A0A096N926_PAPAN Loading...

Protein S100-A14

Modulates P53/TP53 protein levels, and thereby plays a role in the regulation of cell survival and apoptosis. Depending on the context, it can promote cell proliferation or apoptosis. Plays a role in the regulation of cell migration by modulating the levels of MMP2, a matrix protease that is under transcriptional control of P53/TP53. Does not bind calcium.

AlphaFold DB (A0A2K5Z3Q3), UniProt , Accession A0A096N926, Species PAPAN (Papio anubis, Olive baboon), Gene S100A14, Length 104 aa.

						>A0A096N926_PAPAN|A0A096N926|S100A14
MGQCRSANAEDAQEFSDVERAIETLIKNFHQYSVEGGKETLTPSELRDLVTQQLPHLMPSNCGLEEKIANLGSCNDSKLEFGSFWELIGEAAKSVKPERPVRGR
					

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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	M	45.6	Very low	46.9	Very low	256 Å²	256	145.5 Å²	145.5	100%	1.261	82%	0.823	S	S	*	*				0	117.6	0	-64.7	174.3	-173.5	0	0	107
2	G	41.8	Very low	47.2	Very low	75 Å²	75	140.9 Å²	140.9	77%	0.773	82%	0.817	S	S	*	*			trans	-172.5	81.7	-177.5	0	0	0	0	0	109.4
3	Q	51.7	Low	47.8	Very low	175 Å²	175	139.6 Å²	139.6	82%	0.818	80%	0.798	S	S	*	*			trans	-85.7	109.6	170.6	-70.1	172.9	70.8	0	0	107.2
4	C	44.2	Very low	49.7	Very low	124 Å²	124	141.9 Å²	141.9	84%	0.838	80%	0.798	S	S	*	*			trans	-104.2	83.4	162.1	-65.4	0	0	0	0	107.3
5	R	49.9	Very low	51.7	Low	225 Å²	225	137.1 Å²	137.1	85%	0.849	77%	0.766	S	S	*	*			trans	-89.1	93.9	161.3	-80.4	178.7	146.8	-178.6	-7.4	106.5	A7	R5-A7 PolarHBondContact O-N 3.34Å
6	S	47.3	Very low	54.2	Low	109 Å²	109	132.1 Å²	132.1	76%	0.762	74%	0.743	S	S	*	*			trans	-74.6	86.5	167.1	-59.6	0	0	0	0	107.9	N8	S6-N8 PolarHBondContact O-N 2.98Å
7	A	47.6	Very low	56.4	Low	93 Å²	93	132.1 Å²	132.1	77%	0.769	74%	0.741	S	S	*	*			trans	-72.3	105.4	158.8	0	0	0	0	0	106.8	R5	R5-A7 PolarHBondContact O-N 3.34Å
8	N	50.6	Low	58.4	Low	148 Å²	148	130.3 Å²	130.3	79%	0.791	73%	0.733	S	S	*	*			trans	-85.9	106.1	154.2	-82.7	-62.2	0	0	0	104.8	S6	S6-N8 PolarHBondContact O-N 2.98Å
9	A	42.4	Very low	60	Low	71 Å²	71	128.3 Å²	128.3	59%	0.587	72%	0.718	S	S	*	*				54.7	85.5	104.7	0	0	0	0	0	109.5	D11	A9-D11 PolarHBondContact O-N 2.77Å; A9-D11 VanDerWaalsContact O-N 3.14Å
10	E	47.8	Very low	61.5	Low	197 Å²	197	127.1 Å²	127.1	92%	0.921	70%	0.701	S	S	*	*				42.5	40.6	76.7	-60.3	-174.6	96.1	0	0	112.8	A12	E10-A12 VanDerWaalsContact C-N 3.32Å; E10-A12 PolarHBondContact O-N 3.43Å
11	D	46.7	Very low	62.8	Low	127 Å²	127	123.9 Å²	123.9	68%	0.679	69%	0.691	S	S	*	*			trans	-80.2	91.6	149.8	-161.6	-94.4	0	0	0	106.6	A9 Q13	A9-D11 PolarHBondContact O-N 2.77Å; A9-D11 VanDerWaalsContact O-N 3.14Å; D11-Q13 PolarHBondContact O-N 2.82Å
12	A	50.6	Low	65	Low	91 Å²	91	115 Å²	115	75%	0.752	65%	0.648	S	S	*	*			trans	-72.7	61.7	171.7	0	0	0	0	0	109.4	E10 E14	E10-A12 VanDerWaalsContact C-N 3.32Å; E10-A12 PolarHBondContact O-N 3.43Å; A12-E14 PolarHBondContact O-N 2.71Å; A12-E14 VanDerWaalsContact O-N 3.1Å
13	Q	55.8	Low	67.3	Low	124 Å²	124	114.9 Å²	114.9	58%	0.579	63%	0.627	S	S	*	*			trans	-56	115.2	152.8	-172.9	102.9	-2.9	0	0	105.1	D11 F15	D11-Q13 PolarHBondContact O-N 2.82Å; Q13-F15 HydrophobicContact CB-CE1 4.39Å; Q13-F15 HydrophobicContact CB-CE2 4.23Å; Q13-F15 HydrophobicContact CB-CZ 4.12Å; Q13-F15 HydrophobicContact CG-CD1 4.42Å; Q13-F15 HydrophobicContact CG-CE1 4.18Å; Q13-F15 HydrophobicContact CG-CZ 4.4Å; Q13-F15 VanDerWaalsContact O-CD2 3.29Å; Q13-F15 WeakPolarHBondContact O-CD2 3.35Å; Q13-F15 PolarHBondContact O-N 2.96Å
14	E	74.1	Confident	69.2	Low	171 Å²	171	110 Å²	110	80%	0.799	61%	0.61	S	S	*	*			trans	-67.8	82.2	174.6	-69.4	-157.4	92	0	0	108.5	A12 S16	A12-E14 PolarHBondContact O-N 2.71Å; A12-E14 VanDerWaalsContact O-N 3.1Å; E14-S16 PolarHBondContact O-N 3.07Å
15	F	79.6	Confident	71.4	Confident	70 Å²	70	105.6 Å²	105.6	31%	0.307	58%	0.578	S	S	.	*			trans	-55.8	134.4	171	-68.7	-65.6	0	0	0	108.6	Q13 E19 R20	Q13-F15 HydrophobicContact CB-CE1 4.39Å; Q13-F15 HydrophobicContact CB-CE2 4.23Å; Q13-F15 HydrophobicContact CB-CZ 4.12Å; Q13-F15 HydrophobicContact CG-CD1 4.42Å; Q13-F15 HydrophobicContact CG-CE1 4.18Å; Q13-F15 HydrophobicContact CG-CZ 4.4Å; Q13-F15 VanDerWaalsContact O-CD2 3.29Å; Q13-F15 WeakPolarHBondContact O-CD2 3.35Å; Q13-F15 PolarHBondContact O-N 2.96Å; F15-E19 HydrophobicContact CB-CB 3.78Å; F15-E19 HydrophobicContact CD1-CB 3.89Å; F15-E19 HydrophobicContact CD1-CG 4.49Å; F15-E19 HydrophobicContact CG-CB 4.21Å; F15-R20 HydrophobicContact CB-CG 3.56Å; F15-R20 PolarHBondContact O-NE 3.32Å; F15-R20 PolarHBondContact O-NH1 3.14Å; F15-R20 VanDerWaalsContact O-NH1 3.13Å
16	S	91	Very high	73.4	Confident	58 Å²	58	97.9 Å²	97.9	41%	0.406	55%	0.553	S	S	.	*			trans	-56.9	158.7	167.8	63.4	0	0	0	0	110.2	E14 V18 E19 R20	E14-S16 PolarHBondContact O-N 3.07Å; S16-V18 PolarHBondContact O-N 3Å; S16-V18 VanDerWaalsContact O-N 3.08Å; S16-E19 VanDerWaalsContact CB-OE2 3.32Å; S16-E19 WeakPolarHBondContact CB-OE2 3.28Å; S16-E19 PolarHBondContact N-OE2 3.28Å; S16-E19 PolarHBondContact O-N 3.17Å; S16-E19 WeakPolarHBondContact OG-CG 3.4Å; S16-E19 PolarHBondContact OG-N 3.1Å; S16-E19 PolarHBondContact OG-OE2 2.77Å; S16-R20 PolarHBondContact O-N 2.64Å
17	D	91.6	Very high	75.4	Confident	132 Å²	132	98.1 Å²	98.1	71%	0.706	54%	0.54	S	S	*	.	H	α-helix	trans	-56.4	-30.8	-179.9	-63.4	-51.6	0	0	0	112.5	A21	D17-A21 WeakPolarHBondContact O-CB 3.35Å; D17-A21 PolarHBondContact O-N 2.7Å
18	V	92.6	Very high	77.5	Confident	100 Å²	100	95 Å²	95	61%	0.606	51%	0.511	S	S	*	.	H	α-helix	trans	-68.1	-47.3	175.3	-179.4	0	0	0	0	111.2	S16 R20 A21 I22	S16-V18 PolarHBondContact O-N 3Å; S16-V18 VanDerWaalsContact O-N 3.08Å; V18-R20 VanDerWaalsContact C-N 3.34Å; V18-R20 PolarHBondContact O-N 2.76Å; V18-A21 PolarHBondContact O-N 3.45Å; V18-I22 HydrophobicContact CG1-CD1 4.06Å; V18-I22 VanDerWaalsContact O-CG1 3.32Å; V18-I22 WeakPolarHBondContact O-CG1 3.3Å; V18-I22 PolarHBondContact O-N 3.22Å
19	E	88.5	Confident	79.5	Confident	92 Å²	92	88 Å²	88	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-41.4	177.5	-72.2	166.5	114.8	0	0	111.4	F15 S16 A21 I22 E23	F15-E19 HydrophobicContact CB-CB 3.78Å; F15-E19 HydrophobicContact CD1-CB 3.89Å; F15-E19 HydrophobicContact CD1-CG 4.49Å; F15-E19 HydrophobicContact CG-CB 4.21Å; S16-E19 VanDerWaalsContact CB-OE2 3.32Å; S16-E19 WeakPolarHBondContact CB-OE2 3.28Å; S16-E19 PolarHBondContact N-OE2 3.28Å; S16-E19 PolarHBondContact O-N 3.17Å; S16-E19 WeakPolarHBondContact OG-CG 3.4Å; S16-E19 PolarHBondContact OG-N 3.1Å; S16-E19 PolarHBondContact OG-OE2 2.77Å; E19-A21 VanDerWaalsContact C-N 3.33Å; E19-A21 PolarHBondContact O-N 3.35Å; E19-I22 PolarHBondContact O-N 3.34Å; E19-E23 WeakPolarHBondContact O-CB 3.16Å; E19-E23 PolarHBondContact O-N 2.78Å
20	R	90.2	Very high	81.7	Confident	104 Å²	104	89 Å²	89	39%	0.392	47%	0.465	S	S	.	.	H	α-helix	trans	-62.5	-39	173.8	-68.7	-174	176.2	126.7	0	112.3	F15 S16 V18 E23 T24	F15-R20 HydrophobicContact CB-CG 3.56Å; F15-R20 PolarHBondContact O-NE 3.32Å; F15-R20 PolarHBondContact O-NH1 3.14Å; F15-R20 VanDerWaalsContact O-NH1 3.13Å; S16-R20 PolarHBondContact O-N 2.64Å; V18-R20 VanDerWaalsContact C-N 3.34Å; V18-R20 PolarHBondContact O-N 2.76Å; R20-E23 PolarHBondContact O-N 3.05Å; R20-T24 VanDerWaalsContact O-CB 3.26Å; R20-T24 WeakPolarHBondContact O-CB 3.35Å; R20-T24 PolarHBondContact O-N 3.31Å; R20-T24 PolarHBondContact O-OG1 3Å
21	A	90.3	Very high	83.8	Confident	60 Å²	60	85.4 Å²	85.4	50%	0.496	45%	0.449	S	S	.	.	H	α-helix	trans	-65.3	-42.5	176.7	0	0	0	0	0	111.6	D17 V18 E19 T24 L25	D17-A21 WeakPolarHBondContact O-CB 3.35Å; D17-A21 PolarHBondContact O-N 2.7Å; V18-A21 PolarHBondContact O-N 3.45Å; E19-A21 VanDerWaalsContact C-N 3.33Å; E19-A21 PolarHBondContact O-N 3.35Å; A21-T24 PolarHBondContact O-N 2.82Å; A21-L25 PolarHBondContact O-N 2.84Å
22	I	90.8	Very high	85.9	Confident	69 Å²	69	80.5 Å²	80.5	35%	0.354	42%	0.421	S	S	.	.	H	α-helix	trans	-62.8	-48.2	175.3	-64.7	163.7	0	0	0	110.3	V18 E19 T24 L25 I26 W85	V18-I22 HydrophobicContact CG1-CD1 4.06Å; V18-I22 VanDerWaalsContact O-CG1 3.32Å; V18-I22 WeakPolarHBondContact O-CG1 3.3Å; V18-I22 PolarHBondContact O-N 3.22Å; E19-I22 PolarHBondContact O-N 3.34Å; I22-T24 VanDerWaalsContact C-N 3.3Å; I22-T24 PolarHBondContact O-N 3.47Å; I22-L25 WeakPolarHBondContact O-CB 3.33Å; I22-L25 PolarHBondContact O-N 3.39Å; I22-L25 VanDerWaalsContact O-N 3.11Å; I22-I26 HydrophobicContact CG2-CD1 3.91Å; I22-I26 WeakPolarHBondContact O-CG1 3.42Å; I22-I26 PolarHBondContact O-N 3.2Å; I22-W85 HydrophobicContact CG1-CH2 4.17Å
23	E	90.3	Very high	87.8	Confident	72 Å²	72	76.1 Å²	76.1	34%	0.336	39%	0.385	S	S	.	.	H	α-helix	trans	-59.5	-42.7	177.9	-166.2	-158.1	52.7	0	0	111.5	E19 R20 L25 I26 K27	E19-E23 WeakPolarHBondContact O-CB 3.16Å; E19-E23 PolarHBondContact O-N 2.78Å; R20-E23 PolarHBondContact O-N 3.05Å; E23-L25 VanDerWaalsContact C-N 3.3Å; E23-L25 PolarHBondContact O-N 2.8Å; E23-I26 PolarHBondContact O-N 3.26Å; E23-K27 VanDerWaalsContact CD-CE 3.41Å; E23-K27 HydrophobicContact CG-CD 4.2Å; E23-K27 WeakPolarHBondContact O-CB 3.09Å; E23-K27 WeakPolarHBondContact O-CG 3.18Å; E23-K27 PolarHBondContact O-N 3.01Å; E23-K27 WeakPolarHBondContact OE1-CE 3.21Å; E23-K27 IonicContact OE1-NZ 2.67Å; E23-K27 PolarHBondContact OE1-NZ 3.49Å; E23-K27 WeakPolarHBondContact OE2-CE 3.31Å; E23-K27 IonicContact OE2-NZ 2.88Å; E23-K27 PolarHBondContact OE2-NZ 2.87Å
24	T	91.3	Very high	89.3	Confident	73 Å²	73	75.2 Å²	75.2	45%	0.448	39%	0.387	S	S	.	.	H	α-helix	trans	-61.1	-40.7	175.9	-61.3	0	0	0	0	111	R20 A21 I22 K27 N28	R20-T24 VanDerWaalsContact O-CB 3.26Å; R20-T24 WeakPolarHBondContact O-CB 3.35Å; R20-T24 PolarHBondContact O-N 3.31Å; R20-T24 PolarHBondContact O-OG1 3Å; A21-T24 PolarHBondContact O-N 2.82Å; I22-T24 VanDerWaalsContact C-N 3.3Å; I22-T24 PolarHBondContact O-N 3.47Å; T24-K27 PolarHBondContact O-N 3.4Å; T24-N28 WeakPolarHBondContact CG2-ND2 3.37Å; T24-N28 WeakPolarHBondContact O-CB 3.34Å; T24-N28 PolarHBondContact O-N 3.03Å; T24-N28 PolarHBondContact O-ND2 3Å
25	L	90.6	Very high	89.7	Confident	32 Å²	32	74 Å²	74	17%	0.168	38%	0.381	C	S	.	.	H	α-helix	trans	-64.7	-44	178	-158.7	100.5	0	0	0	111.7	A21 I22 E23 N28 F29 F81 F84 W85 I88	A21-L25 PolarHBondContact O-N 2.84Å; I22-L25 WeakPolarHBondContact O-CB 3.33Å; I22-L25 PolarHBondContact O-N 3.39Å; I22-L25 VanDerWaalsContact O-N 3.11Å; E23-L25 VanDerWaalsContact C-N 3.3Å; E23-L25 PolarHBondContact O-N 2.8Å; L25-N28 PolarHBondContact O-N 3.46Å; L25-F29 PolarHBondContact O-N 3.44Å; L25-F81 HydrophobicContact CD2-CE2 4.25Å; L25-F81 HydrophobicContact CD2-CZ 4.25Å; L25-F84 HydrophobicContact CD1-CE1 4.37Å; L25-F84 HydrophobicContact CD2-CD1 4.23Å; L25-F84 HydrophobicContact CD2-CE1 3.65Å; L25-F84 HydrophobicContact CG-CE1 3.82Å; L25-F84 HydrophobicContact CG-CZ 4.43Å; L25-W85 HydrophobicContact CB-CZ3 4.44Å; L25-W85 HydrophobicContact CD2-CD2 4.41Å; L25-W85 HydrophobicContact CD2-CE3 3.21Å; L25-W85 HydrophobicContact CD2-CH2 4.43Å; L25-W85 HydrophobicContact CD2-CZ3 3.24Å; L25-W85 HydrophobicContact CG-CZ3 4.37Å; L25-I88 HydrophobicContact CD1-CG1 4.33Å; L25-I88 HydrophobicContact CD1-CG2 4.34Å; L25-I88 HydrophobicContact CD2-CG1 4.39Å
26	I	90.9	Very high	89.6	Confident	62 Å²	62	70.8 Å²	70.8	32%	0.318	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-47.8	176.8	-65.7	164.4	0	0	0	110.5	I22 E23 N28 F29 H30 F81	I22-I26 HydrophobicContact CG2-CD1 3.91Å; I22-I26 WeakPolarHBondContact O-CG1 3.42Å; I22-I26 PolarHBondContact O-N 3.2Å; E23-I26 PolarHBondContact O-N 3.26Å; I26-N28 VanDerWaalsContact C-N 3.33Å; I26-N28 PolarHBondContact O-N 3.47Å; I26-F29 WeakPolarHBondContact O-CB 3.19Å; I26-F29 PolarHBondContact O-N 3.28Å; I26-H30 PolarHBondContact O-CD2 2.67Å; I26-H30 PolarHBondContact O-N 2.97Å; I26-F81 HydrophobicContact CG1-CE1 4.2Å; I26-F81 HydrophobicContact CG1-CE2 4.01Å; I26-F81 HydrophobicContact CG1-CZ 3.53Å
27	K	91.1	Very high	89.2	Confident	115 Å²	115	70.3 Å²	70.3	50%	0.5	37%	0.373	S	S	.	.	H	α-helix	trans	-58.7	-44.6	178	-77.4	174	178.1	168.3	0	111.6	E23 T24 H30 Q31	E23-K27 VanDerWaalsContact CD-CE 3.41Å; E23-K27 HydrophobicContact CG-CD 4.2Å; E23-K27 WeakPolarHBondContact O-CB 3.09Å; E23-K27 WeakPolarHBondContact O-CG 3.18Å; E23-K27 PolarHBondContact O-N 3.01Å; E23-K27 WeakPolarHBondContact OE1-CE 3.21Å; E23-K27 IonicContact OE1-NZ 2.67Å; E23-K27 PolarHBondContact OE1-NZ 3.49Å; E23-K27 WeakPolarHBondContact OE2-CE 3.31Å; E23-K27 IonicContact OE2-NZ 2.88Å; E23-K27 PolarHBondContact OE2-NZ 2.87Å; T24-K27 PolarHBondContact O-N 3.4Å; K27-H30 PolarHBondContact O-N 2.82Å; K27-Q31 WeakPolarHBondContact O-CB 3.38Å; K27-Q31 PolarHBondContact O-N 3.47Å
28	N	91.4	Very high	88.8	Confident	28 Å²	28	70.7 Å²	70.7	15%	0.15	37%	0.368	C	S	.	.	H	α-helix	trans	-62	-47.8	176.3	-84.9	-78.7	0	0	0	111	T24 L25 I26 H30 Q31 Y32 Q53	T24-N28 WeakPolarHBondContact CG2-ND2 3.37Å; T24-N28 WeakPolarHBondContact O-CB 3.34Å; T24-N28 PolarHBondContact O-N 3.03Å; T24-N28 PolarHBondContact O-ND2 3Å; L25-N28 PolarHBondContact O-N 3.46Å; I26-N28 VanDerWaalsContact C-N 3.33Å; I26-N28 PolarHBondContact O-N 3.47Å; N28-H30 PolarHBondContact O-N 3.23Å; N28-Q31 WeakPolarHBondContact O-CB 3.46Å; N28-Q31 PolarHBondContact O-N 3.42Å; N28-Q31 VanDerWaalsContact O-N 3.07Å; N28-Y32 VanDerWaalsContact O-CD2 3.26Å; N28-Y32 WeakPolarHBondContact O-CD2 3.32Å; N28-Y32 PolarHBondContact O-N 2.87Å; N28-Y32 VanDerWaalsContact O-N 3.1Å; N28-Q53 PolarHBondContact OD1-OE1 2.95Å
29	F	91.2	Very high	88.4	Confident	1 Å²	1	73.3 Å²	73.3	0%	0.004	37%	0.374	C	S	.	.	H	α-helix	trans	-52.2	-53.9	176.7	-179.8	-91.4	0	0	0	111.9	L25 I26 Q31 Y32 S33 L41 L79 F81 F84	L25-F29 PolarHBondContact O-N 3.44Å; I26-F29 WeakPolarHBondContact O-CB 3.19Å; I26-F29 PolarHBondContact O-N 3.28Å; F29-Q31 VanDerWaalsContact C-N 3.27Å; F29-Q31 PolarHBondContact O-N 3.3Å; F29-Y32 PolarHBondContact O-N 2.98Å; F29-Y32 VanDerWaalsContact O-N 3.17Å; F29-S33 WeakPolarHBondContact CE1-OG 3.28Å; F29-S33 WeakPolarHBondContact O-CB 3.14Å; F29-S33 PolarHBondContact O-N 3.34Å; F29-S33 PolarHBondContact O-OG 3.14Å; F29-L41 HydrophobicContact CD2-CD1 3.48Å; F29-L41 VanDerWaalsContact CD2-CD1 3.48Å; F29-L41 HydrophobicContact CD2-CG 3.93Å; F29-L41 HydrophobicContact CE2-CB 4.45Å; F29-L41 HydrophobicContact CE2-CD1 3.4Å; F29-L41 HydrophobicContact CE2-CG 3.55Å; F29-L41 HydrophobicContact CZ-CD1 4.39Å; F29-L41 HydrophobicContact CZ-CG 4.08Å; F29-L79 HydrophobicContact CE2-CD2 4.27Å; F29-F81 HydrophobicContact CB-CD2 3.82Å; F29-F81 HydrophobicContact CB-CE2 4.04Å; F29-F81 HydrophobicContact CD1-CB 4.25Å; F29-F81 AromaticContact CD1-CD2 3.85Å; F29-F81 HydrophobicContact CD1-CD2 3.85Å; F29-F81 AromaticContact CD2-CD2 3.82Å; F29-F81 HydrophobicContact CD2-CD2 3.82Å; F29-F81 HydrophobicContact CE1-CB 3.93Å; F29-F81 HydrophobicContact CE1-CD2 4.37Å; F29-F81 HydrophobicContact CE2-CB 4.28Å; F29-F81 HydrophobicContact CE2-CD2 4.32Å; F29-F81 AromaticContact CG-CD2 3.56Å; F29-F81 HydrophobicContact CG-CD2 3.56Å; F29-F81 HydrophobicContact CG-CE2 4.28Å; F29-F81 HydrophobicContact CZ-CB 3.95Å; F29-F84 HydrophobicContact CB-CD1 4.34Å; F29-F84 HydrophobicContact CB-CE1 4.28Å; F29-F84 HydrophobicContact CD2-CB 3.9Å; F29-F84 AromaticContact CD2-CD1 3.6Å; F29-F84 HydrophobicContact CD2-CD1 3.6Å; F29-F84 HydrophobicContact CD2-CD2 4.44Å; F29-F84 HydrophobicContact CD2-CE1 4.21Å; F29-F84 AromaticContact CD2-CG 3.73Å; F29-F84 HydrophobicContact CD2-CG 3.73Å; F29-F84 HydrophobicContact CE2-CB 3.79Å; F29-F84 HydrophobicContact CE2-CD1 4.36Å; F29-F84 HydrophobicContact CE2-CG 4.12Å; F29-F84 HydrophobicContact CG-CD1 4.36Å
30	H	89.9	Confident	88.4	Confident	91 Å²	91	69.8 Å²	69.8	42%	0.421	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-27.8	179.9	-70	-67	0	0	0	114.1	I26 K27 N28 K38	I26-H30 PolarHBondContact O-CD2 2.67Å; I26-H30 PolarHBondContact O-N 2.97Å; K27-H30 PolarHBondContact O-N 2.82Å; N28-H30 PolarHBondContact O-N 3.23Å; H30-K38 PolarHBondContact CE1-O 2.95Å; H30-K38 PolarHBondContact ND1-O 2.88Å
31	Q	91.5	Very high	88.3	Confident	122 Å²	122	64.8 Å²	64.8	57%	0.57	34%	0.34	S	S	*	.	H	α-helix	trans	-67	-38	175.6	-176.2	-175.9	-89.2	0	0	111.7	K27 N28 F29 V34	K27-Q31 WeakPolarHBondContact O-CB 3.38Å; K27-Q31 PolarHBondContact O-N 3.47Å; N28-Q31 WeakPolarHBondContact O-CB 3.46Å; N28-Q31 PolarHBondContact O-N 3.42Å; N28-Q31 VanDerWaalsContact O-N 3.07Å; F29-Q31 VanDerWaalsContact C-N 3.27Å; F29-Q31 PolarHBondContact O-N 3.3Å; Q31-V34 WeakPolarHBondContact O-CG2 3.45Å
32	Y	91	Very high	88.2	Confident	23 Å²	23	63.2 Å²	63.2	9%	0.09	32%	0.324	C	S	.	.	H	α-helix	trans	-89.8	-18.2	-178.6	-74	-89.5	0	0	0	113.3	N28 F29 V34 E45 D48 L49 Q52 Q53	N28-Y32 VanDerWaalsContact O-CD2 3.26Å; N28-Y32 WeakPolarHBondContact O-CD2 3.32Å; N28-Y32 PolarHBondContact O-N 2.87Å; N28-Y32 VanDerWaalsContact O-N 3.1Å; F29-Y32 PolarHBondContact O-N 2.98Å; F29-Y32 VanDerWaalsContact O-N 3.17Å; Y32-V34 PolarHBondContact O-N 3.23Å; Y32-E45 WeakPolarHBondContact O-CB 3.49Å; Y32-E45 WeakPolarHBondContact O-CG 3.15Å; Y32-D48 HydrophobicContact CD1-CB 4.37Å; Y32-D48 HydrophobicContact CE1-CB 4.46Å; Y32-D48 VanDerWaalsContact CE1-OD1 3.28Å; Y32-D48 WeakPolarHBondContact CE1-OD1 3.42Å; Y32-L49 HydrophobicContact CD1-CB 4.02Å; Y32-L49 HydrophobicContact CD2-CB 4.02Å; Y32-L49 HydrophobicContact CD2-CD1 3.94Å; Y32-L49 HydrophobicContact CD2-CG 3.89Å; Y32-L49 HydrophobicContact CE1-CB 4.47Å; Y32-L49 HydrophobicContact CE2-CB 4.49Å; Y32-L49 HydrophobicContact CE2-CG 4.33Å; Y32-L49 HydrophobicContact CG-CB 3.79Å; Y32-L49 HydrophobicContact CG-CD1 4.16Å; Y32-L49 HydrophobicContact CG-CG 4.15Å; Y32-Q52 PolarHBondContact OH-OE1 2.72Å; Y32-Q53 HydrophobicContact CE2-CG 3.77Å; Y32-Q53 PolarHBondContact OH-NE2 3.21Å
33	S	89.8	Confident	88	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.32	C	S	.	.			trans	-78	36.5	179	-63.9	0	0	0	0	114.6	F29 G37 K38 T40 L41 E45	F29-S33 WeakPolarHBondContact CE1-OG 3.28Å; F29-S33 WeakPolarHBondContact O-CB 3.14Å; F29-S33 PolarHBondContact O-N 3.34Å; F29-S33 PolarHBondContact O-OG 3.14Å; S33-G37 PolarHBondContact O-N 3.42Å; S33-K38 WeakPolarHBondContact O-CA 3.49Å; S33-K38 PolarHBondContact O-N 3.22Å; S33-T40 WeakPolarHBondContact CB-O 3.26Å; S33-T40 PolarHBondContact OG-O 3.41Å; S33-L41 WeakPolarHBondContact OG-CD2 3.43Å; S33-L41 WeakPolarHBondContact OG-CG 3.42Å; S33-E45 VanDerWaalsContact C-OE1 3.23Å
34	V	88	Confident	87.8	Confident	104 Å²	104	62.2 Å²	62.2	63%	0.63	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-49.5	-174	-178.2	0	0	0	0	112.5	Q31 Y32 G37 E45	Q31-V34 WeakPolarHBondContact O-CG2 3.45Å; Y32-V34 PolarHBondContact O-N 3.23Å; V34-G37 PolarHBondContact O-N 3.46Å; V34-E45 PolarHBondContact N-OE1 3.07Å
35	E	82.2	Confident	87.7	Confident	145 Å²	145	59.3 Å²	59.3	68%	0.678	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-35.9	175.7	-57.8	-175	75.2	0	0	111.5	G37 T42 E45	E35-G37 PolarHBondContact O-N 3.2Å; E35-T42 HydrophobicContact CB-CG2 4.08Å; E35-E45 WeakPolarHBondContact CA-OE1 3.49Å; E35-E45 WeakPolarHBondContact CB-OE1 3.42Å; E35-E45 PolarHBondContact N-OE1 3.18Å
36	G	77	Confident	87.6	Confident	3 Å²	3	57.8 Å²	57.8	3%	0.031	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	17.8	174.5	0	0	0	0	0	115.3	K38 T40 E45	G36-K38 PolarHBondContact O-N 2.86Å; G36-T40 CarbonylContact C-O 3.5Å; G36-T40 WeakPolarHBondContact CA-O 3.44Å; G36-T40 PolarHBondContact O-N 2.91Å; G36-T40 PolarHBondContact O-OG1 2.92Å; G36-E45 PolarHBondContact N-OE2 2.84Å
37	G	82.9	Confident	87.4	Confident	48 Å²	48	61.7 Å²	61.7	50%	0.495	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	21.3	169.6	0	0	0	0	0	115.3	S33 V34 E35 E39	S33-G37 PolarHBondContact O-N 3.42Å; V34-G37 PolarHBondContact O-N 3.46Å; E35-G37 PolarHBondContact O-N 3.2Å; G37-E39 PolarHBondContact O-N 3.1Å
38	K	83.1	Confident	87.3	Confident	140 Å²	140	59.5 Å²	59.5	61%	0.609	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	-2	-174.5	-56.5	-176.7	177	-177.3	0	115.7	H30 S33 G36	H30-K38 PolarHBondContact CE1-O 2.95Å; H30-K38 PolarHBondContact ND1-O 2.88Å; S33-K38 WeakPolarHBondContact O-CA 3.49Å; S33-K38 PolarHBondContact O-N 3.22Å; G36-K38 PolarHBondContact O-N 2.86Å
39	E	84.6	Confident	87.3	Confident	155 Å²	155	58.3 Å²	58.3	72%	0.724	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-21.9	-179.5	-63.5	179.7	101.3	0	0	111.4	G37	G37-E39 PolarHBondContact O-N 3.1Å
40	T	88.4	Confident	87.1	Confident	18 Å²	18	58.2 Å²	58.2	11%	0.11	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	157.4	-174.4	63.9	0	0	0	0	112.5	S33 G36 K78 L79 E80	S33-T40 WeakPolarHBondContact CB-O 3.26Å; S33-T40 PolarHBondContact OG-O 3.41Å; G36-T40 CarbonylContact C-O 3.5Å; G36-T40 WeakPolarHBondContact CA-O 3.44Å; G36-T40 PolarHBondContact O-N 2.91Å; G36-T40 PolarHBondContact O-OG1 2.92Å; T40-K78 HydrophobicContact CG2-CB 3.82Å; T40-K78 WeakPolarHBondContact OG1-CB 3.39Å; T40-K78 VanDerWaalsContact OG1-CD 3.32Å; T40-K78 WeakPolarHBondContact OG1-CD 3.42Å; T40-K78 WeakPolarHBondContact OG1-CG 3.35Å; T40-L79 CarbonylContact C-O 3.49Å; T40-L79 VanDerWaalsContact CA-O 3.25Å; T40-L79 WeakPolarHBondContact CA-O 3.33Å; T40-E80 HydrophobicContact CG2-CG 4.14Å
41	L	88.6	Confident	86.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	135.7	172.1	-69.8	168.2	0	0	0	110.5	F29 S33 E45 L46 L49 L79 F84	F29-L41 HydrophobicContact CD2-CD1 3.48Å; F29-L41 VanDerWaalsContact CD2-CD1 3.48Å; F29-L41 HydrophobicContact CD2-CG 3.93Å; F29-L41 HydrophobicContact CE2-CB 4.45Å; F29-L41 HydrophobicContact CE2-CD1 3.4Å; F29-L41 HydrophobicContact CE2-CG 3.55Å; F29-L41 HydrophobicContact CZ-CD1 4.39Å; F29-L41 HydrophobicContact CZ-CG 4.08Å; S33-L41 WeakPolarHBondContact OG-CD2 3.43Å; S33-L41 WeakPolarHBondContact OG-CG 3.42Å; L41-E45 HydrophobicContact CB-CB 4.47Å; L41-E45 HydrophobicContact CD2-CB 3.7Å; L41-L46 HydrophobicContact CB-CB 4.43Å; L41-L46 HydrophobicContact CD1-CD1 4.18Å; L41-L49 HydrophobicContact CD1-CD1 4.09Å; L41-L79 HydrophobicContact CB-CB 4.31Å; L41-L79 HydrophobicContact CB-CD2 4.2Å; L41-L79 HydrophobicContact CD1-CD2 3.95Å; L41-L79 PolarHBondContact N-O 3Å; L41-L79 PolarHBondContact O-N 3.42Å; L41-F84 HydrophobicContact CD1-CD2 4.31Å
42	T	88.2	Confident	86.8	Confident	27 Å²	27	55.2 Å²	55.2	17%	0.166	29%	0.29	C	S	.	.			trans	-75.6	162.3	163.7	63.7	0	0	0	0	110.9	E35 S44 E45 L46	E35-T42 HydrophobicContact CB-CG2 4.08Å; T42-S44 PolarHBondContact O-N 2.76Å; T42-E45 WeakPolarHBondContact CB-OE2 3.25Å; T42-E45 VanDerWaalsContact CG2-OE2 3.3Å; T42-E45 WeakPolarHBondContact CG2-OE2 3.28Å; T42-E45 PolarHBondContact N-OE2 2.84Å; T42-E45 PolarHBondContact O-N 3.19Å; T42-E45 VanDerWaalsContact OG1-CD 3.31Å; T42-E45 WeakPolarHBondContact OG1-CG 3.32Å; T42-E45 PolarHBondContact OG1-N 3.36Å; T42-E45 PolarHBondContact OG1-OE2 2.81Å; T42-L46 WeakPolarHBondContact O-CB 3.32Å; T42-L46 PolarHBondContact O-N 3.35Å
43	P	85.8	Confident	86.7	Confident	41 Å²	41	58.2 Å²	58.2	27%	0.266	31%	0.306	S	S	.	.	H	α-helix	trans	-45.8	-43.9	169.9	-36.7	41.3	0	0	0	114.8	R47 I68	P43-R47 PolarHBondContact O-N 2.88Å; P43-R47 VanDerWaalsContact O-N 3.14Å; P43-I68 HydrophobicContact CB-CG2 3.81Å
44	S	86.5	Confident	86.6	Confident	79 Å²	79	59 Å²	59	55%	0.552	31%	0.31	S	S	*	.	H	α-helix	trans	-68.2	-45.5	-179	-61.3	0	0	0	0	111.7	T42 R47 D48	T42-S44 PolarHBondContact O-N 2.76Å; S44-R47 WeakPolarHBondContact O-CB 3.44Å; S44-R47 PolarHBondContact O-N 3.38Å; S44-D48 PolarHBondContact O-N 3.13Å
45	E	90.1	Very high	86.4	Confident	11 Å²	11	57 Å²	57	5%	0.051	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-40.2	179.4	-68.8	168.7	130.2	0	0	112.1	Y32 S33 V34 E35 G36 L41 T42 R47 D48 L49	Y32-E45 WeakPolarHBondContact O-CB 3.49Å; Y32-E45 WeakPolarHBondContact O-CG 3.15Å; S33-E45 VanDerWaalsContact C-OE1 3.23Å; V34-E45 PolarHBondContact N-OE1 3.07Å; E35-E45 WeakPolarHBondContact CA-OE1 3.49Å; E35-E45 WeakPolarHBondContact CB-OE1 3.42Å; E35-E45 PolarHBondContact N-OE1 3.18Å; G36-E45 PolarHBondContact N-OE2 2.84Å; L41-E45 HydrophobicContact CB-CB 4.47Å; L41-E45 HydrophobicContact CD2-CB 3.7Å; T42-E45 WeakPolarHBondContact CB-OE2 3.25Å; T42-E45 VanDerWaalsContact CG2-OE2 3.3Å; T42-E45 WeakPolarHBondContact CG2-OE2 3.28Å; T42-E45 PolarHBondContact N-OE2 2.84Å; T42-E45 PolarHBondContact O-N 3.19Å; T42-E45 VanDerWaalsContact OG1-CD 3.31Å; T42-E45 WeakPolarHBondContact OG1-CG 3.32Å; T42-E45 PolarHBondContact OG1-N 3.36Å; T42-E45 PolarHBondContact OG1-OE2 2.81Å; E45-R47 VanDerWaalsContact C-N 3.3Å; E45-R47 PolarHBondContact O-N 2.89Å; E45-D48 PolarHBondContact O-N 3.05Å; E45-L49 WeakPolarHBondContact O-CB 3.36Å; E45-L49 PolarHBondContact O-N 3.01Å
46	L	87	Confident	86.4	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-59.9	-43.7	173.9	177.3	63.1	0	0	0	111	L41 T42 D48 L49 V50 I68 L71 L79 F84 L87	L41-L46 HydrophobicContact CB-CB 4.43Å; L41-L46 HydrophobicContact CD1-CD1 4.18Å; T42-L46 WeakPolarHBondContact O-CB 3.32Å; T42-L46 PolarHBondContact O-N 3.35Å; L46-D48 VanDerWaalsContact C-N 3.32Å; L46-D48 PolarHBondContact O-N 3.35Å; L46-L49 PolarHBondContact O-N 3.47Å; L46-V50 HydrophobicContact CD1-CG2 4.02Å; L46-V50 HydrophobicContact CG-CG2 4.47Å; L46-V50 WeakPolarHBondContact O-CB 3.34Å; L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.36Å; L46-V50 PolarHBondContact O-N 2.9Å; L46-I68 HydrophobicContact CD2-CG1 4.22Å; L46-L71 HydrophobicContact CD2-CD1 3.6Å; L46-L79 HydrophobicContact CD1-CD2 4.34Å; L46-L79 HydrophobicContact CD2-CD1 4.2Å; L46-F84 HydrophobicContact CD1-CD2 4.21Å; L46-L87 HydrophobicContact CD1-CD2 4.09Å
47	R	87.1	Confident	86.4	Confident	144 Å²	144	62.4 Å²	62.4	54%	0.543	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-43.5	176.9	-163.6	-177.3	73	151.2	3	111.1	P43 S44 E45 T51 L64 I68	P43-R47 PolarHBondContact O-N 2.88Å; P43-R47 VanDerWaalsContact O-N 3.14Å; S44-R47 WeakPolarHBondContact O-CB 3.44Å; S44-R47 PolarHBondContact O-N 3.38Å; E45-R47 VanDerWaalsContact C-N 3.3Å; E45-R47 PolarHBondContact O-N 2.89Å; R47-T51 HydrophobicContact CG-CG2 4.43Å; R47-T51 WeakPolarHBondContact O-CB 3.27Å; R47-T51 WeakPolarHBondContact O-CG2 3.45Å; R47-T51 PolarHBondContact O-N 3.13Å; R47-T51 PolarHBondContact O-OG1 2.85Å; R47-L64 HydrophobicContact CG-CD2 4.2Å; R47-I68 HydrophobicContact CB-CD1 3.81Å; R47-I68 HydrophobicContact CG-CD1 4.03Å
48	D	89.8	Confident	86.1	Confident	69 Å²	69	60.9 Å²	60.9	37%	0.369	31%	0.305	S	S	.	.	H	α-helix	trans	-65.2	-46.9	-179.9	-158.5	-116.8	0	0	0	111.7	Y32 S44 E45 L46 V50 T51 Q52	Y32-D48 HydrophobicContact CD1-CB 4.37Å; Y32-D48 HydrophobicContact CE1-CB 4.46Å; Y32-D48 VanDerWaalsContact CE1-OD1 3.28Å; Y32-D48 WeakPolarHBondContact CE1-OD1 3.42Å; S44-D48 PolarHBondContact O-N 3.13Å; E45-D48 PolarHBondContact O-N 3.05Å; L46-D48 VanDerWaalsContact C-N 3.32Å; L46-D48 PolarHBondContact O-N 3.35Å; D48-V50 PolarHBondContact O-N 3.44Å; D48-T51 PolarHBondContact O-N 2.72Å; D48-T51 PolarHBondContact O-OG1 3.27Å; D48-Q52 WeakPolarHBondContact O-CB 3.24Å; D48-Q52 VanDerWaalsContact O-CG 3.31Å; D48-Q52 WeakPolarHBondContact O-CG 3.43Å; D48-Q52 PolarHBondContact O-N 3.47Å; D48-Q52 PolarHBondContact OD1-NE2 3.42Å; D48-Q52 PolarHBondContact OD2-NE2 3.34Å
49	L	90.3	Very high	85.5	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-51.1	174.9	-175.4	161.4	0	0	0	111.4	Y32 L41 E45 L46 T51 Q52 Q53 L54 F84	Y32-L49 HydrophobicContact CD1-CB 4.02Å; Y32-L49 HydrophobicContact CD2-CB 4.02Å; Y32-L49 HydrophobicContact CD2-CD1 3.94Å; Y32-L49 HydrophobicContact CD2-CG 3.89Å; Y32-L49 HydrophobicContact CE1-CB 4.47Å; Y32-L49 HydrophobicContact CE2-CB 4.49Å; Y32-L49 HydrophobicContact CE2-CG 4.33Å; Y32-L49 HydrophobicContact CG-CB 3.79Å; Y32-L49 HydrophobicContact CG-CD1 4.16Å; Y32-L49 HydrophobicContact CG-CG 4.15Å; L41-L49 HydrophobicContact CD1-CD1 4.09Å; E45-L49 WeakPolarHBondContact O-CB 3.36Å; E45-L49 PolarHBondContact O-N 3.01Å; L46-L49 PolarHBondContact O-N 3.47Å; L49-T51 PolarHBondContact O-N 3.42Å; L49-Q52 PolarHBondContact O-N 2.8Å; L49-Q53 HydrophobicContact CD2-CB 4.5Å; L49-Q53 WeakPolarHBondContact O-CB 3.26Å; L49-Q53 PolarHBondContact O-N 3.46Å; L49-L54 HydrophobicContact CD2-CD1 3.94Å; L49-F84 HydrophobicContact CD1-CE2 4.06Å; L49-F84 HydrophobicContact CD1-CZ 3.99Å; L49-F84 HydrophobicContact CD2-CE2 3.6Å; L49-F84 HydrophobicContact CD2-CZ 3.72Å
50	V	86.4	Confident	84.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-43.3	-176.2	171.2	0	0	0	0	111.3	L46 D48 Q52 L54 M58 L64	L46-V50 HydrophobicContact CD1-CG2 4.02Å; L46-V50 HydrophobicContact CG-CG2 4.47Å; L46-V50 WeakPolarHBondContact O-CB 3.34Å; L46-V50 VanDerWaalsContact O-CG2 3.28Å; L46-V50 WeakPolarHBondContact O-CG2 3.36Å; L46-V50 PolarHBondContact O-N 2.9Å; D48-V50 PolarHBondContact O-N 3.44Å; V50-Q52 VanDerWaalsContact C-N 3.35Å; V50-Q52 PolarHBondContact O-N 3.42Å; V50-L54 HydrophobicContact CG2-CD1 4.31Å; V50-L54 CarbonylContact O-C 3.27Å; V50-L54 VanDerWaalsContact O-C 3.27Å; V50-L54 WeakPolarHBondContact O-CA 3.4Å; V50-L54 WeakPolarHBondContact O-CB 3.42Å; V50-L54 PolarHBondContact O-N 2.86Å; V50-M58 HydrophobicContact CG1-CB 3.56Å; V50-M58 WeakPolarHBondContact CG1-O 3.49Å; V50-M58 HydrophobicContact CG1-SD 4.35Å; V50-M58 HydrophobicContact CG2-SD 4.43Å; V50-L64 HydrophobicContact CB-CD1 4.08Å; V50-L64 HydrophobicContact CB-CD2 4.12Å; V50-L64 HydrophobicContact CG1-CD1 3.98Å; V50-L64 HydrophobicContact CG1-CD2 3.82Å; V50-L64 HydrophobicContact CG1-CG 4.48Å; V50-L64 HydrophobicContact CG2-CD1 3.94Å
51	T	86.4	Confident	82.9	Confident	50 Å²	50	60.1 Å²	60.1	31%	0.307	32%	0.321	S	S	.	.	H	α-helix	trans	-67.5	-34.6	-179.1	54.9	0	0	0	0	112.8	R47 D48 L49	R47-T51 HydrophobicContact CG-CG2 4.43Å; R47-T51 WeakPolarHBondContact O-CB 3.27Å; R47-T51 WeakPolarHBondContact O-CG2 3.45Å; R47-T51 PolarHBondContact O-N 3.13Å; R47-T51 PolarHBondContact O-OG1 2.85Å; D48-T51 PolarHBondContact O-N 2.72Å; D48-T51 PolarHBondContact O-OG1 3.27Å; L49-T51 PolarHBondContact O-N 3.42Å
52	Q	89.6	Confident	81.5	Confident	99 Å²	99	64.3 Å²	64.3	46%	0.463	35%	0.349	S	S	.	.	H	α-helix	trans	-89.1	-44.1	-177.4	-66.6	-179.6	30.6	0	0	113.5	Y32 D48 L49 V50	Y32-Q52 PolarHBondContact OH-OE1 2.72Å; D48-Q52 WeakPolarHBondContact O-CB 3.24Å; D48-Q52 VanDerWaalsContact O-CG 3.31Å; D48-Q52 WeakPolarHBondContact O-CG 3.43Å; D48-Q52 PolarHBondContact O-N 3.47Å; D48-Q52 PolarHBondContact OD1-NE2 3.42Å; D48-Q52 PolarHBondContact OD2-NE2 3.34Å; L49-Q52 PolarHBondContact O-N 2.8Å; V50-Q52 VanDerWaalsContact C-N 3.35Å; V50-Q52 PolarHBondContact O-N 3.42Å
53	Q	90.1	Very high	80.5	Confident	87 Å²	87	64.8 Å²	64.8	41%	0.407	36%	0.359	S	S	.	.	H	α-helix	trans	-95.5	-23	-172.3	-58.7	-57.7	-47.3	0	0	113.1	N28 Y32 L49	N28-Q53 PolarHBondContact OD1-OE1 2.95Å; Y32-Q53 HydrophobicContact CE2-CG 3.77Å; Y32-Q53 PolarHBondContact OH-NE2 3.21Å; L49-Q53 HydrophobicContact CD2-CB 4.5Å; L49-Q53 WeakPolarHBondContact O-CB 3.26Å; L49-Q53 PolarHBondContact O-N 3.46Å
54	L	85.9	Confident	80.1	Confident	17 Å²	17	63 Å²	63	9%	0.089	35%	0.348	C	S	.	.			trans	-126.5	36.6	-172.6	-54.7	168.8	0	0	0	114.2	L49 V50 H56 L57 M58 I88	L49-L54 HydrophobicContact CD2-CD1 3.94Å; V50-L54 HydrophobicContact CG2-CD1 4.31Å; V50-L54 CarbonylContact O-C 3.27Å; V50-L54 VanDerWaalsContact O-C 3.27Å; V50-L54 WeakPolarHBondContact O-CA 3.4Å; V50-L54 WeakPolarHBondContact O-CB 3.42Å; V50-L54 PolarHBondContact O-N 2.86Å; L54-H56 PolarHBondContact O-N 2.93Å; L54-H56 VanDerWaalsContact O-N 3.11Å; L54-L57 HydrophobicContact CB-CB 4.28Å; L54-L57 HydrophobicContact CD2-CD1 3.7Å; L54-L57 PolarHBondContact O-N 3.47Å; L54-L57 VanDerWaalsContact O-N 3.13Å; L54-M58 HydrophobicContact CB-CB 4.5Å; L54-M58 PolarHBondContact O-N 3.48Å; L54-I88 HydrophobicContact CD1-CD1 3.24Å; L54-I88 HydrophobicContact CD2-CD1 4.32Å; L54-I88 HydrophobicContact CG-CD1 4.42Å
55	P	84.8	Confident	79.6	Confident	60 Å²	60	65.8 Å²	65.8	39%	0.39	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.3	-171.3	27	-36.1	0	0	0	113.9
56	H	82.6	Confident	79	Confident	183 Å²	183	71.6 Å²	71.6	85%	0.847	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-22.2	179.7	-58.5	-62.7	0	0	0	113.7	L54	L54-H56 PolarHBondContact O-N 2.93Å; L54-H56 VanDerWaalsContact O-N 3.11Å
57	L	77.1	Confident	78.4	Confident	79 Å²	79	75.1 Å²	75.1	41%	0.414	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-38.2	-179.1	-72.6	173.3	0	0	0	111.5	L54 V95	L54-L57 HydrophobicContact CB-CB 4.28Å; L54-L57 HydrophobicContact CD2-CD1 3.7Å; L54-L57 PolarHBondContact O-N 3.47Å; L54-L57 VanDerWaalsContact O-N 3.13Å; L57-V95 HydrophobicContact CD2-CG2 3.16Å
58	M	76.1	Confident	78	Confident	17 Å²	17	69.5 Å²	69.5	8%	0.084	38%	0.375	C	S	.	.	S	Bend	trans	-136.2	74.1	-179.1	-69.2	-170.9	78.5	0	0	108.8	V50 L54 S60 L87 A91	V50-M58 HydrophobicContact CG1-CB 3.56Å; V50-M58 WeakPolarHBondContact CG1-O 3.49Å; V50-M58 HydrophobicContact CG1-SD 4.35Å; V50-M58 HydrophobicContact CG2-SD 4.43Å; L54-M58 HydrophobicContact CB-CB 4.5Å; L54-M58 PolarHBondContact O-N 3.48Å; M58-S60 PolarHBondContact O-N 3.11Å; M58-L87 HydrophobicContact CE-CD1 3.66Å; M58-L87 HydrophobicContact CE-CD2 3.89Å; M58-L87 HydrophobicContact CE-CG 3.67Å; M58-L87 HydrophobicContact SD-CD2 4.08Å; M58-L87 HydrophobicContact SD-CG 3.9Å; M58-A91 HydrophobicContact CG-CB 3.36Å; M58-A91 HydrophobicContact SD-CB 3.8Å
59	P	69.8	Low	77.3	Confident	64 Å²	64	69.2 Å²	69.2	42%	0.416	38%	0.382	S	S	.	.			trans	-56.9	137.8	175.2	22.3	-30.1	0	0	0	108.8	N61 C62	P59-N61 PolarHBondContact O-N 2.89Å; P59-C62 HydrophobicContact CG-CB 3.98Å; P59-C62 WeakPolarHBondContact O-CB 3.45Å; P59-C62 PolarHBondContact O-N 3.31Å
60	S	61.5	Low	76.3	Confident	68 Å²	68	74.7 Å²	74.7	48%	0.476	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-18.4	-168.1	-42	0	0	0	0	114.6	M58	M58-S60 PolarHBondContact O-N 3.11Å
61	N	57.4	Low	75.4	Confident	164 Å²	164	76.5 Å²	76.5	88%	0.877	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-0.1	-179.1	-136.9	96.4	0	0	0	114.5	P59	P59-N61 PolarHBondContact O-N 2.89Å
62	C	59.7	Low	74	Confident	89 Å²	89	76 Å²	76	60%	0.601	43%	0.425	S	S	*	.	S	Bend	trans	-104.2	67.4	-173.5	-163	0	0	0	0	111.6	P59 L64	P59-C62 HydrophobicContact CG-CB 3.98Å; P59-C62 WeakPolarHBondContact O-CB 3.45Å; P59-C62 PolarHBondContact O-N 3.31Å; C62-L64 PolarHBondContact O-N 2.96Å; C62-L64 VanDerWaalsContact O-N 3.13Å
63	G	66.6	Low	72.4	Confident	37 Å²	37	76.7 Å²	76.7	38%	0.381	44%	0.441	S	S	.	.	S	Bend	trans	73.4	2.8	171.8	0	0	0	0	0	115.9	E65 E66 K67	G63-E65 VanDerWaalsContact C-N 3.33Å; G63-E65 PolarHBondContact O-N 2.82Å; G63-E66 PolarHBondContact O-N 3.39Å; G63-K67 WeakPolarHBondContact O-CG 3.29Å; G63-K67 PolarHBondContact O-N 3.39Å
64	L	76.4	Confident	70.5	Confident	4 Å²	4	76.4 Å²	76.4	2%	0.021	45%	0.448	C	S	.	.	H	α-helix	trans	-57.7	-45.1	175.9	179.6	63.2	0	0	0	111.5	R47 V50 C62 E66 K67 I68	R47-L64 HydrophobicContact CG-CD2 4.2Å; V50-L64 HydrophobicContact CB-CD1 4.08Å; V50-L64 HydrophobicContact CB-CD2 4.12Å; V50-L64 HydrophobicContact CG1-CD1 3.98Å; V50-L64 HydrophobicContact CG1-CD2 3.82Å; V50-L64 HydrophobicContact CG1-CG 4.48Å; V50-L64 HydrophobicContact CG2-CD1 3.94Å; C62-L64 PolarHBondContact O-N 2.96Å; C62-L64 VanDerWaalsContact O-N 3.13Å; L64-E66 VanDerWaalsContact C-N 3.34Å; L64-E66 PolarHBondContact O-N 3.01Å; L64-K67 PolarHBondContact O-N 2.98Å; L64-I68 HydrophobicContact CD1-CD1 4.05Å; L64-I68 HydrophobicContact CD1-CG1 4.35Å; L64-I68 HydrophobicContact CD2-CD1 4.45Å; L64-I68 HydrophobicContact CG-CD1 3.8Å; L64-I68 HydrophobicContact CG-CG1 4.48Å; L64-I68 WeakPolarHBondContact O-CB 3.17Å; L64-I68 VanDerWaalsContact O-CG1 3.27Å; L64-I68 WeakPolarHBondContact O-CG1 3.39Å; L64-I68 PolarHBondContact O-N 3.37Å
65	E	77.5	Confident	68.9	Low	136 Å²	136	84 Å²	84	64%	0.636	49%	0.489	S	S	*	.	H	α-helix	trans	-66.4	-35.2	178.9	-64	-131.8	107.7	0	0	112.5	G63 I68 A69	G63-E65 VanDerWaalsContact C-N 3.33Å; G63-E65 PolarHBondContact O-N 2.82Å; E65-I68 PolarHBondContact O-N 3.41Å; E65-A69 VanDerWaalsContact O-CB 3.24Å; E65-A69 WeakPolarHBondContact O-CB 3.39Å; E65-A69 PolarHBondContact O-N 3.25Å
66	E	77.7	Confident	67.6	Low	134 Å²	134	87.2 Å²	87.2	63%	0.626	50%	0.503	S	S	*	.	H	α-helix	trans	-66.5	-41.5	174.3	-176.3	-179.8	87	0	0	111	G63 L64 A69 N70	G63-E66 PolarHBondContact O-N 3.39Å; L64-E66 VanDerWaalsContact C-N 3.34Å; L64-E66 PolarHBondContact O-N 3.01Å; E66-A69 PolarHBondContact O-N 3.34Å; E66-N70 WeakPolarHBondContact O-CB 3.49Å; E66-N70 PolarHBondContact O-N 2.88Å; E66-N70 PolarHBondContact O-ND2 3.33Å
67	K	73.3	Confident	66.7	Low	75 Å²	75	80.3 Å²	80.3	33%	0.326	48%	0.475	S	S	.	.	H	α-helix	trans	-64.5	-42.8	174.6	-67.5	-71.3	-173.4	173.6	0	111.4	G63 L64 A69 N70 L71 L87 E90	G63-K67 WeakPolarHBondContact O-CG 3.29Å; G63-K67 PolarHBondContact O-N 3.39Å; L64-K67 PolarHBondContact O-N 2.98Å; K67-A69 VanDerWaalsContact C-N 3.35Å; K67-N70 PolarHBondContact O-N 3.06Å; K67-L71 WeakPolarHBondContact O-CD1 3.39Å; K67-L71 WeakPolarHBondContact O-CG 3.49Å; K67-L71 PolarHBondContact O-N 3.08Å; K67-L87 HydrophobicContact CD-CD1 4.14Å; K67-L87 HydrophobicContact CG-CD1 4.02Å; K67-E90 WeakPolarHBondContact CE-OE1 3.28Å; K67-E90 IonicContact NZ-OE1 2.71Å; K67-E90 PolarHBondContact NZ-OE1 3.32Å
68	I	78.7	Confident	66.6	Low	25 Å²	25	81.7 Å²	81.7	13%	0.128	48%	0.478	C	S	.	.	H	α-helix	trans	-63	-40.8	174.9	-70.8	168.8	0	0	0	111.1	P43 L46 R47 L64 E65 L71 G72	P43-I68 HydrophobicContact CB-CG2 3.81Å; L46-I68 HydrophobicContact CD2-CG1 4.22Å; R47-I68 HydrophobicContact CB-CD1 3.81Å; R47-I68 HydrophobicContact CG-CD1 4.03Å; L64-I68 HydrophobicContact CD1-CD1 4.05Å; L64-I68 HydrophobicContact CD1-CG1 4.35Å; L64-I68 HydrophobicContact CD2-CD1 4.45Å; L64-I68 HydrophobicContact CG-CD1 3.8Å; L64-I68 HydrophobicContact CG-CG1 4.48Å; L64-I68 WeakPolarHBondContact O-CB 3.17Å; L64-I68 VanDerWaalsContact O-CG1 3.27Å; L64-I68 WeakPolarHBondContact O-CG1 3.39Å; L64-I68 PolarHBondContact O-N 3.37Å; E65-I68 PolarHBondContact O-N 3.41Å; I68-L71 WeakPolarHBondContact O-CB 2.77Å; I68-L71 PolarHBondContact O-N 3.19Å; I68-G72 PolarHBondContact O-N 3.01Å
69	A	75.4	Confident	67	Low	63 Å²	63	81.4 Å²	81.4	52%	0.521	48%	0.476	S	S	.	.	H	α-helix	trans	-67	-39.4	177.4	0	0	0	0	0	112.4	E65 E66 K67 L71 G72 S73	E65-A69 VanDerWaalsContact O-CB 3.24Å; E65-A69 WeakPolarHBondContact O-CB 3.39Å; E65-A69 PolarHBondContact O-N 3.25Å; E66-A69 PolarHBondContact O-N 3.34Å; K67-A69 VanDerWaalsContact C-N 3.35Å; A69-L71 VanDerWaalsContact C-N 3.25Å; A69-L71 PolarHBondContact O-N 3.2Å; A69-G72 PolarHBondContact O-N 3.11Å; A69-S73 PolarHBondContact O-N 3.34Å
70	N	69.2	Low	67.8	Low	117 Å²	117	84.8 Å²	84.8	63%	0.626	49%	0.486	S	S	*	.	H	α-helix	trans	-63	-33.5	173.3	-82.5	-70	0	0	0	112	E66 K67	E66-N70 WeakPolarHBondContact O-CB 3.49Å; E66-N70 PolarHBondContact O-N 2.88Å; E66-N70 PolarHBondContact O-ND2 3.33Å; K67-N70 PolarHBondContact O-N 3.06Å
71	L	68.3	Low	69.1	Low	38 Å²	38	84.4 Å²	84.4	20%	0.199	48%	0.476	C	S	.	.	H	α-helix	trans	-70	-56.8	171.3	-67.5	161	0	0	0	110.2	L46 K67 I68 A69 S73 S77 L79	L46-L71 HydrophobicContact CD2-CD1 3.6Å; K67-L71 WeakPolarHBondContact O-CD1 3.39Å; K67-L71 WeakPolarHBondContact O-CG 3.49Å; K67-L71 PolarHBondContact O-N 3.08Å; I68-L71 WeakPolarHBondContact O-CB 2.77Å; I68-L71 PolarHBondContact O-N 3.19Å; A69-L71 VanDerWaalsContact C-N 3.25Å; A69-L71 PolarHBondContact O-N 3.2Å; L71-S73 PolarHBondContact O-N 2.63Å; L71-S77 WeakPolarHBondContact O-CB 3.32Å; L71-S77 PolarHBondContact O-OG 3.23Å; L71-L79 HydrophobicContact CD1-CB 4.41Å; L71-L79 HydrophobicContact CD1-CD1 3.47Å; L71-L79 VanDerWaalsContact CD1-CD1 3.47Å; L71-L79 HydrophobicContact CD2-CB 4.28Å; L71-L79 HydrophobicContact CD2-CD1 3.74Å; L71-L79 HydrophobicContact CG-CD1 4.25Å
72	G	56.7	Low	70.4	Confident	39 Å²	39	78.7 Å²	78.7	40%	0.402	46%	0.456	S	S	.	.	H	α-helix	trans	-68.6	0.2	-170.4	0	0	0	0	0	117.9	I68 A69 C74	I68-G72 PolarHBondContact O-N 3.01Å; A69-G72 PolarHBondContact O-N 3.11Å; G72-C74 PolarHBondContact O-N 2.86Å
73	S	56.1	Low	71.6	Confident	115 Å²	115	77 Å²	77	80%	0.804	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.1	176.1	-166.9	0	0	0	0	113.4	A69 L71	A69-S73 PolarHBondContact O-N 3.34Å; L71-S73 PolarHBondContact O-N 2.63Å
74	C	50.5	Low	72.5	Confident	80 Å²	80	75.3 Å²	75.3	54%	0.541	43%	0.427	S	S	.	.	S	Bend	trans	-107.8	125.4	169.1	-160.2	0	0	0	0	108.5	G72 D76 S77	G72-C74 PolarHBondContact O-N 2.86Å; C74-D76 PolarHBondContact O-N 2.8Å; C74-S77 WeakPolarHBondContact CB-OG 3.32Å; C74-S77 VanDerWaalsContact O-CB 3.28Å; C74-S77 WeakPolarHBondContact O-CB 3.38Å; C74-S77 PolarHBondContact O-N 3.13Å; C74-S77 PolarHBondContact O-OG 2.97Å
75	N	51	Low	73.1	Confident	178 Å²	178	80.8 Å²	80.8	95%	0.952	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-3.5	-176	-83.2	-44.1	0	0	0	115
76	D	57	Low	73.5	Confident	127 Å²	127	81 Å²	81	68%	0.679	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	11.5	175.8	-121.8	-76.7	0	0	0	112.7	C74 K78	C74-D76 PolarHBondContact O-N 2.8Å; D76-K78 VanDerWaalsContact C-N 3.34Å; D76-K78 PolarHBondContact O-N 2.67Å
77	S	64	Low	73.8	Confident	38 Å²	38	75.3 Å²	75.3	27%	0.266	42%	0.423	S	S	.	.			trans	-67.5	91.4	-178.8	-81.2	0	0	0	0	112.1	L71 C74	L71-S77 WeakPolarHBondContact O-CB 3.32Å; L71-S77 PolarHBondContact O-OG 3.23Å; C74-S77 WeakPolarHBondContact CB-OG 3.32Å; C74-S77 VanDerWaalsContact O-CB 3.28Å; C74-S77 WeakPolarHBondContact O-CB 3.38Å; C74-S77 PolarHBondContact O-N 3.13Å; C74-S77 PolarHBondContact O-OG 2.97Å
78	K	75.2	Confident	74.3	Confident	108 Å²	108	72.9 Å²	72.9	47%	0.47	41%	0.413	S	S	.	.			trans	-92.1	135.7	168.6	-83.8	170.1	177.3	178.2	0	108.9	T40 D76	T40-K78 HydrophobicContact CG2-CB 3.82Å; T40-K78 WeakPolarHBondContact OG1-CB 3.39Å; T40-K78 VanDerWaalsContact OG1-CD 3.32Å; T40-K78 WeakPolarHBondContact OG1-CD 3.42Å; T40-K78 WeakPolarHBondContact OG1-CG 3.35Å; D76-K78 VanDerWaalsContact C-N 3.34Å; D76-K78 PolarHBondContact O-N 2.67Å
79	L	84.1	Confident	74.7	Confident	11 Å²	11	73.2 Å²	73.2	6%	0.058	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	112.9	-179.7	179.1	128.5	0	0	0	110.2	F29 T40 L41 L46 L71 F84	F29-L79 HydrophobicContact CE2-CD2 4.27Å; T40-L79 CarbonylContact C-O 3.49Å; T40-L79 VanDerWaalsContact CA-O 3.25Å; T40-L79 WeakPolarHBondContact CA-O 3.33Å; L41-L79 HydrophobicContact CB-CB 4.31Å; L41-L79 HydrophobicContact CB-CD2 4.2Å; L41-L79 HydrophobicContact CD1-CD2 3.95Å; L41-L79 PolarHBondContact N-O 3Å; L41-L79 PolarHBondContact O-N 3.42Å; L46-L79 HydrophobicContact CD1-CD2 4.34Å; L46-L79 HydrophobicContact CD2-CD1 4.2Å; L71-L79 HydrophobicContact CD1-CB 4.41Å; L71-L79 HydrophobicContact CD1-CD1 3.47Å; L71-L79 VanDerWaalsContact CD1-CD1 3.47Å; L71-L79 HydrophobicContact CD2-CB 4.28Å; L71-L79 HydrophobicContact CD2-CD1 3.74Å; L71-L79 HydrophobicContact CG-CD1 4.25Å; L79-F84 HydrophobicContact CD2-CB 3.56Å; L79-F84 HydrophobicContact CD2-CD2 4.44Å; L79-F84 HydrophobicContact CD2-CG 4.44Å
80	E	87.9	Confident	75	Confident	134 Å²	134	74.7 Å²	74.7	63%	0.626	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	160.4	174.5	-63.3	-178.1	93.1	0	0	111.8	T40 G82 S83 F84	T40-E80 HydrophobicContact CG2-CG 4.14Å; E80-G82 PolarHBondContact O-N 3.08Å; E80-S83 PolarHBondContact O-N 2.84Å; E80-F84 PolarHBondContact O-N 3.3Å; E80-F84 VanDerWaalsContact O-N 3.08Å
81	F	87.8	Confident	75.6	Confident	61 Å²	61	69.7 Å²	69.7	27%	0.268	39%	0.394	S	S	.	.	H	α-helix	trans	-57.8	-33.6	179.7	-178.5	-104.2	0	0	0	113.3	L25 I26 F29 F84 W85	L25-F81 HydrophobicContact CD2-CE2 4.25Å; L25-F81 HydrophobicContact CD2-CZ 4.25Å; I26-F81 HydrophobicContact CG1-CE1 4.2Å; I26-F81 HydrophobicContact CG1-CE2 4.01Å; I26-F81 HydrophobicContact CG1-CZ 3.53Å; F29-F81 HydrophobicContact CB-CD2 3.82Å; F29-F81 HydrophobicContact CB-CE2 4.04Å; F29-F81 HydrophobicContact CD1-CB 4.25Å; F29-F81 AromaticContact CD1-CD2 3.85Å; F29-F81 HydrophobicContact CD1-CD2 3.85Å; F29-F81 AromaticContact CD2-CD2 3.82Å; F29-F81 HydrophobicContact CD2-CD2 3.82Å; F29-F81 HydrophobicContact CE1-CB 3.93Å; F29-F81 HydrophobicContact CE1-CD2 4.37Å; F29-F81 HydrophobicContact CE2-CB 4.28Å; F29-F81 HydrophobicContact CE2-CD2 4.32Å; F29-F81 AromaticContact CG-CD2 3.56Å; F29-F81 HydrophobicContact CG-CD2 3.56Å; F29-F81 HydrophobicContact CG-CE2 4.28Å; F29-F81 HydrophobicContact CZ-CB 3.95Å; F81-F84 AromaticContact CD2-CD1 4Å; F81-F84 HydrophobicContact CD2-CD1 4Å; F81-F84 AromaticContact CE2-CD1 3.95Å; F81-F84 HydrophobicContact CE2-CD1 3.95Å; F81-F84 HydrophobicContact CE2-CE1 4.39Å; F81-F84 WeakPolarHBondContact O-CB 3.29Å; F81-F84 PolarHBondContact O-N 3.06Å; F81-W85 HydrophobicContact CE1-CE3 4.34Å; F81-W85 AromaticContact CZ-CE3 3.92Å; F81-W85 HydrophobicContact CZ-CE3 3.92Å; F81-W85 WeakPolarHBondContact O-CB 3.43Å; F81-W85 PolarHBondContact O-N 3.22Å
82	G	86.1	Confident	76.3	Confident	44 Å²	44	70.4 Å²	70.4	45%	0.454	41%	0.405	S	S	.	.	H	α-helix	trans	-60	-49.5	176.7	0	0	0	0	0	112.3	E80 F84 W85 E86	E80-G82 PolarHBondContact O-N 3.08Å; G82-F84 VanDerWaalsContact C-N 3.32Å; G82-F84 PolarHBondContact O-N 3.46Å; G82-W85 WeakPolarHBondContact O-CB 3.49Å; G82-W85 PolarHBondContact O-N 3.39Å; G82-W85 VanDerWaalsContact O-N 3.14Å; G82-E86 PolarHBondContact O-N 3.38Å
83	S	83.8	Confident	77.4	Confident	52 Å²	52	76.8 Å²	76.8	36%	0.364	42%	0.422	S	S	.	.	H	α-helix	trans	-67.2	-33.2	177.7	-56.2	0	0	0	0	112.4	E80 L87	E80-S83 PolarHBondContact O-N 2.84Å; S83-L87 PolarHBondContact O-N 2.81Å; S83-L87 VanDerWaalsContact O-N 3.17Å
84	F	86.1	Confident	78.2	Confident	2 Å²	2	76.1 Å²	76.1	1%	0.009	42%	0.417	C	S	.	.	H	α-helix	trans	-60.1	-48.2	169.1	176.3	-116.3	0	0	0	111.5	L25 F29 L41 L46 L49 L79 E80 F81 G82 E86 L87 I88	L25-F84 HydrophobicContact CD1-CE1 4.37Å; L25-F84 HydrophobicContact CD2-CD1 4.23Å; L25-F84 HydrophobicContact CD2-CE1 3.65Å; L25-F84 HydrophobicContact CG-CE1 3.82Å; L25-F84 HydrophobicContact CG-CZ 4.43Å; F29-F84 HydrophobicContact CB-CD1 4.34Å; F29-F84 HydrophobicContact CB-CE1 4.28Å; F29-F84 HydrophobicContact CD2-CB 3.9Å; F29-F84 AromaticContact CD2-CD1 3.6Å; F29-F84 HydrophobicContact CD2-CD1 3.6Å; F29-F84 HydrophobicContact CD2-CD2 4.44Å; F29-F84 HydrophobicContact CD2-CE1 4.21Å; F29-F84 AromaticContact CD2-CG 3.73Å; F29-F84 HydrophobicContact CD2-CG 3.73Å; F29-F84 HydrophobicContact CE2-CB 3.79Å; F29-F84 HydrophobicContact CE2-CD1 4.36Å; F29-F84 HydrophobicContact CE2-CG 4.12Å; F29-F84 HydrophobicContact CG-CD1 4.36Å; L41-F84 HydrophobicContact CD1-CD2 4.31Å; L46-F84 HydrophobicContact CD1-CD2 4.21Å; L49-F84 HydrophobicContact CD1-CE2 4.06Å; L49-F84 HydrophobicContact CD1-CZ 3.99Å; L49-F84 HydrophobicContact CD2-CE2 3.6Å; L49-F84 HydrophobicContact CD2-CZ 3.72Å; L79-F84 HydrophobicContact CD2-CB 3.56Å; L79-F84 HydrophobicContact CD2-CD2 4.44Å; L79-F84 HydrophobicContact CD2-CG 4.44Å; E80-F84 PolarHBondContact O-N 3.3Å; E80-F84 VanDerWaalsContact O-N 3.08Å; F81-F84 AromaticContact CD2-CD1 4Å; F81-F84 HydrophobicContact CD2-CD1 4Å; F81-F84 AromaticContact CE2-CD1 3.95Å; F81-F84 HydrophobicContact CE2-CD1 3.95Å; F81-F84 HydrophobicContact CE2-CE1 4.39Å; F81-F84 WeakPolarHBondContact O-CB 3.29Å; F81-F84 PolarHBondContact O-N 3.06Å; G82-F84 VanDerWaalsContact C-N 3.32Å; G82-F84 PolarHBondContact O-N 3.46Å; F84-E86 VanDerWaalsContact C-N 3.31Å; F84-E86 PolarHBondContact O-N 2.91Å; F84-L87 VanDerWaalsContact O-CB 3.29Å; F84-L87 WeakPolarHBondContact O-CB 3.33Å; F84-L87 PolarHBondContact O-N 3.43Å; F84-L87 VanDerWaalsContact O-N 3.1Å; F84-I88 HydrophobicContact CD1-CG1 4.46Å; F84-I88 HydrophobicContact CD2-CG1 4.4Å; F84-I88 HydrophobicContact CE1-CD1 4.49Å; F84-I88 HydrophobicContact CE1-CG1 4.07Å; F84-I88 HydrophobicContact CE2-CD1 3.76Å; F84-I88 HydrophobicContact CE2-CG1 3.96Å; F84-I88 HydrophobicContact CZ-CD1 3.72Å; F84-I88 HydrophobicContact CZ-CG1 3.78Å; F84-I88 WeakPolarHBondContact O-CG1 3.43Å; F84-I88 PolarHBondContact O-N 3.14Å
85	W	88.1	Confident	79.3	Confident	119 Å²	119	75.8 Å²	75.8	45%	0.451	41%	0.412	S	S	.	.	H	α-helix	trans	-60.9	-40.2	179.7	-174.1	-92.3	0	0	0	112.3	I22 L25 F81 G82 L87 I88 G89	I22-W85 HydrophobicContact CG1-CH2 4.17Å; L25-W85 HydrophobicContact CB-CZ3 4.44Å; L25-W85 HydrophobicContact CD2-CD2 4.41Å; L25-W85 HydrophobicContact CD2-CE3 3.21Å; L25-W85 HydrophobicContact CD2-CH2 4.43Å; L25-W85 HydrophobicContact CD2-CZ3 3.24Å; L25-W85 HydrophobicContact CG-CZ3 4.37Å; F81-W85 HydrophobicContact CE1-CE3 4.34Å; F81-W85 AromaticContact CZ-CE3 3.92Å; F81-W85 HydrophobicContact CZ-CE3 3.92Å; F81-W85 WeakPolarHBondContact O-CB 3.43Å; F81-W85 PolarHBondContact O-N 3.22Å; G82-W85 WeakPolarHBondContact O-CB 3.49Å; G82-W85 PolarHBondContact O-N 3.39Å; G82-W85 VanDerWaalsContact O-N 3.14Å; W85-L87 VanDerWaalsContact C-N 3.31Å; W85-L87 PolarHBondContact O-N 3.1Å; W85-I88 PolarHBondContact O-N 3.44Å; W85-G89 PolarHBondContact O-N 3.17Å
86	E	85.3	Confident	80	Confident	141 Å²	141	76 Å²	76	66%	0.659	41%	0.405	S	S	*	.	H	α-helix	trans	-59.8	-41	173.9	-70.7	-174.6	100	0	0	112.2	G82 F84 G89 E90	G82-E86 PolarHBondContact O-N 3.38Å; F84-E86 VanDerWaalsContact C-N 3.31Å; F84-E86 PolarHBondContact O-N 2.91Å; E86-G89 PolarHBondContact O-N 2.84Å; E86-E90 PolarHBondContact O-N 2.99Å
87	L	84	Confident	80.1	Confident	14 Å²	14	75.3 Å²	75.3	7%	0.073	41%	0.407	C	S	.	.	H	α-helix	trans	-62.1	-46	176.3	-173.6	71.6	0	0	0	111.7	L46 M58 K67 S83 F84 W85 G89 E90 A91	L46-L87 HydrophobicContact CD1-CD2 4.09Å; M58-L87 HydrophobicContact CE-CD1 3.66Å; M58-L87 HydrophobicContact CE-CD2 3.89Å; M58-L87 HydrophobicContact CE-CG 3.67Å; M58-L87 HydrophobicContact SD-CD2 4.08Å; M58-L87 HydrophobicContact SD-CG 3.9Å; K67-L87 HydrophobicContact CD-CD1 4.14Å; K67-L87 HydrophobicContact CG-CD1 4.02Å; S83-L87 PolarHBondContact O-N 2.81Å; S83-L87 VanDerWaalsContact O-N 3.17Å; F84-L87 VanDerWaalsContact O-CB 3.29Å; F84-L87 WeakPolarHBondContact O-CB 3.33Å; F84-L87 PolarHBondContact O-N 3.43Å; F84-L87 VanDerWaalsContact O-N 3.1Å; W85-L87 VanDerWaalsContact C-N 3.31Å; W85-L87 PolarHBondContact O-N 3.1Å; L87-G89 VanDerWaalsContact C-N 3.3Å; L87-G89 PolarHBondContact O-N 2.91Å; L87-E90 PolarHBondContact O-N 3.02Å; L87-A91 PolarHBondContact O-N 2.94Å
88	I	85.3	Confident	79.5	Confident	25 Å²	25	82.5 Å²	82.5	13%	0.128	44%	0.437	C	S	.	.	H	α-helix	trans	-61.2	-42.4	175.7	-59.4	-59.8	0	0	0	110.6	L25 L54 F84 W85 E90 A91 A92	L25-I88 HydrophobicContact CD1-CG1 4.33Å; L25-I88 HydrophobicContact CD1-CG2 4.34Å; L25-I88 HydrophobicContact CD2-CG1 4.39Å; L54-I88 HydrophobicContact CD1-CD1 3.24Å; L54-I88 HydrophobicContact CD2-CD1 4.32Å; L54-I88 HydrophobicContact CG-CD1 4.42Å; F84-I88 HydrophobicContact CD1-CG1 4.46Å; F84-I88 HydrophobicContact CD2-CG1 4.4Å; F84-I88 HydrophobicContact CE1-CD1 4.49Å; F84-I88 HydrophobicContact CE1-CG1 4.07Å; F84-I88 HydrophobicContact CE2-CD1 3.76Å; F84-I88 HydrophobicContact CE2-CG1 3.96Å; F84-I88 HydrophobicContact CZ-CD1 3.72Å; F84-I88 HydrophobicContact CZ-CG1 3.78Å; F84-I88 WeakPolarHBondContact O-CG1 3.43Å; F84-I88 PolarHBondContact O-N 3.14Å; W85-I88 PolarHBondContact O-N 3.44Å; I88-E90 VanDerWaalsContact C-N 3.33Å; I88-E90 PolarHBondContact O-N 3.48Å; I88-A91 PolarHBondContact O-N 3.33Å; I88-A92 VanDerWaalsContact O-CB 3.28Å; I88-A92 WeakPolarHBondContact O-CB 3.48Å; I88-A92 PolarHBondContact O-N 3.27Å
89	G	86.1	Confident	78.4	Confident	32 Å²	32	88.2 Å²	88.2	33%	0.33	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-38.8	175.9	0	0	0	0	0	113	W85 E86 L87 K93	W85-G89 PolarHBondContact O-N 3.17Å; E86-G89 PolarHBondContact O-N 2.84Å; L87-G89 VanDerWaalsContact C-N 3.3Å; L87-G89 PolarHBondContact O-N 2.91Å; G89-K93 WeakPolarHBondContact O-CG 3.16Å; G89-K93 PolarHBondContact O-N 3.03Å
90	E	83.1	Confident	76.7	Confident	94 Å²	94	93.4 Å²	93.4	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-67.4	-44.4	174.7	-174.7	162.1	87.4	0	0	112.1	K67 E86 L87 I88 A92 K93	K67-E90 WeakPolarHBondContact CE-OE1 3.28Å; K67-E90 IonicContact NZ-OE1 2.71Å; K67-E90 PolarHBondContact NZ-OE1 3.32Å; E86-E90 PolarHBondContact O-N 2.99Å; L87-E90 PolarHBondContact O-N 3.02Å; I88-E90 VanDerWaalsContact C-N 3.33Å; I88-E90 PolarHBondContact O-N 3.48Å; E90-A92 PolarHBondContact O-N 2.71Å; E90-K93 WeakPolarHBondContact O-CB 3.33Å; E90-K93 PolarHBondContact O-N 3.28Å
91	A	80.2	Confident	75	Confident	12 Å²	12	93.6 Å²	93.6	10%	0.099	50%	0.5	C	S	.	.	H	α-helix	trans	-61.7	-43.2	175.2	0	0	0	0	0	112	M58 L87 I88 K93 S94	M58-A91 HydrophobicContact CG-CB 3.36Å; M58-A91 HydrophobicContact SD-CB 3.8Å; L87-A91 PolarHBondContact O-N 2.94Å; I88-A91 PolarHBondContact O-N 3.33Å; A91-K93 VanDerWaalsContact C-N 3.27Å; A91-K93 PolarHBondContact O-N 3.45Å; A91-S94 WeakPolarHBondContact O-CB 3.38Å; A91-S94 PolarHBondContact O-N 2.91Å
92	A	83.6	Confident	73.4	Confident	53 Å²	53	102.3 Å²	102.3	44%	0.438	53%	0.531	S	S	.	.	H	α-helix	trans	-61.3	-31.7	179.7	0	0	0	0	0	113	I88 E90 S94 V95	I88-A92 VanDerWaalsContact O-CB 3.28Å; I88-A92 WeakPolarHBondContact O-CB 3.48Å; I88-A92 PolarHBondContact O-N 3.27Å; E90-A92 PolarHBondContact O-N 2.71Å; A92-S94 PolarHBondContact O-N 3.13Å; A92-V95 WeakPolarHBondContact O-CB 3.41Å; A92-V95 PolarHBondContact O-N 3.16Å
93	K	80.8	Confident	72.3	Confident	172 Å²	172	103.1 Å²	103.1	75%	0.748	54%	0.539	S	S	*	.	H	α-helix	trans	-60.9	-27.7	174.1	-70.2	168.4	-171.5	172.5	0	112.8	G89 E90 A91 V95	G89-K93 WeakPolarHBondContact O-CG 3.16Å; G89-K93 PolarHBondContact O-N 3.03Å; E90-K93 WeakPolarHBondContact O-CB 3.33Å; E90-K93 PolarHBondContact O-N 3.28Å; A91-K93 VanDerWaalsContact C-N 3.27Å; A91-K93 PolarHBondContact O-N 3.45Å; K93-V95 VanDerWaalsContact C-N 3.31Å
94	S	72.1	Confident	70.6	Confident	101 Å²	101	115.8 Å²	115.8	71%	0.706	58%	0.579	S	S	*	*	H	α-helix	trans	-81.9	-13.7	178.7	-59.5	0	0	0	0	112.6	A91 A92 K96	A91-S94 WeakPolarHBondContact O-CB 3.38Å; A91-S94 PolarHBondContact O-N 2.91Å; A92-S94 PolarHBondContact O-N 3.13Å; S94-K96 PolarHBondContact O-N 3.05Å; S94-K96 VanDerWaalsContact O-N 3.16Å
95	V	73.6	Confident	69.9	Low	73 Å²	73	121.5 Å²	121.5	44%	0.442	61%	0.607	S	S	.	*			trans	-76.4	102.4	173.9	-172.9	0	0	0	0	108.4	L57 A92 K93	L57-V95 HydrophobicContact CD2-CG2 3.16Å; A92-V95 WeakPolarHBondContact O-CB 3.41Å; A92-V95 PolarHBondContact O-N 3.16Å; K93-V95 VanDerWaalsContact C-N 3.31Å
96	K	64.9	Low	68.9	Low	183 Å²	183	121.6 Å²	121.6	80%	0.796	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-73.9	126.4	166.3	-66.2	177.2	-175.7	174	0	106.9	S94 E98	S94-K96 PolarHBondContact O-N 3.05Å; S94-K96 VanDerWaalsContact O-N 3.16Å; K96-E98 PolarHBondContact O-N 3.3Å; K96-E98 VanDerWaalsContact O-N 3.13Å
97	P	60	Low	68	Low	113 Å²	113	120.5 Å²	120.5	73%	0.734	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-56.7	125.8	165	24.6	-31	0	0	0	106.5	R99	P97-R99 PolarHBondContact O-N 3.23Å
98	E	51.9	Low	67.1	Low	189 Å²	189	126.8 Å²	126.8	88%	0.883	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-50.3	122.1	173.1	-89.3	-167.1	82.5	0	0	107.5	K96	K96-E98 PolarHBondContact O-N 3.3Å; K96-E98 VanDerWaalsContact O-N 3.13Å
99	R	51.2	Low	65.9	Low	227 Å²	227	133.1 Å²	133.1	86%	0.857	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-57.8	132.9	176.3	-66.1	-179	175.2	-157.2	-2.4	106.2	P97 V101	P97-R99 PolarHBondContact O-N 3.23Å; R99-V101 PolarHBondContact O-N 2.85Å
100	P	48.7	Very low	64.6	Low	121 Å²	121	139.9 Å²	139.9	79%	0.786	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-55.2	123.9	173.2	22.3	-30.2	0	0	0	106.9	R102	P100-R102 VanDerWaalsContact C-N 3.34Å; P100-R102 PolarHBondContact O-N 2.82Å
101	V	51.8	Low	63.2	Low	137 Å²	137	143.1 Å²	143.1	83%	0.83	72%	0.719	S	S	*	*			trans	-49.9	106.5	169.8	161.4	0	0	0	0	105.8	R99 G103	R99-V101 PolarHBondContact O-N 2.85Å; V101-G103 PolarHBondContact O-N 3.03Å
102	R	54.1	Low	61.9	Low	244 Å²	244	153.2 Å²	153.2	92%	0.921	77%	0.767	S	S	*	*			trans	-71.8	90.7	171.8	-172.2	171.5	-89	-144.4	-4.2	104.9	P100 R104	P100-R102 VanDerWaalsContact C-N 3.34Å; P100-R102 PolarHBondContact O-N 2.82Å; R102-R104 PolarHBondContact O-N 3.45Å
103	G	62.8	Low	60.1	Low	61 Å²	61	161.6 Å²	161.6	63%	0.629	79%	0.794	S	S	*	*			trans	-50.8	132.6	170.5	0	0	0	0	0	109.2	V101	V101-G103 PolarHBondContact O-N 3.03Å
104	R	49.8	Very low	58.3	Low	318 Å²	318	160.6 Å²	160.6	100%	1.2	80%	0.799	S	S	*	*			trans	-71.1	0	-174.5	-146.5	-169.6	-146.7	-169.8	6.3	111.8	R102	R102-R104 PolarHBondContact O-N 3.45Å

Retrieved 104 of 104 residues in 60.9 ms (Link to these results)

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