X5DP77_HUMAN Loading...

Inositol polyphosphate-1-phosphatase isoform A

AlphaFold DB , UniProt , Accession X5DP77, Species HUMAN (Homo sapiens, Human), Gene INPP1, Length 93 aa.

						>X5DP77_HUMAN|X5DP77|INPP1
MSDILRELLCVSEKAANIARACRQQEALFQLLIEEKKEGEKNKKFAVDFKTLADVLVQEVIKQNMENKFPGLEKNIFGEESNEFTNDWGKRLP
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60.7	Low	92.8	Very high	204 Å²	204	91.7 Å²	91.7	100%	1.005	47%	0.474	S	S	*	.				0	-44.2	0	-120.7	73.1	166.9	0	0	112.8	D3 I4 L5	M1-D3 VanDerWaalsContact C-N 3.27Å; M1-D3 PolarHBondContact O-N 3.25Å; M1-I4 PolarHBondContact O-N 2.95Å; M1-L5 PolarHBondContact O-N 3.26Å
2	S	88.4	Confident	93.2	Very high	85 Å²	85	89.1 Å²	89.1	59%	0.594	47%	0.469	S	S	*	.	H	α-helix	trans	-57.1	-35.9	180	51.7	0	0	0	0	114.1	L5 R6	S2-L5 PolarHBondContact O-N 2.86Å; S2-R6 VanDerWaalsContact O-CB 3.26Å; S2-R6 WeakPolarHBondContact O-CB 3.37Å; S2-R6 PolarHBondContact O-N 3.16Å
3	D	94.3	Very high	93.6	Very high	91 Å²	91	89.8 Å²	89.8	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-74.3	-35.3	-173.4	-54.5	-36.6	0	0	0	112.8	M1 R6 E7 F69	M1-D3 VanDerWaalsContact C-N 3.27Å; M1-D3 PolarHBondContact O-N 3.25Å; D3-R6 PolarHBondContact O-N 3.37Å; D3-E7 WeakPolarHBondContact O-CB 3.38Å; D3-E7 PolarHBondContact O-N 2.86Å; D3-F69 HydrophobicContact CB-CE1 4.34Å; D3-F69 HydrophobicContact CB-CZ 4.14Å
4	I	95.3	Very high	93.9	Very high	63 Å²	63	90 Å²	90	32%	0.323	46%	0.464	S	S	.	.	H	α-helix	trans	-64.7	-48.7	173.7	-65.4	175.1	0	0	0	109.3	M1 R6 E7 L8 M65 F69	M1-I4 PolarHBondContact O-N 2.95Å; I4-R6 VanDerWaalsContact C-N 3.33Å; I4-R6 PolarHBondContact O-N 2.98Å; I4-E7 PolarHBondContact O-N 2.84Å; I4-L8 HydrophobicContact CG2-CD1 3.98Å; I4-L8 HydrophobicContact CG2-CG 4.41Å; I4-L8 WeakPolarHBondContact O-CB 3.44Å; I4-L8 VanDerWaalsContact O-CG 3.31Å; I4-L8 WeakPolarHBondContact O-CG 3.29Å; I4-L8 PolarHBondContact O-N 3.39Å; I4-M65 HydrophobicContact CG2-CE 3.96Å; I4-F69 HydrophobicContact CG1-CD1 4.22Å; I4-F69 HydrophobicContact CG1-CD2 4.46Å; I4-F69 HydrophobicContact CG1-CE1 3.94Å; I4-F69 HydrophobicContact CG1-CE2 4.19Å; I4-F69 HydrophobicContact CG1-CG 4.47Å; I4-F69 HydrophobicContact CG1-CZ 3.92Å
5	L	96.7	Very high	94.2	Very high	108 Å²	108	84.7 Å²	84.7	57%	0.565	44%	0.438	S	S	*	.	H	α-helix	trans	-61.5	-42.8	178.1	179	62.1	0	0	0	111.6	M1 S2 E7 L8 L9	M1-L5 PolarHBondContact O-N 3.26Å; S2-L5 PolarHBondContact O-N 2.86Å; L5-E7 VanDerWaalsContact C-N 3.32Å; L5-E7 PolarHBondContact O-N 3.25Å; L5-L8 PolarHBondContact O-N 2.91Å; L5-L9 WeakPolarHBondContact O-CG 3.4Å; L5-L9 PolarHBondContact O-N 2.84Å
6	R	97.3	Very high	94.4	Very high	174 Å²	174	81.6 Å²	81.6	66%	0.657	43%	0.43	S	S	*	.	H	α-helix	trans	-61.1	-43	176.5	-176.2	177.1	178.9	-177.9	1	111.3	S2 D3 I4 L9 C10	S2-R6 VanDerWaalsContact O-CB 3.26Å; S2-R6 WeakPolarHBondContact O-CB 3.37Å; S2-R6 PolarHBondContact O-N 3.16Å; D3-R6 PolarHBondContact O-N 3.37Å; I4-R6 VanDerWaalsContact C-N 3.33Å; I4-R6 PolarHBondContact O-N 2.98Å; R6-L9 PolarHBondContact O-N 2.76Å; R6-C10 PolarHBondContact O-N 2.74Å; R6-C10 VanDerWaalsContact O-N 3.11Å; R6-C10 PolarHBondContact O-SG 2.95Å
7	E	97.3	Very high	94.7	Very high	26 Å²	26	81.1 Å²	81.1	12%	0.121	43%	0.427	C	S	.	.	H	α-helix	trans	-66.3	-42.4	176.7	-167.5	61.8	-161.7	0	0	111.8	D3 I4 L5 L9 C10 V11 M65 K68 F69	D3-E7 WeakPolarHBondContact O-CB 3.38Å; D3-E7 PolarHBondContact O-N 2.86Å; I4-E7 PolarHBondContact O-N 2.84Å; L5-E7 VanDerWaalsContact C-N 3.32Å; L5-E7 PolarHBondContact O-N 3.25Å; E7-L9 PolarHBondContact O-N 2.9Å; E7-C10 WeakPolarHBondContact O-CA 3.45Å; E7-C10 WeakPolarHBondContact O-CB 3.42Å; E7-C10 PolarHBondContact O-N 2.88Å; E7-V11 HydrophobicContact CG-CG1 4.16Å; E7-V11 WeakPolarHBondContact O-CG2 3.43Å; E7-V11 PolarHBondContact O-N 3.41Å; E7-M65 HydrophobicContact CB-CE 4.41Å; E7-M65 HydrophobicContact CB-SD 3.97Å; E7-M65 HydrophobicContact CG-SD 3.59Å; E7-M65 VanDerWaalsContact CG-SD 3.59Å; E7-K68 HydrophobicContact CB-CD 4.14Å; E7-K68 HydrophobicContact CG-CD 3.67Å; E7-K68 WeakPolarHBondContact OE2-CD 3.3Å; E7-K68 WeakPolarHBondContact OE2-CE 3.49Å; E7-K68 IonicContact OE2-NZ 2.6Å; E7-K68 PolarHBondContact OE2-NZ 2.87Å; E7-F69 HydrophobicContact CB-CE2 3.71Å; E7-F69 HydrophobicContact CB-CZ 4.33Å; E7-F69 HydrophobicContact CG-CE2 4.04Å
8	L	97	Very high	94.7	Very high	75 Å²	75	78.4 Å²	78.4	39%	0.393	41%	0.413	S	S	.	.	H	α-helix	trans	-55.7	-39.2	175.2	-75	171.3	0	0	0	111.9	I4 L5 V11 S12 M65	I4-L8 HydrophobicContact CG2-CD1 3.98Å; I4-L8 HydrophobicContact CG2-CG 4.41Å; I4-L8 WeakPolarHBondContact O-CB 3.44Å; I4-L8 VanDerWaalsContact O-CG 3.31Å; I4-L8 WeakPolarHBondContact O-CG 3.29Å; I4-L8 PolarHBondContact O-N 3.39Å; L5-L8 PolarHBondContact O-N 2.91Å; L8-V11 WeakPolarHBondContact O-CG2 3.43Å; L8-S12 VanDerWaalsContact O-CB 3.23Å; L8-S12 WeakPolarHBondContact O-CB 3.42Å; L8-S12 PolarHBondContact O-N 3.12Å; L8-S12 PolarHBondContact O-OG 3.18Å; L8-M65 HydrophobicContact CD2-CE 3.87Å; L8-M65 HydrophobicContact CD2-CG 4.26Å; L8-M65 HydrophobicContact CD2-SD 3.82Å; L8-M65 HydrophobicContact CG-CE 3.88Å; L8-M65 HydrophobicContact CG-SD 4.14Å
9	L	98.2	Very high	94.8	Very high	110 Å²	110	77.1 Å²	77.1	58%	0.576	41%	0.414	S	S	*	.	H	α-helix	trans	-67	-39.3	173.4	-69.2	171.1	0	0	0	112.7	L5 R6 E7 S12 E13	L5-L9 WeakPolarHBondContact O-CG 3.4Å; L5-L9 PolarHBondContact O-N 2.84Å; R6-L9 PolarHBondContact O-N 2.76Å; E7-L9 PolarHBondContact O-N 2.9Å; L9-S12 PolarHBondContact O-OG 2.99Å; L9-E13 PolarHBondContact O-N 3.26Å
10	C	97.9	Very high	94.9	Very high	70 Å²	70	77.8 Å²	77.8	47%	0.473	41%	0.411	S	S	.	.	H	α-helix	trans	-67.1	-44.7	176.9	-69.9	0	0	0	0	111.9	R6 E7 E13 K14	R6-C10 PolarHBondContact O-N 2.74Å; R6-C10 VanDerWaalsContact O-N 3.11Å; R6-C10 PolarHBondContact O-SG 2.95Å; E7-C10 WeakPolarHBondContact O-CA 3.45Å; E7-C10 WeakPolarHBondContact O-CB 3.42Å; E7-C10 PolarHBondContact O-N 2.88Å; C10-E13 PolarHBondContact O-N 3.06Å; C10-K14 PolarHBondContact O-N 3.4Å; C10-K14 VanDerWaalsContact O-N 3.1Å
11	V	97.8	Very high	95	Very high	3 Å²	3	75.5 Å²	75.5	2%	0.018	40%	0.403	C	S	.	.	H	α-helix	trans	-75.3	-27.8	-179.2	-56.3	0	0	0	0	112.3	E7 L8 K14 A15 I61 N64 M65	E7-V11 HydrophobicContact CG-CG1 4.16Å; E7-V11 WeakPolarHBondContact O-CG2 3.43Å; E7-V11 PolarHBondContact O-N 3.41Å; L8-V11 WeakPolarHBondContact O-CG2 3.43Å; V11-K14 WeakPolarHBondContact O-CB 3.5Å; V11-K14 PolarHBondContact O-N 2.68Å; V11-A15 PolarHBondContact O-N 3.02Å; V11-I61 HydrophobicContact CG2-CG1 4.37Å; V11-I61 HydrophobicContact CG2-CG2 4.11Å; V11-N64 HydrophobicContact CB-CB 4.44Å; V11-N64 HydrophobicContact CG1-CB 3.45Å; V11-N64 VanDerWaalsContact CG1-CB 3.45Å; V11-M65 HydrophobicContact CG2-CG 4.46Å; V11-M65 HydrophobicContact CG2-SD 4.17Å
12	S	98.1	Very high	96.6	Very high	60 Å²	60	66.4 Å²	66.4	42%	0.42	36%	0.359	S	S	.	.	H	α-helix	trans	-66.3	-39.2	171.9	71.5	0	0	0	0	111.5	L8 L9 K14 A15 A16	L8-S12 VanDerWaalsContact O-CB 3.23Å; L8-S12 WeakPolarHBondContact O-CB 3.42Å; L8-S12 PolarHBondContact O-N 3.12Å; L8-S12 PolarHBondContact O-OG 3.18Å; L9-S12 PolarHBondContact O-OG 2.99Å; S12-K14 VanDerWaalsContact C-N 3.32Å; S12-K14 PolarHBondContact O-N 3.43Å; S12-A15 WeakPolarHBondContact O-CB 3.36Å; S12-A15 PolarHBondContact O-N 2.97Å; S12-A16 WeakPolarHBondContact O-CB 3.4Å; S12-A16 PolarHBondContact O-N 3.05Å
13	E	98.4	Very high	96.8	Very high	98 Å²	98	70.6 Å²	70.6	46%	0.458	36%	0.362	S	S	.	.	H	α-helix	trans	-66.9	-36	173.5	-178.5	55.1	-153.8	0	0	111.4	L9 C10 A16 N17 R20	L9-E13 PolarHBondContact O-N 3.26Å; C10-E13 PolarHBondContact O-N 3.06Å; E13-A16 PolarHBondContact O-N 3.4Å; E13-N17 PolarHBondContact O-N 2.74Å; E13-N17 PolarHBondContact O-ND2 3.42Å; E13-R20 IonicContact OE1-CZ 3.91Å; E13-R20 IonicContact OE1-NH2 2.68Å; E13-R20 PolarHBondContact OE1-NH2 3.28Å
14	K	97.9	Very high	96.8	Very high	93 Å²	93	73.3 Å²	73.3	40%	0.404	37%	0.372	S	S	.	.	H	α-helix	trans	-61.9	-44.4	172	-167.7	178	-178.5	176.8	0	111.7	C10 V11 S12 A16 N17 I18 V60 N64	C10-K14 PolarHBondContact O-N 3.4Å; C10-K14 VanDerWaalsContact O-N 3.1Å; V11-K14 WeakPolarHBondContact O-CB 3.5Å; V11-K14 PolarHBondContact O-N 2.68Å; S12-K14 VanDerWaalsContact C-N 3.32Å; S12-K14 PolarHBondContact O-N 3.43Å; K14-A16 VanDerWaalsContact C-N 3.35Å; K14-N17 WeakPolarHBondContact O-CB 3.29Å; K14-N17 PolarHBondContact O-N 3.39Å; K14-I18 PolarHBondContact O-N 2.93Å; K14-I18 VanDerWaalsContact O-N 3.14Å; K14-V60 HydrophobicContact CD-CG1 3.91Å; K14-V60 HydrophobicContact CG-CG1 4.24Å; K14-N64 PolarHBondContact NZ-ND2 3.46Å; K14-N64 VanDerWaalsContact NZ-ND2 3.14Å; K14-N64 PolarHBondContact NZ-OD1 3.33Å
15	A	97.8	Very high	96.8	Very high	10 Å²	10	75.7 Å²	75.7	8%	0.083	38%	0.381	C	S	.	.	H	α-helix	trans	-60.8	-42.8	172.9	0	0	0	0	0	112	V11 S12 N17 I18 A19 V57 I61	V11-A15 PolarHBondContact O-N 3.02Å; S12-A15 WeakPolarHBondContact O-CB 3.36Å; S12-A15 PolarHBondContact O-N 2.97Å; A15-N17 VanDerWaalsContact C-N 3.3Å; A15-N17 PolarHBondContact O-N 3.42Å; A15-I18 WeakPolarHBondContact O-CB 3.47Å; A15-I18 PolarHBondContact O-N 3.1Å; A15-I18 VanDerWaalsContact O-N 3.14Å; A15-A19 PolarHBondContact O-N 3.28Å; A15-V57 HydrophobicContact CB-CG1 3.69Å; A15-I61 HydrophobicContact CB-CD1 4.08Å; A15-I61 HydrophobicContact CB-CG1 4.31Å
16	A	97.9	Very high	96.4	Very high	36 Å²	36	76.4 Å²	76.4	30%	0.298	38%	0.382	S	S	.	.	H	α-helix	trans	-62.5	-36.4	175.9	0	0	0	0	0	112.5	S12 E13 K14 A19 R20	S12-A16 WeakPolarHBondContact O-CB 3.4Å; S12-A16 PolarHBondContact O-N 3.05Å; E13-A16 PolarHBondContact O-N 3.4Å; K14-A16 VanDerWaalsContact C-N 3.35Å; A16-A19 PolarHBondContact O-N 2.96Å; A16-R20 WeakPolarHBondContact O-CB 3.42Å; A16-R20 WeakPolarHBondContact O-CG 3.46Å; A16-R20 PolarHBondContact O-N 3.14Å; A16-R20 PolarHBondContact O-NE 3.29Å
17	N	98.3	Very high	96	Very high	72 Å²	72	71.7 Å²	71.7	39%	0.385	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-41.3	173.1	-75.8	-59.9	0	0	0	111.9	E13 K14 A15 R20 A21	E13-N17 PolarHBondContact O-N 2.74Å; E13-N17 PolarHBondContact O-ND2 3.42Å; K14-N17 WeakPolarHBondContact O-CB 3.29Å; K14-N17 PolarHBondContact O-N 3.39Å; A15-N17 VanDerWaalsContact C-N 3.3Å; A15-N17 PolarHBondContact O-N 3.42Å; N17-R20 VanDerWaalsContact CG-NH2 3.33Å; N17-R20 PolarHBondContact O-N 2.75Å; N17-R20 PolarHBondContact OD1-NH1 3.5Å; N17-R20 PolarHBondContact OD1-NH2 3.43Å; N17-A21 WeakPolarHBondContact O-CB 3.38Å; N17-A21 PolarHBondContact O-N 3.14Å
18	I	96.3	Very high	95.7	Very high	34 Å²	34	72.6 Å²	72.6	17%	0.174	39%	0.386	C	S	.	.	H	α-helix	trans	-61.9	-50.5	175.1	-65.2	167	0	0	0	110.1	K14 A15 R20 A21 C22 L56 V57 V60	K14-I18 PolarHBondContact O-N 2.93Å; K14-I18 VanDerWaalsContact O-N 3.14Å; A15-I18 WeakPolarHBondContact O-CB 3.47Å; A15-I18 PolarHBondContact O-N 3.1Å; A15-I18 VanDerWaalsContact O-N 3.14Å; I18-R20 VanDerWaalsContact C-N 3.28Å; I18-R20 PolarHBondContact O-N 2.89Å; I18-A21 WeakPolarHBondContact O-CB 3.48Å; I18-A21 PolarHBondContact O-N 3.37Å; I18-C22 PolarHBondContact O-N 3.25Å; I18-C22 PolarHBondContact O-SG 3.25Å; I18-C22 VanDerWaalsContact O-SG 3.37Å; I18-L56 HydrophobicContact CG2-CD2 4.01Å; I18-V57 HydrophobicContact CB-CG2 4.36Å; I18-V57 HydrophobicContact CG2-CG2 4.06Å; I18-V60 HydrophobicContact CD1-CB 4.2Å; I18-V60 HydrophobicContact CD1-CG1 4.07Å; I18-V60 HydrophobicContact CD1-CG2 3.86Å
19	A	95.6	Very high	95.2	Very high	52 Å²	52	72 Å²	72	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-58.7	-39.5	178.7	0	0	0	0	0	112.5	A15 A16	A15-A19 PolarHBondContact O-N 3.28Å; A16-A19 PolarHBondContact O-N 2.96Å
20	R	97.8	Very high	94.7	Very high	92 Å²	92	71.2 Å²	71.2	35%	0.347	37%	0.373	S	S	.	.	H	α-helix	trans	-65.6	-44.4	173.1	-80.1	-176.7	-84.8	119.6	-7.6	112	E13 A16 N17 I18 C22 R23 Q24	E13-R20 IonicContact OE1-CZ 3.91Å; E13-R20 IonicContact OE1-NH2 2.68Å; E13-R20 PolarHBondContact OE1-NH2 3.28Å; A16-R20 WeakPolarHBondContact O-CB 3.42Å; A16-R20 WeakPolarHBondContact O-CG 3.46Å; A16-R20 PolarHBondContact O-N 3.14Å; A16-R20 PolarHBondContact O-NE 3.29Å; N17-R20 VanDerWaalsContact CG-NH2 3.33Å; N17-R20 PolarHBondContact O-N 2.75Å; N17-R20 PolarHBondContact OD1-NH1 3.5Å; N17-R20 PolarHBondContact OD1-NH2 3.43Å; I18-R20 VanDerWaalsContact C-N 3.28Å; I18-R20 PolarHBondContact O-N 2.89Å; R20-C22 VanDerWaalsContact C-N 3.32Å; R20-C22 PolarHBondContact O-N 2.97Å; R20-R23 PolarHBondContact O-N 2.86Å; R20-Q24 WeakPolarHBondContact O-CB 3.44Å; R20-Q24 VanDerWaalsContact O-CG 3.29Å; R20-Q24 WeakPolarHBondContact O-CG 3.47Å; R20-Q24 PolarHBondContact O-N 2.97Å
21	A	96.3	Very high	94.1	Very high	30 Å²	30	71.6 Å²	71.6	25%	0.248	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-42.3	178.3	0	0	0	0	0	111.8	N17 I18 R23 Q24 Q25	N17-A21 WeakPolarHBondContact O-CB 3.38Å; N17-A21 PolarHBondContact O-N 3.14Å; I18-A21 WeakPolarHBondContact O-CB 3.48Å; I18-A21 PolarHBondContact O-N 3.37Å; A21-R23 PolarHBondContact O-N 3.3Å; A21-R23 VanDerWaalsContact O-N 3.12Å; A21-Q24 PolarHBondContact O-N 3.38Å; A21-Q25 WeakPolarHBondContact O-CB 3.38Å; A21-Q25 PolarHBondContact O-N 3.09Å
22	C	94.1	Very high	93.3	Very high	13 Å²	13	74.2 Å²	74.2	9%	0.088	38%	0.384	C	S	.	.	H	α-helix	trans	-56.9	-26.5	174.7	-68	0	0	0	0	113.5	I18 R20 L28 F29	I18-C22 PolarHBondContact O-N 3.25Å; I18-C22 PolarHBondContact O-SG 3.25Å; I18-C22 VanDerWaalsContact O-SG 3.37Å; R20-C22 VanDerWaalsContact C-N 3.32Å; R20-C22 PolarHBondContact O-N 2.97Å; C22-L28 CarbonylContact O-C 3.36Å; C22-F29 VanDerWaalsContact O-CA 3.29Å; C22-F29 WeakPolarHBondContact O-CA 3.11Å; C22-F29 PolarHBondContact O-N 3.14Å
23	R	92.6	Very high	92.4	Very high	173 Å²	173	75.1 Å²	75.1	65%	0.653	38%	0.383	S	S	*	.	H	α-helix	trans	-98.4	-28.8	178.9	-63.3	-178.1	70.1	107.9	3	114.1	R20 A21 L32	R20-R23 PolarHBondContact O-N 2.86Å; A21-R23 PolarHBondContact O-N 3.3Å; A21-R23 VanDerWaalsContact O-N 3.12Å; R23-L32 HydrophobicContact CG-CD2 4.07Å
24	Q	94.8	Very high	91	Very high	148 Å²	148	76.2 Å²	76.2	69%	0.692	39%	0.388	S	S	*	.	H	α-helix	trans	-90.6	-27.3	-174.3	-70.9	176.6	-10.8	0	0	112.6	R20 A21	R20-Q24 WeakPolarHBondContact O-CB 3.44Å; R20-Q24 VanDerWaalsContact O-CG 3.29Å; R20-Q24 WeakPolarHBondContact O-CG 3.47Å; R20-Q24 PolarHBondContact O-N 2.97Å; A21-Q24 PolarHBondContact O-N 3.38Å
25	Q	93.9	Very high	89	Confident	112 Å²	112	79.8 Å²	79.8	52%	0.523	41%	0.406	S	S	.	.	S	Bend	trans	-87.8	115.9	176.6	-64.9	-169.5	-21.6	0	0	109.5	A21 A27 L28 F29	A21-Q25 WeakPolarHBondContact O-CB 3.38Å; A21-Q25 PolarHBondContact O-N 3.09Å; Q25-A27 VanDerWaalsContact C-N 3.27Å; Q25-A27 PolarHBondContact O-N 2.76Å; Q25-A27 VanDerWaalsContact O-N 3.16Å; Q25-L28 HydrophobicContact CB-CB 4.29Å; Q25-L28 HydrophobicContact CB-CD1 4.13Å; Q25-L28 HydrophobicContact CB-CG 4.08Å; Q25-L28 PolarHBondContact O-N 2.96Å; Q25-F29 WeakPolarHBondContact O-CB 3.33Å; Q25-F29 PolarHBondContact O-N 3.41Å
26	E	89.5	Confident	86.9	Confident	123 Å²	123	87.4 Å²	87.4	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-49.6	-46.3	-175.7	-171.2	60.6	-143.8	0	0	112.5	L28 F29 Q30	E26-L28 VanDerWaalsContact C-N 3.35Å; E26-L28 PolarHBondContact O-N 3.29Å; E26-F29 PolarHBondContact O-N 2.8Å; E26-Q30 VanDerWaalsContact O-CG 3.3Å; E26-Q30 WeakPolarHBondContact O-CG 3.26Å; E26-Q30 PolarHBondContact O-N 3.13Å; E26-Q30 PolarHBondContact OE1-NE2 3.13Å
27	A	88.9	Confident	84.6	Confident	75 Å²	75	93.6 Å²	93.6	62%	0.62	46%	0.458	S	S	*	.	H	α-helix	trans	-61.6	-39.2	179.9	0	0	0	0	0	113.4	Q25 L31	Q25-A27 VanDerWaalsContact C-N 3.27Å; Q25-A27 PolarHBondContact O-N 2.76Å; Q25-A27 VanDerWaalsContact O-N 3.16Å; A27-L31 WeakPolarHBondContact O-CG 3.45Å
28	L	89.8	Confident	82.1	Confident	46 Å²	46	99.8 Å²	99.8	24%	0.241	48%	0.484	C	S	.	.	H	α-helix	trans	-77.2	-35.7	177.6	-57.7	-176.9	0	0	0	111.3	C22 Q25 E26 Q30 L31 L32 F49	C22-L28 CarbonylContact O-C 3.36Å; Q25-L28 HydrophobicContact CB-CB 4.29Å; Q25-L28 HydrophobicContact CB-CD1 4.13Å; Q25-L28 HydrophobicContact CB-CG 4.08Å; Q25-L28 PolarHBondContact O-N 2.96Å; E26-L28 VanDerWaalsContact C-N 3.35Å; E26-L28 PolarHBondContact O-N 3.29Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; L28-L31 PolarHBondContact O-N 3.43Å; L28-L32 PolarHBondContact O-N 2.96Å; L28-F49 HydrophobicContact CB-CE1 4.46Å; L28-F49 HydrophobicContact CB-CZ 4.08Å; L28-F49 HydrophobicContact CD2-CE2 4.38Å; L28-F49 HydrophobicContact CD2-CZ 3.98Å; L28-F49 WeakPolarHBondContact O-CE1 3.38Å
29	F	88.1	Confident	79.8	Confident	61 Å²	61	101.5 Å²	101.5	27%	0.268	51%	0.51	S	S	.	.	H	α-helix	trans	-63.7	-42.5	177.9	-178.8	-114.7	0	0	0	110.9	C22 Q25 E26 L31 L32 I33	C22-F29 VanDerWaalsContact O-CA 3.29Å; C22-F29 WeakPolarHBondContact O-CA 3.11Å; C22-F29 PolarHBondContact O-N 3.14Å; Q25-F29 WeakPolarHBondContact O-CB 3.33Å; Q25-F29 PolarHBondContact O-N 3.41Å; E26-F29 PolarHBondContact O-N 2.8Å; F29-L31 VanDerWaalsContact C-N 3.31Å; F29-L31 PolarHBondContact O-N 3.23Å; F29-L32 WeakPolarHBondContact O-CA 3.2Å; F29-L32 WeakPolarHBondContact O-CB 3.35Å; F29-L32 PolarHBondContact O-N 2.6Å; F29-I33 HydrophobicContact CD1-CD1 4.22Å; F29-I33 HydrophobicContact CD2-CG2 4.06Å; F29-I33 HydrophobicContact CE1-CD1 3.76Å; F29-I33 HydrophobicContact CE1-CG2 4.14Å; F29-I33 HydrophobicContact CE2-CG2 3.51Å; F29-I33 HydrophobicContact CZ-CD1 4.2Å; F29-I33 HydrophobicContact CZ-CG2 3.56Å; F29-I33 WeakPolarHBondContact O-CG1 3.42Å; F29-I33 PolarHBondContact O-N 2.9Å
30	Q	86.1	Confident	77.6	Confident	95 Å²	95	104.8 Å²	104.8	44%	0.444	52%	0.517	S	S	.	.	H	α-helix	trans	-57.7	-43.4	174.6	-70.5	-59.1	-35.6	0	0	111.9	E26 L28 L32 I33 E34	E26-Q30 VanDerWaalsContact O-CG 3.3Å; E26-Q30 WeakPolarHBondContact O-CG 3.26Å; E26-Q30 PolarHBondContact O-N 3.13Å; E26-Q30 PolarHBondContact OE1-NE2 3.13Å; L28-Q30 VanDerWaalsContact C-N 3.34Å; Q30-L32 VanDerWaalsContact C-N 3.29Å; Q30-L32 PolarHBondContact O-N 3.47Å; Q30-I33 PolarHBondContact O-N 3.36Å; Q30-E34 WeakPolarHBondContact O-CB 3.47Å; Q30-E34 PolarHBondContact O-N 2.84Å
31	L	85.8	Confident	75.1	Confident	77 Å²	77	109.4 Å²	109.4	40%	0.403	54%	0.54	S	S	.	.	H	α-helix	trans	-65.5	-32.5	175.5	-63.8	170.9	0	0	0	112.6	A27 L28 F29 F49	A27-L31 WeakPolarHBondContact O-CG 3.45Å; L28-L31 PolarHBondContact O-N 3.43Å; F29-L31 VanDerWaalsContact C-N 3.31Å; F29-L31 PolarHBondContact O-N 3.23Å; L31-F49 HydrophobicContact CB-CB 4.06Å; L31-F49 HydrophobicContact CB-CD1 3.86Å; L31-F49 HydrophobicContact CB-CD2 3.63Å; L31-F49 HydrophobicContact CB-CE1 4.18Å; L31-F49 HydrophobicContact CB-CE2 3.97Å; L31-F49 HydrophobicContact CB-CG 3.56Å; L31-F49 HydrophobicContact CB-CZ 4.24Å; L31-F49 HydrophobicContact CD1-CD2 3.88Å; L31-F49 HydrophobicContact CD1-CE2 3.7Å; L31-F49 HydrophobicContact CD1-CZ 4.36Å; L31-F49 HydrophobicContact CG-CD2 4.36Å; L31-F49 WeakPolarHBondContact O-CB 3.3Å
32	L	82.3	Confident	72.6	Confident	58 Å²	58	115.3 Å²	115.3	30%	0.304	57%	0.567	S	S	.	*	H	α-helix	trans	-72.1	-35.8	178.2	-172.2	69.2	0	0	0	112.9	R23 L28 F29 Q30 F49 K50	R23-L32 HydrophobicContact CG-CD2 4.07Å; L28-L32 PolarHBondContact O-N 2.96Å; F29-L32 WeakPolarHBondContact O-CA 3.2Å; F29-L32 WeakPolarHBondContact O-CB 3.35Å; F29-L32 PolarHBondContact O-N 2.6Å; Q30-L32 VanDerWaalsContact C-N 3.29Å; Q30-L32 PolarHBondContact O-N 3.47Å; L32-F49 HydrophobicContact CB-CD1 3.96Å; L32-F49 HydrophobicContact CB-CE1 4.19Å; L32-F49 HydrophobicContact CD1-CD1 4.08Å; L32-F49 HydrophobicContact CD1-CE1 4.49Å; L32-K50 HydrophobicContact CD1-CB 4.5Å
33	I	77.8	Confident	70.4	Confident	80 Å²	80	122 Å²	122	41%	0.41	59%	0.594	S	S	.	*	H	α-helix	trans	-97.7	0.5	-179.3	69.9	168.9	0	0	0	113.4	F29 Q30 E35	F29-I33 HydrophobicContact CD1-CD1 4.22Å; F29-I33 HydrophobicContact CD2-CG2 4.06Å; F29-I33 HydrophobicContact CE1-CD1 3.76Å; F29-I33 HydrophobicContact CE1-CG2 4.14Å; F29-I33 HydrophobicContact CE2-CG2 3.51Å; F29-I33 HydrophobicContact CZ-CD1 4.2Å; F29-I33 HydrophobicContact CZ-CG2 3.56Å; F29-I33 WeakPolarHBondContact O-CG1 3.42Å; F29-I33 PolarHBondContact O-N 2.9Å; Q30-I33 PolarHBondContact O-N 3.36Å; I33-E35 PolarHBondContact O-N 3.11Å
34	E	68.8	Low	68.1	Low	121 Å²	121	121.8 Å²	121.8	57%	0.565	60%	0.598	S	S	*	*			trans	-64.5	88.4	176.1	-167.2	164.7	-163.3	0	0	108.7	Q30	Q30-E34 WeakPolarHBondContact O-CB 3.47Å; Q30-E34 PolarHBondContact O-N 2.84Å
35	E	56	Low	65.8	Low	168 Å²	168	120.9 Å²	120.9	79%	0.785	59%	0.592	S	S	*	*			trans	-61.9	139.9	175.6	-74.2	-173.2	161.2	0	0	109.2	I33 K37	I33-E35 PolarHBondContact O-N 3.11Å; E35-K37 VanDerWaalsContact C-N 3.26Å; E35-K37 PolarHBondContact O-N 2.97Å
36	K	54.8	Low	63.9	Low	170 Å²	170	118.1 Å²	118.1	74%	0.739	59%	0.589	S	S	*	*			trans	-59.3	91.2	166.7	-71.6	178.7	-179.9	165.5	0	108.2	E38	K36-E38 PolarHBondContact O-N 3.43Å; K36-E38 VanDerWaalsContact O-N 3.13Å
37	K	48.7	Very low	62.3	Low	166 Å²	166	114.3 Å²	114.3	72%	0.722	57%	0.574	S	S	*	*			trans	-56	120.9	178.7	-72.3	-176.6	-179.5	172.9	0	109.3	E35 G39 E40	E35-K37 VanDerWaalsContact C-N 3.26Å; E35-K37 PolarHBondContact O-N 2.97Å; K37-G39 VanDerWaalsContact C-N 3.27Å; K37-G39 PolarHBondContact O-N 3.27Å; K37-E40 PolarHBondContact O-N 2.72Å; K37-E40 VanDerWaalsContact O-N 3.13Å
38	E	45.8	Very low	61.8	Low	201 Å²	201	113.6 Å²	113.6	94%	0.939	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	86	175	-74.7	-173.2	142.1	0	0	110.1	K36	K36-E38 PolarHBondContact O-N 3.43Å; K36-E38 VanDerWaalsContact O-N 3.13Å
39	G	47.9	Very low	61.5	Low	70 Å²	70	113.4 Å²	113.4	72%	0.722	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.9	-31.1	-176.2	0	0	0	0	0	112.5	K37 K41	K37-G39 VanDerWaalsContact C-N 3.27Å; K37-G39 PolarHBondContact O-N 3.27Å; G39-K41 PolarHBondContact O-N 3.37Å
40	E	50	Low	61.4	Low	121 Å²	121	116.7 Å²	116.7	57%	0.565	57%	0.571	S	S	*	*			trans	-99.2	49.2	174.2	-64.5	-161	160.9	0	0	111.6	K37 N42 K43	K37-E40 PolarHBondContact O-N 2.72Å; K37-E40 VanDerWaalsContact O-N 3.13Å; E40-N42 PolarHBondContact O-N 2.97Å; E40-K43 PolarHBondContact O-N 2.94Å
41	K	46.3	Very low	61.5	Low	190 Å²	190	114.2 Å²	114.2	83%	0.826	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-2.5	175	-77.8	-175.4	175.9	178	0	114.5	G39	G39-K41 PolarHBondContact O-N 3.37Å
42	N	42.4	Very low	61.6	Low	154 Å²	154	114.2 Å²	114.2	82%	0.824	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	-1.8	-175.5	-79.3	-15.5	0	0	0	116.3	E40 K44	E40-N42 PolarHBondContact O-N 2.97Å; N42-K44 PolarHBondContact O-N 3.49Å
43	K	47.4	Very low	62	Low	152 Å²	152	112.1 Å²	112.1	66%	0.661	55%	0.554	S	S	*	*			trans	-97.8	77.7	164.6	-76.3	-174.6	-178.3	172.5	0	108.6	E40 F45	E40-K43 PolarHBondContact O-N 2.94Å; K43-F45 VanDerWaalsContact C-N 3.27Å; K43-F45 PolarHBondContact O-N 3.48Å
44	K	45.3	Very low	62.7	Low	169 Å²	169	111.6 Å²	111.6	74%	0.735	55%	0.551	S	S	*	*			trans	-58.5	90.7	168.4	-67.8	176.7	176.3	177.5	0	108.3	N42 A46	N42-K44 PolarHBondContact O-N 3.49Å; K44-A46 PolarHBondContact O-N 2.96Å
45	F	47	Very low	63.8	Low	130 Å²	130	106 Å²	106	57%	0.57	53%	0.526	S	S	*	.			trans	-62.2	102.1	140.4	-70.3	-73.3	0	0	0	104.4	K43 V47	K43-F45 VanDerWaalsContact C-N 3.27Å; K43-F45 PolarHBondContact O-N 3.48Å; F45-V47 PolarHBondContact O-N 3.38Å; F45-V47 VanDerWaalsContact O-N 3.1Å
46	A	52.8	Low	65.6	Low	54 Å²	54	102.1 Å²	102.1	45%	0.446	51%	0.51	S	S	.	.	S	Bend	trans	-63.4	-13.8	-175.1	0	0	0	0	0	112.1	K44 T85	K44-A46 PolarHBondContact O-N 2.96Å; A46-T85 VanDerWaalsContact CB-O 3.31Å; A46-T85 WeakPolarHBondContact CB-O 3.45Å
47	V	57	Low	67.6	Low	43 Å²	43	95.7 Å²	95.7	26%	0.261	49%	0.485	S	S	.	.	S	Bend	trans	-138.3	125.7	172.8	-179.1	0	0	0	0	106.6	F45 T51 F84	F45-V47 PolarHBondContact O-N 3.38Å; F45-V47 VanDerWaalsContact O-N 3.1Å; V47-T51 HydrophobicContact CG1-CG2 3.66Å; V47-F84 HydrophobicContact CB-CD1 4.5Å; V47-F84 HydrophobicContact CG1-CD1 4.01Å; V47-F84 HydrophobicContact CG1-CE1 4.22Å; V47-F84 HydrophobicContact CG2-CD1 4.11Å
48	D	77.5	Confident	69.9	Low	60 Å²	60	89.9 Å²	89.9	32%	0.321	46%	0.46	S	S	.	.			trans	-73.7	153	174.2	63.7	40.8	0	0	0	110.2	K50 T51 L52	D48-K50 PolarHBondContact O-N 2.88Å; D48-K50 VanDerWaalsContact O-N 3.09Å; D48-K50 WeakPolarHBondContact OD1-CB 3.42Å; D48-K50 PolarHBondContact OD1-N 3.43Å; D48-T51 PolarHBondContact O-N 3.02Å; D48-T51 PolarHBondContact OD1-N 3.3Å; D48-T51 PolarHBondContact OD1-OG1 2.92Å; D48-T51 VanDerWaalsContact OD1-OG1 3.05Å; D48-L52 PolarHBondContact O-N 2.86Å; D48-L52 VanDerWaalsContact O-N 3.11Å
49	F	84.3	Confident	72.2	Confident	41 Å²	41	82.2 Å²	82.2	18%	0.18	43%	0.425	C	S	.	.	H	α-helix	trans	-59.4	-25.7	-176.1	-177.2	-99.1	0	0	0	112.5	L28 L31 L32 L52 A53	L28-F49 HydrophobicContact CB-CE1 4.46Å; L28-F49 HydrophobicContact CB-CZ 4.08Å; L28-F49 HydrophobicContact CD2-CE2 4.38Å; L28-F49 HydrophobicContact CD2-CZ 3.98Å; L28-F49 WeakPolarHBondContact O-CE1 3.38Å; L31-F49 HydrophobicContact CB-CB 4.06Å; L31-F49 HydrophobicContact CB-CD1 3.86Å; L31-F49 HydrophobicContact CB-CD2 3.63Å; L31-F49 HydrophobicContact CB-CE1 4.18Å; L31-F49 HydrophobicContact CB-CE2 3.97Å; L31-F49 HydrophobicContact CB-CG 3.56Å; L31-F49 HydrophobicContact CB-CZ 4.24Å; L31-F49 HydrophobicContact CD1-CD2 3.88Å; L31-F49 HydrophobicContact CD1-CE2 3.7Å; L31-F49 HydrophobicContact CD1-CZ 4.36Å; L31-F49 HydrophobicContact CG-CD2 4.36Å; L31-F49 WeakPolarHBondContact O-CB 3.3Å; L32-F49 HydrophobicContact CB-CD1 3.96Å; L32-F49 HydrophobicContact CB-CE1 4.19Å; L32-F49 HydrophobicContact CD1-CD1 4.08Å; L32-F49 HydrophobicContact CD1-CE1 4.49Å; F49-L52 HydrophobicContact CD2-CD2 4.19Å; F49-L52 HydrophobicContact CE2-CD2 4.4Å; F49-L52 PolarHBondContact O-N 3.03Å; F49-A53 PolarHBondContact O-N 3.47Å
50	K	86.6	Confident	74.5	Confident	130 Å²	130	80.1 Å²	80.1	57%	0.565	40%	0.397	S	S	*	.	H	α-helix	trans	-62.8	-53.2	172.8	176.7	-171.7	171.8	-169.7	0	110.7	L32 D48 L52 A53 D54	L32-K50 HydrophobicContact CD1-CB 4.5Å; D48-K50 PolarHBondContact O-N 2.88Å; D48-K50 VanDerWaalsContact O-N 3.09Å; D48-K50 WeakPolarHBondContact OD1-CB 3.42Å; D48-K50 PolarHBondContact OD1-N 3.43Å; K50-L52 PolarHBondContact O-N 3.04Å; K50-A53 WeakPolarHBondContact O-CB 3.47Å; K50-A53 PolarHBondContact O-N 2.96Å; K50-D54 PolarHBondContact O-N 2.91Å
51	T	86.4	Confident	76.8	Confident	43 Å²	43	76.6 Å²	76.6	26%	0.264	38%	0.382	S	S	.	.	H	α-helix	trans	-57.6	-38.8	175.9	-60.4	0	0	0	0	111.2	V47 D48 A53 D54 V55	V47-T51 HydrophobicContact CG1-CG2 3.66Å; D48-T51 PolarHBondContact O-N 3.02Å; D48-T51 PolarHBondContact OD1-N 3.3Å; D48-T51 PolarHBondContact OD1-OG1 2.92Å; D48-T51 VanDerWaalsContact OD1-OG1 3.05Å; T51-A53 PolarHBondContact O-N 3.36Å; T51-D54 PolarHBondContact O-N 3.46Å; T51-V55 HydrophobicContact CG2-CG2 4.32Å; T51-V55 WeakPolarHBondContact O-CG2 3.23Å; T51-V55 PolarHBondContact O-N 3.03Å
52	L	87.8	Confident	79.1	Confident	77 Å²	77	70 Å²	70	40%	0.403	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-43.5	174.3	-179.6	65.2	0	0	0	112.5	D48 F49 K50 L56 F84	D48-L52 PolarHBondContact O-N 2.86Å; D48-L52 VanDerWaalsContact O-N 3.11Å; F49-L52 HydrophobicContact CD2-CD2 4.19Å; F49-L52 HydrophobicContact CE2-CD2 4.4Å; F49-L52 PolarHBondContact O-N 3.03Å; K50-L52 PolarHBondContact O-N 3.04Å; L52-L56 VanDerWaalsContact O-CB 3.3Å; L52-L56 WeakPolarHBondContact O-CB 3.41Å; L52-L56 PolarHBondContact O-N 3.11Å; L52-F84 HydrophobicContact CD1-CD1 4.4Å; L52-F84 HydrophobicContact CD1-CE1 3.64Å; L52-F84 HydrophobicContact CD1-CE2 4.42Å; L52-F84 HydrophobicContact CD1-CZ 3.6Å
53	A	91.3	Very high	81.6	Confident	15 Å²	15	66.2 Å²	66.2	12%	0.124	33%	0.331	C	S	.	.	H	α-helix	trans	-66.3	-40.3	177.8	0	0	0	0	0	112	F49 K50 T51 L56 V57	F49-A53 PolarHBondContact O-N 3.47Å; K50-A53 WeakPolarHBondContact O-CB 3.47Å; K50-A53 PolarHBondContact O-N 2.96Å; T51-A53 PolarHBondContact O-N 3.36Å; A53-L56 PolarHBondContact O-N 3.05Å; A53-V57 WeakPolarHBondContact O-CG2 3.38Å; A53-V57 PolarHBondContact O-N 2.87Å
54	D	92.4	Very high	84	Confident	68 Å²	68	60.9 Å²	60.9	36%	0.364	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-46.3	178.1	-68.2	-28.2	0	0	0	110.9	K50 T51 L56 V57 Q58 E80	K50-D54 PolarHBondContact O-N 2.91Å; T51-D54 PolarHBondContact O-N 3.46Å; D54-L56 PolarHBondContact O-N 2.81Å; D54-V57 PolarHBondContact O-N 3.37Å; D54-Q58 PolarHBondContact O-N 3.45Å; D54-E80 HydrophobicContact CB-CG 3.91Å
55	V	92.9	Very high	86.4	Confident	5 Å²	5	53 Å²	53	3%	0.03	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-44.7	174.2	177.6	0	0	0	0	111.4	T51 V57 Q58 E59 E80 S81 F84	T51-V55 HydrophobicContact CG2-CG2 4.32Å; T51-V55 WeakPolarHBondContact O-CG2 3.23Å; T51-V55 PolarHBondContact O-N 3.03Å; V55-V57 VanDerWaalsContact C-N 3.34Å; V55-V57 PolarHBondContact O-N 3.24Å; V55-Q58 PolarHBondContact O-N 3.29Å; V55-E59 WeakPolarHBondContact O-CB 3.19Å; V55-E59 PolarHBondContact O-N 2.86Å; V55-E80 HydrophobicContact CB-CB 4.45Å; V55-E80 HydrophobicContact CG2-CB 3.68Å; V55-E80 HydrophobicContact CG2-CG 4.09Å; V55-S81 WeakPolarHBondContact CG2-O 3.46Å; V55-F84 HydrophobicContact CB-CE1 3.9Å; V55-F84 HydrophobicContact CB-CE2 4.43Å; V55-F84 HydrophobicContact CB-CZ 3.46Å; V55-F84 VanDerWaalsContact CB-CZ 3.46Å; V55-F84 HydrophobicContact CG1-CE1 4.05Å; V55-F84 HydrophobicContact CG1-CE2 3.71Å; V55-F84 HydrophobicContact CG1-CZ 3.21Å; V55-F84 HydrophobicContact CG2-CE1 3.75Å; V55-F84 HydrophobicContact CG2-CZ 3.8Å
56	L	93.8	Very high	88.7	Confident	86 Å²	86	49.6 Å²	49.6	45%	0.45	26%	0.261	S	S	.	.	H	α-helix	trans	-59.8	-44.6	179.2	176.1	63.6	0	0	0	111.5	I18 L52 A53 D54 E59 V60	I18-L56 HydrophobicContact CG2-CD2 4.01Å; L52-L56 VanDerWaalsContact O-CB 3.3Å; L52-L56 WeakPolarHBondContact O-CB 3.41Å; L52-L56 PolarHBondContact O-N 3.11Å; A53-L56 PolarHBondContact O-N 3.05Å; D54-L56 PolarHBondContact O-N 2.81Å; L56-E59 PolarHBondContact O-N 3.04Å; L56-V60 HydrophobicContact CD1-CG2 4.06Å; L56-V60 HydrophobicContact CG-CG2 4.47Å; L56-V60 WeakPolarHBondContact O-CB 3.37Å; L56-V60 WeakPolarHBondContact O-CG2 3.29Å; L56-V60 PolarHBondContact O-N 3.1Å
57	V	96.8	Very high	90.8	Very high	35 Å²	35	52.9 Å²	52.9	21%	0.212	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-47	177.5	163.8	0	0	0	0	110.7	A15 I18 A53 D54 V55 V60 I61	A15-V57 HydrophobicContact CB-CG1 3.69Å; I18-V57 HydrophobicContact CB-CG2 4.36Å; I18-V57 HydrophobicContact CG2-CG2 4.06Å; A53-V57 WeakPolarHBondContact O-CG2 3.38Å; A53-V57 PolarHBondContact O-N 2.87Å; D54-V57 PolarHBondContact O-N 3.37Å; V55-V57 VanDerWaalsContact C-N 3.34Å; V55-V57 PolarHBondContact O-N 3.24Å; V57-V60 PolarHBondContact O-N 3Å; V57-I61 HydrophobicContact CG1-CD1 4.14Å; V57-I61 WeakPolarHBondContact O-CG1 3.49Å; V57-I61 PolarHBondContact O-N 2.99Å; V57-I61 VanDerWaalsContact O-N 3.12Å
58	Q	95.9	Very high	92.6	Very high	43 Å²	43	56 Å²	56	20%	0.201	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-47	179.2	-171.5	179.1	-71.7	0	0	111.7	D54 V55 I61 K62 G78 E80	D54-Q58 PolarHBondContact O-N 3.45Å; V55-Q58 PolarHBondContact O-N 3.29Å; Q58-I61 PolarHBondContact O-N 3.4Å; Q58-K62 WeakPolarHBondContact O-CB 3.21Å; Q58-K62 PolarHBondContact O-N 3.34Å; Q58-G78 VanDerWaalsContact OE1-CA 3.29Å; Q58-E80 PolarHBondContact NE2-O 3.26Å
59	E	95.4	Very high	93.5	Very high	41 Å²	41	55.5 Å²	55.5	19%	0.192	28%	0.276	C	S	.	.	H	α-helix	trans	-70.4	-35.8	-177.3	-163.5	58.2	-149.8	0	0	111.7	V55 L56 I61 K62 Q63	V55-E59 WeakPolarHBondContact O-CB 3.19Å; V55-E59 PolarHBondContact O-N 2.86Å; L56-E59 PolarHBondContact O-N 3.04Å; E59-I61 VanDerWaalsContact C-N 3.34Å; E59-I61 PolarHBondContact O-N 3.13Å; E59-K62 PolarHBondContact O-N 3.48Å; E59-Q63 HydrophobicContact CG-CG 4.1Å; E59-Q63 VanDerWaalsContact O-CB 3.29Å; E59-Q63 WeakPolarHBondContact O-CB 3.43Å; E59-Q63 WeakPolarHBondContact O-CG 3.26Å; E59-Q63 PolarHBondContact O-N 3Å; E59-Q63 WeakPolarHBondContact OE1-CG 3.47Å; E59-Q63 PolarHBondContact OE1-NE2 3.06Å
60	V	96.3	Very high	94	Very high	25 Å²	25	58.9 Å²	58.9	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-45.1	172.1	165.5	0	0	0	0	110.8	K14 I18 L56 V57 N64	K14-V60 HydrophobicContact CD-CG1 3.91Å; K14-V60 HydrophobicContact CG-CG1 4.24Å; I18-V60 HydrophobicContact CD1-CB 4.2Å; I18-V60 HydrophobicContact CD1-CG1 4.07Å; I18-V60 HydrophobicContact CD1-CG2 3.86Å; L56-V60 HydrophobicContact CD1-CG2 4.06Å; L56-V60 HydrophobicContact CG-CG2 4.47Å; L56-V60 WeakPolarHBondContact O-CB 3.37Å; L56-V60 WeakPolarHBondContact O-CG2 3.29Å; L56-V60 PolarHBondContact O-N 3.1Å; V57-V60 PolarHBondContact O-N 3Å; V60-N64 WeakPolarHBondContact O-CB 3.43Å; V60-N64 PolarHBondContact O-N 3.44Å; V60-N64 PolarHBondContact O-ND2 2.97Å
61	I	96.8	Very high	94.3	Very high	48 Å²	48	54.4 Å²	54.4	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-51.2	177.3	-68.4	167.3	0	0	0	109.8	V11 A15 V57 Q58 E59 Q63 N64 M65	V11-I61 HydrophobicContact CG2-CG1 4.37Å; V11-I61 HydrophobicContact CG2-CG2 4.11Å; A15-I61 HydrophobicContact CB-CD1 4.08Å; A15-I61 HydrophobicContact CB-CG1 4.31Å; V57-I61 HydrophobicContact CG1-CD1 4.14Å; V57-I61 WeakPolarHBondContact O-CG1 3.49Å; V57-I61 PolarHBondContact O-N 2.99Å; V57-I61 VanDerWaalsContact O-N 3.12Å; Q58-I61 PolarHBondContact O-N 3.4Å; E59-I61 VanDerWaalsContact C-N 3.34Å; E59-I61 PolarHBondContact O-N 3.13Å; I61-Q63 PolarHBondContact O-N 3.5Å; I61-N64 PolarHBondContact O-N 2.85Å; I61-M65 HydrophobicContact CG2-CG 4.36Å; I61-M65 WeakPolarHBondContact O-CB 3.43Å; I61-M65 VanDerWaalsContact O-CG 3.26Å; I61-M65 WeakPolarHBondContact O-CG 3.5Å; I61-M65 PolarHBondContact O-N 3.27Å
62	K	96.1	Very high	94.6	Very high	51 Å²	51	54.5 Å²	54.5	22%	0.222	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-51.1	-178.8	-174.6	179.3	176.1	-171	0	112.3	Q58 E59 N64 M65 E66 E73 I76	Q58-K62 WeakPolarHBondContact O-CB 3.21Å; Q58-K62 PolarHBondContact O-N 3.34Å; E59-K62 PolarHBondContact O-N 3.48Å; K62-N64 PolarHBondContact O-N 2.88Å; K62-M65 PolarHBondContact O-N 3.12Å; K62-E66 WeakPolarHBondContact O-CB 3.4Å; K62-E66 PolarHBondContact O-N 3.31Å; K62-E73 HydrophobicContact CG-CB 4.44Å; K62-I76 HydrophobicContact CB-CG2 4.16Å; K62-I76 HydrophobicContact CG-CB 4.3Å; K62-I76 HydrophobicContact CG-CD1 4.49Å; K62-I76 HydrophobicContact CG-CG2 4.19Å
63	Q	95.1	Very high	94.6	Very high	75 Å²	75	52.5 Å²	52.5	35%	0.35	28%	0.281	S	S	.	.	H	α-helix	trans	-65.6	-38.8	-179.1	-69.4	-67.3	-30.8	0	0	112.8	E59 I61 N67	E59-Q63 HydrophobicContact CG-CG 4.1Å; E59-Q63 VanDerWaalsContact O-CB 3.29Å; E59-Q63 WeakPolarHBondContact O-CB 3.43Å; E59-Q63 WeakPolarHBondContact O-CG 3.26Å; E59-Q63 PolarHBondContact O-N 3Å; E59-Q63 WeakPolarHBondContact OE1-CG 3.47Å; E59-Q63 PolarHBondContact OE1-NE2 3.06Å; I61-Q63 PolarHBondContact O-N 3.5Å; Q63-N67 WeakPolarHBondContact O-CB 3.42Å; Q63-N67 VanDerWaalsContact O-CG 3.22Å; Q63-N67 PolarHBondContact O-N 3.33Å; Q63-N67 PolarHBondContact O-ND2 3.46Å
64	N	96.4	Very high	94.6	Very high	40 Å²	40	59 Å²	59	21%	0.214	31%	0.306	C	S	.	.	H	α-helix	trans	-68.2	-39	177.2	-78.2	-90.6	0	0	0	111.2	V11 K14 V60 I61 K62 K68	V11-N64 HydrophobicContact CB-CB 4.44Å; V11-N64 HydrophobicContact CG1-CB 3.45Å; V11-N64 VanDerWaalsContact CG1-CB 3.45Å; K14-N64 PolarHBondContact NZ-ND2 3.46Å; K14-N64 VanDerWaalsContact NZ-ND2 3.14Å; K14-N64 PolarHBondContact NZ-OD1 3.33Å; V60-N64 WeakPolarHBondContact O-CB 3.43Å; V60-N64 PolarHBondContact O-N 3.44Å; V60-N64 PolarHBondContact O-ND2 2.97Å; I61-N64 PolarHBondContact O-N 2.85Å; K62-N64 PolarHBondContact O-N 2.88Å; N64-K68 PolarHBondContact O-N 2.88Å
65	M	96.8	Very high	94.7	Very high	3 Å²	3	61 Å²	61	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-67.3	-40.6	175.9	-67.7	-56.7	-64.6	0	0	112.2	I4 E7 L8 V11 I61 K62 K68 F69 L72 I76	I4-M65 HydrophobicContact CG2-CE 3.96Å; E7-M65 HydrophobicContact CB-CE 4.41Å; E7-M65 HydrophobicContact CB-SD 3.97Å; E7-M65 HydrophobicContact CG-SD 3.59Å; E7-M65 VanDerWaalsContact CG-SD 3.59Å; L8-M65 HydrophobicContact CD2-CE 3.87Å; L8-M65 HydrophobicContact CD2-CG 4.26Å; L8-M65 HydrophobicContact CD2-SD 3.82Å; L8-M65 HydrophobicContact CG-CE 3.88Å; L8-M65 HydrophobicContact CG-SD 4.14Å; V11-M65 HydrophobicContact CG2-CG 4.46Å; V11-M65 HydrophobicContact CG2-SD 4.17Å; I61-M65 HydrophobicContact CG2-CG 4.36Å; I61-M65 WeakPolarHBondContact O-CB 3.43Å; I61-M65 VanDerWaalsContact O-CG 3.26Å; I61-M65 WeakPolarHBondContact O-CG 3.5Å; I61-M65 PolarHBondContact O-N 3.27Å; K62-M65 PolarHBondContact O-N 3.12Å; M65-K68 PolarHBondContact O-N 3.27Å; M65-F69 HydrophobicContact CE-CD2 3.84Å; M65-F69 HydrophobicContact CE-CE2 3.99Å; M65-F69 WeakPolarHBondContact O-CA 3.31Å; M65-F69 WeakPolarHBondContact O-CB 3.31Å; M65-F69 PolarHBondContact O-N 3.02Å; M65-L72 HydrophobicContact CB-CD2 4.28Å; M65-L72 HydrophobicContact CE-CD2 3.65Å; M65-I76 HydrophobicContact CB-CD1 3.5Å; M65-I76 HydrophobicContact CG-CD1 4.09Å
66	E	95.6	Very high	94.7	Very high	58 Å²	58	62.8 Å²	62.8	27%	0.271	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-49.3	174.5	-177.4	175.1	174.2	0	0	112	K62 K68 F69 P70 E73	K62-E66 WeakPolarHBondContact O-CB 3.4Å; K62-E66 PolarHBondContact O-N 3.31Å; E66-K68 PolarHBondContact O-N 3.02Å; E66-F69 CarbonylContact O-C 3.41Å; E66-F69 PolarHBondContact O-N 3.44Å; E66-P70 WeakPolarHBondContact O-CA 3.37Å; E66-P70 VanDerWaalsContact O-N 3.09Å; E66-E73 HydrophobicContact CB-CB 3.98Å; E66-E73 HydrophobicContact CG-CB 3.92Å; E66-E73 HydrophobicContact CG-CG 4.18Å; E66-E73 WeakPolarHBondContact OE2-CB 3.45Å
67	N	95.4	Very high	94.7	Very high	123 Å²	123	67 Å²	67	66%	0.658	34%	0.341	S	S	*	.	H	α-helix	trans	-59.7	-35.2	-178.6	-78	-43.3	0	0	0	112.6	Q63	Q63-N67 WeakPolarHBondContact O-CB 3.42Å; Q63-N67 VanDerWaalsContact O-CG 3.22Å; Q63-N67 PolarHBondContact O-N 3.33Å; Q63-N67 PolarHBondContact O-ND2 3.46Å
68	K	96.1	Very high	94.6	Very high	108 Å²	108	67.7 Å²	67.7	47%	0.47	35%	0.354	S	S	.	.	H	α-helix	trans	-89.2	-31.3	179.8	-166.7	168.2	-174.3	164.8	0	113.4	E7 N64 M65 E66	E7-K68 HydrophobicContact CB-CD 4.14Å; E7-K68 HydrophobicContact CG-CD 3.67Å; E7-K68 WeakPolarHBondContact OE2-CD 3.3Å; E7-K68 WeakPolarHBondContact OE2-CE 3.49Å; E7-K68 IonicContact OE2-NZ 2.6Å; E7-K68 PolarHBondContact OE2-NZ 2.87Å; N64-K68 PolarHBondContact O-N 2.88Å; M65-K68 PolarHBondContact O-N 3.27Å; E66-K68 PolarHBondContact O-N 3.02Å
69	F	95.9	Very high	94.4	Very high	50 Å²	50	74.3 Å²	74.3	22%	0.219	39%	0.386	C	S	.	.	S	Bend	trans	-131.1	78.7	-179.4	-53.1	-77.6	0	0	0	109.6	D3 I4 E7 M65 E66 G71 L72	D3-F69 HydrophobicContact CB-CE1 4.34Å; D3-F69 HydrophobicContact CB-CZ 4.14Å; I4-F69 HydrophobicContact CG1-CD1 4.22Å; I4-F69 HydrophobicContact CG1-CD2 4.46Å; I4-F69 HydrophobicContact CG1-CE1 3.94Å; I4-F69 HydrophobicContact CG1-CE2 4.19Å; I4-F69 HydrophobicContact CG1-CG 4.47Å; I4-F69 HydrophobicContact CG1-CZ 3.92Å; E7-F69 HydrophobicContact CB-CE2 3.71Å; E7-F69 HydrophobicContact CB-CZ 4.33Å; E7-F69 HydrophobicContact CG-CE2 4.04Å; M65-F69 HydrophobicContact CE-CD2 3.84Å; M65-F69 HydrophobicContact CE-CE2 3.99Å; M65-F69 WeakPolarHBondContact O-CA 3.31Å; M65-F69 WeakPolarHBondContact O-CB 3.31Å; M65-F69 PolarHBondContact O-N 3.02Å; E66-F69 CarbonylContact O-C 3.41Å; E66-F69 PolarHBondContact O-N 3.44Å; F69-G71 PolarHBondContact O-N 3.28Å; F69-L72 HydrophobicContact CB-CB 4.11Å; F69-L72 HydrophobicContact CB-CD2 4.01Å; F69-L72 HydrophobicContact CD2-CD2 4.34Å; F69-L72 HydrophobicContact CG-CD2 4.45Å; F69-L72 WeakPolarHBondContact O-CB 3.45Å; F69-L72 PolarHBondContact O-N 3.4Å; F69-L72 VanDerWaalsContact O-N 3.09Å
70	P	95.2	Very high	94.2	Very high	112 Å²	112	74.6 Å²	74.6	73%	0.727	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	133.6	-178	-27.2	35.2	0	0	0	112.3	E66	E66-P70 WeakPolarHBondContact O-CA 3.37Å; E66-P70 VanDerWaalsContact O-N 3.09Å
71	G	92	Very high	93.8	Very high	37 Å²	37	76.6 Å²	76.6	38%	0.381	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-9.3	-176.5	0	0	0	0	0	114.3	F69 E73	F69-G71 PolarHBondContact O-N 3.28Å; G71-E73 VanDerWaalsContact C-N 3.34Å; G71-E73 WeakPolarHBondContact CA-OE2 3.33Å; G71-E73 PolarHBondContact N-OE2 3.46Å
72	L	92.8	Very high	93.1	Very high	44 Å²	44	77.1 Å²	77.1	23%	0.23	41%	0.405	C	S	.	.			trans	-75.4	-22.9	177.4	-166.3	62.9	0	0	0	112.5	M65 F69 K74 N75 I76	M65-L72 HydrophobicContact CB-CD2 4.28Å; M65-L72 HydrophobicContact CE-CD2 3.65Å; F69-L72 HydrophobicContact CB-CB 4.11Å; F69-L72 HydrophobicContact CB-CD2 4.01Å; F69-L72 HydrophobicContact CD2-CD2 4.34Å; F69-L72 HydrophobicContact CG-CD2 4.45Å; F69-L72 WeakPolarHBondContact O-CB 3.45Å; F69-L72 PolarHBondContact O-N 3.4Å; F69-L72 VanDerWaalsContact O-N 3.09Å; L72-K74 PolarHBondContact O-N 2.86Å; L72-K74 VanDerWaalsContact O-N 3.14Å; L72-N75 PolarHBondContact O-N 2.78Å; L72-I76 HydrophobicContact CG-CD1 4.24Å; L72-I76 HydrophobicContact CG-CG1 4.41Å; L72-I76 PolarHBondContact O-N 3.09Å
73	E	88.4	Confident	92.5	Very high	35 Å²	35	80.2 Å²	80.2	16%	0.164	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-56.4	-31.9	-178.2	73.3	-70.5	164.1	0	0	113.4	K62 E66 G71 N75 I76	K62-E73 HydrophobicContact CG-CB 4.44Å; E66-E73 HydrophobicContact CB-CB 3.98Å; E66-E73 HydrophobicContact CG-CB 3.92Å; E66-E73 HydrophobicContact CG-CG 4.18Å; E66-E73 WeakPolarHBondContact OE2-CB 3.45Å; G71-E73 VanDerWaalsContact C-N 3.34Å; G71-E73 WeakPolarHBondContact CA-OE2 3.33Å; G71-E73 PolarHBondContact N-OE2 3.46Å; E73-N75 PolarHBondContact O-N 3.31Å; E73-I76 PolarHBondContact O-N 3.37Å
74	K	91	Very high	91.5	Very high	152 Å²	152	78.6 Å²	78.6	66%	0.661	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-72.2	-14.5	179.4	-58.9	179.2	-172.7	175	0	113.1	L72 F77	L72-K74 PolarHBondContact O-N 2.86Å; L72-K74 VanDerWaalsContact O-N 3.14Å; K74-F77 WeakPolarHBondContact O-CZ 3.16Å
75	N	93.9	Very high	90.4	Very high	110 Å²	110	79.6 Å²	79.6	59%	0.588	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-112	5.1	-178.5	-57.5	-59.3	0	0	0	112.2	L72 E73	L72-N75 PolarHBondContact O-N 2.78Å; E73-N75 PolarHBondContact O-N 3.31Å
76	I	93.3	Very high	89.1	Confident	43 Å²	43	81 Å²	81	22%	0.221	43%	0.428	C	S	.	.			trans	-101.1	105	175.4	-63.1	171.5	0	0	0	107.8	K62 M65 L72 E73	K62-I76 HydrophobicContact CB-CG2 4.16Å; K62-I76 HydrophobicContact CG-CB 4.3Å; K62-I76 HydrophobicContact CG-CD1 4.49Å; K62-I76 HydrophobicContact CG-CG2 4.19Å; M65-I76 HydrophobicContact CB-CD1 3.5Å; M65-I76 HydrophobicContact CG-CD1 4.09Å; L72-I76 HydrophobicContact CG-CD1 4.24Å; L72-I76 HydrophobicContact CG-CG1 4.41Å; L72-I76 PolarHBondContact O-N 3.09Å; E73-I76 PolarHBondContact O-N 3.37Å
77	F	94.4	Very high	87.8	Confident	175 Å²	175	83.7 Å²	83.7	77%	0.768	44%	0.444	S	S	*	.			trans	-106.3	153.4	176.4	-52	-76.6	0	0	0	109.7	K74	K74-F77 WeakPolarHBondContact O-CZ 3.16Å
78	G	93.1	Very high	86.7	Confident	48 Å²	48	88.5 Å²	88.5	50%	0.495	45%	0.453	S	S	.	.			trans	-153.7	175.8	179.3	0	0	0	0	0	111.8	Q58	Q58-G78 VanDerWaalsContact OE1-CA 3.29Å
79	E	93	Very high	85.5	Confident	183 Å²	183	86.1 Å²	86.1	86%	0.855	46%	0.459	S	S	*	.	S	Bend	trans	-71.6	-39	-178.8	179.9	172.1	-177.4	0	0	111.5
80	E	91.4	Very high	84.6	Confident	47 Å²	47	90.1 Å²	90.1	22%	0.22	48%	0.476	C	S	.	.	S	Bend	trans	-90.1	144.7	-169.9	-65.6	-60.2	159.2	0	0	112.7	D54 V55 Q58	D54-E80 HydrophobicContact CB-CG 3.91Å; V55-E80 HydrophobicContact CB-CB 4.45Å; V55-E80 HydrophobicContact CG2-CB 3.68Å; V55-E80 HydrophobicContact CG2-CG 4.09Å; Q58-E80 PolarHBondContact NE2-O 3.26Å
81	S	87.6	Confident	83.6	Confident	67 Å²	67	93.6 Å²	93.6	47%	0.469	48%	0.475	S	S	.	.			trans	-82.9	138.8	166.9	-176.9	0	0	0	0	109.5	V55 E83	V55-S81 WeakPolarHBondContact CG2-O 3.46Å; S81-E83 PolarHBondContact O-N 2.81Å; S81-E83 PolarHBondContact OG-N 2.79Å
82	N	82.4	Confident	82.6	Confident	59 Å²	59	95 Å²	95	32%	0.316	47%	0.473	S	S	.	.	S	Bend	trans	-76.1	3.3	170.6	68.8	-47	0	0	0	112.9	P93	N82-P93 CarbonylContact O-C 3.58Å
83	E	82.7	Confident	81	Confident	116 Å²	116	99.4 Å²	99.4	54%	0.542	51%	0.505	S	S	.	.			trans	-93.2	124.4	175.7	-63.7	-172.9	-176.5	0	0	111.6	S81 L92	S81-E83 PolarHBondContact O-N 2.81Å; S81-E83 PolarHBondContact OG-N 2.79Å; E83-L92 CarbonylContact C-O 3.2Å; E83-L92 WeakPolarHBondContact CA-O 3.32Å
84	F	74.8	Confident	80.6	Confident	41 Å²	41	102.7 Å²	102.7	18%	0.18	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	150.3	174.5	-59.4	-82.3	0	0	0	111.3	V47 L52 V55 R91 L92	V47-F84 HydrophobicContact CB-CD1 4.5Å; V47-F84 HydrophobicContact CG1-CD1 4.01Å; V47-F84 HydrophobicContact CG1-CE1 4.22Å; V47-F84 HydrophobicContact CG2-CD1 4.11Å; L52-F84 HydrophobicContact CD1-CD1 4.4Å; L52-F84 HydrophobicContact CD1-CE1 3.64Å; L52-F84 HydrophobicContact CD1-CE2 4.42Å; L52-F84 HydrophobicContact CD1-CZ 3.6Å; V55-F84 HydrophobicContact CB-CE1 3.9Å; V55-F84 HydrophobicContact CB-CE2 4.43Å; V55-F84 HydrophobicContact CB-CZ 3.46Å; V55-F84 VanDerWaalsContact CB-CZ 3.46Å; V55-F84 HydrophobicContact CG1-CE1 4.05Å; V55-F84 HydrophobicContact CG1-CE2 3.71Å; V55-F84 HydrophobicContact CG1-CZ 3.21Å; V55-F84 HydrophobicContact CG2-CE1 3.75Å; V55-F84 HydrophobicContact CG2-CZ 3.8Å; F84-R91 CarbonylContact O-C 3.49Å; F84-R91 VanDerWaalsContact O-CA 3.27Å; F84-R91 WeakPolarHBondContact O-CA 2.99Å; F84-L92 PolarHBondContact N-O 3.14Å; F84-L92 PolarHBondContact O-N 2.86Å
85	T	71.9	Confident	80.1	Confident	60 Å²	60	100.1 Å²	100.1	37%	0.368	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.4	165.4	-57.8	0	0	0	0	108.5	A46 K90	A46-T85 VanDerWaalsContact CB-O 3.31Å; A46-T85 WeakPolarHBondContact CB-O 3.45Å; T85-K90 WeakPolarHBondContact CA-O 3.5Å
86	N	70.8	Confident	79.3	Confident	34 Å²	34	99.5 Å²	99.5	18%	0.182	51%	0.51	C	S	.	.			trans	-81.7	176.4	177.4	69.4	15.8	0	0	0	112.2	W88 G89 K90 L92	N86-W88 HydrophobicContact CB-CE3 4.5Å; N86-W88 PolarHBondContact O-N 3.31Å; N86-W88 PolarHBondContact OD1-N 2.77Å; N86-W88 VanDerWaalsContact OD1-N 3.13Å; N86-G89 PolarHBondContact O-N 3.27Å; N86-G89 PolarHBondContact OD1-N 3.35Å; N86-K90 PolarHBondContact N-O 3.18Å; N86-K90 WeakPolarHBondContact OD1-CB 3.27Å; N86-K90 PolarHBondContact OD1-N 3.37Å; N86-K90 PolarHBondContact OD1-O 3.41Å; N86-L92 HydrophobicContact CB-CD1 4.06Å
87	D	67.4	Low	78.5	Confident	113 Å²	113	102.8 Å²	102.8	60%	0.604	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-19.1	-177.4	-59.3	-17.8	0	0	0	114.1
88	W	72.9	Confident	77.5	Confident	225 Å²	225	98.3 Å²	98.3	85%	0.852	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	7.3	176	-56.7	-69	0	0	0	113.5	N86 K90	N86-W88 HydrophobicContact CB-CE3 4.5Å; N86-W88 PolarHBondContact O-N 3.31Å; N86-W88 PolarHBondContact OD1-N 2.77Å; N86-W88 VanDerWaalsContact OD1-N 3.13Å; W88-K90 PolarHBondContact O-N 2.92Å
89	G	71.6	Confident	76.5	Confident	58 Å²	58	101.7 Å²	101.7	60%	0.598	51%	0.513	S	S	*	.	S	Bend	trans	73.7	11.3	-178.9	0	0	0	0	0	114	N86	N86-G89 PolarHBondContact O-N 3.27Å; N86-G89 PolarHBondContact OD1-N 3.35Å
90	K	75.3	Confident	75.3	Confident	133 Å²	133	95.9 Å²	95.9	58%	0.578	49%	0.489	S	S	*	.			trans	-85.7	129	177.6	-178.4	-178.9	177.5	-175.3	0	109.4	T85 N86 W88 L92	T85-K90 WeakPolarHBondContact CA-O 3.5Å; N86-K90 PolarHBondContact N-O 3.18Å; N86-K90 WeakPolarHBondContact OD1-CB 3.27Å; N86-K90 PolarHBondContact OD1-N 3.37Å; N86-K90 PolarHBondContact OD1-O 3.41Å; W88-K90 PolarHBondContact O-N 2.92Å; K90-L92 HydrophobicContact CD-CD2 4.24Å; K90-L92 HydrophobicContact CG-CD2 4.41Å
91	R	75.7	Confident	74	Confident	185 Å²	185	99.6 Å²	99.6	70%	0.698	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	129.2	169.4	-72.1	-168	-70.5	-109	2.3	110.6	F84	F84-R91 CarbonylContact O-C 3.49Å; F84-R91 VanDerWaalsContact O-CA 3.27Å; F84-R91 WeakPolarHBondContact O-CA 2.99Å
92	L	69.8	Low	72.9	Confident	67 Å²	67	102.3 Å²	102.3	35%	0.351	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.3	174.9	-61.5	175.4	0	0	0	107.6	E83 F84 N86 K90	E83-L92 CarbonylContact C-O 3.2Å; E83-L92 WeakPolarHBondContact CA-O 3.32Å; F84-L92 PolarHBondContact N-O 3.14Å; F84-L92 PolarHBondContact O-N 2.86Å; N86-L92 HydrophobicContact CB-CD1 4.06Å; K90-L92 HydrophobicContact CD-CD2 4.24Å; K90-L92 HydrophobicContact CG-CD2 4.41Å
93	P	59.9	Low	72.1	Confident	137 Å²	137	106.3 Å²	106.3	89%	0.89	53%	0.531	S	S	*	.			trans	-73.9	0	168.3	35.5	-36	0	0	0	111.9	N82	N82-P93 CarbonylContact O-C 3.58Å

Retrieved 93 of 93 residues in 25.5 ms (Link to these results)

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