicContact CD1-CD1 4.18Å; F65-L69 HydrophobicContact CE1-CD1 3.74Å; F65-L69 HydrophobicContact CE1-CG 4.23Å; F65-L69 HydrophobicContact CE2-CD2 4.29Å; F65-L69 HydrophobicContact CE2-CG 4.31Å; F65-L69 HydrophobicContact CZ-CD1 4.01Å; F65-L69 HydrophobicContact CZ-CD2 4.04Å; F65-L69 HydrophobicContact CZ-CG 4.08Å; F65-L69 WeakPolarHBondContact O-CG 3.18Å; F65-L69 PolarHBondContact O-N 3.45Å; P66-L69 PolarHBondContact O-N 3.48Å; E67-L69 PolarHBondContact O-N 3.48Å; L69-M72 PolarHBondContact O-N 3.47Å; L69-A73 WeakPolarHBondContact O-CB 3.4Å; L69-A73 PolarHBondContact O-N 3.01Å
70	T	79.6	Confident	74.7	Confident	90 Å²	90	61.2 Å²	61.2	55%	0.552	32%	0.321	S	S	*	.	H	α-helix	trans	-65	-42.5	176.6	-56.7	0	0	0	0	111	P66 E67 F68 R74	P66-T70 PolarHBondContact O-N 3.47Å; P66-T70 PolarHBondContact O-OG1 2.82Å; E67-T70 WeakPolarHBondContact O-CB 2.95Å; E67-T70 PolarHBondContact O-N 3.09Å; E67-T70 VanDerWaalsContact O-N 3.13Å; F68-T70 VanDerWaalsContact C-N 3.29Å; F68-T70 PolarHBondContact O-N 3.22Å; T70-R74 WeakPolarHBondContact O-CB 3.47Å; T70-R74 PolarHBondContact O-N 3.27Å
71	M	77.6	Confident	73.5	Confident	20 Å²	20	59.8 Å²	59.8	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-51.1	174	-170.2	-173	69.8	0	0	111.7	V55 I63 E67 F68 R74 K75	V55-M71 HydrophobicContact CB-CB 4.35Å; V55-M71 HydrophobicContact CG1-CB 3.78Å; V55-M71 HydrophobicContact CG1-CG 3.93Å; V55-M71 HydrophobicContact CG2-CB 4.39Å; I63-M71 HydrophobicContact CD1-SD 4.28Å; E67-M71 PolarHBondContact O-N 2.92Å; F68-M71 HydrophobicContact CD2-CE 3.64Å; F68-M71 HydrophobicContact CE2-CE 3.67Å; F68-M71 WeakPolarHBondContact O-CB 3.16Å; F68-M71 PolarHBondContact O-N 3.41Å; M71-R74 PolarHBondContact O-N 2.96Å; M71-K75 WeakPolarHBondContact O-CB 3.41Å; M71-K75 PolarHBondContact O-N 2.77Å
72	M	74.3	Confident	72.6	Confident	43 Å²	43	63.2 Å²	63.2	21%	0.212	33%	0.326	C	S	.	.	H	α-helix	trans	-69.2	-39.2	-177	-68.8	-64.1	-76.8	0	0	111.8	F12 F68 L69 R74 K75 M76	F12-M72 HydrophobicContact CD1-CB 3.93Å; F12-M72 HydrophobicContact CD1-CE 3.97Å; F12-M72 HydrophobicContact CD1-CG 4.1Å; F12-M72 HydrophobicContact CE1-CB 3.68Å; F12-M72 HydrophobicContact CE1-CE 3.83Å; F12-M72 HydrophobicContact CE1-CG 4.23Å; F12-M72 HydrophobicContact CZ-CB 4.25Å; F68-M72 HydrophobicContact CD1-CG 3.93Å; F68-M72 HydrophobicContact CD2-CG 4.46Å; F68-M72 HydrophobicContact CE1-CG 3.57Å; F68-M72 HydrophobicContact CE1-SD 4.41Å; F68-M72 HydrophobicContact CE2-CG 4.14Å; F68-M72 HydrophobicContact CE2-SD 4.33Å; F68-M72 HydrophobicContact CG-CG 4.37Å; F68-M72 HydrophobicContact CZ-CE 4.45Å; F68-M72 HydrophobicContact CZ-CG 3.68Å; F68-M72 HydrophobicContact CZ-SD 3.96Å; F68-M72 WeakPolarHBondContact O-CB 3.27Å; F68-M72 VanDerWaalsContact O-CG 3.27Å; F68-M72 WeakPolarHBondContact O-CG 3.42Å; F68-M72 PolarHBondContact O-N 3.41Å; L69-M72 PolarHBondContact O-N 3.47Å; M72-R74 VanDerWaalsContact C-N 3.31Å; M72-R74 PolarHBondContact O-N 3.39Å; M72-K75 PolarHBondContact O-N 2.63Å; M72-M76 WeakPolarHBondContact O-CB 3.31Å; M72-M76 WeakPolarHBondContact O-CG 3.32Å; M72-M76 PolarHBondContact O-N 3.21Å
73	A	69.9	Low	71.7	Confident	42 Å²	42	68.1 Å²	68.1	35%	0.347	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-38.6	174.6	0	0	0	0	0	111.7	L69 K77	L69-A73 WeakPolarHBondContact O-CB 3.4Å; L69-A73 PolarHBondContact O-N 3.01Å; A73-K77 WeakPolarHBondContact O-CB 3.47Å; A73-K77 PolarHBondContact O-N 3.29Å
74	R	66.7	Low	70.9	Confident	154 Å²	154	74.4 Å²	74.4	58%	0.581	38%	0.376	S	S	*	.	H	α-helix	trans	-69	-46.8	175.2	-167.8	175.5	-177.8	-176	-1	111.5	T70 M71 M72 K77 D78	T70-R74 WeakPolarHBondContact O-CB 3.47Å; T70-R74 PolarHBondContact O-N 3.27Å; M71-R74 PolarHBondContact O-N 2.96Å; M72-R74 VanDerWaalsContact C-N 3.31Å; M72-R74 PolarHBondContact O-N 3.39Å; R74-K77 WeakPolarHBondContact O-CB 3.45Å; R74-K77 PolarHBondContact O-N 2.8Å; R74-D78 PolarHBondContact O-N 2.93Å
75	K	62.5	Low	70.3	Confident	109 Å²	109	72.9 Å²	72.9	47%	0.474	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-38.9	177.5	-95.4	-179.6	172.1	-84.1	0	113.7	M71 M72 K77 D78 T79	M71-K75 WeakPolarHBondContact O-CB 3.41Å; M71-K75 PolarHBondContact O-N 2.77Å; M72-K75 PolarHBondContact O-N 2.63Å; K75-K77 VanDerWaalsContact C-N 3.29Å; K75-D78 PolarHBondContact O-N 3.29Å; K75-T79 WeakPolarHBondContact O-CB 3.46Å; K75-T79 PolarHBondContact O-N 2.85Å; K75-T79 PolarHBondContact O-OG1 3.45Å
76	M	55.4	Low	70.1	Confident	77 Å²	77	74.4 Å²	74.4	38%	0.379	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-41.1	172.5	-82.5	-171.4	154.3	0	0	110.7	F12 M72 D78 D80	F12-M76 HydrophobicContact CE1-CE 4.04Å; F12-M76 HydrophobicContact CE1-SD 4.09Å; F12-M76 HydrophobicContact CZ-CE 3.93Å; F12-M76 HydrophobicContact CZ-SD 3.55Å; F12-M76 VanDerWaalsContact CZ-SD 3.55Å; M72-M76 WeakPolarHBondContact O-CB 3.31Å; M72-M76 WeakPolarHBondContact O-CG 3.32Å; M72-M76 PolarHBondContact O-N 3.21Å; M76-D78 VanDerWaalsContact C-N 3.3Å; M76-D78 PolarHBondContact O-N 3.39Å; M76-D80 WeakPolarHBondContact O-CB 3.38Å; M76-D80 PolarHBondContact O-N 3.25Å
77	K	56.1	Low	70	Confident	156 Å²	156	76.9 Å²	76.9	68%	0.678	38%	0.377	S	S	*	.	H	α-helix	trans	-64.9	-32.9	176.5	-151.2	179.3	-177.1	-172.1	0	113.3	A73 R74 K75 S81	A73-K77 WeakPolarHBondContact O-CB 3.47Å; A73-K77 PolarHBondContact O-N 3.29Å; R74-K77 WeakPolarHBondContact O-CB 3.45Å; R74-K77 PolarHBondContact O-N 2.8Å; K75-K77 VanDerWaalsContact C-N 3.29Å; K77-S81 VanDerWaalsContact O-CB 3.32Å; K77-S81 WeakPolarHBondContact O-CB 3.2Å; K77-S81 PolarHBondContact O-OG 2.73Å
78	D	53.5	Low	69.8	Low	97 Å²	97	77.5 Å²	77.5	52%	0.519	39%	0.385	S	S	.	.	H	α-helix	trans	-90.5	-36.3	-178.2	-67.8	-26.6	0	0	0	113.4	R74 K75 M76 E82	R74-D78 PolarHBondContact O-N 2.93Å; K75-D78 PolarHBondContact O-N 3.29Å; M76-D78 VanDerWaalsContact C-N 3.3Å; M76-D78 PolarHBondContact O-N 3.39Å; D78-E82 PolarHBondContact O-N 3.41Å
79	T	47.1	Very low	69.8	Low	76 Å²	76	78.1 Å²	78.1	47%	0.466	39%	0.387	S	S	.	.	H	α-helix	trans	-92.6	-40.6	-169.7	-36.6	0	0	0	0	112.8	K75 S81 E83	K75-T79 WeakPolarHBondContact O-CB 3.46Å; K75-T79 PolarHBondContact O-N 2.85Å; K75-T79 PolarHBondContact O-OG1 3.45Å; T79-S81 VanDerWaalsContact C-N 3.33Å; T79-E83 PolarHBondContact O-N 2.99Å
80	D	52.2	Low	70	Confident	84 Å²	84	84.6 Å²	84.6	45%	0.449	41%	0.41	S	S	.	.	H	α-helix	trans	-68	-39.6	175.6	-64.8	-45	0	0	0	109.5	M76 E84	M76-D80 WeakPolarHBondContact O-CB 3.38Å; M76-D80 PolarHBondContact O-N 3.25Å; D80-E84 WeakPolarHBondContact O-CB 3.37Å; D80-E84 WeakPolarHBondContact O-CG 3.21Å; D80-E84 PolarHBondContact O-N 2.96Å
81	S	62.1	Low	70.4	Confident	43 Å²	43	83.8 Å²	83.8	30%	0.301	40%	0.404	S	S	.	.	H	α-helix	trans	-63.2	-45.4	177.6	-52.5	0	0	0	0	113.3	K77 T79 I85	K77-S81 VanDerWaalsContact O-CB 3.32Å; K77-S81 WeakPolarHBondContact O-CB 3.2Å; K77-S81 PolarHBondContact O-OG 2.73Å; T79-S81 VanDerWaalsContact C-N 3.33Å; S81-I85 WeakPolarHBondContact O-CB 3.47Å; S81-I85 WeakPolarHBondContact O-CD1 3.37Å; S81-I85 WeakPolarHBondContact O-CG1 3.34Å; S81-I85 PolarHBondContact O-N 3.31Å
82	E	68.3	Low	70.8	Confident	99 Å²	99	83.9 Å²	83.9	46%	0.463	40%	0.404	S	S	.	.	H	α-helix	trans	-70.2	-43.4	-173.7	-166.9	-172.7	127.1	0	0	112.7	D78 R86	D78-E82 PolarHBondContact O-N 3.41Å; E82-R86 WeakPolarHBondContact O-CB 3.39Å; E82-R86 PolarHBondContact O-N 3.23Å; E82-R86 IonicContact OE1-CZ 3.94Å; E82-R86 IonicContact OE1-NH1 3.46Å; E82-R86 PolarHBondContact OE1-NH1 3.3Å; E82-R86 IonicContact OE1-NH2 2.98Å; E82-R86 PolarHBondContact OE1-NH2 3.4Å
83	E	70.6	Confident	71.5	Confident	129 Å²	129	82.6 Å²	82.6	60%	0.603	40%	0.398	S	S	*	.	H	α-helix	trans	-69.3	-42.6	176.3	-73.7	-137.9	124.7	0	0	111.5	T79 I85 R86 E87	T79-E83 PolarHBondContact O-N 2.99Å; E83-I85 PolarHBondContact O-N 3.24Å; E83-R86 PolarHBondContact O-N 3.39Å; E83-E87 WeakPolarHBondContact O-CG 3.31Å; E83-E87 PolarHBondContact O-N 3.34Å
84	E	72.6	Confident	72.3	Confident	133 Å²	133	86 Å²	86	62%	0.621	41%	0.405	S	S	*	.	H	α-helix	trans	-63.2	-41.5	174.9	-73.6	-172.7	124.6	0	0	111.9	D80 R86 E87 A88	D80-E84 WeakPolarHBondContact O-CB 3.37Å; D80-E84 WeakPolarHBondContact O-CG 3.21Å; D80-E84 PolarHBondContact O-N 2.96Å; E84-R86 VanDerWaalsContact C-N 3.31Å; E84-R86 PolarHBondContact O-N 3.25Å; E84-E87 PolarHBondContact O-N 3.03Å; E84-A88 VanDerWaalsContact O-CB 3.27Å; E84-A88 WeakPolarHBondContact O-CB 3.47Å; E84-A88 PolarHBondContact O-N 3.11Å
85	I	79.6	Confident	73.3	Confident	12 Å²	12	83.8 Å²	83.8	6%	0.062	41%	0.405	C	S	.	.	H	α-helix	trans	-65.6	-37.2	176.4	-69.7	164.4	0	0	0	110.3	S81 E83 A88 F89 F141 V142 M145 T146	S81-I85 WeakPolarHBondContact O-CB 3.47Å; S81-I85 WeakPolarHBondContact O-CD1 3.37Å; S81-I85 WeakPolarHBondContact O-CG1 3.34Å; S81-I85 PolarHBondContact O-N 3.31Å; E83-I85 PolarHBondContact O-N 3.24Å; I85-A88 PolarHBondContact O-N 2.86Å; I85-F89 VanDerWaalsContact O-CB 3.32Å; I85-F89 WeakPolarHBondContact O-CB 3.34Å; I85-F89 PolarHBondContact O-N 3.17Å; I85-F141 HydrophobicContact CG2-CD1 3.82Å; I85-F141 HydrophobicContact CG2-CE1 4Å; I85-V142 HydrophobicContact CG2-CB 4.4Å; I85-V142 HydrophobicContact CG2-CG2 3.63Å; I85-M145 HydrophobicContact CD1-CB 4.03Å; I85-M145 HydrophobicContact CG1-CB 4.06Å; I85-T146 HydrophobicContact CD1-CG2 3.93Å
86	R	82.6	Confident	74.5	Confident	78 Å²	78	81.5 Å²	81.5	29%	0.294	41%	0.412	S	S	.	.	H	α-helix	trans	-68.4	-40.3	176.2	-175.7	177.8	-69.4	133.8	4	112.3	E82 E83 E84 F89 R90 Y138	E82-R86 WeakPolarHBondContact O-CB 3.39Å; E82-R86 PolarHBondContact O-N 3.23Å; E82-R86 IonicContact OE1-CZ 3.94Å; E82-R86 IonicContact OE1-NH1 3.46Å; E82-R86 PolarHBondContact OE1-NH1 3.3Å; E82-R86 IonicContact OE1-NH2 2.98Å; E82-R86 PolarHBondContact OE1-NH2 3.4Å; E83-R86 PolarHBondContact O-N 3.39Å; E84-R86 VanDerWaalsContact C-N 3.31Å; E84-R86 PolarHBondContact O-N 3.25Å; R86-F89 PolarHBondContact O-N 2.67Å; R86-R90 WeakPolarHBondContact O-CG 3.14Å; R86-R90 PolarHBondContact O-N 3.39Å; R86-R90 VanDerWaalsContact O-N 3.12Å; R86-Y138 HydrophobicContact CB-CE2 4.19Å; R86-Y138 HydrophobicContact CG-CE2 4.47Å; R86-Y138 PolarHBondContact NH2-OH 3.17Å
87	E	83.6	Confident	76.2	Confident	130 Å²	130	81.1 Å²	81.1	61%	0.607	41%	0.412	S	S	*	.	H	α-helix	trans	-66.2	-43.2	173.3	-71.3	-159.6	152.7	0	0	111.3	E83 E84 F89 R90 V91	E83-E87 WeakPolarHBondContact O-CG 3.31Å; E83-E87 PolarHBondContact O-N 3.34Å; E84-E87 PolarHBondContact O-N 3.03Å; E87-F89 VanDerWaalsContact C-N 3.35Å; E87-F89 PolarHBondContact O-N 3.45Å; E87-R90 PolarHBondContact O-N 2.96Å; E87-V91 WeakPolarHBondContact O-CG2 3.15Å; E87-V91 PolarHBondContact O-N 3.33Å; E87-V91 VanDerWaalsContact O-N 3.09Å
88	A	82.8	Confident	77.8	Confident	25 Å²	25	75.1 Å²	75.1	21%	0.207	39%	0.394	C	S	.	.	H	α-helix	trans	-58.2	-47.4	173.8	0	0	0	0	0	110.9	E84 I85 R90 V91 F92 F141	E84-A88 VanDerWaalsContact O-CB 3.27Å; E84-A88 WeakPolarHBondContact O-CB 3.47Å; E84-A88 PolarHBondContact O-N 3.11Å; I85-A88 PolarHBondContact O-N 2.86Å; A88-R90 VanDerWaalsContact C-N 3.3Å; A88-R90 PolarHBondContact O-N 3.15Å; A88-V91 WeakPolarHBondContact O-CA 3.43Å; A88-V91 WeakPolarHBondContact O-CB 3.37Å; A88-V91 PolarHBondContact O-N 2.75Å; A88-F92 WeakPolarHBondContact O-CD2 3.31Å; A88-F92 PolarHBondContact O-N 2.88Å; A88-F141 HydrophobicContact CB-CE1 4.12Å; A88-F141 HydrophobicContact CB-CZ 4.26Å
89	F	86.7	Confident	79.6	Confident	13 Å²	13	75 Å²	75	6%	0.057	39%	0.387	C	S	.	.	H	α-helix	trans	-55.6	-44.7	177.4	-171.3	-93.1	0	0	0	111.8	I85 R86 E87 V91 F92 D93 G98 I100 Y138 F141	I85-F89 VanDerWaalsContact O-CB 3.32Å; I85-F89 WeakPolarHBondContact O-CB 3.34Å; I85-F89 PolarHBondContact O-N 3.17Å; R86-F89 PolarHBondContact O-N 2.67Å; E87-F89 VanDerWaalsContact C-N 3.35Å; E87-F89 PolarHBondContact O-N 3.45Å; F89-V91 PolarHBondContact O-N 3.19Å; F89-F92 PolarHBondContact O-N 2.81Å; F89-F92 VanDerWaalsContact O-N 3.1Å; F89-D93 HydrophobicContact CD1-CB 4.24Å; F89-D93 HydrophobicContact CE1-CB 3.9Å; F89-D93 HydrophobicContact CZ-CB 4.47Å; F89-D93 PolarHBondContact O-N 2.89Å; F89-G98 WeakPolarHBondContact CZ-O 3.27Å; F89-I100 HydrophobicContact CD2-CD1 3.52Å; F89-I100 HydrophobicContact CD2-CG1 4.15Å; F89-I100 HydrophobicContact CE2-CD1 3.44Å; F89-I100 VanDerWaalsContact CE2-CD1 3.44Å; F89-I100 HydrophobicContact CE2-CG1 3.68Å; F89-I100 HydrophobicContact CG-CD1 4.39Å; F89-I100 HydrophobicContact CZ-CD1 4.25Å; F89-I100 HydrophobicContact CZ-CG1 4Å; F89-Y138 HydrophobicContact CB-CD2 4.17Å; F89-Y138 HydrophobicContact CB-CE2 4.49Å; F89-Y138 HydrophobicContact CD1-CD2 4.21Å; F89-Y138 HydrophobicContact CD2-CD2 4.11Å; F89-Y138 AromaticContact CG-CD2 3.88Å; F89-Y138 HydrophobicContact CG-CD2 3.88Å; F89-F141 HydrophobicContact CB-CD1 4.04Å; F89-F141 HydrophobicContact CB-CE1 4.13Å; F89-F141 HydrophobicContact CD2-CB 3.61Å; F89-F141 AromaticContact CD2-CD1 3.69Å; F89-F141 HydrophobicContact CD2-CD1 3.69Å; F89-F141 HydrophobicContact CD2-CD2 4.27Å; F89-F141 HydrophobicContact CD2-CE1 4.41Å; F89-F141 AromaticContact CD2-CG 3.6Å; F89-F141 HydrophobicContact CD2-CG 3.6Å; F89-F141 HydrophobicContact CE2-CB 3.84Å; F89-F141 HydrophobicContact CE2-CG 4.24Å; F89-F141 HydrophobicContact CG-CD1 4.38Å
90	R	86.8	Confident	81.7	Confident	167 Å²	167	71.5 Å²	71.5	63%	0.63	37%	0.365	S	S	*	.	H	α-helix	trans	-65.5	-23.9	175.4	-72	175.3	178.6	167.8	2.6	114.1	R86 E87 A88	R86-R90 WeakPolarHBondContact O-CG 3.14Å; R86-R90 PolarHBondContact O-N 3.39Å; R86-R90 VanDerWaalsContact O-N 3.12Å; E87-R90 PolarHBondContact O-N 2.96Å; A88-R90 VanDerWaalsContact C-N 3.3Å; A88-R90 PolarHBondContact O-N 3.15Å
91	V	86.5	Confident	83.6	Confident	73 Å²	73	68.9 Å²	68.9	44%	0.442	35%	0.353	S	S	.	.	H	α-helix	trans	-71.6	-38.3	173.7	173.3	0	0	0	0	110	E87 A88 F89 K94 V108	E87-V91 WeakPolarHBondContact O-CG2 3.15Å; E87-V91 PolarHBondContact O-N 3.33Å; E87-V91 VanDerWaalsContact O-N 3.09Å; A88-V91 WeakPolarHBondContact O-CA 3.43Å; A88-V91 WeakPolarHBondContact O-CB 3.37Å; A88-V91 PolarHBondContact O-N 2.75Å; F89-V91 PolarHBondContact O-N 3.19Å; V91-K94 WeakPolarHBondContact O-CE 3.2Å; V91-K94 PolarHBondContact O-NZ 2.97Å; V91-V108 HydrophobicContact CG1-CG1 4Å; V91-V108 WeakPolarHBondContact O-CG2 3.13Å
92	F	86.6	Confident	84.9	Confident	22 Å²	22	68.1 Å²	68.1	10%	0.096	35%	0.35	C	S	.	.	H	α-helix	trans	-74.5	-54.8	177.2	-70.4	-77.5	0	0	0	112.9	A88 F89 K94 I100 E104 L105 V108 M109 F141	A88-F92 WeakPolarHBondContact O-CD2 3.31Å; A88-F92 PolarHBondContact O-N 2.88Å; F89-F92 PolarHBondContact O-N 2.81Å; F89-F92 VanDerWaalsContact O-N 3.1Å; F92-K94 PolarHBondContact O-N 3.44Å; F92-I100 HydrophobicContact CB-CD1 3.45Å; F92-I100 VanDerWaalsContact CB-CD1 3.45Å; F92-I100 HydrophobicContact CB-CG1 3.7Å; F92-I100 HydrophobicContact CB-CG2 4.01Å; F92-I100 HydrophobicContact CG-CD1 4.16Å; F92-E104 WeakPolarHBondContact O-CB 3.37Å; F92-L105 HydrophobicContact CD1-CD1 3.71Å; F92-L105 HydrophobicContact CE1-CD1 3.65Å; F92-V108 HydrophobicContact CD1-CB 3.63Å; F92-V108 HydrophobicContact CD1-CG1 3.61Å; F92-V108 HydrophobicContact CD1-CG2 4.07Å; F92-V108 HydrophobicContact CE1-CB 3.73Å; F92-V108 HydrophobicContact CE1-CG1 3.36Å; F92-V108 HydrophobicContact CG-CG1 4.33Å; F92-V108 HydrophobicContact CZ-CG1 3.89Å; F92-M109 HydrophobicContact CE1-CE 4.01Å; F92-M109 HydrophobicContact CZ-CE 4.12Å; F92-F141 AromaticContact CD2-CE2 3.77Å; F92-F141 HydrophobicContact CD2-CE2 3.77Å; F92-F141 AromaticContact CD2-CZ 3.63Å; F92-F141 HydrophobicContact CD2-CZ 3.63Å; F92-F141 HydrophobicContact CE2-CE2 4.02Å; F92-F141 AromaticContact CE2-CZ 3.76Å; F92-F141 HydrophobicContact CE2-CZ 3.76Å; F92-F141 HydrophobicContact CG-CE2 4.42Å
93	D	90	Very high	85.9	Confident	16 Å²	16	66 Å²	66	9%	0.086	35%	0.349	C	S	.	.			trans	-70.8	94.4	176.8	177.2	9.8	0	0	0	110.4	F89 D95 G96 N97 G98 I100	F89-D93 HydrophobicContact CD1-CB 4.24Å; F89-D93 HydrophobicContact CE1-CB 3.9Å; F89-D93 HydrophobicContact CZ-CB 4.47Å; F89-D93 PolarHBondContact O-N 2.89Å; D93-D95 VanDerWaalsContact OD1-OD1 3.07Å; D93-G96 VanDerWaalsContact OD1-CA 3.23Å; D93-G96 WeakPolarHBondContact OD1-CA 3.46Å; D93-G96 PolarHBondContact OD1-N 3.05Å; D93-G96 WeakPolarHBondContact OD2-CA 3.31Å; D93-N97 PolarHBondContact OD1-N 2.82Å; D93-N97 PolarHBondContact OD2-N 2.99Å; D93-G98 WeakPolarHBondContact OD2-CA 3.38Å; D93-G98 PolarHBondContact OD2-N 3.01Å; D93-I100 HydrophobicContact CB-CG1 4.32Å
94	K	85.2	Confident	86.8	Confident	114 Å²	114	60.7 Å²	60.7	50%	0.496	32%	0.324	S	S	.	.	S	Bend	trans	-82.8	-32.4	-173.4	-75.5	-57.2	-170.6	-147	0	112.3	V91 F92 E104	V91-K94 WeakPolarHBondContact O-CE 3.2Å; V91-K94 PolarHBondContact O-NZ 2.97Å; F92-K94 PolarHBondContact O-N 3.44Å; K94-E104 HydrophobicContact CB-CG 4.36Å; K94-E104 PolarHBondContact N-OE1 3.38Å
95	D	88.7	Confident	87.5	Confident	107 Å²	107	54.9 Å²	54.9	57%	0.572	30%	0.297	S	S	*	.	S	Bend	trans	-87.5	-12.7	-179.8	73.3	9	0	0	0	112.9	D93 N97 E104	D93-D95 VanDerWaalsContact OD1-OD1 3.07Å; D95-N97 VanDerWaalsContact C-N 3.33Å; D95-N97 WeakPolarHBondContact OD1-CB 3.2Å; D95-N97 PolarHBondContact OD1-N 2.79Å; D95-N97 PolarHBondContact OD1-ND2 3.29Å; D95-N97 PolarHBondContact OD2-ND2 3.08Å; D95-E104 PolarHBondContact N-OE1 3.22Å
96	G	87.9	Confident	87.8	Confident	60 Å²	60	59.1 Å²	59.1	62%	0.619	31%	0.313	S	S	*	.			trans	75	23.5	176.4	0	0	0	0	0	112.7	D93 G98	D93-G96 VanDerWaalsContact OD1-CA 3.23Å; D93-G96 WeakPolarHBondContact OD1-CA 3.46Å; D93-G96 PolarHBondContact OD1-N 3.05Å; D93-G96 WeakPolarHBondContact OD2-CA 3.31Å; G96-G98 VanDerWaalsContact C-N 3.26Å; G96-G98 PolarHBondContact O-N 2.83Å
97	N	89.9	Confident	88	Confident	70 Å²	70	60 Å²	60	37%	0.374	32%	0.32	S	S	.	.	S	Bend	trans	-79.6	-8.3	-177.4	73.4	25.8	0	0	0	112.8	D93 D95 Y99	D93-N97 PolarHBondContact OD1-N 2.82Å; D93-N97 PolarHBondContact OD2-N 2.99Å; D95-N97 VanDerWaalsContact C-N 3.33Å; D95-N97 WeakPolarHBondContact OD1-CB 3.2Å; D95-N97 PolarHBondContact OD1-N 2.79Å; D95-N97 PolarHBondContact OD1-ND2 3.29Å; D95-N97 PolarHBondContact OD2-ND2 3.08Å; N97-Y99 WeakPolarHBondContact O-CD2 3.4Å; N97-Y99 WeakPolarHBondContact OD1-CA 3.4Å; N97-Y99 VanDerWaalsContact OD1-CB 3.3Å; N97-Y99 WeakPolarHBondContact OD1-CB 3.43Å; N97-Y99 PolarHBondContact OD1-N 2.91Å; N97-Y99 PolarHBondContact OD1-O 2.73Å
98	G	89.5	Confident	88.2	Confident	30 Å²	30	54 Å²	54	31%	0.309	29%	0.292	S	S	.	.	S	Bend	trans	90.4	7.1	-178.5	0	0	0	0	0	115	F89 D93 G96	F89-G98 WeakPolarHBondContact CZ-O 3.27Å; D93-G98 WeakPolarHBondContact OD2-CA 3.38Å; D93-G98 PolarHBondContact OD2-N 3.01Å; G96-G98 VanDerWaalsContact C-N 3.26Å; G96-G98 PolarHBondContact O-N 2.83Å
99	Y	92.6	Very high	88.2	Confident	93 Å²	93	54 Å²	54	37%	0.365	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	134.4	-177.7	-60.5	-96.5	0	0	0	110.3	N97 D133 Q135 V136 N137	N97-Y99 WeakPolarHBondContact O-CD2 3.4Å; N97-Y99 WeakPolarHBondContact OD1-CA 3.4Å; N97-Y99 VanDerWaalsContact OD1-CB 3.3Å; N97-Y99 WeakPolarHBondContact OD1-CB 3.43Å; N97-Y99 PolarHBondContact OD1-N 2.91Å; N97-Y99 PolarHBondContact OD1-O 2.73Å; Y99-D133 WeakPolarHBondContact CE1-OD2 3.18Å; Y99-Q135 HydrophobicContact CD1-CB 4.28Å; Y99-V136 WeakPolarHBondContact CA-O 3.4Å; Y99-N137 HydrophobicContact CD1-CB 3.87Å; Y99-N137 HydrophobicContact CE1-CB 3.86Å
100	I	91.1	Very high	88	Confident	3 Å²	3	56.6 Å²	56.6	2%	0.015	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.1	174.2	-58.3	164.2	0	0	0	108.3	F89 F92 D93 E104 L105 V136 F141	F89-I100 HydrophobicContact CD2-CD1 3.52Å; F89-I100 HydrophobicContact CD2-CG1 4.15Å; F89-I100 HydrophobicContact CE2-CD1 3.44Å; F89-I100 VanDerWaalsContact CE2-CD1 3.44Å; F89-I100 HydrophobicContact CE2-CG1 3.68Å; F89-I100 HydrophobicContact CG-CD1 4.39Å; F89-I100 HydrophobicContact CZ-CD1 4.25Å; F89-I100 HydrophobicContact CZ-CG1 4Å; F92-I100 HydrophobicContact CB-CD1 3.45Å; F92-I100 VanDerWaalsContact CB-CD1 3.45Å; F92-I100 HydrophobicContact CB-CG1 3.7Å; F92-I100 HydrophobicContact CB-CG2 4.01Å; F92-I100 HydrophobicContact CG-CD1 4.16Å; D93-I100 HydrophobicContact CB-CG1 4.32Å; I100-E104 HydrophobicContact CG2-CB 4.35Å; I100-L105 HydrophobicContact CG2-CB 4.06Å; I100-V136 HydrophobicContact CB-CB 4.33Å; I100-V136 PolarHBondContact N-O 2.82Å; I100-V136 PolarHBondContact O-N 2.68Å; I100-F141 HydrophobicContact CD1-CD2 3.48Å; I100-F141 VanDerWaalsContact CD1-CD2 3.48Å; I100-F141 HydrophobicContact CD1-CE2 3.81Å; I100-F141 HydrophobicContact CD1-CG 4.07Å
101	S	91.6	Very high	87.6	Confident	29 Å²	29	53.7 Å²	53.7	20%	0.203	30%	0.302	C	S	.	.			trans	-79.1	157.2	171.4	66	0	0	0	0	112.1	A103 E104 L105	S101-A103 PolarHBondContact O-N 2.86Å; S101-A103 VanDerWaalsContact O-N 3.15Å; S101-E104 WeakPolarHBondContact CB-OE2 3.35Å; S101-E104 PolarHBondContact N-OE2 3.45Å; S101-E104 WeakPolarHBondContact O-CB 3.21Å; S101-E104 PolarHBondContact O-N 3.33Å; S101-E104 WeakPolarHBondContact OG-CG 3.44Å; S101-E104 PolarHBondContact OG-N 2.84Å; S101-E104 PolarHBondContact OG-OE2 2.83Å; S101-L105 PolarHBondContact O-N 3.13Å
102	A	89.3	Confident	87.1	Confident	27 Å²	27	56 Å²	56	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-52.6	-36.8	172.6	0	0	0	0	0	112.7	R106 V121 I125	A102-R106 WeakPolarHBondContact O-CB 3.31Å; A102-R106 PolarHBondContact O-N 3.46Å; A102-V121 HydrophobicContact CB-CG1 4Å; A102-V121 WeakPolarHBondContact O-CG1 3.36Å; A102-I125 HydrophobicContact CB-CG1 4.08Å
103	A	88.9	Confident	86.7	Confident	54 Å²	54	58 Å²	58	45%	0.446	34%	0.338	S	S	.	.	H	α-helix	trans	-65.9	-39.1	178.3	0	0	0	0	0	112.6	S101 H107	S101-A103 PolarHBondContact O-N 2.86Å; S101-A103 VanDerWaalsContact O-N 3.15Å; A103-H107 WeakPolarHBondContact O-CB 3.42Å; A103-H107 PolarHBondContact O-N 3.06Å; A103-H107 VanDerWaalsContact O-N 3.07Å
104	E	90.1	Very high	86.1	Confident	18 Å²	18	62.8 Å²	62.8	8%	0.084	36%	0.36	C	S	.	.	H	α-helix	trans	-71.6	-45	177.5	-76.4	167.4	129.5	0	0	111.9	F92 K94 D95 I100 S101 R106 H107 V108	F92-E104 WeakPolarHBondContact O-CB 3.37Å; K94-E104 HydrophobicContact CB-CG 4.36Å; K94-E104 PolarHBondContact N-OE1 3.38Å; D95-E104 PolarHBondContact N-OE1 3.22Å; I100-E104 HydrophobicContact CG2-CB 4.35Å; S101-E104 WeakPolarHBondContact CB-OE2 3.35Å; S101-E104 PolarHBondContact N-OE2 3.45Å; S101-E104 WeakPolarHBondContact O-CB 3.21Å; S101-E104 PolarHBondContact O-N 3.33Å; S101-E104 WeakPolarHBondContact OG-CG 3.44Å; S101-E104 PolarHBondContact OG-N 2.84Å; S101-E104 PolarHBondContact OG-OE2 2.83Å; E104-R106 VanDerWaalsContact C-N 3.32Å; E104-R106 PolarHBondContact O-N 3.45Å; E104-H107 PolarHBondContact O-N 3.29Å; E104-H107 VanDerWaalsContact O-N 3.13Å; E104-V108 WeakPolarHBondContact O-CG2 3.35Å; E104-V108 PolarHBondContact O-N 2.94Å
105	L	87.7	Confident	85.9	Confident	11 Å²	11	66.2 Å²	66.2	6%	0.058	38%	0.375	C	S	.	.	H	α-helix	trans	-55	-49.8	174.8	-172.9	62.9	0	0	0	110.6	F92 I100 S101 H107 V108 M109 V121 M124 I125	F92-L105 HydrophobicContact CD1-CD1 3.71Å; F92-L105 HydrophobicContact CE1-CD1 3.65Å; I100-L105 HydrophobicContact CG2-CB 4.06Å; S101-L105 PolarHBondContact O-N 3.13Å; L105-H107 VanDerWaalsContact C-N 3.35Å; L105-H107 PolarHBondContact O-N 3.45Å; L105-V108 PolarHBondContact O-N 3.07Å; L105-M109 HydrophobicContact CD1-CE 4.03Å; L105-M109 HydrophobicContact CD1-CG 4.5Å; L105-M109 WeakPolarHBondContact O-CB 3.4Å; L105-M109 VanDerWaalsContact O-CG 3.26Å; L105-M109 WeakPolarHBondContact O-CG 3.48Å; L105-M109 PolarHBondContact O-N 3.46Å; L105-V121 HydrophobicContact CB-CG1 4.4Å; L105-V121 HydrophobicContact CD2-CG1 4.23Å; L105-M124 HydrophobicContact CD2-CB 4.03Å; L105-I125 HydrophobicContact CD2-CD1 3.8Å; L105-I125 HydrophobicContact CD2-CG1 4.03Å
106	R	86.3	Confident	85.5	Confident	102 Å²	102	62.9 Å²	62.9	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-59.6	-43.9	176.6	-170.4	-176.9	67.8	-139.4	-9.7	112.5	A102 E104 V108 M109 T110 D118 V121	A102-R106 WeakPolarHBondContact O-CB 3.31Å; A102-R106 PolarHBondContact O-N 3.46Å; E104-R106 VanDerWaalsContact C-N 3.32Å; E104-R106 PolarHBondContact O-N 3.45Å; R106-V108 VanDerWaalsContact C-N 3.33Å; R106-V108 PolarHBondContact O-N 3.29Å; R106-M109 PolarHBondContact O-N 2.81Å; R106-T110 WeakPolarHBondContact O-CB 3.41Å; R106-T110 PolarHBondContact O-N 2.99Å; R106-T110 PolarHBondContact O-OG1 2.92Å; R106-D118 IonicContact CZ-OD1 2.66Å; R106-D118 IonicContact NH1-OD1 3.47Å; R106-D118 PolarHBondContact NH1-OD1 3.08Å; R106-V121 HydrophobicContact CB-CG1 4.38Å; R106-V121 HydrophobicContact CB-CG2 4Å; R106-V121 HydrophobicContact CG-CG2 4.19Å
107	H	86.7	Confident	85.5	Confident	95 Å²	95	63 Å²	63	44%	0.44	35%	0.345	S	S	.	.	H	α-helix	trans	-62	-44.1	-178.6	-176.6	69.9	0	0	0	111.3	A103 E104 L105 N111	A103-H107 WeakPolarHBondContact O-CB 3.42Å; A103-H107 PolarHBondContact O-N 3.06Å; A103-H107 VanDerWaalsContact O-N 3.07Å; E104-H107 PolarHBondContact O-N 3.29Å; E104-H107 VanDerWaalsContact O-N 3.13Å; L105-H107 VanDerWaalsContact C-N 3.35Å; L105-H107 PolarHBondContact O-N 3.45Å; H107-N111 PolarHBondContact CD2-ND2 3.23Å; H107-N111 PolarHBondContact NE2-ND2 3.08Å; H107-N111 VanDerWaalsContact O-CG 3.27Å; H107-N111 PolarHBondContact O-N 3.45Å; H107-N111 VanDerWaalsContact O-N 3.12Å; H107-N111 PolarHBondContact O-ND2 2.96Å
108	V	86.2	Confident	85.2	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.024	35%	0.352	C	S	.	.	H	α-helix	trans	-69	-45	178.7	175.1	0	0	0	0	111.9	V91 F92 E104 L105 R106 T110 N111 L112	V91-V108 HydrophobicContact CG1-CG1 4Å; V91-V108 WeakPolarHBondContact O-CG2 3.13Å; F92-V108 HydrophobicContact CD1-CB 3.63Å; F92-V108 HydrophobicContact CD1-CG1 3.61Å; F92-V108 HydrophobicContact CD1-CG2 4.07Å; F92-V108 HydrophobicContact CE1-CB 3.73Å; F92-V108 HydrophobicContact CE1-CG1 3.36Å; F92-V108 HydrophobicContact CG-CG1 4.33Å; F92-V108 HydrophobicContact CZ-CG1 3.89Å; E104-V108 WeakPolarHBondContact O-CG2 3.35Å; E104-V108 PolarHBondContact O-N 2.94Å; L105-V108 PolarHBondContact O-N 3.07Å; R106-V108 VanDerWaalsContact C-N 3.33Å; R106-V108 PolarHBondContact O-N 3.29Å; V108-T110 VanDerWaalsContact C-N 3.29Å; V108-T110 PolarHBondContact O-N 3.08Å; V108-N111 WeakPolarHBondContact O-CB 3.1Å; V108-N111 PolarHBondContact O-N 3.11Å; V108-L112 HydrophobicContact CG1-CD1 3.88Å; V108-L112 HydrophobicContact CG1-CG 4.37Å; V108-L112 WeakPolarHBondContact O-CG 3.35Å; V108-L112 PolarHBondContact O-N 3.45Å
109	M	82.9	Confident	85.1	Confident	27 Å²	27	69.7 Å²	69.7	13%	0.133	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-41.9	177.3	-68.4	-62.6	-173.7	0	0	111.8	F92 L105 R106 N111 L112 G113 E114 L116 M124	F92-M109 HydrophobicContact CE1-CE 4.01Å; F92-M109 HydrophobicContact CZ-CE 4.12Å; L105-M109 HydrophobicContact CD1-CE 4.03Å; L105-M109 HydrophobicContact CD1-CG 4.5Å; L105-M109 WeakPolarHBondContact O-CB 3.4Å; L105-M109 VanDerWaalsContact O-CG 3.26Å; L105-M109 WeakPolarHBondContact O-CG 3.48Å; L105-M109 PolarHBondContact O-N 3.46Å; R106-M109 PolarHBondContact O-N 2.81Å; M109-N111 VanDerWaalsContact C-N 3.32Å; M109-N111 PolarHBondContact O-N 3.27Å; M109-L112 PolarHBondContact O-N 3.44Å; M109-L112 VanDerWaalsContact O-N 3.14Å; M109-L112 HydrophobicContact SD-CD1 4.41Å; M109-G113 PolarHBondContact O-N 3.03Å; M109-E114 CarbonylContact C-O 3.56Å; M109-E114 PolarHBondContact O-N 3.33Å; M109-L116 HydrophobicContact CB-CD1 3.8Å; M109-L116 HydrophobicContact CB-CG 4.31Å; M109-L116 HydrophobicContact CG-CD1 3.62Å; M109-L116 HydrophobicContact SD-CD1 4.42Å; M109-M124 HydrophobicContact CE-CE 3.96Å
110	T	83	Confident	84.8	Confident	67 Å²	67	69.4 Å²	69.4	41%	0.411	37%	0.372	S	S	.	.	H	α-helix	trans	-61.1	-39.9	174.9	-56.1	0	0	0	0	112.1	R106 V108 L112 G113 E114	R106-T110 WeakPolarHBondContact O-CB 3.41Å; R106-T110 PolarHBondContact O-N 2.99Å; R106-T110 PolarHBondContact O-OG1 2.92Å; V108-T110 VanDerWaalsContact C-N 3.29Å; V108-T110 PolarHBondContact O-N 3.08Å; T110-L112 VanDerWaalsContact C-N 3.34Å; T110-G113 PolarHBondContact O-N 2.74Å; T110-E114 VanDerWaalsContact CA-O 3.29Å; T110-E114 WeakPolarHBondContact CA-O 3.47Å; T110-E114 PolarHBondContact N-O 3.05Å
111	N	78.3	Confident	84.6	Confident	106 Å²	106	69.4 Å²	69.4	57%	0.567	37%	0.372	S	S	*	.	H	α-helix	trans	-71.4	-28.3	177.5	-71.8	-28.3	0	0	0	112.9	H107 V108 M109 G113	H107-N111 PolarHBondContact CD2-ND2 3.23Å; H107-N111 PolarHBondContact NE2-ND2 3.08Å; H107-N111 VanDerWaalsContact O-CG 3.27Å; H107-N111 PolarHBondContact O-N 3.45Å; H107-N111 VanDerWaalsContact O-N 3.12Å; H107-N111 PolarHBondContact O-ND2 2.96Å; V108-N111 WeakPolarHBondContact O-CB 3.1Å; V108-N111 PolarHBondContact O-N 3.11Å; M109-N111 VanDerWaalsContact C-N 3.32Å; M109-N111 PolarHBondContact O-N 3.27Å; N111-G113 PolarHBondContact O-N 2.93Å
112	L	76.8	Confident	84.3	Confident	120 Å²	120	72 Å²	72	63%	0.628	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.4	172.8	-70.2	169.5	0	0	0	112.8	V108 M109 T110	V108-L112 HydrophobicContact CG1-CD1 3.88Å; V108-L112 HydrophobicContact CG1-CG 4.37Å; V108-L112 WeakPolarHBondContact O-CG 3.35Å; V108-L112 PolarHBondContact O-N 3.45Å; M109-L112 PolarHBondContact O-N 3.44Å; M109-L112 VanDerWaalsContact O-N 3.14Å; M109-L112 HydrophobicContact SD-CD1 4.41Å; T110-L112 VanDerWaalsContact C-N 3.34Å
113	G	77.9	Confident	84.3	Confident	64 Å²	64	76 Å²	76	66%	0.66	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.5	0.4	177.8	0	0	0	0	0	114.1	M109 T110 N111	M109-G113 PolarHBondContact O-N 3.03Å; T110-G113 PolarHBondContact O-N 2.74Å; N111-G113 PolarHBondContact O-N 2.93Å
114	E	78.1	Confident	84.1	Confident	117 Å²	117	76.2 Å²	76.2	55%	0.547	39%	0.39	S	S	.	.			trans	-91.4	122.3	174.6	-62.4	-140.8	156.6	0	0	110.5	M109 T110	M109-E114 CarbonylContact C-O 3.56Å; M109-E114 PolarHBondContact O-N 3.33Å; T110-E114 VanDerWaalsContact CA-O 3.29Å; T110-E114 WeakPolarHBondContact CA-O 3.47Å; T110-E114 PolarHBondContact N-O 3.05Å
115	K	79.3	Confident	84	Confident	187 Å²	187	75.9 Å²	75.9	81%	0.813	39%	0.389	S	S	*	.			trans	-98.9	92.3	175.9	-71.7	-175	179.3	179.7	0	108.8
116	L	81.4	Confident	84	Confident	36 Å²	36	84 Å²	84	19%	0.188	42%	0.419	C	S	.	.			trans	-83.6	143.3	171.4	-58	175.6	0	0	0	110.1	M109 E120 V121 M124	M109-L116 HydrophobicContact CB-CD1 3.8Å; M109-L116 HydrophobicContact CB-CG 4.31Å; M109-L116 HydrophobicContact CG-CD1 3.62Å; M109-L116 HydrophobicContact SD-CD1 4.42Å; L116-E120 VanDerWaalsContact CA-OE2 3.27Å; L116-E120 WeakPolarHBondContact CA-OE2 3.37Å; L116-E120 HydrophobicContact CB-CB 4.2Å; L116-E120 HydrophobicContact CD2-CB 4.36Å; L116-V121 HydrophobicContact CB-CG2 3.75Å; L116-V121 HydrophobicContact CD1-CG2 4.15Å; L116-M124 HydrophobicContact CD1-SD 3.76Å
117	T	87.1	Confident	84	Confident	62 Å²	62	86.6 Å²	86.6	38%	0.38	44%	0.435	S	S	.	.			trans	-74.5	163.3	167.9	75.6	0	0	0	0	110.5	E119 E120 V121	T117-E119 PolarHBondContact O-N 3.36Å; T117-E119 PolarHBondContact OG1-N 3.13Å; T117-E119 PolarHBondContact OG1-OE2 2.87Å; T117-E119 VanDerWaalsContact OG1-OE2 3.08Å; T117-E120 PolarHBondContact N-OE2 2.82Å; T117-E120 PolarHBondContact O-N 2.98Å; T117-E120 PolarHBondContact OG1-N 3.38Å; T117-V121 WeakPolarHBondContact O-CG2 3.25Å; T117-V121 PolarHBondContact O-N 2.76Å; T117-V121 VanDerWaalsContact O-N 3.1Å
118	D	83.8	Confident	84	Confident	97 Å²	97	82.4 Å²	82.4	52%	0.519	42%	0.417	S	S	.	.	H	α-helix	trans	-60	-32.1	175.1	-68.8	-29.7	0	0	0	110.9	R106 D122	R106-D118 IonicContact CZ-OD1 2.66Å; R106-D118 IonicContact NH1-OD1 3.47Å; R106-D118 PolarHBondContact NH1-OD1 3.08Å; D118-D122 WeakPolarHBondContact O-CB 3.08Å; D118-D122 VanDerWaalsContact O-CG 3.26Å; D118-D122 PolarHBondContact O-N 2.92Å
119	E	87.9	Confident	84.2	Confident	144 Å²	144	83.7 Å²	83.7	67%	0.673	42%	0.424	S	S	*	.	H	α-helix	trans	-68.4	-40	176.2	-60.6	115	171	0	0	112.9	T117 D122 E123	T117-E119 PolarHBondContact O-N 3.36Å; T117-E119 PolarHBondContact OG1-N 3.13Å; T117-E119 PolarHBondContact OG1-OE2 2.87Å; T117-E119 VanDerWaalsContact OG1-OE2 3.08Å; E119-D122 PolarHBondContact O-N 2.96Å; E119-E123 WeakPolarHBondContact O-CB 3.44Å; E119-E123 PolarHBondContact O-N 3.18Å
120	E	86.2	Confident	84.5	Confident	87 Å²	87	87.7 Å²	87.7	41%	0.407	44%	0.444	S	S	.	.	H	α-helix	trans	-66.7	-39.8	177.8	-70	173.1	138.5	0	0	111.1	L116 T117 E123 M124	L116-E120 VanDerWaalsContact CA-OE2 3.27Å; L116-E120 WeakPolarHBondContact CA-OE2 3.37Å; L116-E120 HydrophobicContact CB-CB 4.2Å; L116-E120 HydrophobicContact CD2-CB 4.36Å; T117-E120 PolarHBondContact N-OE2 2.82Å; T117-E120 PolarHBondContact O-N 2.98Å; T117-E120 PolarHBondContact OG1-N 3.38Å; E120-E123 PolarHBondContact O-N 2.84Å; E120-M124 WeakPolarHBondContact O-CG 3.46Å; E120-M124 PolarHBondContact O-N 3.48Å
121	V	86.8	Confident	84.7	Confident	4 Å²	4	88.9 Å²	88.9	2%	0.024	45%	0.448	C	S	.	.	H	α-helix	trans	-65.6	-44.3	175.6	173.8	0	0	0	0	111.1	A102 L105 R106 L116 T117 E123 M124 I125	A102-V121 HydrophobicContact CB-CG1 4Å; A102-V121 WeakPolarHBondContact O-CG1 3.36Å; L105-V121 HydrophobicContact CB-CG1 4.4Å; L105-V121 HydrophobicContact CD2-CG1 4.23Å; R106-V121 HydrophobicContact CB-CG1 4.38Å; R106-V121 HydrophobicContact CB-CG2 4Å; R106-V121 HydrophobicContact CG-CG2 4.19Å; L116-V121 HydrophobicContact CB-CG2 3.75Å; L116-V121 HydrophobicContact CD1-CG2 4.15Å; T117-V121 WeakPolarHBondContact O-CG2 3.25Å; T117-V121 PolarHBondContact O-N 2.76Å; T117-V121 VanDerWaalsContact O-N 3.1Å; V121-E123 VanDerWaalsContact C-N 3.27Å; V121-E123 PolarHBondContact O-N 2.91Å; V121-M124 PolarHBondContact O-N 2.86Å; V121-I125 WeakPolarHBondContact O-CG1 3.38Å; V121-I125 PolarHBondContact O-N 3.24Å
122	D	86.5	Confident	85.3	Confident	82 Å²	82	86.7 Å²	86.7	44%	0.439	45%	0.451	S	S	.	.	H	α-helix	trans	-64.1	-33.2	177.5	-77.7	-9.8	0	0	0	112.1	D118 E119 R126	D118-D122 WeakPolarHBondContact O-CB 3.08Å; D118-D122 VanDerWaalsContact O-CG 3.26Å; D118-D122 PolarHBondContact O-N 2.92Å; E119-D122 PolarHBondContact O-N 2.96Å; D122-R126 VanDerWaalsContact O-CB 3.3Å; D122-R126 WeakPolarHBondContact O-CB 3.4Å; D122-R126 PolarHBondContact O-N 2.63Å
123	E	87.6	Confident	85.9	Confident	113 Å²	113	84.3 Å²	84.3	53%	0.528	44%	0.439	S	S	.	.	H	α-helix	trans	-68.7	-45.6	174.3	-169	163.7	-153.2	0	0	111.2	E119 E120 V121 I125 R126 E127	E119-E123 WeakPolarHBondContact O-CB 3.44Å; E119-E123 PolarHBondContact O-N 3.18Å; E120-E123 PolarHBondContact O-N 2.84Å; V121-E123 VanDerWaalsContact C-N 3.27Å; V121-E123 PolarHBondContact O-N 2.91Å; E123-I125 PolarHBondContact O-N 3.49Å; E123-R126 PolarHBondContact O-N 3.46Å; E123-E127 WeakPolarHBondContact O-CG 2.96Å; E123-E127 PolarHBondContact O-N 3.42Å
124	M	85.4	Confident	86.4	Confident	58 Å²	58	83.2 Å²	83.2	29%	0.286	43%	0.427	S	S	.	.	H	α-helix	trans	-59.5	-44.6	175.2	-71.1	-174.5	75.5	0	0	112.8	L105 M109 L116 E120 V121 R126 E127 A128	L105-M124 HydrophobicContact CD2-CB 4.03Å; M109-M124 HydrophobicContact CE-CE 3.96Å; L116-M124 HydrophobicContact CD1-SD 3.76Å; E120-M124 WeakPolarHBondContact O-CG 3.46Å; E120-M124 PolarHBondContact O-N 3.48Å; V121-M124 PolarHBondContact O-N 2.86Å; M124-R126 VanDerWaalsContact C-N 3.35Å; M124-E127 PolarHBondContact O-N 2.92Å; M124-A128 PolarHBondContact O-N 3.41Å
125	I	88.6	Confident	87	Confident	11 Å²	11	80.6 Å²	80.6	6%	0.056	42%	0.415	C	S	.	.	H	α-helix	trans	-61.2	-47	176	-67.3	-70.8	0	0	0	109.6	A102 L105 V121 E123 E127 A128 D129 V136	A102-I125 HydrophobicContact CB-CG1 4.08Å; L105-I125 HydrophobicContact CD2-CD1 3.8Å; L105-I125 HydrophobicContact CD2-CG1 4.03Å; V121-I125 WeakPolarHBondContact O-CG1 3.38Å; V121-I125 PolarHBondContact O-N 3.24Å; E123-I125 PolarHBondContact O-N 3.49Å; I125-E127 VanDerWaalsContact C-N 3.27Å; I125-E127 PolarHBondContact O-N 2.89Å; I125-A128 PolarHBondContact O-N 2.78Å; I125-A128 VanDerWaalsContact O-N 3.13Å; I125-D129 HydrophobicContact CG2-CB 4.41Å; I125-D129 WeakPolarHBondContact O-CB 3.37Å; I125-D129 PolarHBondContact O-N 3.22Å; I125-V136 HydrophobicContact CD1-CG2 3.68Å; I125-V136 HydrophobicContact CG2-CG2 4.5Å
126	R	88	Confident	87.6	Confident	181 Å²	181	72 Å²	72	68%	0.683	38%	0.378	S	S	*	.	H	α-helix	trans	-64.3	-30.5	-178.7	-168.5	-175.9	-59.2	141.1	9.1	113.5	D122 E123 M124	D122-R126 VanDerWaalsContact O-CB 3.3Å; D122-R126 WeakPolarHBondContact O-CB 3.4Å; D122-R126 PolarHBondContact O-N 2.63Å; E123-R126 PolarHBondContact O-N 3.46Å; M124-R126 VanDerWaalsContact C-N 3.35Å
127	E	86	Confident	88.1	Confident	156 Å²	156	71.6 Å²	71.6	73%	0.729	38%	0.376	S	S	*	.	H	α-helix	trans	-73.9	-31.9	175.7	-73.8	-169.1	162	0	0	112.6	E123 M124 I125	E123-E127 WeakPolarHBondContact O-CG 2.96Å; E123-E127 PolarHBondContact O-N 3.42Å; M124-E127 PolarHBondContact O-N 2.92Å; I125-E127 VanDerWaalsContact C-N 3.27Å; I125-E127 PolarHBondContact O-N 2.89Å
128	A	86.3	Confident	88.2	Confident	7 Å²	7	71.7 Å²	71.7	6%	0.058	37%	0.37	C	S	.	.	H	α-helix	trans	-90.2	-29.1	-179.4	0	0	0	0	0	113.8	M124 I125 I130 V136 E140 M144	M124-A128 PolarHBondContact O-N 3.41Å; I125-A128 PolarHBondContact O-N 2.78Å; I125-A128 VanDerWaalsContact O-N 3.13Å; A128-I130 PolarHBondContact O-N 3.14Å; A128-V136 HydrophobicContact CB-CG1 4.08Å; A128-V136 HydrophobicContact CB-CG2 3.7Å; A128-E140 WeakPolarHBondContact O-CB 3.44Å; A128-M144 HydrophobicContact CB-CB 4.44Å; A128-M144 HydrophobicContact CB-CG 4.46Å; A128-M144 HydrophobicContact CB-SD 4.07Å
129	D	90.3	Very high	88.3	Confident	32 Å²	32	74 Å²	74	17%	0.171	38%	0.378	C	S	.	.			trans	-74.5	98.8	-179	177.8	13	0	0	0	110.8	I125 G132 D133 G134	I125-D129 HydrophobicContact CG2-CB 4.41Å; I125-D129 WeakPolarHBondContact O-CB 3.37Å; I125-D129 PolarHBondContact O-N 3.22Å; D129-G132 WeakPolarHBondContact OD1-CA 3.46Å; D129-G132 PolarHBondContact OD1-N 2.79Å; D129-G132 WeakPolarHBondContact OD2-CA 3.43Å; D129-D133 PolarHBondContact OD1-N 2.88Å; D129-D133 VanDerWaalsContact OD1-N 3.17Å; D129-D133 PolarHBondContact OD2-N 3.06Å; D129-G134 VanDerWaalsContact OD2-CA 3.3Å; D129-G134 WeakPolarHBondContact OD2-CA 3.45Å; D129-G134 PolarHBondContact OD2-N 2.81Å
130	I	88.5	Confident	88.4	Confident	110 Å²	110	67.6 Å²	67.6	56%	0.564	35%	0.348	S	S	*	.	S	Bend	trans	-89.3	-35.4	-176.9	-62.5	171.7	0	0	0	110.1	A128 E140	A128-I130 PolarHBondContact O-N 3.14Å; I130-E140 HydrophobicContact CB-CG 4.32Å; I130-E140 HydrophobicContact CD1-CG 4.28Å; I130-E140 HydrophobicContact CG1-CG 4.31Å; I130-E140 PolarHBondContact N-OE1 2.88Å
131	D	88.9	Confident	88.4	Confident	93 Å²	93	63.6 Å²	63.6	50%	0.497	33%	0.329	S	S	.	.	S	Bend	trans	-85.1	-13.9	-177.7	73.8	22.9	0	0	0	114	D133 N137 E140	D131-D133 VanDerWaalsContact OD1-CB 3.27Å; D131-D133 WeakPolarHBondContact OD1-CB 3.34Å; D131-D133 VanDerWaalsContact OD1-CG 3.25Å; D131-D133 PolarHBondContact OD1-N 3.2Å; D131-N137 PolarHBondContact OD2-ND2 2.89Å; D131-E140 PolarHBondContact N-OE1 3.45Å; D131-E140 VanDerWaalsContact N-OE1 3.12Å
132	G	89.6	Confident	88.3	Confident	60 Å²	60	65.2 Å²	65.2	62%	0.619	34%	0.339	S	S	*	.			trans	80.8	21.6	174.4	0	0	0	0	0	114	D129 G134	D129-G132 WeakPolarHBondContact OD1-CA 3.46Å; D129-G132 PolarHBondContact OD1-N 2.79Å; D129-G132 WeakPolarHBondContact OD2-CA 3.43Å; G132-G134 VanDerWaalsContact C-N 3.27Å
133	D	89.4	Confident	88.1	Confident	69 Å²	69	66.5 Å²	66.5	37%	0.369	34%	0.342	S	S	.	.	S	Bend	trans	-80	-7.7	-179.8	82.7	1.4	0	0	0	113.9	Y99 D129 D131 Q135	Y99-D133 WeakPolarHBondContact CE1-OD2 3.18Å; D129-D133 PolarHBondContact OD1-N 2.88Å; D129-D133 VanDerWaalsContact OD1-N 3.17Å; D129-D133 PolarHBondContact OD2-N 3.06Å; D131-D133 VanDerWaalsContact OD1-CB 3.27Å; D131-D133 WeakPolarHBondContact OD1-CB 3.34Å; D131-D133 VanDerWaalsContact OD1-CG 3.25Å; D131-D133 PolarHBondContact OD1-N 3.2Å; D133-Q135 VanDerWaalsContact C-N 3.31Å; D133-Q135 WeakPolarHBondContact OD1-CA 3.37Å; D133-Q135 WeakPolarHBondContact OD1-CB 3.22Å; D133-Q135 PolarHBondContact OD1-N 2.73Å
134	G	88.3	Confident	87.7	Confident	41 Å²	41	64.7 Å²	64.7	42%	0.423	34%	0.335	S	S	.	.	S	Bend	trans	79.3	12.2	-179.8	0	0	0	0	0	114	D129 G132	D129-G134 VanDerWaalsContact OD2-CA 3.3Å; D129-G134 WeakPolarHBondContact OD2-CA 3.45Å; D129-G134 PolarHBondContact OD2-N 2.81Å; G132-G134 VanDerWaalsContact C-N 3.27Å
135	Q	91.3	Very high	87.3	Confident	63 Å²	63	66.4 Å²	66.4	29%	0.294	34%	0.343	S	S	.	.	S	Bend	trans	-129.6	174.3	174.1	-50.4	-168.8	-105.9	0	0	109	Y99 D133	Y99-Q135 HydrophobicContact CD1-CB 4.28Å; D133-Q135 VanDerWaalsContact C-N 3.31Å; D133-Q135 WeakPolarHBondContact OD1-CA 3.37Å; D133-Q135 WeakPolarHBondContact OD1-CB 3.22Å; D133-Q135 PolarHBondContact OD1-N 2.73Å
136	V	92.2	Very high	86.4	Confident	6 Å²	6	69.7 Å²	69.7	4%	0.036	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112.1	177	179.6	0	0	0	0	108.9	Y99 I100 I125 A128 E140 F141	Y99-V136 WeakPolarHBondContact CA-O 3.4Å; I100-V136 HydrophobicContact CB-CB 4.33Å; I100-V136 PolarHBondContact N-O 2.82Å; I100-V136 PolarHBondContact O-N 2.68Å; I125-V136 HydrophobicContact CD1-CG2 3.68Å; I125-V136 HydrophobicContact CG2-CG2 4.5Å; A128-V136 HydrophobicContact CB-CG1 4.08Å; A128-V136 HydrophobicContact CB-CG2 3.7Å; V136-E140 WeakPolarHBondContact CA-OE2 3.38Å; V136-E140 HydrophobicContact CG1-CB 3.8Å; V136-F141 HydrophobicContact CG1-CB 3.95Å
137	N	92.1	Very high	85	Confident	27 Å²	27	65 Å²	65	14%	0.144	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	173.1	175.9	72.4	52.7	0	0	0	111.6	Y99 D131 E139 E140 F141	Y99-N137 HydrophobicContact CD1-CB 3.87Å; Y99-N137 HydrophobicContact CE1-CB 3.86Å; D131-N137 PolarHBondContact OD2-ND2 2.89Å; N137-E139 VanDerWaalsContact C-N 3.34Å; N137-E139 PolarHBondContact O-N 2.92Å; N137-E139 WeakPolarHBondContact OD1-CB 3.23Å; N137-E139 PolarHBondContact OD1-N 3.33Å; N137-E140 PolarHBondContact N-OE2 2.66Å; N137-E140 PolarHBondContact ND2-OE2 2.91Å; N137-E140 PolarHBondContact O-N 3.24Å; N137-E140 PolarHBondContact OD1-N 3.43Å; N137-F141 WeakPolarHBondContact O-CB 3.47Å; N137-F141 PolarHBondContact O-N 3.26Å
138	Y	88.4	Confident	82.9	Confident	64 Å²	64	70.6 Å²	70.6	25%	0.251	39%	0.386	S	S	.	.	H	α-helix	trans	-59.5	-40.6	-177.8	177.6	-108	0	0	0	113.5	R86 F89 F141 V142	R86-Y138 HydrophobicContact CB-CE2 4.19Å; R86-Y138 HydrophobicContact CG-CE2 4.47Å; R86-Y138 PolarHBondContact NH2-OH 3.17Å; F89-Y138 HydrophobicContact CB-CD2 4.17Å; F89-Y138 HydrophobicContact CB-CE2 4.49Å; F89-Y138 HydrophobicContact CD1-CD2 4.21Å; F89-Y138 HydrophobicContact CD2-CD2 4.11Å; F89-Y138 AromaticContact CG-CD2 3.88Å; F89-Y138 HydrophobicContact CG-CD2 3.88Å; Y138-F141 PolarHBondContact O-N 2.95Å; Y138-V142 HydrophobicContact CD1-CG2 4.24Å; Y138-V142 HydrophobicContact CD2-CG2 4.22Å; Y138-V142 HydrophobicContact CE1-CG2 3.87Å; Y138-V142 HydrophobicContact CE2-CG2 3.82Å; Y138-V142 HydrophobicContact CG-CG2 4.42Å; Y138-V142 WeakPolarHBondContact O-CB 3.44Å; Y138-V142 WeakPolarHBondContact O-CG2 3.41Å; Y138-V142 PolarHBondContact O-N 3.35Å
139	E	87.1	Confident	82.7	Confident	147 Å²	147	73.8 Å²	73.8	69%	0.687	40%	0.402	S	S	*	.	H	α-helix	trans	-68.6	-40	-178.5	-62.2	-174.9	169.7	0	0	111.1	N137 V142 Q143	N137-E139 VanDerWaalsContact C-N 3.34Å; N137-E139 PolarHBondContact O-N 2.92Å; N137-E139 WeakPolarHBondContact OD1-CB 3.23Å; N137-E139 PolarHBondContact OD1-N 3.33Å; E139-V142 PolarHBondContact O-N 3.33Å; E139-Q143 WeakPolarHBondContact O-CG 3.48Å; E139-Q143 PolarHBondContact O-N 3.05Å
140	E	89.6	Confident	82.3	Confident	8 Å²	8	76 Å²	76	4%	0.037	41%	0.414	C	S	.	.	H	α-helix	trans	-64.5	-43.3	174.5	-71.7	170.9	153.2	0	0	111.9	A128 I130 D131 V136 N137 V142 Q143 M144	A128-E140 WeakPolarHBondContact O-CB 3.44Å; I130-E140 HydrophobicContact CB-CG 4.32Å; I130-E140 HydrophobicContact CD1-CG 4.28Å; I130-E140 HydrophobicContact CG1-CG 4.31Å; I130-E140 PolarHBondContact N-OE1 2.88Å; D131-E140 PolarHBondContact N-OE1 3.45Å; D131-E140 VanDerWaalsContact N-OE1 3.12Å; V136-E140 WeakPolarHBondContact CA-OE2 3.38Å; V136-E140 HydrophobicContact CG1-CB 3.8Å; N137-E140 PolarHBondContact N-OE2 2.66Å; N137-E140 PolarHBondContact ND2-OE2 2.91Å; N137-E140 PolarHBondContact O-N 3.24Å; N137-E140 PolarHBondContact OD1-N 3.43Å; E140-V142 PolarHBondContact O-N 3.14Å; E140-Q143 PolarHBondContact O-N 2.78Å; E140-M144 WeakPolarHBondContact O-CB 3.45Å; E140-M144 PolarHBondContact O-N 3.45Å
141	F	86.4	Confident	82	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.018	41%	0.406	C	S	.	.	H	α-helix	trans	-63.8	-40.6	175.4	-172.2	-98.5	0	0	0	112.1	I85 A88 F89 F92 I100 V136 N137 Y138 M144 M145	I85-F141 HydrophobicContact CG2-CD1 3.82Å; I85-F141 HydrophobicContact CG2-CE1 4Å; A88-F141 HydrophobicContact CB-CE1 4.12Å; A88-F141 HydrophobicContact CB-CZ 4.26Å; F89-F141 HydrophobicContact CB-CD1 4.04Å; F89-F141 HydrophobicContact CB-CE1 4.13Å; F89-F141 HydrophobicContact CD2-CB 3.61Å; F89-F141 AromaticContact CD2-CD1 3.69Å; F89-F141 HydrophobicContact CD2-CD1 3.69Å; F89-F141 HydrophobicContact CD2-CD2 4.27Å; F89-F141 HydrophobicContact CD2-CE1 4.41Å; F89-F141 AromaticContact CD2-CG 3.6Å; F89-F141 HydrophobicContact CD2-CG 3.6Å; F89-F141 HydrophobicContact CE2-CB 3.84Å; F89-F141 HydrophobicContact CE2-CG 4.24Å; F89-F141 HydrophobicContact CG-CD1 4.38Å; F92-F141 AromaticContact CD2-CE2 3.77Å; F92-F141 HydrophobicContact CD2-CE2 3.77Å; F92-F141 AromaticContact CD2-CZ 3.63Å; F92-F141 HydrophobicContact CD2-CZ 3.63Å; F92-F141 HydrophobicContact CE2-CE2 4.02Å; F92-F141 AromaticContact CE2-CZ 3.76Å; F92-F141 HydrophobicContact CE2-CZ 3.76Å; F92-F141 HydrophobicContact CG-CE2 4.42Å; I100-F141 HydrophobicContact CD1-CD2 3.48Å; I100-F141 VanDerWaalsContact CD1-CD2 3.48Å; I100-F141 HydrophobicContact CD1-CE2 3.81Å; I100-F141 HydrophobicContact CD1-CG 4.07Å; V136-F141 HydrophobicContact CG1-CB 3.95Å; N137-F141 WeakPolarHBondContact O-CB 3.47Å; N137-F141 PolarHBondContact O-N 3.26Å; Y138-F141 PolarHBondContact O-N 2.95Å; F141-M144 HydrophobicContact CD2-CE 3.81Å; F141-M144 HydrophobicContact CE2-CE 3.71Å; F141-M144 PolarHBondContact O-N 3.31Å; F141-M145 HydrophobicContact CD1-CG 4.06Å; F141-M145 HydrophobicContact CE1-CG 3.77Å; F141-M145 HydrophobicContact CE1-SD 4.48Å; F141-M145 HydrophobicContact CZ-CG 4.03Å; F141-M145 HydrophobicContact CZ-SD 4.25Å; F141-M145 WeakPolarHBondContact O-CB 3.48Å; F141-M145 VanDerWaalsContact O-CG 3.23Å; F141-M145 WeakPolarHBondContact O-CG 3.35Å; F141-M145 PolarHBondContact O-N 3.01Å
142	V	84.3	Confident	81.6	Confident	37 Å²	37	73 Å²	73	22%	0.224	40%	0.401	C	S	.	.	H	α-helix	trans	-62.3	-45.6	174	171.4	0	0	0	0	110.1	I85 Y138 E139 E140 M144 M145 T146	I85-V142 HydrophobicContact CG2-CB 4.4Å; I85-V142 HydrophobicContact CG2-CG2 3.63Å; Y138-V142 HydrophobicContact CD1-CG2 4.24Å; Y138-V142 HydrophobicContact CD2-CG2 4.22Å; Y138-V142 HydrophobicContact CE1-CG2 3.87Å; Y138-V142 HydrophobicContact CE2-CG2 3.82Å; Y138-V142 HydrophobicContact CG-CG2 4.42Å; Y138-V142 WeakPolarHBondContact O-CB 3.44Å; Y138-V142 WeakPolarHBondContact O-CG2 3.41Å; Y138-V142 PolarHBondContact O-N 3.35Å; E139-V142 PolarHBondContact O-N 3.33Å; E140-V142 PolarHBondContact O-N 3.14Å; V142-M144 VanDerWaalsContact C-N 3.35Å; V142-M144 PolarHBondContact O-N 3.11Å; V142-M145 PolarHBondContact O-N 2.94Å; V142-T146 HydrophobicContact CG1-CG2 4.13Å; V142-T146 WeakPolarHBondContact O-CB 3.16Å; V142-T146 WeakPolarHBondContact O-CG2 3.3Å; V142-T146 PolarHBondContact O-N 2.96Å; V142-T146 PolarHBondContact O-OG1 2.73Å
143	Q	81.4	Confident	81.1	Confident	110 Å²	110	73.8 Å²	73.8	51%	0.514	39%	0.387	S	S	.	.	H	α-helix	trans	-60.7	-43.6	176.5	-77	-170.4	24.7	0	0	111.8	E139 E140 M145 T146 A147	E139-Q143 WeakPolarHBondContact O-CG 3.48Å; E139-Q143 PolarHBondContact O-N 3.05Å; E140-Q143 PolarHBondContact O-N 2.78Å; Q143-M145 VanDerWaalsContact C-N 3.32Å; Q143-M145 PolarHBondContact O-N 3.36Å; Q143-T146 PolarHBondContact O-N 3.15Å; Q143-T146 PolarHBondContact O-OG1 3.46Å; Q143-A147 WeakPolarHBondContact O-CB 3.35Å; Q143-A147 PolarHBondContact O-N 2.96Å
144	M	80.5	Confident	80.5	Confident	74 Å²	74	74.1 Å²	74.1	37%	0.365	39%	0.388	S	S	.	.	H	α-helix	trans	-59.1	-42.6	175.3	-173.2	-166.8	73.9	0	0	111.9	A128 E140 F141 V142	A128-M144 HydrophobicContact CB-CB 4.44Å; A128-M144 HydrophobicContact CB-CG 4.46Å; A128-M144 HydrophobicContact CB-SD 4.07Å; E140-M144 WeakPolarHBondContact O-CB 3.45Å; E140-M144 PolarHBondContact O-N 3.45Å; F141-M144 HydrophobicContact CD2-CE 3.81Å; F141-M144 HydrophobicContact CE2-CE 3.71Å; F141-M144 PolarHBondContact O-N 3.31Å; V142-M144 VanDerWaalsContact C-N 3.35Å; V142-M144 PolarHBondContact O-N 3.11Å
145	M	76.7	Confident	80	Confident	94 Å²	94	76.5 Å²	76.5	46%	0.463	39%	0.386	S	S	.	.	H	α-helix	trans	-77.5	-25.7	-178.2	-68.7	-71.3	-77.9	0	0	113.4	I85 F141 V142 Q143	I85-M145 HydrophobicContact CD1-CB 4.03Å; I85-M145 HydrophobicContact CG1-CB 4.06Å; F141-M145 HydrophobicContact CD1-CG 4.06Å; F141-M145 HydrophobicContact CE1-CG 3.77Å; F141-M145 HydrophobicContact CE1-SD 4.48Å; F141-M145 HydrophobicContact CZ-CG 4.03Å; F141-M145 HydrophobicContact CZ-SD 4.25Å; F141-M145 WeakPolarHBondContact O-CB 3.48Å; F141-M145 VanDerWaalsContact O-CG 3.23Å; F141-M145 WeakPolarHBondContact O-CG 3.35Å; F141-M145 PolarHBondContact O-N 3.01Å; V142-M145 PolarHBondContact O-N 2.94Å; Q143-M145 VanDerWaalsContact C-N 3.32Å; Q143-M145 PolarHBondContact O-N 3.36Å
146	T	69.3	Low	79.1	Confident	81 Å²	81	77.5 Å²	77.5	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-97.5	-19.3	-178.5	53.8	0	0	0	0	113.7	I85 V142 Q143 K148	I85-T146 HydrophobicContact CD1-CG2 3.93Å; V142-T146 HydrophobicContact CG1-CG2 4.13Å; V142-T146 WeakPolarHBondContact O-CB 3.16Å; V142-T146 WeakPolarHBondContact O-CG2 3.3Å; V142-T146 PolarHBondContact O-N 2.96Å; V142-T146 PolarHBondContact O-OG1 2.73Å; Q143-T146 PolarHBondContact O-N 3.15Å; Q143-T146 PolarHBondContact O-OG1 3.46Å; T146-K148 VanDerWaalsContact C-N 3.28Å; T146-K148 PolarHBondContact O-N 3.22Å
147	A	59.5	Low	78	Confident	83 Å²	83	83.5 Å²	83.5	69%	0.686	42%	0.423	S	S	*	.			trans	-70.2	83.3	171.4	0	0	0	0	0	110.5	Q143	Q143-A147 WeakPolarHBondContact O-CB 3.35Å; Q143-A147 PolarHBondContact O-N 2.96Å
148	K	41.1	Very low	76.8	Confident	273 Å²	273	88.6 Å²	88.6	100%	1.187	45%	0.448	S	S	*	.			trans	-109.4	0	166.1	-104.3	-175.8	179.8	172.2	0	111	T146	T146-K148 VanDerWaalsContact C-N 3.28Å; T146-K148 PolarHBondContact O-N 3.22Å

Retrieved 148 of 148 residues in 315.9 ms (Link to these results)

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