A0A087Y608_POEFO Loading...

Polyadenylate-binding protein

Binds and protects the poly(A) tail of mRNA with or without an AU-rich element (ARE) and prevents mRNA deadenylation. Stimulates the translation of mRNAs to which it is bound during early development. Binds the poly(A) tail of mRNA.

AlphaFold DB , UniProt , Accession A0A087Y608, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 619 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.5	Very low	47.5	Very low	241 Å²	241	104.1 Å²	104.1	100%	1.187	67%	0.67	S	S	*	*				0	127.8	0	-72.3	165.6	166.4	0	0	107.7
2	N	31.7	Very low	51.1	Low	166 Å²	166	96.1 Å²	96.1	89%	0.888	62%	0.619	S	S	*	*			trans	-165.1	84	165.2	-102.5	-6.4	0	0	0	106.8
3	G	36.7	Very low	54.3	Low	91 Å²	91	88.7 Å²	88.7	94%	0.938	57%	0.571	S	S	*	*			trans	-96	85.6	-177.9	0	0	0	0	0	110.9
4	S	41	Very low	57.1	Low	114 Å²	114	86.2 Å²	86.2	80%	0.797	55%	0.546	S	S	*	.			trans	-128.1	50.3	177.5	66.1	0	0	0	0	111.3
5	G	38.6	Very low	59.5	Low	60 Å²	60	80.5 Å²	80.5	62%	0.619	51%	0.509	S	S	*	.	S	Bend	trans	-73.3	162.6	164.4	0	0	0	0	0	111.1	A7	G5-A7 PolarHBondContact O-N 3.12Å
6	P	43.5	Very low	61.5	Low	77 Å²	77	75.4 Å²	75.4	50%	0.5	48%	0.477	S	S	.	.			trans	-61	120.8	174.3	26.3	-33.5	0	0	0	109.7	Y8	P6-Y8 HydrophobicContact CG-CE2 4.17Å; P6-Y8 WeakPolarHBondContact O-CD2 3.24Å; P6-Y8 PolarHBondContact O-N 2.63Å
7	A	39.3	Very low	63.2	Low	93 Å²	93	73.6 Å²	73.6	77%	0.769	46%	0.464	S	S	*	.			trans	-70.5	91.8	-178.2	0	0	0	0	0	110.6	G5 P9	G5-A7 PolarHBondContact O-N 3.12Å; A7-P9 WeakPolarHBondContact O-CD 3.38Å; A7-P9 WeakPolarHBondContact O-CG 3.21Å; A7-P9 VanDerWaalsContact O-N 3.14Å
8	Y	53.8	Low	64.8	Low	78 Å²	78	69.7 Å²	69.7	31%	0.306	44%	0.438	S	S	.	.			trans	-61.1	108	168.8	-67.2	-73.1	0	0	0	108.8	P6 L10 W86	P6-Y8 HydrophobicContact CG-CE2 4.17Å; P6-Y8 WeakPolarHBondContact O-CD2 3.24Å; P6-Y8 PolarHBondContact O-N 2.63Å; Y8-L10 PolarHBondContact O-N 2.99Å; Y8-W86 HydrophobicContact CD1-CB 4.5Å; Y8-W86 HydrophobicContact CD2-CB 4.44Å; Y8-W86 HydrophobicContact CD2-CD2 4.06Å; Y8-W86 HydrophobicContact CD2-CE3 4.42Å; Y8-W86 HydrophobicContact CD2-CG 4.05Å; Y8-W86 HydrophobicContact CE1-CB 4.16Å; Y8-W86 HydrophobicContact CE2-CB 4.1Å; Y8-W86 AromaticContact CE2-CD1 3.9Å; Y8-W86 HydrophobicContact CE2-CD2 4.33Å; Y8-W86 AromaticContact CE2-CG 3.85Å; Y8-W86 HydrophobicContact CE2-CG 3.85Å; Y8-W86 HydrophobicContact CG-CE3 4.5Å
9	P	53.3	Low	66.3	Low	127 Å²	127	68.4 Å²	68.4	83%	0.825	43%	0.426	S	S	*	.	S	Bend	trans	-75	5.5	-168.4	-16.8	32.8	0	0	0	114.1	A7	A7-P9 WeakPolarHBondContact O-CD 3.38Å; A7-P9 WeakPolarHBondContact O-CG 3.21Å; A7-P9 VanDerWaalsContact O-N 3.14Å
10	L	62.4	Low	67.5	Low	88 Å²	88	67.3 Å²	67.3	46%	0.461	42%	0.42	S	S	.	.	S	Bend	trans	-141.6	130.7	-172.9	-60.4	172	0	0	0	107.4	Y8 S12	Y8-L10 PolarHBondContact O-N 2.99Å; L10-S12 WeakPolarHBondContact CB-OG 3.3Å; L10-S12 PolarHBondContact O-N 3.1Å
11	A	86.3	Confident	68.7	Low	10 Å²	10	68.2 Å²	68.2	8%	0.083	42%	0.422	C	S	.	.			trans	-74.1	51.4	175.3	0	0	0	0	0	111.8	N58 F59 Q61 P62 A65	A11-N58 WeakPolarHBondContact O-CA 3.38Å; A11-F59 HydrophobicContact CB-CB 3.99Å; A11-F59 PolarHBondContact O-N 3.46Å; A11-Q61 WeakPolarHBondContact CB-O 3.18Å; A11-P62 HydrophobicContact CB-CG 4.44Å; A11-A65 HydrophobicContact CB-CB 4.12Å
12	S	90.7	Very high	71.5	Confident	8 Å²	8	56.8 Å²	56.8	6%	0.056	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	115.8	-169.6	-66.8	0	0	0	0	111	L10 I57 N58 S87	L10-S12 WeakPolarHBondContact CB-OG 3.3Å; L10-S12 PolarHBondContact O-N 3.1Å; S12-I57 WeakPolarHBondContact CA-O 3.46Å; S12-N58 WeakPolarHBondContact CB-OD1 3.11Å; S12-N58 PolarHBondContact OG-OD1 3.06Å; S12-S87 WeakPolarHBondContact O-CB 3.43Å; S12-S87 PolarHBondContact O-N 2.82Å
13	L	93.1	Very high	74.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	138.4	172	-56.7	-177.8	0	0	0	111.1	Y56 I57 F59 A65 A68 I84 M85 W86	L13-Y56 WeakPolarHBondContact O-CA 3.31Å; L13-I57 PolarHBondContact N-O 2.82Å; L13-I57 PolarHBondContact O-N 2.84Å; L13-F59 HydrophobicContact CD1-CD2 4.35Å; L13-F59 HydrophobicContact CD1-CE2 3.73Å; L13-F59 HydrophobicContact CG-CE2 4.34Å; L13-A65 HydrophobicContact CD1-CB 4.21Å; L13-A65 WeakPolarHBondContact CD1-O 3.47Å; L13-A65 HydrophobicContact CD2-CB 4.05Å; L13-A65 HydrophobicContact CG-CB 4.01Å; L13-A68 HydrophobicContact CD1-CB 3.87Å; L13-I84 HydrophobicContact CB-CG2 4.07Å; L13-I84 HydrophobicContact CD1-CG2 3.73Å; L13-I84 HydrophobicContact CD2-CG2 4.39Å; L13-I84 HydrophobicContact CG-CG2 4.29Å; L13-M85 CarbonylContact C-O 3.58Å; L13-M85 WeakPolarHBondContact CA-O 3.45Å; L13-W86 HydrophobicContact CD2-CD2 4.11Å; L13-W86 HydrophobicContact CD2-CE3 3.7Å; L13-W86 HydrophobicContact CD2-CH2 4.39Å; L13-W86 HydrophobicContact CD2-CZ3 3.86Å
14	Y	93.1	Very high	77.2	Confident	54 Å²	54	50 Å²	50	21%	0.212	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.1	161.1	168.7	-89.7	0	0	0	108.5	Y54 Y56 I84 M85	Y14-Y54 HydrophobicContact CD2-CD2 4.06Å; Y14-Y54 AromaticContact CE2-CD2 3.48Å; Y14-Y54 HydrophobicContact CE2-CD2 3.48Å; Y14-Y54 VanDerWaalsContact CE2-CD2 3.48Å; Y14-Y54 HydrophobicContact CE2-CE2 4.26Å; Y14-Y54 AromaticContact CE2-CG 3.66Å; Y14-Y54 HydrophobicContact CE2-CG 3.66Å; Y14-Y56 HydrophobicContact CD2-CD1 4.45Å; Y14-Y56 AromaticContact CD2-CE1 3.81Å; Y14-Y56 HydrophobicContact CD2-CE1 3.81Å; Y14-Y56 HydrophobicContact CG-CE1 4.47Å; Y14-I84 CarbonylContact O-C 3.58Å; Y14-I84 WeakPolarHBondContact O-CA 3.42Å; Y14-M85 HydrophobicContact CD1-CB 4.26Å; Y14-M85 HydrophobicContact CD1-CG 4.31Å; Y14-M85 HydrophobicContact CD1-SD 4.25Å; Y14-M85 HydrophobicContact CE1-SD 4.5Å; Y14-M85 PolarHBondContact N-O 3.05Å; Y14-M85 PolarHBondContact O-N 3Å
15	V	94.1	Very high	79.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	99.9	175.1	-171.4	0	0	0	0	108.7	L18 F31 Y54 A55 I57 I82 I84	V15-L18 HydrophobicContact CG1-CD2 3.83Å; V15-F31 HydrophobicContact CG1-CE2 4.36Å; V15-F31 HydrophobicContact CG1-CZ 4.34Å; V15-F31 HydrophobicContact CG2-CE2 4.29Å; V15-F31 HydrophobicContact CG2-CZ 4.11Å; V15-Y54 CarbonylContact O-C 3.57Å; V15-Y54 WeakPolarHBondContact O-CA 3.42Å; V15-A55 PolarHBondContact N-O 2.88Å; V15-A55 PolarHBondContact O-N 2.86Å; V15-I57 HydrophobicContact CG2-CD1 3.83Å; V15-I57 HydrophobicContact CG2-CG1 4.09Å; V15-I82 HydrophobicContact CG1-CB 4.01Å; V15-I82 HydrophobicContact CG1-CD1 4.27Å; V15-I82 HydrophobicContact CG1-CG1 4.39Å; V15-I84 HydrophobicContact CG1-CG1 4.47Å
16	G	91.4	Very high	82.4	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	177.2	-178.9	0	0	0	0	0	114.5	L18 G53 R83	G16-L18 PolarHBondContact O-N 3.08Å; G16-G53 CarbonylContact C-O 3.53Å; G16-R83 PolarHBondContact N-O 3.35Å; G16-R83 PolarHBondContact O-N 2.85Å
17	D	89.6	Confident	84.8	Confident	45 Å²	45	44.9 Å²	44.9	24%	0.241	26%	0.261	C	S	.	.	S	Bend	trans	61.9	18.8	175.3	-69.5	-56.6	0	0	0	116.2	G53 R83 K129	D17-G53 PolarHBondContact N-O 2.72Å; D17-R83 HydrophobicContact CB-CB 4.42Å; D17-R83 IonicContact OD2-CZ 2.79Å; D17-R83 IonicContact OD2-NE 3.97Å; D17-R83 PolarHBondContact OD2-NE 2.7Å; D17-R83 IonicContact OD2-NH2 3.38Å; D17-R83 PolarHBondContact OD2-NH2 3.49Å; D17-K129 IonicContact OD1-NZ 3.03Å; D17-K129 PolarHBondContact OD1-NZ 2.97Å; D17-K129 WeakPolarHBondContact OD2-CD 3.32Å; D17-K129 WeakPolarHBondContact OD2-CE 3.24Å; D17-K129 IonicContact OD2-NZ 3.33Å; D17-K129 PolarHBondContact OD2-NZ 2.78Å
18	L	92.9	Very high	87.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	25%	0.249	C	C	.	.			trans	-57.1	146.9	176.9	-58.8	-178	0	0	0	112.6	V15 G16 V22 L27 G53 A55 I82	V15-L18 HydrophobicContact CG1-CD2 3.83Å; G16-L18 PolarHBondContact O-N 3.08Å; L18-V22 HydrophobicContact CB-CB 4.29Å; L18-V22 HydrophobicContact CB-CG2 4.34Å; L18-V22 HydrophobicContact CD1-CG1 4.2Å; L18-V22 HydrophobicContact CD2-CG1 4.39Å; L18-L27 HydrophobicContact CD1-CD1 4.11Å; L18-L27 HydrophobicContact CD1-CD2 4.39Å; L18-L27 HydrophobicContact CD2-CD2 4.05Å; L18-G53 PolarHBondContact N-O 2.68Å; L18-A55 HydrophobicContact CD1-CB 3.74Å; L18-I82 HydrophobicContact CD2-CB 4.23Å; L18-I82 HydrophobicContact CD2-CG2 3.63Å
19	H	91.8	Very high	89.4	Confident	46 Å²	46	50.2 Å²	50.2	21%	0.213	27%	0.268	C	S	.	.			trans	-65.7	141.6	167	-171.1	-85.8	0	0	0	110.2	D21 V22 K78 R80	H19-D21 VanDerWaalsContact CE1-CG 3.46Å; H19-D21 IonicContact CE1-OD1 2.73Å; H19-D21 IonicContact CE1-OD2 3.58Å; H19-D21 PolarHBondContact CE1-OD2 3.35Å; H19-D21 PolarHBondContact ND1-N 2.89Å; H19-D21 IonicContact ND1-OD1 2.82Å; H19-D21 IonicContact ND1-OD2 3.95Å; H19-D21 PolarHBondContact ND1-OD2 2.87Å; H19-D21 PolarHBondContact O-N 3.26Å; H19-V22 HydrophobicContact CB-CG2 3.96Å; H19-V22 WeakPolarHBondContact O-CB 3.11Å; H19-V22 WeakPolarHBondContact O-CG2 3.41Å; H19-V22 PolarHBondContact O-N 3.14Å; H19-K78 HydrophobicContact CB-CB 3.89Å; H19-R80 HydrophobicContact CB-CG 4.42Å
20	P	91.4	Very high	91.3	Very high	46 Å²	46	47.2 Å²	47.2	30%	0.299	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-25.9	-173.3	-29.8	37	0	0	0	115.9	S51	P20-S51 WeakPolarHBondContact O-CB 3.46Å
21	D	91.4	Very high	92.9	Very high	86 Å²	86	43 Å²	43	46%	0.46	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.4	177.9	-36.2	-22.3	0	0	0	114.3	H19 T23 K78	H19-D21 VanDerWaalsContact CE1-CG 3.46Å; H19-D21 IonicContact CE1-OD1 2.73Å; H19-D21 IonicContact CE1-OD2 3.58Å; H19-D21 PolarHBondContact CE1-OD2 3.35Å; H19-D21 PolarHBondContact ND1-N 2.89Å; H19-D21 IonicContact ND1-OD1 2.82Å; H19-D21 IonicContact ND1-OD2 3.95Å; H19-D21 PolarHBondContact ND1-OD2 2.87Å; H19-D21 PolarHBondContact O-N 3.26Å; D21-T23 PolarHBondContact O-N 3.38Å; D21-K78 HydrophobicContact CB-CD 4.17Å; D21-K78 IonicContact OD2-NZ 3.83Å; D21-K78 PolarHBondContact OD2-NZ 3.23Å
22	V	94.4	Very high	93.3	Very high	1 Å²	1	45 Å²	45	1%	0.006	23%	0.233	C	C	.	.			trans	-65.8	125.5	179.6	172.5	0	0	0	0	109.2	L18 H19 M26 L27 I77	L18-V22 HydrophobicContact CB-CB 4.29Å; L18-V22 HydrophobicContact CB-CG2 4.34Å; L18-V22 HydrophobicContact CD1-CG1 4.2Å; L18-V22 HydrophobicContact CD2-CG1 4.39Å; H19-V22 HydrophobicContact CB-CG2 3.96Å; H19-V22 WeakPolarHBondContact O-CB 3.11Å; H19-V22 WeakPolarHBondContact O-CG2 3.41Å; H19-V22 PolarHBondContact O-N 3.14Å; V22-M26 HydrophobicContact CG1-CB 4.46Å; V22-L27 HydrophobicContact CG1-CD1 4.25Å; V22-L27 HydrophobicContact CG1-CD2 3.87Å; V22-L27 HydrophobicContact CG1-CG 3.76Å; V22-I77 HydrophobicContact CG2-CG2 3.68Å
23	T	94	Very high	93.4	Very high	50 Å²	50	49.5 Å²	49.5	31%	0.307	26%	0.262	S	S	.	.			trans	-101.1	162	177.2	61.1	0	0	0	0	111.5	D21 A25 M26 L27	D21-T23 PolarHBondContact O-N 3.38Å; T23-A25 PolarHBondContact O-N 3.28Å; T23-M26 PolarHBondContact O-N 3.32Å; T23-M26 VanDerWaalsContact O-N 3.09Å; T23-M26 PolarHBondContact OG1-N 3.36Å; T23-L27 PolarHBondContact O-N 2.59Å; T23-L27 VanDerWaalsContact O-N 3.14Å
24	E	94.3	Very high	93.4	Very high	66 Å²	66	50 Å²	50	31%	0.308	27%	0.267	S	S	.	.	H	α-helix	trans	-53.7	-38.2	174.1	-59.7	73.8	-169.8	0	0	110.9	L27 Y28 I40 V42 R44	E24-L27 PolarHBondContact O-N 3.29Å; E24-Y28 PolarHBondContact O-N 3.28Å; E24-I40 HydrophobicContact CB-CG2 4.23Å; E24-V42 HydrophobicContact CG-CB 4.38Å; E24-V42 HydrophobicContact CG-CG2 3.93Å; E24-V42 WeakPolarHBondContact OE1-CB 3.48Å; E24-R44 IonicContact OE1-CZ 2.83Å; E24-R44 IonicContact OE1-NE 3.51Å; E24-R44 PolarHBondContact OE1-NE 2.9Å; E24-R44 VanDerWaalsContact OE1-NE 3.1Å; E24-R44 IonicContact OE1-NH2 3.56Å; E24-R44 PolarHBondContact OE1-NH2 3.27Å; E24-R44 IonicContact OE2-CZ 3.49Å; E24-R44 IonicContact OE2-NH2 3.35Å; E24-R44 PolarHBondContact OE2-NH2 2.63Å
25	A	94.3	Very high	93.4	Very high	68 Å²	68	48.1 Å²	48.1	56%	0.562	26%	0.264	S	S	*	.	H	α-helix	trans	-69.5	-37.3	176.6	0	0	0	0	0	113.8	T23 L27 Y28 Q29	T23-A25 PolarHBondContact O-N 3.28Å; A25-L27 VanDerWaalsContact C-N 3.32Å; A25-Y28 PolarHBondContact O-N 2.81Å; A25-Q29 PolarHBondContact O-N 3.19Å
26	M	94.6	Very high	93.4	Very high	74 Å²	74	51.3 Å²	51.3	37%	0.365	28%	0.284	S	S	.	.	H	α-helix	trans	-66.1	-37.1	174.5	-73.4	-179.9	170.8	0	0	111.6	V22 T23 K30 K78	V22-M26 HydrophobicContact CG1-CB 4.46Å; T23-M26 PolarHBondContact O-N 3.32Å; T23-M26 VanDerWaalsContact O-N 3.09Å; T23-M26 PolarHBondContact OG1-N 3.36Å; M26-K30 WeakPolarHBondContact O-CB 3.2Å; M26-K30 PolarHBondContact O-N 3.11Å; M26-K78 HydrophobicContact CE-CD 4.42Å; M26-K78 HydrophobicContact SD-CD 4.11Å; M26-K78 HydrophobicContact SD-CG 4.4Å
27	L	94.9	Very high	93.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-44.9	172.7	-65.5	174.1	0	0	0	111	L18 V22 T23 E24 A25 Q29 K30 F31 I40 V42 A55 I57 I77	L18-L27 HydrophobicContact CD1-CD1 4.11Å; L18-L27 HydrophobicContact CD1-CD2 4.39Å; L18-L27 HydrophobicContact CD2-CD2 4.05Å; V22-L27 HydrophobicContact CG1-CD1 4.25Å; V22-L27 HydrophobicContact CG1-CD2 3.87Å; V22-L27 HydrophobicContact CG1-CG 3.76Å; T23-L27 PolarHBondContact O-N 2.59Å; T23-L27 VanDerWaalsContact O-N 3.14Å; E24-L27 PolarHBondContact O-N 3.29Å; A25-L27 VanDerWaalsContact C-N 3.32Å; L27-Q29 VanDerWaalsContact C-N 3.35Å; L27-Q29 PolarHBondContact O-N 3.35Å; L27-K30 PolarHBondContact O-N 3.29Å; L27-K30 VanDerWaalsContact O-N 3.11Å; L27-F31 HydrophobicContact CB-CD2 4.45Å; L27-F31 HydrophobicContact CD2-CD2 4.42Å; L27-F31 HydrophobicContact CD2-CE2 4.09Å; L27-F31 WeakPolarHBondContact O-CB 3.27Å; L27-F31 WeakPolarHBondContact O-CD2 3.36Å; L27-F31 PolarHBondContact O-N 3Å; L27-I40 HydrophobicContact CB-CD1 4Å; L27-I40 HydrophobicContact CB-CG2 4.1Å; L27-I40 HydrophobicContact CD1-CG2 3.89Å; L27-V42 HydrophobicContact CD1-CG2 3.74Å; L27-A55 HydrophobicContact CD1-CB 3.48Å; L27-A55 VanDerWaalsContact CD1-CB 3.48Å; L27-I57 HydrophobicContact CB-CD1 4.24Å; L27-I77 HydrophobicContact CD2-CD1 4.06Å
28	Y	95	Very high	93.6	Very high	130 Å²	130	56.7 Å²	56.7	51%	0.51	31%	0.31	S	S	.	.	H	α-helix	trans	-56.4	-48.1	177.2	-172.5	-93.5	0	0	0	111.9	E24 A25 K30 F31 S32 I37 I40	E24-Y28 PolarHBondContact O-N 3.28Å; A25-Y28 PolarHBondContact O-N 2.81Å; Y28-K30 VanDerWaalsContact C-N 3.29Å; Y28-K30 PolarHBondContact O-N 3.09Å; Y28-F31 PolarHBondContact O-N 3.27Å; Y28-S32 VanDerWaalsContact O-CB 3.27Å; Y28-S32 WeakPolarHBondContact O-CB 3.33Å; Y28-S32 PolarHBondContact O-N 2.98Å; Y28-S32 PolarHBondContact O-OG 2.75Å; Y28-I37 HydrophobicContact CD2-CB 4.39Å; Y28-I37 HydrophobicContact CD2-CD1 4.01Å; Y28-I37 HydrophobicContact CE2-CB 4.23Å; Y28-I37 HydrophobicContact CE2-CD1 4.39Å; Y28-I40 VanDerWaalsContact CA-CD1 3.48Å; Y28-I40 HydrophobicContact CD2-CD1 4.18Å; Y28-I40 HydrophobicContact CG-CD1 4.48Å; Y28-I40 VanDerWaalsContact N-CD1 3.34Å
29	Q	94	Very high	93.6	Very high	154 Å²	154	59.1 Å²	59.1	72%	0.72	33%	0.327	S	S	*	.	H	α-helix	trans	-63.1	-32.4	177.8	-173	-179.2	8.3	0	0	113.1	A25 L27	A25-Q29 PolarHBondContact O-N 3.19Å; L27-Q29 VanDerWaalsContact C-N 3.35Å; L27-Q29 PolarHBondContact O-N 3.35Å
30	K	94.3	Very high	93.8	Very high	63 Å²	63	58.6 Å²	58.6	27%	0.274	33%	0.326	S	S	.	.	H	α-helix	trans	-77.5	-38.1	178.6	178	57.3	-173	170.9	0	112.5	M26 L27 Y28 P33 M72 D75 I77	M26-K30 WeakPolarHBondContact O-CB 3.2Å; M26-K30 PolarHBondContact O-N 3.11Å; L27-K30 PolarHBondContact O-N 3.29Å; L27-K30 VanDerWaalsContact O-N 3.11Å; Y28-K30 VanDerWaalsContact C-N 3.29Å; Y28-K30 PolarHBondContact O-N 3.09Å; K30-P33 WeakPolarHBondContact O-CD 3.43Å; K30-M72 WeakPolarHBondContact O-CE 3.44Å; K30-D75 VanDerWaalsContact CE-CG 3.47Å; K30-D75 WeakPolarHBondContact CE-OD2 3.2Å; K30-D75 IonicContact NZ-OD1 3.1Å; K30-D75 PolarHBondContact NZ-OD1 3.22Å; K30-D75 IonicContact NZ-OD2 2.81Å; K30-D75 PolarHBondContact NZ-OD2 3.44Å; K30-I77 HydrophobicContact CB-CD1 4.24Å; K30-I77 HydrophobicContact CG-CD1 4.06Å
31	F	95.1	Very high	93.9	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-97.8	-18.7	-170.6	-77.8	-74.7	0	0	0	115	V15 L27 Y28 P33 A34 I37 I57 F59 A68 M72 I82 I84	V15-F31 HydrophobicContact CG1-CE2 4.36Å; V15-F31 HydrophobicContact CG1-CZ 4.34Å; V15-F31 HydrophobicContact CG2-CE2 4.29Å; V15-F31 HydrophobicContact CG2-CZ 4.11Å; L27-F31 HydrophobicContact CB-CD2 4.45Å; L27-F31 HydrophobicContact CD2-CD2 4.42Å; L27-F31 HydrophobicContact CD2-CE2 4.09Å; L27-F31 WeakPolarHBondContact O-CB 3.27Å; L27-F31 WeakPolarHBondContact O-CD2 3.36Å; L27-F31 PolarHBondContact O-N 3Å; Y28-F31 PolarHBondContact O-N 3.27Å; F31-P33 VanDerWaalsContact C-N 3.27Å; F31-A34 WeakPolarHBondContact O-CB 3.49Å; F31-A34 PolarHBondContact O-N 3.18Å; F31-I37 HydrophobicContact CB-CD1 3.65Å; F31-I57 HydrophobicContact CB-CD1 4.29Å; F31-I57 HydrophobicContact CD1-CD1 4.4Å; F31-I57 HydrophobicContact CD2-CD1 3.23Å; F31-I57 HydrophobicContact CE2-CD1 3.55Å; F31-I57 HydrophobicContact CG-CD1 3.72Å; F31-I57 HydrophobicContact CZ-CD1 4.25Å; F31-F59 HydrophobicContact CB-CZ 4.14Å; F31-F59 HydrophobicContact CD1-CZ 4.13Å; F31-F59 HydrophobicContact CG-CZ 4.49Å; F31-A68 HydrophobicContact CD1-CB 3.99Å; F31-A68 HydrophobicContact CE1-CB 4.2Å; F31-M72 HydrophobicContact CD1-SD 3.55Å; F31-M72 VanDerWaalsContact CD1-SD 3.55Å; F31-M72 HydrophobicContact CE1-CB 3.96Å; F31-M72 HydrophobicContact CE1-SD 3.85Å; F31-M72 HydrophobicContact CG-SD 4.27Å; F31-I82 HydrophobicContact CE2-CD1 3.99Å; F31-I82 HydrophobicContact CZ-CD1 3.67Å; F31-I84 HydrophobicContact CE1-CD1 3.6Å; F31-I84 HydrophobicContact CZ-CD1 3.67Å; F31-I84 HydrophobicContact CZ-CG1 4.24Å
32	S	93.9	Very high	94.1	Very high	51 Å²	51	61.2 Å²	61.2	36%	0.357	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-24	177.2	64.1	0	0	0	0	115.8	Y28 A34 G35	Y28-S32 VanDerWaalsContact O-CB 3.27Å; Y28-S32 WeakPolarHBondContact O-CB 3.33Å; Y28-S32 PolarHBondContact O-N 2.98Å; Y28-S32 PolarHBondContact O-OG 2.75Å; S32-A34 PolarHBondContact O-N 2.88Å; S32-G35 PolarHBondContact O-N 2.89Å
33	P	94.8	Very high	94	Very high	103 Å²	103	62.1 Å²	62.1	67%	0.669	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.3	171.7	-21.2	34.9	0	0	0	114.8	K30 F31 M72	K30-P33 WeakPolarHBondContact O-CD 3.43Å; F31-P33 VanDerWaalsContact C-N 3.27Å; P33-M72 HydrophobicContact CB-CE 4.15Å
34	A	92.2	Very high	94	Very high	11 Å²	11	64.4 Å²	64.4	9%	0.091	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-26	176.6	0	0	0	0	0	112.9	F31 S32 F59 A68 M72	F31-A34 WeakPolarHBondContact O-CB 3.49Å; F31-A34 PolarHBondContact O-N 3.18Å; S32-A34 PolarHBondContact O-N 2.88Å; A34-F59 HydrophobicContact CB-CE1 4.11Å; A34-F59 HydrophobicContact CB-CZ 4.4Å; A34-A68 HydrophobicContact CB-CB 3.7Å; A34-M72 HydrophobicContact CB-CE 3.81Å; A34-M72 HydrophobicContact CB-SD 4.49Å
35	G	92.5	Very high	93.8	Very high	15 Å²	15	63.6 Å²	63.6	16%	0.155	33%	0.331	C	S	.	.	S	Bend	trans	156.5	178	177.6	0	0	0	0	0	114	S32 I37	S32-G35 PolarHBondContact O-N 2.89Å; G35-I37 PolarHBondContact O-N 3.47Å
36	P	93.7	Very high	93.5	Very high	66 Å²	66	67.4 Å²	67.4	43%	0.429	34%	0.341	S	S	.	.			trans	-60.8	120.4	178.1	23.3	-33.7	0	0	0	112.8	Q60 D64	P36-Q60 HydrophobicContact CB-CB 4.13Å; P36-Q60 HydrophobicContact CG-CB 3.94Å; P36-Q60 PolarHBondContact O-N 2.9Å; P36-D64 WeakPolarHBondContact CD-OD2 3.02Å
37	I	94.3	Very high	93.2	Very high	28 Å²	28	71.2 Å²	71.2	14%	0.144	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	119.6	178.8	-54.3	176.9	0	0	0	110	Y28 F31 G35 I40 I57 N58 F59	Y28-I37 HydrophobicContact CD2-CB 4.39Å; Y28-I37 HydrophobicContact CD2-CD1 4.01Å; Y28-I37 HydrophobicContact CE2-CB 4.23Å; Y28-I37 HydrophobicContact CE2-CD1 4.39Å; F31-I37 HydrophobicContact CB-CD1 3.65Å; G35-I37 PolarHBondContact O-N 3.47Å; I37-I40 HydrophobicContact CD1-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CD1 4.16Å; I37-I40 HydrophobicContact CG2-CG1 3.68Å; I37-I57 HydrophobicContact CD1-CG2 4.48Å; I37-I57 HydrophobicContact CG2-CG2 3.87Å; I37-N58 WeakPolarHBondContact CG2-O 3.4Å; I37-F59 HydrophobicContact CD1-CE1 4.45Å; I37-F59 HydrophobicContact CG1-CD1 4.06Å; I37-F59 HydrophobicContact CG1-CE1 3.8Å; I37-F59 HydrophobicContact CG1-CZ 4.4Å
38	M	92.9	Very high	93	Very high	130 Å²	130	75.2 Å²	75.2	64%	0.64	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	-40.6	175	178.3	177.1	57.9	0	0	112.3	N58	M38-N58 WeakPolarHBondContact CA-O 3.32Å; M38-N58 WeakPolarHBondContact CB-O 3.34Å; M38-N58 HydrophobicContact CE-CB 3.74Å; M38-N58 PolarHBondContact N-O 2.81Å
39	S	92.6	Very high	92.6	Very high	53 Å²	53	77.6 Å²	77.6	37%	0.371	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	153.1	175.2	48.9	0	0	0	0	114.2	N58	S39-N58 PolarHBondContact N-O 3.45Å; S39-N58 VanDerWaalsContact N-O 3.11Å; S39-N58 PolarHBondContact O-N 3.01Å; S39-N58 PolarHBondContact OG-ND2 2.85Å
40	I	94.9	Very high	92.3	Very high	35 Å²	35	78.3 Å²	78.3	18%	0.179	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	137.3	173	-58.2	-174.1	0	0	0	109.4	E24 L27 Y28 I37 I57	E24-I40 HydrophobicContact CB-CG2 4.23Å; L27-I40 HydrophobicContact CB-CD1 4Å; L27-I40 HydrophobicContact CB-CG2 4.1Å; L27-I40 HydrophobicContact CD1-CG2 3.89Å; Y28-I40 VanDerWaalsContact CA-CD1 3.48Å; Y28-I40 HydrophobicContact CD2-CD1 4.18Å; Y28-I40 HydrophobicContact CG-CD1 4.48Å; Y28-I40 VanDerWaalsContact N-CD1 3.34Å; I37-I40 HydrophobicContact CD1-CD1 4.07Å; I37-I40 HydrophobicContact CG2-CD1 4.16Å; I37-I40 HydrophobicContact CG2-CG1 3.68Å; I40-I57 HydrophobicContact CD1-CD1 4.49Å; I40-I57 HydrophobicContact CG1-CG1 4.24Å; I40-I57 HydrophobicContact CG1-CG2 4.28Å; I40-I57 HydrophobicContact CG2-CG1 4.31Å
41	R	93.8	Very high	92.1	Very high	179 Å²	179	75.9 Å²	75.9	68%	0.675	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	101.7	176.7	-176.3	-175.6	-62.9	-99.1	1.2	110.2	C43 A55 Y56	R41-C43 PolarHBondContact O-N 2.88Å; R41-A55 CarbonylContact O-C 3.49Å; R41-A55 WeakPolarHBondContact O-CA 3.5Å; R41-A55 WeakPolarHBondContact O-CB 3.39Å; R41-Y56 PolarHBondContact N-O 3.06Å; R41-Y56 PolarHBondContact O-N 3.07Å
42	V	94.9	Very high	91.9	Very high	8 Å²	8	80.3 Å²	80.3	5%	0.048	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	124.7	166	-179.6	0	0	0	0	108	E24 L27 R44 A55	E24-V42 HydrophobicContact CG-CB 4.38Å; E24-V42 HydrophobicContact CG-CG2 3.93Å; E24-V42 WeakPolarHBondContact OE1-CB 3.48Å; L27-V42 HydrophobicContact CD1-CG2 3.74Å; V42-R44 HydrophobicContact CG1-CG 4.24Å; V42-R44 PolarHBondContact O-N 2.75Å; V42-A55 HydrophobicContact CB-CB 4.41Å; V42-A55 HydrophobicContact CG2-CB 4.1Å
43	C	92.6	Very high	91.7	Very high	20 Å²	20	78.7 Å²	78.7	14%	0.135	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	123.2	177.2	-75.6	0	0	0	0	109.5	R41 L52 Y54	R41-C43 PolarHBondContact O-N 2.88Å; C43-L52 HydrophobicContact CB-CD1 4.3Å; C43-L52 PolarHBondContact O-N 2.85Å; C43-Y54 HydrophobicContact CB-CD1 4.47Å; C43-Y54 HydrophobicContact CB-CD2 3.82Å; C43-Y54 HydrophobicContact CB-CE1 4.07Å; C43-Y54 HydrophobicContact CB-CE2 3.34Å; C43-Y54 HydrophobicContact CB-CG 4.36Å; C43-Y54 VanDerWaalsContact CB-CZ 3.47Å; C43-Y54 PolarHBondContact N-O 3.48Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.15Å
44	R	94.1	Very high	91.7	Very high	99 Å²	99	76.7 Å²	76.7	37%	0.374	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	147	-176.3	-60	170.3	-173.7	-113.6	8.6	109.2	E24 V42 I46 R50	E24-R44 IonicContact OE1-CZ 2.83Å; E24-R44 IonicContact OE1-NE 3.51Å; E24-R44 PolarHBondContact OE1-NE 2.9Å; E24-R44 VanDerWaalsContact OE1-NE 3.1Å; E24-R44 IonicContact OE1-NH2 3.56Å; E24-R44 PolarHBondContact OE1-NH2 3.27Å; E24-R44 IonicContact OE2-CZ 3.49Å; E24-R44 IonicContact OE2-NH2 3.35Å; E24-R44 PolarHBondContact OE2-NH2 2.63Å; V42-R44 HydrophobicContact CG1-CG 4.24Å; V42-R44 PolarHBondContact O-N 2.75Å; R44-I46 PolarHBondContact O-N 2.8Å; R44-R50 CarbonylContact C-O 3.59Å; R44-R50 VanDerWaalsContact CA-O 3.22Å; R44-R50 WeakPolarHBondContact CA-O 3.3Å
45	D	90.1	Very high	91.8	Very high	49 Å²	49	76.2 Å²	76.2	26%	0.262	37%	0.371	S	S	.	.			trans	-54.6	130.3	169.8	176.6	-12.3	0	0	0	109.9	I47 T48 R49 R50 L52	D45-I47 VanDerWaalsContact C-N 3.27Å; D45-I47 PolarHBondContact O-N 2.87Å; D45-I47 PolarHBondContact OD1-N 2.88Å; D45-T48 WeakPolarHBondContact CB-OG1 3.29Å; D45-T48 VanDerWaalsContact CG-N 3.33Å; D45-T48 PolarHBondContact OD1-N 2.82Å; D45-T48 VanDerWaalsContact OD2-CB 3.29Å; D45-T48 WeakPolarHBondContact OD2-CB 3.06Å; D45-T48 WeakPolarHBondContact OD2-CG2 3.28Å; D45-T48 PolarHBondContact OD2-N 3.28Å; D45-T48 PolarHBondContact OD2-OG1 3.09Å; D45-R49 WeakPolarHBondContact O-CA 3.37Å; D45-R49 PolarHBondContact O-N 3.43Å; D45-R50 PolarHBondContact N-O 2.95Å; D45-L52 HydrophobicContact CB-CD2 4.04Å
46	I	87.5	Confident	91.9	Very high	148 Å²	148	78 Å²	78	76%	0.759	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-38.8	-178.3	-59.2	174.9	0	0	0	110.8	R44 R49	R44-I46 PolarHBondContact O-N 2.8Å; I46-R49 PolarHBondContact O-NE 2.95Å
47	I	89.2	Confident	92	Very high	153 Å²	153	74.9 Å²	74.9	79%	0.785	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-59.5	-176.6	-56.7	174.9	0	0	0	110	D45 R49	D45-I47 VanDerWaalsContact C-N 3.27Å; D45-I47 PolarHBondContact O-N 2.87Å; D45-I47 PolarHBondContact OD1-N 2.88Å; I47-R49 PolarHBondContact O-N 3.26Å
48	T	89.9	Confident	92	Very high	84 Å²	84	75 Å²	75	52%	0.515	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-7.6	-172.5	74.8	0	0	0	0	114.6	D45 R50	D45-T48 WeakPolarHBondContact CB-OG1 3.29Å; D45-T48 VanDerWaalsContact CG-N 3.33Å; D45-T48 PolarHBondContact OD1-N 2.82Å; D45-T48 VanDerWaalsContact OD2-CB 3.29Å; D45-T48 WeakPolarHBondContact OD2-CB 3.06Å; D45-T48 WeakPolarHBondContact OD2-CG2 3.28Å; D45-T48 PolarHBondContact OD2-N 3.28Å; D45-T48 PolarHBondContact OD2-OG1 3.09Å; T48-R50 PolarHBondContact O-N 3.04Å; T48-R50 WeakPolarHBondContact OG1-CB 3.44Å
49	R	87.8	Confident	92	Very high	180 Å²	180	69 Å²	69	68%	0.679	32%	0.324	S	S	*	.			trans	54.7	9.7	-176.2	-60.5	-61.4	-175.7	136.1	2.3	115.6	D45 I46 I47	D45-R49 WeakPolarHBondContact O-CA 3.37Å; D45-R49 PolarHBondContact O-N 3.43Å; I46-R49 PolarHBondContact O-NE 2.95Å; I47-R49 PolarHBondContact O-N 3.26Å
50	R	87.4	Confident	92	Very high	169 Å²	169	72.5 Å²	72.5	64%	0.638	34%	0.335	S	S	*	.			trans	-72.1	140.2	173.7	-171.8	178.1	-62.2	-82.5	-2.7	110	R44 D45 T48 L52	R44-R50 CarbonylContact C-O 3.59Å; R44-R50 VanDerWaalsContact CA-O 3.22Å; R44-R50 WeakPolarHBondContact CA-O 3.3Å; D45-R50 PolarHBondContact N-O 2.95Å; T48-R50 PolarHBondContact O-N 3.04Å; T48-R50 WeakPolarHBondContact OG1-CB 3.44Å; R50-L52 PolarHBondContact O-N 3.35Å
51	S	90.3	Very high	91.8	Very high	12 Å²	12	75.9 Å²	75.9	8%	0.084	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	135.7	171.7	177.5	0	0	0	0	110.9	P20 G53	P20-S51 WeakPolarHBondContact O-CB 3.46Å; S51-G53 PolarHBondContact O-N 3.37Å; S51-G53 PolarHBondContact OG-N 3.19Å; S51-G53 VanDerWaalsContact OG-N 3.11Å
52	L	90.2	Very high	91.7	Very high	93 Å²	93	70.5 Å²	70.5	49%	0.487	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	4.9	172.5	-59.7	177.3	0	0	0	112.1	C43 D45 R50 Y54	C43-L52 HydrophobicContact CB-CD1 4.3Å; C43-L52 PolarHBondContact O-N 2.85Å; D45-L52 HydrophobicContact CB-CD2 4.04Å; R50-L52 PolarHBondContact O-N 3.35Å; L52-Y54 HydrophobicContact CB-CD1 3.84Å; L52-Y54 HydrophobicContact CB-CE1 3.51Å; L52-Y54 HydrophobicContact CD1-CE1 4Å; L52-Y54 HydrophobicContact CG-CE1 4.41Å
53	G	91	Very high	91.5	Very high	18 Å²	18	73.1 Å²	73.1	19%	0.186	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	81.6	16.1	-179.7	0	0	0	0	0	114.2	G16 D17 L18 S51	G16-G53 CarbonylContact C-O 3.53Å; D17-G53 PolarHBondContact N-O 2.72Å; L18-G53 PolarHBondContact N-O 2.68Å; S51-G53 PolarHBondContact O-N 3.37Å; S51-G53 PolarHBondContact OG-N 3.19Å; S51-G53 VanDerWaalsContact OG-N 3.11Å
54	Y	93.9	Very high	91.6	Very high	61 Å²	61	73.4 Å²	73.4	24%	0.239	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	161.4	174.9	70	-86.4	0	0	0	112.9	Y14 V15 C43 L52 Y56	Y14-Y54 HydrophobicContact CD2-CD2 4.06Å; Y14-Y54 AromaticContact CE2-CD2 3.48Å; Y14-Y54 HydrophobicContact CE2-CD2 3.48Å; Y14-Y54 VanDerWaalsContact CE2-CD2 3.48Å; Y14-Y54 HydrophobicContact CE2-CE2 4.26Å; Y14-Y54 AromaticContact CE2-CG 3.66Å; Y14-Y54 HydrophobicContact CE2-CG 3.66Å; V15-Y54 CarbonylContact O-C 3.57Å; V15-Y54 WeakPolarHBondContact O-CA 3.42Å; C43-Y54 HydrophobicContact CB-CD1 4.47Å; C43-Y54 HydrophobicContact CB-CD2 3.82Å; C43-Y54 HydrophobicContact CB-CE1 4.07Å; C43-Y54 HydrophobicContact CB-CE2 3.34Å; C43-Y54 HydrophobicContact CB-CG 4.36Å; C43-Y54 VanDerWaalsContact CB-CZ 3.47Å; C43-Y54 PolarHBondContact N-O 3.48Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.15Å; L52-Y54 HydrophobicContact CB-CD1 3.84Å; L52-Y54 HydrophobicContact CB-CE1 3.51Å; L52-Y54 HydrophobicContact CD1-CE1 4Å; L52-Y54 HydrophobicContact CG-CE1 4.41Å; Y54-Y56 HydrophobicContact CD2-CE2 4.26Å; Y54-Y56 AromaticContact CE2-CE2 3.8Å; Y54-Y56 HydrophobicContact CE2-CE2 3.8Å
55	A	95.1	Very high	91.5	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	165.2	176	0	0	0	0	0	111	V15 L18 L27 R41 V42	V15-A55 PolarHBondContact N-O 2.88Å; V15-A55 PolarHBondContact O-N 2.86Å; L18-A55 HydrophobicContact CD1-CB 3.74Å; L27-A55 HydrophobicContact CD1-CB 3.48Å; L27-A55 VanDerWaalsContact CD1-CB 3.48Å; R41-A55 CarbonylContact O-C 3.49Å; R41-A55 WeakPolarHBondContact O-CA 3.5Å; R41-A55 WeakPolarHBondContact O-CB 3.39Å; V42-A55 HydrophobicContact CB-CB 4.41Å; V42-A55 HydrophobicContact CG2-CB 4.1Å
56	Y	94.4	Very high	91.5	Very high	53 Å²	53	71.6 Å²	71.6	21%	0.208	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139.1	162.7	-62.2	-78.8	0	0	0	109.7	L13 Y14 R41 Y54 S87	L13-Y56 WeakPolarHBondContact O-CA 3.31Å; Y14-Y56 HydrophobicContact CD2-CD1 4.45Å; Y14-Y56 AromaticContact CD2-CE1 3.81Å; Y14-Y56 HydrophobicContact CD2-CE1 3.81Å; Y14-Y56 HydrophobicContact CG-CE1 4.47Å; R41-Y56 PolarHBondContact N-O 3.06Å; R41-Y56 PolarHBondContact O-N 3.07Å; Y54-Y56 HydrophobicContact CD2-CE2 4.26Å; Y54-Y56 AromaticContact CE2-CE2 3.8Å; Y54-Y56 HydrophobicContact CE2-CE2 3.8Å; Y56-S87 WeakPolarHBondContact CD1-OG 3.19Å; Y56-S87 WeakPolarHBondContact CE1-OG 3.41Å
57	I	95	Very high	91.7	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.9	174.9	-58.8	-175.4	0	0	0	107.2	S12 L13 V15 L27 F31 I37 I40 F59	S12-I57 WeakPolarHBondContact CA-O 3.46Å; L13-I57 PolarHBondContact N-O 2.82Å; L13-I57 PolarHBondContact O-N 2.84Å; V15-I57 HydrophobicContact CG2-CD1 3.83Å; V15-I57 HydrophobicContact CG2-CG1 4.09Å; L27-I57 HydrophobicContact CB-CD1 4.24Å; F31-I57 HydrophobicContact CB-CD1 4.29Å; F31-I57 HydrophobicContact CD1-CD1 4.4Å; F31-I57 HydrophobicContact CD2-CD1 3.23Å; F31-I57 HydrophobicContact CE2-CD1 3.55Å; F31-I57 HydrophobicContact CG-CD1 3.72Å; F31-I57 HydrophobicContact CZ-CD1 4.25Å; I37-I57 HydrophobicContact CD1-CG2 4.48Å; I37-I57 HydrophobicContact CG2-CG2 3.87Å; I40-I57 HydrophobicContact CD1-CD1 4.49Å; I40-I57 HydrophobicContact CG1-CG1 4.24Å; I40-I57 HydrophobicContact CG1-CG2 4.28Å; I40-I57 HydrophobicContact CG2-CG1 4.31Å; I57-F59 HydrophobicContact CB-CE2 4.45Å; I57-F59 HydrophobicContact CG2-CD2 4.04Å; I57-F59 HydrophobicContact CG2-CE2 3.58Å; I57-F59 HydrophobicContact CG2-CZ 4.04Å
58	N	93.6	Very high	91.9	Very high	30 Å²	30	60 Å²	60	16%	0.16	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	118.1	174.6	-52.3	-60.6	0	0	0	108.1	A11 S12 I37 M38 S39	A11-N58 WeakPolarHBondContact O-CA 3.38Å; S12-N58 WeakPolarHBondContact CB-OD1 3.11Å; S12-N58 PolarHBondContact OG-OD1 3.06Å; I37-N58 WeakPolarHBondContact CG2-O 3.4Å; M38-N58 WeakPolarHBondContact CA-O 3.32Å; M38-N58 WeakPolarHBondContact CB-O 3.34Å; M38-N58 HydrophobicContact CE-CB 3.74Å; M38-N58 PolarHBondContact N-O 2.81Å; S39-N58 PolarHBondContact N-O 3.45Å; S39-N58 VanDerWaalsContact N-O 3.11Å; S39-N58 PolarHBondContact O-N 3.01Å; S39-N58 PolarHBondContact OG-ND2 2.85Å
59	F	94.1	Very high	91.9	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.018	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	170.2	171.5	-70.6	-93.5	0	0	0	111	A11 L13 F31 A34 I37 I57 D64 A65 A68	A11-F59 HydrophobicContact CB-CB 3.99Å; A11-F59 PolarHBondContact O-N 3.46Å; L13-F59 HydrophobicContact CD1-CD2 4.35Å; L13-F59 HydrophobicContact CD1-CE2 3.73Å; L13-F59 HydrophobicContact CG-CE2 4.34Å; F31-F59 HydrophobicContact CB-CZ 4.14Å; F31-F59 HydrophobicContact CD1-CZ 4.13Å; F31-F59 HydrophobicContact CG-CZ 4.49Å; A34-F59 HydrophobicContact CB-CE1 4.11Å; A34-F59 HydrophobicContact CB-CZ 4.4Å; I37-F59 HydrophobicContact CD1-CE1 4.45Å; I37-F59 HydrophobicContact CG1-CD1 4.06Å; I37-F59 HydrophobicContact CG1-CE1 3.8Å; I37-F59 HydrophobicContact CG1-CZ 4.4Å; I57-F59 HydrophobicContact CB-CE2 4.45Å; I57-F59 HydrophobicContact CG2-CD2 4.04Å; I57-F59 HydrophobicContact CG2-CE2 3.58Å; I57-F59 HydrophobicContact CG2-CZ 4.04Å; F59-D64 HydrophobicContact CB-CB 3.92Å; F59-D64 HydrophobicContact CD1-CB 3.52Å; F59-D64 HydrophobicContact CE1-CB 4.28Å; F59-D64 HydrophobicContact CG-CB 3.9Å; F59-A65 HydrophobicContact CB-CB 4.26Å; F59-A65 HydrophobicContact CD2-CB 3.66Å; F59-A65 HydrophobicContact CE2-CB 4.36Å; F59-A65 HydrophobicContact CG-CB 4.17Å; F59-A68 HydrophobicContact CE1-CB 4.42Å; F59-A68 HydrophobicContact CE2-CB 3.92Å; F59-A68 HydrophobicContact CZ-CB 3.6Å
60	Q	91.8	Very high	91.9	Very high	128 Å²	128	54.3 Å²	54.3	60%	0.598	28%	0.279	S	S	*	.	S	Bend	trans	-82.8	-34.1	173.3	-165.4	174.3	2.1	0	0	111.9	P36	P36-Q60 HydrophobicContact CB-CB 4.13Å; P36-Q60 HydrophobicContact CG-CB 3.94Å; P36-Q60 PolarHBondContact O-N 2.9Å
61	Q	91.4	Very high	91.9	Very high	105 Å²	105	50.9 Å²	50.9	49%	0.491	28%	0.278	S	S	.	.	S	Bend	trans	-117.4	146.3	173.8	-56.7	-61.3	-23.2	0	0	112.2	A11 A63 D64	A11-Q61 WeakPolarHBondContact CB-O 3.18Å; Q61-A63 VanDerWaalsContact C-N 3.27Å; Q61-A63 PolarHBondContact O-N 2.81Å; Q61-D64 WeakPolarHBondContact CB-OD2 3.4Å; Q61-D64 PolarHBondContact N-OD2 2.9Å; Q61-D64 VanDerWaalsContact N-OD2 3.14Å; Q61-D64 WeakPolarHBondContact O-CB 3.46Å; Q61-D64 PolarHBondContact O-N 3.49Å
62	P	91	Very high	92	Very high	67 Å²	67	51 Å²	51	44%	0.435	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-34.8	173.2	-25.1	35.4	0	0	0	113.5	A11 D64 A65 E66	A11-P62 HydrophobicContact CB-CG 4.44Å; P62-D64 VanDerWaalsContact C-N 3.33Å; P62-D64 PolarHBondContact O-N 2.8Å; P62-A65 WeakPolarHBondContact O-CB 3.48Å; P62-A65 PolarHBondContact O-N 3.35Å; P62-A65 VanDerWaalsContact O-N 3.12Å; P62-E66 PolarHBondContact O-N 3.3Å
63	A	91.7	Very high	92	Very high	62 Å²	62	48 Å²	48	51%	0.512	26%	0.262	S	S	.	.	H	α-helix	trans	-63.9	-34.7	178.1	0	0	0	0	0	112.9	Q61 A65 E66 C67	Q61-A63 VanDerWaalsContact C-N 3.27Å; Q61-A63 PolarHBondContact O-N 2.81Å; A63-A65 VanDerWaalsContact C-N 3.29Å; A63-A65 PolarHBondContact O-N 2.81Å; A63-E66 PolarHBondContact O-N 2.94Å; A63-C67 VanDerWaalsContact O-CB 3.24Å; A63-C67 WeakPolarHBondContact O-CB 3.41Å; A63-C67 PolarHBondContact O-N 2.95Å
64	D	93.3	Very high	91.8	Very high	27 Å²	27	48.7 Å²	48.7	14%	0.144	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-37.9	174.1	-48.7	-28.3	0	0	0	110.7	P36 F59 Q61 P62 A68	P36-D64 WeakPolarHBondContact CD-OD2 3.02Å; F59-D64 HydrophobicContact CB-CB 3.92Å; F59-D64 HydrophobicContact CD1-CB 3.52Å; F59-D64 HydrophobicContact CE1-CB 4.28Å; F59-D64 HydrophobicContact CG-CB 3.9Å; Q61-D64 WeakPolarHBondContact CB-OD2 3.4Å; Q61-D64 PolarHBondContact N-OD2 2.9Å; Q61-D64 VanDerWaalsContact N-OD2 3.14Å; Q61-D64 WeakPolarHBondContact O-CB 3.46Å; Q61-D64 PolarHBondContact O-N 3.49Å; P62-D64 VanDerWaalsContact C-N 3.33Å; P62-D64 PolarHBondContact O-N 2.8Å; D64-A68 WeakPolarHBondContact O-CB 3.48Å; D64-A68 PolarHBondContact O-N 3.1Å
65	A	91.8	Very high	91.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-73	-36.9	178.9	0	0	0	0	0	112.3	A11 L13 F59 P62 A63 A68 L69 W86	A11-A65 HydrophobicContact CB-CB 4.12Å; L13-A65 HydrophobicContact CD1-CB 4.21Å; L13-A65 WeakPolarHBondContact CD1-O 3.47Å; L13-A65 HydrophobicContact CD2-CB 4.05Å; L13-A65 HydrophobicContact CG-CB 4.01Å; F59-A65 HydrophobicContact CB-CB 4.26Å; F59-A65 HydrophobicContact CD2-CB 3.66Å; F59-A65 HydrophobicContact CE2-CB 4.36Å; F59-A65 HydrophobicContact CG-CB 4.17Å; P62-A65 WeakPolarHBondContact O-CB 3.48Å; P62-A65 PolarHBondContact O-N 3.35Å; P62-A65 VanDerWaalsContact O-N 3.12Å; A63-A65 VanDerWaalsContact C-N 3.29Å; A63-A65 PolarHBondContact O-N 2.81Å; A65-A68 PolarHBondContact O-N 2.94Å; A65-L69 WeakPolarHBondContact O-CB 3.28Å; A65-L69 PolarHBondContact O-N 2.96Å; A65-W86 HydrophobicContact CB-CH2 3.82Å; A65-W86 HydrophobicContact CB-CZ3 3.83Å
66	E	90.5	Very high	91.4	Very high	110 Å²	110	53 Å²	53	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-48.6	171.6	-171	169.4	-141.1	0	0	110.7	P62 A63 A68 L69 D70 W86	P62-E66 PolarHBondContact O-N 3.3Å; A63-E66 PolarHBondContact O-N 2.94Å; E66-A68 VanDerWaalsContact C-N 3.3Å; E66-A68 PolarHBondContact O-N 2.9Å; E66-L69 WeakPolarHBondContact O-CB 3.43Å; E66-L69 PolarHBondContact O-N 3.3Å; E66-D70 PolarHBondContact O-N 2.84Å; E66-W86 HydrophobicContact CB-CH2 4.47Å; E66-W86 HydrophobicContact CB-CZ2 4.24Å
67	C	91.8	Very high	91.3	Very high	56 Å²	56	51.4 Å²	51.4	38%	0.378	28%	0.284	S	S	.	.	H	α-helix	trans	-54.5	-43.3	172.6	179.7	0	0	0	0	112.7	A63 T71	A63-C67 VanDerWaalsContact O-CB 3.24Å; A63-C67 WeakPolarHBondContact O-CB 3.41Å; A63-C67 PolarHBondContact O-N 2.95Å; C67-T71 WeakPolarHBondContact O-CB 3.42Å; C67-T71 PolarHBondContact O-N 2.85Å; C67-T71 PolarHBondContact O-OG1 2.84Å
68	A	93.2	Very high	91	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.3	-37.6	175.6	0	0	0	0	0	113.1	L13 F31 A34 F59 D64 A65 E66 M72 I84	L13-A68 HydrophobicContact CD1-CB 3.87Å; F31-A68 HydrophobicContact CD1-CB 3.99Å; F31-A68 HydrophobicContact CE1-CB 4.2Å; A34-A68 HydrophobicContact CB-CB 3.7Å; F59-A68 HydrophobicContact CE1-CB 4.42Å; F59-A68 HydrophobicContact CE2-CB 3.92Å; F59-A68 HydrophobicContact CZ-CB 3.6Å; D64-A68 WeakPolarHBondContact O-CB 3.48Å; D64-A68 PolarHBondContact O-N 3.1Å; A65-A68 PolarHBondContact O-N 2.94Å; E66-A68 VanDerWaalsContact C-N 3.3Å; E66-A68 PolarHBondContact O-N 2.9Å; A68-M72 WeakPolarHBondContact O-CB 3.5Å; A68-M72 PolarHBondContact O-N 3.33Å; A68-M72 VanDerWaalsContact O-N 3.1Å; A68-I84 WeakPolarHBondContact O-CD1 3.47Å
69	L	90.3	Very high	90.6	Very high	28 Å²	28	57.9 Å²	57.9	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-67.1	-39.9	177.4	177.5	64.1	0	0	0	111.8	A65 E66 N73 I84 W86	A65-L69 WeakPolarHBondContact O-CB 3.28Å; A65-L69 PolarHBondContact O-N 2.96Å; E66-L69 WeakPolarHBondContact O-CB 3.43Å; E66-L69 PolarHBondContact O-N 3.3Å; L69-N73 VanDerWaalsContact O-CB 3.32Å; L69-N73 WeakPolarHBondContact O-CB 3.28Å; L69-I84 HydrophobicContact CB-CG2 4.43Å; L69-I84 HydrophobicContact CD1-CB 3.88Å; L69-I84 HydrophobicContact CD1-CG2 3.65Å; L69-W86 HydrophobicContact CD2-CZ2 4.36Å
70	D	87.1	Confident	90.3	Very high	117 Å²	117	63.1 Å²	63.1	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-81.5	-39.3	-179.2	-71	-8.9	0	0	0	112.4	E66	E66-D70 PolarHBondContact O-N 2.84Å
71	T	89.1	Confident	90.1	Very high	98 Å²	98	59.4 Å²	59.4	60%	0.601	34%	0.336	S	S	*	.	H	α-helix	trans	-86.1	-31.4	-172	-49.8	0	0	0	0	113.5	C67	C67-T71 WeakPolarHBondContact O-CB 3.42Å; C67-T71 PolarHBondContact O-N 2.85Å; C67-T71 PolarHBondContact O-OG1 2.84Å
72	M	91.3	Very high	90.2	Very high	13 Å²	13	54.4 Å²	54.4	6%	0.064	31%	0.313	C	S	.	.	S	Bend	trans	-117.2	7.7	-167.4	-52.6	-175.4	-179.3	0	0	114.6	K30 F31 P33 A34 A68 D75 I84	K30-M72 WeakPolarHBondContact O-CE 3.44Å; F31-M72 HydrophobicContact CD1-SD 3.55Å; F31-M72 VanDerWaalsContact CD1-SD 3.55Å; F31-M72 HydrophobicContact CE1-CB 3.96Å; F31-M72 HydrophobicContact CE1-SD 3.85Å; F31-M72 HydrophobicContact CG-SD 4.27Å; P33-M72 HydrophobicContact CB-CE 4.15Å; A34-M72 HydrophobicContact CB-CE 3.81Å; A34-M72 HydrophobicContact CB-SD 4.49Å; A68-M72 WeakPolarHBondContact O-CB 3.5Å; A68-M72 PolarHBondContact O-N 3.33Å; A68-M72 VanDerWaalsContact O-N 3.1Å; M72-D75 WeakPolarHBondContact CA-OD2 3.1Å; M72-D75 WeakPolarHBondContact O-CB 3.43Å; M72-D75 PolarHBondContact O-N 2.71Å; M72-I84 VanDerWaalsContact C-CD1 3.47Å; M72-I84 HydrophobicContact CB-CD1 4Å; M72-I84 WeakPolarHBondContact O-CD1 3.26Å
73	N	89.8	Confident	90.1	Very high	32 Å²	32	53.5 Å²	53.5	17%	0.171	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	142.3	177.8	-150.8	-10.5	0	0	0	110.8	L69 D75 I84	L69-N73 VanDerWaalsContact O-CB 3.32Å; L69-N73 WeakPolarHBondContact O-CB 3.28Å; N73-D75 PolarHBondContact O-N 2.86Å; N73-I84 HydrophobicContact CB-CB 4.37Å; N73-I84 HydrophobicContact CB-CD1 4.27Å; N73-I84 HydrophobicContact CB-CG1 4.36Å; N73-I84 PolarHBondContact ND2-O 3.47Å; N73-I84 VanDerWaalsContact ND2-O 3.12Å; N73-I84 PolarHBondContact OD1-N 3.4Å
74	Y	88.3	Confident	90.2	Very high	31 Å²	31	50.5 Å²	50.5	12%	0.122	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	66	5.4	-175	-40.8	-63.5	0	0	0	115.8	P81 I82 R83 N112 C128	Y74-P81 WeakPolarHBondContact O-CB 3.38Å; Y74-I82 WeakPolarHBondContact CA-O 3.39Å; Y74-I82 PolarHBondContact N-O 3.07Å; Y74-R83 HydrophobicContact CE1-CG 4.13Å; Y74-N112 HydrophobicContact CD1-CB 3.33Å; Y74-N112 HydrophobicContact CD2-CB 3.93Å; Y74-N112 HydrophobicContact CE1-CB 3.81Å; Y74-N112 HydrophobicContact CE2-CB 4.36Å; Y74-N112 HydrophobicContact CG-CB 3.4Å; Y74-C128 WeakPolarHBondContact CE1-O 3.45Å; Y74-C128 PolarHBondContact OH-N 3.14Å; Y74-C128 PolarHBondContact OH-SG 3.28Å
75	D	89.9	Confident	90	Very high	54 Å²	54	50.9 Å²	50.9	29%	0.289	28%	0.278	S	S	.	.			trans	-58.7	142.2	173.3	-104.5	-55	0	0	0	113	K30 M72 N73 I77 P81 I82	K30-D75 VanDerWaalsContact CE-CG 3.47Å; K30-D75 WeakPolarHBondContact CE-OD2 3.2Å; K30-D75 IonicContact NZ-OD1 3.1Å; K30-D75 PolarHBondContact NZ-OD1 3.22Å; K30-D75 IonicContact NZ-OD2 2.81Å; K30-D75 PolarHBondContact NZ-OD2 3.44Å; M72-D75 WeakPolarHBondContact CA-OD2 3.1Å; M72-D75 WeakPolarHBondContact O-CB 3.43Å; M72-D75 PolarHBondContact O-N 2.71Å; N73-D75 PolarHBondContact O-N 2.86Å; D75-I77 PolarHBondContact O-N 2.94Å; D75-P81 CarbonylContact O-C 3.59Å; D75-P81 WeakPolarHBondContact O-CA 3.42Å; D75-I82 HydrophobicContact CB-CD1 4.17Å; D75-I82 HydrophobicContact CB-CG1 4.32Å; D75-I82 WeakPolarHBondContact O-CG1 3.4Å; D75-I82 PolarHBondContact O-N 3.01Å
76	V	90	Very high	89.9	Confident	99 Å²	99	53.5 Å²	53.5	60%	0.6	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	106.3	-171.8	-177.5	0	0	0	0	112.1	R80	V76-R80 CarbonylContact C-O 3.6Å; V76-R80 WeakPolarHBondContact CA-O 3.34Å
77	I	91.8	Very high	89.7	Confident	19 Å²	19	49.1 Å²	49.1	10%	0.097	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.7	170.7	-56.3	-174.3	0	0	0	109.8	V22 L27 K30 D75 G79 R80 I82	V22-I77 HydrophobicContact CG2-CG2 3.68Å; L27-I77 HydrophobicContact CD2-CD1 4.06Å; K30-I77 HydrophobicContact CB-CD1 4.24Å; K30-I77 HydrophobicContact CG-CD1 4.06Å; D75-I77 PolarHBondContact O-N 2.94Å; I77-G79 PolarHBondContact O-N 3.32Å; I77-G79 VanDerWaalsContact O-N 3.17Å; I77-R80 PolarHBondContact N-O 3.36Å; I77-R80 PolarHBondContact O-N 2.92Å; I77-I82 HydrophobicContact CB-CG2 3.93Å; I77-I82 HydrophobicContact CD1-CD1 4Å; I77-I82 HydrophobicContact CD1-CG2 3.73Å; I77-I82 HydrophobicContact CG1-CD1 4.41Å; I77-I82 HydrophobicContact CG1-CG2 3.69Å
78	K	88.7	Confident	89.2	Confident	99 Å²	99	49 Å²	49	43%	0.43	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	42.6	-176.7	-60	-160.8	76.2	179.2	0	113.6	H19 D21 M26	H19-K78 HydrophobicContact CB-CB 3.89Å; D21-K78 HydrophobicContact CB-CD 4.17Å; D21-K78 IonicContact OD2-NZ 3.83Å; D21-K78 PolarHBondContact OD2-NZ 3.23Å; M26-K78 HydrophobicContact CE-CD 4.42Å; M26-K78 HydrophobicContact SD-CD 4.11Å; M26-K78 HydrophobicContact SD-CG 4.4Å
79	G	86.2	Confident	88.4	Confident	67 Å²	67	56.7 Å²	56.7	69%	0.691	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	14.6	178.1	0	0	0	0	0	115.4	I77	I77-G79 PolarHBondContact O-N 3.32Å; I77-G79 VanDerWaalsContact O-N 3.17Å
80	R	86.8	Confident	87.7	Confident	113 Å²	113	59 Å²	59	43%	0.426	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	133.5	170.4	-64	-171.1	-179.3	-175.3	-3	111.5	H19 V76 I77 I82	H19-R80 HydrophobicContact CB-CG 4.42Å; V76-R80 CarbonylContact C-O 3.6Å; V76-R80 WeakPolarHBondContact CA-O 3.34Å; I77-R80 PolarHBondContact N-O 3.36Å; I77-R80 PolarHBondContact O-N 2.92Å; R80-I82 PolarHBondContact O-N 3.44Å
81	P	88.8	Confident	87	Confident	50 Å²	50	57 Å²	57	33%	0.325	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.1	169.6	29.3	-33.5	0	0	0	109.6	Y74 D75	Y74-P81 WeakPolarHBondContact O-CB 3.38Å; D75-P81 CarbonylContact O-C 3.59Å; D75-P81 WeakPolarHBondContact O-CA 3.42Å
82	I	92.3	Very high	86.3	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.294	C	S	.	.			trans	-79.5	149.3	175.5	70.7	-171.5	0	0	0	110.3	V15 L18 F31 Y74 D75 I77 R80 I84	V15-I82 HydrophobicContact CG1-CB 4.01Å; V15-I82 HydrophobicContact CG1-CD1 4.27Å; V15-I82 HydrophobicContact CG1-CG1 4.39Å; L18-I82 HydrophobicContact CD2-CB 4.23Å; L18-I82 HydrophobicContact CD2-CG2 3.63Å; F31-I82 HydrophobicContact CE2-CD1 3.99Å; F31-I82 HydrophobicContact CZ-CD1 3.67Å; Y74-I82 WeakPolarHBondContact CA-O 3.39Å; Y74-I82 PolarHBondContact N-O 3.07Å; D75-I82 HydrophobicContact CB-CD1 4.17Å; D75-I82 HydrophobicContact CB-CG1 4.32Å; D75-I82 WeakPolarHBondContact O-CG1 3.4Å; D75-I82 PolarHBondContact O-N 3.01Å; I77-I82 HydrophobicContact CB-CG2 3.93Å; I77-I82 HydrophobicContact CD1-CD1 4Å; I77-I82 HydrophobicContact CD1-CG2 3.73Å; I77-I82 HydrophobicContact CG1-CD1 4.41Å; I77-I82 HydrophobicContact CG1-CG2 3.69Å; R80-I82 PolarHBondContact O-N 3.44Å; I82-I84 HydrophobicContact CD1-CD1 4.49Å; I82-I84 HydrophobicContact CG1-CG1 4.34Å
83	R	90.4	Very high	85.4	Confident	47 Å²	47	59.2 Å²	59.2	18%	0.177	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	103.9	-178.9	-171	169.7	59.7	77.3	12.1	110.7	G16 D17 Y74 M85 S127 C128	G16-R83 PolarHBondContact N-O 3.35Å; G16-R83 PolarHBondContact O-N 2.85Å; D17-R83 HydrophobicContact CB-CB 4.42Å; D17-R83 IonicContact OD2-CZ 2.79Å; D17-R83 IonicContact OD2-NE 3.97Å; D17-R83 PolarHBondContact OD2-NE 2.7Å; D17-R83 IonicContact OD2-NH2 3.38Å; D17-R83 PolarHBondContact OD2-NH2 3.49Å; Y74-R83 HydrophobicContact CE1-CG 4.13Å; R83-M85 PolarHBondContact NH1-SD 3.32Å; R83-S127 WeakPolarHBondContact CD-OG 3.3Å; R83-S127 WeakPolarHBondContact CG-OG 3.42Å; R83-S127 PolarHBondContact NH1-OG 2.83Å; R83-C128 WeakPolarHBondContact CD-O 3.39Å
84	I	92.1	Very high	84.5	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.3	-177.9	-46.6	177.4	0	0	0	109.5	L13 Y14 V15 F31 A68 L69 M72 N73 I82	L13-I84 HydrophobicContact CB-CG2 4.07Å; L13-I84 HydrophobicContact CD1-CG2 3.73Å; L13-I84 HydrophobicContact CD2-CG2 4.39Å; L13-I84 HydrophobicContact CG-CG2 4.29Å; Y14-I84 CarbonylContact O-C 3.58Å; Y14-I84 WeakPolarHBondContact O-CA 3.42Å; V15-I84 HydrophobicContact CG1-CG1 4.47Å; F31-I84 HydrophobicContact CE1-CD1 3.6Å; F31-I84 HydrophobicContact CZ-CD1 3.67Å; F31-I84 HydrophobicContact CZ-CG1 4.24Å; A68-I84 WeakPolarHBondContact O-CD1 3.47Å; L69-I84 HydrophobicContact CB-CG2 4.43Å; L69-I84 HydrophobicContact CD1-CB 3.88Å; L69-I84 HydrophobicContact CD1-CG2 3.65Å; M72-I84 VanDerWaalsContact C-CD1 3.47Å; M72-I84 HydrophobicContact CB-CD1 4Å; M72-I84 WeakPolarHBondContact O-CD1 3.26Å; N73-I84 HydrophobicContact CB-CB 4.37Å; N73-I84 HydrophobicContact CB-CD1 4.27Å; N73-I84 HydrophobicContact CB-CG1 4.36Å; N73-I84 PolarHBondContact ND2-O 3.47Å; N73-I84 VanDerWaalsContact ND2-O 3.12Å; N73-I84 PolarHBondContact OD1-N 3.4Å; I82-I84 HydrophobicContact CD1-CD1 4.49Å; I82-I84 HydrophobicContact CG1-CG1 4.34Å
85	M	90.1	Very high	83.5	Confident	34 Å²	34	71 Å²	71	17%	0.167	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	160.2	172.7	-57.8	179	61.4	0	0	109.6	L13 Y14 R83 L126 S127	L13-M85 CarbonylContact C-O 3.58Å; L13-M85 WeakPolarHBondContact CA-O 3.45Å; Y14-M85 HydrophobicContact CD1-CB 4.26Å; Y14-M85 HydrophobicContact CD1-CG 4.31Å; Y14-M85 HydrophobicContact CD1-SD 4.25Å; Y14-M85 HydrophobicContact CE1-SD 4.5Å; Y14-M85 PolarHBondContact N-O 3.05Å; Y14-M85 PolarHBondContact O-N 3Å; R83-M85 PolarHBondContact NH1-SD 3.32Å; M85-L126 HydrophobicContact CE-CB 4.36Å; M85-S127 WeakPolarHBondContact CG-OG 3.43Å
86	W	89.6	Confident	82.6	Confident	56 Å²	56	71.6 Å²	71.6	21%	0.212	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	142	161.7	-69.9	110.5	0	0	0	111.2	Y8 L13 A65 E66 L69 Q88	Y8-W86 HydrophobicContact CD1-CB 4.5Å; Y8-W86 HydrophobicContact CD2-CB 4.44Å; Y8-W86 HydrophobicContact CD2-CD2 4.06Å; Y8-W86 HydrophobicContact CD2-CE3 4.42Å; Y8-W86 HydrophobicContact CD2-CG 4.05Å; Y8-W86 HydrophobicContact CE1-CB 4.16Å; Y8-W86 HydrophobicContact CE2-CB 4.1Å; Y8-W86 AromaticContact CE2-CD1 3.9Å; Y8-W86 HydrophobicContact CE2-CD2 4.33Å; Y8-W86 AromaticContact CE2-CG 3.85Å; Y8-W86 HydrophobicContact CE2-CG 3.85Å; Y8-W86 HydrophobicContact CG-CE3 4.5Å; L13-W86 HydrophobicContact CD2-CD2 4.11Å; L13-W86 HydrophobicContact CD2-CE3 3.7Å; L13-W86 HydrophobicContact CD2-CH2 4.39Å; L13-W86 HydrophobicContact CD2-CZ3 3.86Å; A65-W86 HydrophobicContact CB-CH2 3.82Å; A65-W86 HydrophobicContact CB-CZ3 3.83Å; E66-W86 HydrophobicContact CB-CH2 4.47Å; E66-W86 HydrophobicContact CB-CZ2 4.24Å; L69-W86 HydrophobicContact CD2-CZ2 4.36Å; W86-Q88 PolarHBondContact O-N 2.93Å
87	S	86.6	Confident	81.7	Confident	18 Å²	18	68.6 Å²	68.6	13%	0.126	36%	0.361	C	S	.	.			trans	-80.6	77.6	-171.2	175.5	0	0	0	0	113.6	S12 Y56 R89	S12-S87 WeakPolarHBondContact O-CB 3.43Å; S12-S87 PolarHBondContact O-N 2.82Å; Y56-S87 WeakPolarHBondContact CD1-OG 3.19Å; Y56-S87 WeakPolarHBondContact CE1-OG 3.41Å; S87-R89 PolarHBondContact O-N 2.81Å
88	Q	81.1	Confident	81.1	Confident	52 Å²	52	70.7 Å²	70.7	24%	0.243	38%	0.375	C	S	.	.			trans	-62.5	124.1	173	-160	67.2	27.2	0	0	111.5	W86 D90 L93 R94	W86-Q88 PolarHBondContact O-N 2.93Å; Q88-D90 PolarHBondContact NE2-OD2 3.23Å; Q88-L93 HydrophobicContact CG-CB 4.01Å; Q88-R94 HydrophobicContact CB-CG 3.98Å; Q88-R94 HydrophobicContact CG-CG 4.24Å; Q88-R94 VanDerWaalsContact O-CD 3.22Å; Q88-R94 WeakPolarHBondContact O-CD 3.42Å; Q88-R94 PolarHBondContact O-NE 3.33Å
89	R	75.7	Confident	80.8	Confident	163 Å²	163	66.2 Å²	66.2	62%	0.615	36%	0.357	S	S	*	.			trans	-84.5	-37.2	177.6	-69	-178.6	179.7	-110.6	-1.6	112.2	S87 R94	S87-R89 PolarHBondContact O-N 2.81Å; R89-R94 PolarHBondContact O-NE 3.29Å; R89-R94 PolarHBondContact O-NH2 2.77Å
90	D	76.6	Confident	81.1	Confident	76 Å²	76	64.8 Å²	64.8	41%	0.406	33%	0.333	S	S	.	.			trans	-64.8	128.8	-169.8	-46.8	-64.3	0	0	0	112.4	Q88 G92 L93 R94	Q88-D90 PolarHBondContact NE2-OD2 3.23Å; D90-G92 PolarHBondContact O-N 2.97Å; D90-L93 HydrophobicContact CB-CD1 3.93Å; D90-R94 WeakPolarHBondContact O-CB 3.46Å; D90-R94 WeakPolarHBondContact O-CG 3.35Å; D90-R94 PolarHBondContact O-N 3.24Å; D90-R94 PolarHBondContact O-NE 3.25Å; D90-R94 VanDerWaalsContact O-NE 3.12Å
91	P	72.8	Confident	81.3	Confident	74 Å²	74	59.4 Å²	59.4	48%	0.481	31%	0.313	S	S	.	.	H	α-helix	trans	-63.6	-29.6	173.2	-22.7	34.1	0	0	0	112.6	K95	P91-K95 VanDerWaalsContact O-CB 3.23Å; P91-K95 WeakPolarHBondContact O-CB 3.43Å; P91-K95 VanDerWaalsContact O-CG 3.22Å; P91-K95 WeakPolarHBondContact O-CG 3.46Å; P91-K95 PolarHBondContact O-N 3.03Å; P91-K95 VanDerWaalsContact O-N 3.11Å
92	G	74.1	Confident	81.5	Confident	50 Å²	50	58.9 Å²	58.9	52%	0.515	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-63.2	180	0	0	0	0	0	112.2	D90 R94 K95 S96	D90-G92 PolarHBondContact O-N 2.97Å; G92-R94 PolarHBondContact O-N 3.33Å; G92-K95 PolarHBondContact O-N 3.02Å; G92-S96 WeakPolarHBondContact O-CB 3.21Å; G92-S96 PolarHBondContact O-N 2.78Å
93	L	71.4	Confident	81.6	Confident	108 Å²	108	58.9 Å²	58.9	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-58.6	-35.9	178.7	-74.7	88.3	0	0	0	112.2	Q88 D90 K95 S96	Q88-L93 HydrophobicContact CG-CB 4.01Å; D90-L93 HydrophobicContact CB-CD1 3.93Å; L93-K95 VanDerWaalsContact C-N 3.32Å; L93-K95 PolarHBondContact O-N 3.45Å; L93-S96 PolarHBondContact O-OG 3.12Å
94	R	71.3	Confident	81.6	Confident	138 Å²	138	62.2 Å²	62.2	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-71.4	-17.3	176.6	-72.5	-173.3	-69.9	139.8	-4.4	115.4	Q88 R89 D90 G92	Q88-R94 HydrophobicContact CB-CG 3.98Å; Q88-R94 HydrophobicContact CG-CG 4.24Å; Q88-R94 VanDerWaalsContact O-CD 3.22Å; Q88-R94 WeakPolarHBondContact O-CD 3.42Å; Q88-R94 PolarHBondContact O-NE 3.33Å; R89-R94 PolarHBondContact O-NE 3.29Å; R89-R94 PolarHBondContact O-NH2 2.77Å; D90-R94 WeakPolarHBondContact O-CB 3.46Å; D90-R94 WeakPolarHBondContact O-CG 3.35Å; D90-R94 PolarHBondContact O-N 3.24Å; D90-R94 PolarHBondContact O-NE 3.25Å; D90-R94 VanDerWaalsContact O-NE 3.12Å; G92-R94 PolarHBondContact O-N 3.33Å
95	K	68.1	Low	81.5	Confident	173 Å²	173	66.3 Å²	66.3	75%	0.752	34%	0.344	S	S	*	.	H	α-helix	trans	-116.8	-9.6	-176.5	-68	177.6	-178.4	176.9	0	114	P91 G92 L93 G97	P91-K95 VanDerWaalsContact O-CB 3.23Å; P91-K95 WeakPolarHBondContact O-CB 3.43Å; P91-K95 VanDerWaalsContact O-CG 3.22Å; P91-K95 WeakPolarHBondContact O-CG 3.46Å; P91-K95 PolarHBondContact O-N 3.03Å; P91-K95 VanDerWaalsContact O-N 3.11Å; G92-K95 PolarHBondContact O-N 3.02Å; L93-K95 VanDerWaalsContact C-N 3.32Å; L93-K95 PolarHBondContact O-N 3.45Å; K95-G97 VanDerWaalsContact C-N 3.27Å; K95-G97 PolarHBondContact O-N 2.86Å
96	S	70.8	Confident	81.6	Confident	66 Å²	66	64.8 Å²	64.8	46%	0.462	34%	0.336	S	S	.	.	S	Bend	trans	-60.7	-33.2	-174.5	67.7	0	0	0	0	113.5	G92 L93 V98	G92-S96 WeakPolarHBondContact O-CB 3.21Å; G92-S96 PolarHBondContact O-N 2.78Å; L93-S96 PolarHBondContact O-OG 3.12Å; S96-V98 PolarHBondContact O-N 3.06Å; S96-V98 PolarHBondContact OG-N 2.78Å
97	G	70.2	Confident	81.6	Confident	36 Å²	36	63.6 Å²	63.6	37%	0.371	33%	0.334	S	S	.	.			trans	71.6	5.4	-173.4	0	0	0	0	0	113.9	K95 N100	K95-G97 VanDerWaalsContact C-N 3.27Å; K95-G97 PolarHBondContact O-N 2.86Å; G97-N100 WeakPolarHBondContact CA-OD1 3.44Å; G97-N100 WeakPolarHBondContact O-CB 3.34Å; G97-N100 PolarHBondContact O-N 3.33Å; G97-N100 PolarHBondContact O-OD1 2.79Å
98	V	79.2	Confident	81.7	Confident	64 Å²	64	68.2 Å²	68.2	39%	0.388	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	131.7	180	177.1	0	0	0	0	108.9	S96 N100 H144 Q148	S96-V98 PolarHBondContact O-N 3.06Å; S96-V98 PolarHBondContact OG-N 2.78Å; V98-N100 PolarHBondContact O-N 2.93Å; V98-N100 PolarHBondContact O-OD1 3.43Å; V98-H144 PolarHBondContact O-CE1 3.29Å; V98-H144 VanDerWaalsContact O-CE1 3.29Å; V98-H144 PolarHBondContact O-ND1 2.94Å; V98-Q148 HydrophobicContact CG1-CB 3.95Å
99	G	83.8	Confident	82	Confident	4 Å²	4	69.5 Å²	69.5	4%	0.041	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.2	-2	-173.8	0	0	0	0	0	115.2	F145	G99-F145 PolarHBondContact O-N 3.23Å
100	N	90.8	Very high	82.7	Confident	38 Å²	38	62.1 Å²	62.1	20%	0.203	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	120.2	178.5	-62.9	73.8	0	0	0	112	G97 V98 H144 F173	G97-N100 WeakPolarHBondContact CA-OD1 3.44Å; G97-N100 WeakPolarHBondContact O-CB 3.34Å; G97-N100 PolarHBondContact O-N 3.33Å; G97-N100 PolarHBondContact O-OD1 2.79Å; V98-N100 PolarHBondContact O-N 2.93Å; V98-N100 PolarHBondContact O-OD1 3.43Å; N100-H144 PolarHBondContact OD1-CE1 3.29Å; N100-H144 PolarHBondContact OD1-ND1 3.18Å; N100-F173 HydrophobicContact CB-CB 3.57Å; N100-F173 HydrophobicContact CB-CD1 4.34Å; N100-F173 HydrophobicContact CB-CG 4.15Å; N100-F173 WeakPolarHBondContact O-CB 3.36Å; N100-F173 PolarHBondContact O-N 3.13Å
101	I	92.6	Very high	83.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	152.6	169.9	67.1	163.2	0	0	0	111.9	I103 F119 F142 V143 F145 A151 A154 I155 V170 G171	I101-I103 HydrophobicContact CD1-CD1 3.94Å; I101-I103 HydrophobicContact CD1-CG1 4Å; I101-I103 HydrophobicContact CG1-CG1 4.45Å; I101-F119 HydrophobicContact CD1-CD1 3.91Å; I101-F119 HydrophobicContact CD1-CE1 3.83Å; I101-F142 WeakPolarHBondContact O-CA 3.43Å; I101-V143 HydrophobicContact CD1-CB 4Å; I101-V143 HydrophobicContact CD1-CG2 4.48Å; I101-V143 HydrophobicContact CG1-CB 3.67Å; I101-V143 WeakPolarHBondContact CG1-O 3.5Å; I101-V143 PolarHBondContact N-O 2.62Å; I101-V143 PolarHBondContact O-N 3.25Å; I101-V143 VanDerWaalsContact O-N 3.12Å; I101-F145 HydrophobicContact CD1-CE2 3.8Å; I101-F145 HydrophobicContact CG1-CE2 4.15Å; I101-A151 HydrophobicContact CG2-CB 3.58Å; I101-A154 HydrophobicContact CD1-CB 4.26Å; I101-I155 HydrophobicContact CG2-CD1 3.86Å; I101-I155 HydrophobicContact CG2-CG1 3.91Å; I101-V170 HydrophobicContact CB-CG1 4.5Å; I101-V170 HydrophobicContact CD1-CG1 3.76Å; I101-G171 CarbonylContact C-O 3.6Å; I101-G171 WeakPolarHBondContact CA-O 3.38Å
102	F	93.3	Very high	84	Confident	38 Å²	38	59.3 Å²	59.3	17%	0.167	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.4	172.5	166.5	-116.8	0	0	0	109	K104 Y140 G141 F142 G171	F102-K104 HydrophobicContact CE1-CB 3.87Å; F102-K104 HydrophobicContact CE1-CD 4.19Å; F102-K104 HydrophobicContact CE1-CG 4.42Å; F102-K104 HydrophobicContact CE2-CB 4.45Å; F102-K104 HydrophobicContact CZ-CB 3.72Å; F102-K104 HydrophobicContact CZ-CD 4.09Å; F102-K104 HydrophobicContact CZ-CG 4.03Å; F102-Y140 AromaticContact CE2-CD2 3.82Å; F102-Y140 HydrophobicContact CE2-CD2 3.82Å; F102-Y140 HydrophobicContact CE2-CG 4.21Å; F102-G141 WeakPolarHBondContact CD2-O 3.23Å; F102-F142 HydrophobicContact CB-CD1 4.21Å; F102-F142 HydrophobicContact CB-CE1 4.32Å; F102-F142 AromaticContact CD2-CD1 3.82Å; F102-F142 HydrophobicContact CD2-CD1 3.82Å; F102-F142 AromaticContact CD2-CE1 3.4Å; F102-F142 HydrophobicContact CD2-CE1 3.4Å; F102-F142 VanDerWaalsContact CD2-CE1 3.4Å; F102-F142 HydrophobicContact CD2-CZ 4.18Å; F102-F142 HydrophobicContact CE2-CE1 4.11Å; F102-F142 HydrophobicContact CE2-CZ 4.48Å; F102-F142 HydrophobicContact CG-CD1 4.5Å; F102-F142 HydrophobicContact CG-CE1 4.22Å; F102-G171 PolarHBondContact N-O 3.08Å; F102-G171 PolarHBondContact O-N 2.78Å; F102-G171 VanDerWaalsContact O-N 3.09Å
103	I	92.6	Very high	84.6	Confident	1 Å²	1	63 Å²	63	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.5	-178.3	-53.4	161.6	0	0	0	108.4	I101 M106 L115 F119 Y140 G141 V143 V168 F169 V170	I101-I103 HydrophobicContact CD1-CD1 3.94Å; I101-I103 HydrophobicContact CD1-CG1 4Å; I101-I103 HydrophobicContact CG1-CG1 4.45Å; I103-M106 HydrophobicContact CB-CG 4.46Å; I103-M106 HydrophobicContact CB-SD 3.89Å; I103-M106 HydrophobicContact CG2-CG 3.54Å; I103-M106 HydrophobicContact CG2-SD 3.43Å; I103-M106 WeakPolarHBondContact CG2-SD 3.28Å; I103-L115 HydrophobicContact CD1-CD1 3.78Å; I103-F119 HydrophobicContact CD1-CD1 4.35Å; I103-F119 HydrophobicContact CD1-CD2 4.06Å; I103-F119 HydrophobicContact CD1-CE1 3.88Å; I103-F119 HydrophobicContact CD1-CE2 3.57Å; I103-F119 HydrophobicContact CD1-CG 4.43Å; I103-F119 HydrophobicContact CD1-CZ 3.47Å; I103-F119 VanDerWaalsContact CD1-CZ 3.47Å; I103-F119 HydrophobicContact CG1-CZ 4.16Å; I103-Y140 CarbonylContact O-C 3.52Å; I103-Y140 VanDerWaalsContact O-CA 3.24Å; I103-Y140 WeakPolarHBondContact O-CA 3.19Å; I103-Y140 VanDerWaalsContact O-CB 3.32Å; I103-Y140 WeakPolarHBondContact O-CB 3.23Å; I103-G141 PolarHBondContact N-O 3.37Å; I103-G141 PolarHBondContact O-N 3.15Å; I103-V143 HydrophobicContact CD1-CB 4.5Å; I103-V143 HydrophobicContact CD1-CG2 3.64Å; I103-V168 HydrophobicContact CG2-CB 4.42Å; I103-F169 CarbonylContact C-O 3.5Å; I103-F169 WeakPolarHBondContact CA-O 3.37Å; I103-V170 HydrophobicContact CG1-CG1 4.15Å; I103-V170 HydrophobicContact CG1-CG2 4.3Å; I103-V170 HydrophobicContact CG2-CG2 4.19Å
104	K	91.8	Very high	85.4	Confident	117 Å²	117	59.5 Å²	59.5	51%	0.509	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155.4	-174.8	-170.3	-171.7	172.6	-165.3	0	110.8	F102 M106 G139 F169	F102-K104 HydrophobicContact CE1-CB 3.87Å; F102-K104 HydrophobicContact CE1-CD 4.19Å; F102-K104 HydrophobicContact CE1-CG 4.42Å; F102-K104 HydrophobicContact CE2-CB 4.45Å; F102-K104 HydrophobicContact CZ-CB 3.72Å; F102-K104 HydrophobicContact CZ-CD 4.09Å; F102-K104 HydrophobicContact CZ-CG 4.03Å; K104-M106 PolarHBondContact O-N 3.22Å; K104-G139 CarbonylContact C-O 3.55Å; K104-F169 HydrophobicContact CB-CB 4.39Å; K104-F169 HydrophobicContact CB-CD1 4.39Å; K104-F169 PolarHBondContact N-O 3.16Å; K104-F169 PolarHBondContact O-N 2.86Å
105	N	89.9	Confident	86.3	Confident	87 Å²	87	53 Å²	53	47%	0.465	29%	0.286	S	S	.	.	S	Bend	trans	64.7	32.2	-179	-156.8	64.8	0	0	0	112.5	G139 R166 K167	N105-G139 WeakPolarHBondContact CA-O 3.4Å; N105-G139 PolarHBondContact N-O 3.05Å; N105-R166 WeakPolarHBondContact O-CB 3.43Å; N105-K167 PolarHBondContact ND2-O 3.4Å
106	M	90.9	Very high	87.4	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	26%	0.264	C	S	.	.			trans	-70.1	157.9	167.7	-53	-171.4	-42.8	0	0	109.8	I103 K104 I110 L115 V130 G139 V168	I103-M106 HydrophobicContact CB-CG 4.46Å; I103-M106 HydrophobicContact CB-SD 3.89Å; I103-M106 HydrophobicContact CG2-CG 3.54Å; I103-M106 HydrophobicContact CG2-SD 3.43Å; I103-M106 WeakPolarHBondContact CG2-SD 3.28Å; K104-M106 PolarHBondContact O-N 3.22Å; M106-I110 HydrophobicContact CB-CD1 4.09Å; M106-L115 HydrophobicContact SD-CD1 3.68Å; M106-V130 HydrophobicContact CE-CG1 4.11Å; M106-V130 HydrophobicContact CE-CG2 3.94Å; M106-G139 PolarHBondContact N-O 3.45Å; M106-G139 WeakPolarHBondContact O-CA 3.35Å; M106-V168 HydrophobicContact CB-CG1 4.47Å; M106-V168 HydrophobicContact CG-CG1 4.12Å
107	D	89.4	Confident	88.3	Confident	30 Å²	30	49.4 Å²	49.4	16%	0.16	27%	0.265	C	S	.	.			trans	-64.8	152.5	166.3	-157.3	-74.9	0	0	0	111.9	S109 I110 N164 R166	D107-S109 PolarHBondContact O-N 3.35Å; D107-S109 WeakPolarHBondContact OD1-CB 3.47Å; D107-S109 PolarHBondContact OD1-N 3.07Å; D107-S109 PolarHBondContact OD1-OG 2.78Å; D107-I110 HydrophobicContact CB-CD1 4.05Å; D107-I110 HydrophobicContact CB-CG1 4.22Å; D107-I110 PolarHBondContact O-N 3.5Å; D107-N164 HydrophobicContact CB-CB 3.89Å; D107-R166 HydrophobicContact CB-CG 4.43Å; D107-R166 IonicContact OD1-NH2 3.68Å; D107-R166 PolarHBondContact OD1-NH2 2.99Å; D107-R166 IonicContact OD2-CZ 2.6Å; D107-R166 IonicContact OD2-NE 2.84Å; D107-R166 PolarHBondContact OD2-NE 2.84Å; D107-R166 IonicContact OD2-NH2 3.85Å; D107-R166 PolarHBondContact OD2-NH2 3.29Å
108	E	89.3	Confident	89.3	Confident	115 Å²	115	50 Å²	50	54%	0.537	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-18.7	175.6	-74.5	149.8	-105.5	0	0	112.3	I110 S137 R166	E108-I110 VanDerWaalsContact C-N 3.28Å; E108-S137 WeakPolarHBondContact O-CB 3.21Å; E108-R166 IonicContact OE1-CZ 3.81Å; E108-R166 IonicContact OE1-NH1 2.98Å; E108-R166 PolarHBondContact OE1-NH1 3.47Å; E108-R166 IonicContact OE1-NH2 2.62Å; E108-R166 PolarHBondContact OE1-NH2 3.12Å
109	S	88.6	Confident	89.9	Confident	79 Å²	79	47 Å²	47	55%	0.552	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-13.4	172.1	85.5	0	0	0	0	114.1	D107 D111 N164	D107-S109 PolarHBondContact O-N 3.35Å; D107-S109 WeakPolarHBondContact OD1-CB 3.47Å; D107-S109 PolarHBondContact OD1-N 3.07Å; D107-S109 PolarHBondContact OD1-OG 2.78Å; S109-D111 PolarHBondContact O-N 2.8Å; S109-N164 PolarHBondContact OG-ND2 2.84Å
110	I	88.5	Confident	90.3	Very high	8 Å²	8	49.2 Å²	49.2	4%	0.041	26%	0.258	C	S	.	.			trans	-83	115.1	-177.6	-64	167.2	0	0	0	108.4	M106 D107 E108 A114 L115 L163	M106-I110 HydrophobicContact CB-CD1 4.09Å; D107-I110 HydrophobicContact CB-CD1 4.05Å; D107-I110 HydrophobicContact CB-CG1 4.22Å; D107-I110 PolarHBondContact O-N 3.5Å; E108-I110 VanDerWaalsContact C-N 3.28Å; I110-A114 HydrophobicContact CG2-CB 4.39Å; I110-L115 HydrophobicContact CG2-CB 4.29Å; I110-L163 HydrophobicContact CD1-CB 4.25Å; I110-L163 HydrophobicContact CD1-CD2 3.73Å
111	D	88.1	Confident	90.3	Very high	77 Å²	77	51.6 Å²	51.6	41%	0.412	28%	0.282	S	S	.	.			trans	-94.9	-175.3	176.2	85.7	-48.1	0	0	0	111.4	S109 K113 A114 L115 V130	S109-D111 PolarHBondContact O-N 2.8Å; D111-K113 VanDerWaalsContact C-N 3.33Å; D111-K113 PolarHBondContact O-N 3.34Å; D111-K113 PolarHBondContact OD1-N 2.93Å; D111-K113 WeakPolarHBondContact OD2-CB 3.48Å; D111-K113 PolarHBondContact OD2-N 3.2Å; D111-K113 VanDerWaalsContact OD2-N 3.07Å; D111-A114 VanDerWaalsContact OD1-CB 3.26Å; D111-A114 WeakPolarHBondContact OD1-CB 3.09Å; D111-A114 PolarHBondContact OD1-N 3.18Å; D111-L115 VanDerWaalsContact O-CB 3.32Å; D111-L115 WeakPolarHBondContact O-CB 3.35Å; D111-L115 PolarHBondContact O-N 2.91Å; D111-L115 VanDerWaalsContact O-N 3.16Å; D111-V130 VanDerWaalsContact C-CG2 3.48Å; D111-V130 WeakPolarHBondContact O-CG2 3.48Å
112	N	88.6	Confident	90.3	Very high	15 Å²	15	53.1 Å²	53.1	8%	0.08	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-35.2	179.1	-53.1	-72.3	0	0	0	112.1	Y74 L115 Y116 C128 K129 V130	Y74-N112 HydrophobicContact CD1-CB 3.33Å; Y74-N112 HydrophobicContact CD2-CB 3.93Å; Y74-N112 HydrophobicContact CE1-CB 3.81Å; Y74-N112 HydrophobicContact CE2-CB 4.36Å; Y74-N112 HydrophobicContact CG-CB 3.4Å; N112-L115 PolarHBondContact O-N 2.94Å; N112-Y116 PolarHBondContact O-N 3.46Å; N112-C128 PolarHBondContact O-SG 3.42Å; N112-K129 WeakPolarHBondContact OD1-CA 3.41Å; N112-V130 PolarHBondContact OD1-N 3.07Å
113	K	86.8	Confident	90.1	Very high	127 Å²	127	52.4 Å²	52.4	55%	0.552	29%	0.292	S	S	*	.	H	α-helix	trans	-71.2	-50.1	-178.4	-174.9	174.4	177.8	176.1	0	111.3	D111 L115 Y116 D117	D111-K113 VanDerWaalsContact C-N 3.33Å; D111-K113 PolarHBondContact O-N 3.34Å; D111-K113 PolarHBondContact OD1-N 2.93Å; D111-K113 WeakPolarHBondContact OD2-CB 3.48Å; D111-K113 PolarHBondContact OD2-N 3.2Å; D111-K113 VanDerWaalsContact OD2-N 3.07Å; K113-L115 PolarHBondContact O-N 3.09Å; K113-Y116 WeakPolarHBondContact O-CB 3.21Å; K113-Y116 PolarHBondContact O-N 3.13Å; K113-D117 WeakPolarHBondContact CE-OD2 3.48Å; K113-D117 WeakPolarHBondContact CG-OD2 3.26Å; K113-D117 WeakPolarHBondContact O-CB 3.37Å; K113-D117 VanDerWaalsContact O-CG 3.27Å; K113-D117 PolarHBondContact O-N 3.35Å
114	A	89.3	Confident	90	Very high	35 Å²	35	56.2 Å²	56.2	29%	0.289	31%	0.313	S	S	.	.	H	α-helix	trans	-58.1	-33.5	175.1	0	0	0	0	0	112.2	I110 D111 T118	I110-A114 HydrophobicContact CG2-CB 4.39Å; D111-A114 VanDerWaalsContact OD1-CB 3.26Å; D111-A114 WeakPolarHBondContact OD1-CB 3.09Å; D111-A114 PolarHBondContact OD1-N 3.18Å; A114-T118 VanDerWaalsContact O-CB 3.28Å; A114-T118 WeakPolarHBondContact O-CB 3.48Å; A114-T118 PolarHBondContact O-N 3.04Å; A114-T118 PolarHBondContact O-OG1 3.47Å
115	L	90.4	Very high	89.9	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-41.9	173.8	-169.5	68.3	0	0	0	112.5	I103 M106 I110 D111 N112 K113 F119 C128 V130 V143	I103-L115 HydrophobicContact CD1-CD1 3.78Å; M106-L115 HydrophobicContact SD-CD1 3.68Å; I110-L115 HydrophobicContact CG2-CB 4.29Å; D111-L115 VanDerWaalsContact O-CB 3.32Å; D111-L115 WeakPolarHBondContact O-CB 3.35Å; D111-L115 PolarHBondContact O-N 2.91Å; D111-L115 VanDerWaalsContact O-N 3.16Å; N112-L115 PolarHBondContact O-N 2.94Å; K113-L115 PolarHBondContact O-N 3.09Å; L115-F119 HydrophobicContact CD1-CD2 3.89Å; L115-F119 HydrophobicContact CD1-CE2 3.88Å; L115-F119 WeakPolarHBondContact O-CD2 3.37Å; L115-F119 PolarHBondContact O-N 3.38Å; L115-C128 HydrophobicContact CD2-CB 4.15Å; L115-C128 HydrophobicContact CG-CB 4.5Å; L115-V130 HydrophobicContact CB-CG2 4.26Å; L115-V130 HydrophobicContact CD2-CG2 3.88Å; L115-V143 HydrophobicContact CD2-CG2 4.04Å; L115-V143 HydrophobicContact CG-CG2 4.02Å
116	Y	90.1	Very high	89.7	Confident	76 Å²	76	49.2 Å²	49.2	30%	0.298	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-52.3	173.9	-175.6	-88.6	0	0	0	111.2	N112 K113 T118 F119 S120 I125	N112-Y116 PolarHBondContact O-N 3.46Å; K113-Y116 WeakPolarHBondContact O-CB 3.21Å; K113-Y116 PolarHBondContact O-N 3.13Å; Y116-T118 VanDerWaalsContact C-N 3.26Å; Y116-T118 PolarHBondContact O-N 2.95Å; Y116-F119 PolarHBondContact O-N 3.36Å; Y116-F119 VanDerWaalsContact O-N 3.16Å; Y116-S120 WeakPolarHBondContact O-CB 3.4Å; Y116-S120 PolarHBondContact O-N 2.92Å; Y116-S120 PolarHBondContact O-OG 3.22Å; Y116-I125 HydrophobicContact CD2-CB 3.98Å; Y116-I125 HydrophobicContact CD2-CD1 4.16Å; Y116-I125 HydrophobicContact CD2-CG2 3.79Å; Y116-I125 HydrophobicContact CE2-CB 3.69Å; Y116-I125 HydrophobicContact CE2-CG2 3.86Å
117	D	90.3	Very high	89.5	Confident	88 Å²	88	49.4 Å²	49.4	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-33.3	-177.8	-64.5	-12.7	0	0	0	112.1	K113 S120	K113-D117 WeakPolarHBondContact CE-OD2 3.48Å; K113-D117 WeakPolarHBondContact CG-OD2 3.26Å; K113-D117 WeakPolarHBondContact O-CB 3.37Å; K113-D117 VanDerWaalsContact O-CG 3.27Å; K113-D117 PolarHBondContact O-N 3.35Å; D117-S120 PolarHBondContact O-OG 2.89Å
118	T	90.2	Very high	89.5	Confident	48 Å²	48	48.1 Å²	48.1	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-73	-41.8	175.5	-59.2	0	0	0	0	112.7	A114 Y116 M158 L163	A114-T118 VanDerWaalsContact O-CB 3.28Å; A114-T118 WeakPolarHBondContact O-CB 3.48Å; A114-T118 PolarHBondContact O-N 3.04Å; A114-T118 PolarHBondContact O-OG1 3.47Å; Y116-T118 VanDerWaalsContact C-N 3.26Å; Y116-T118 PolarHBondContact O-N 2.95Å; T118-M158 HydrophobicContact CG2-CE 3.65Å; T118-L163 HydrophobicContact CG2-CD1 4.4Å; T118-L163 HydrophobicContact CG2-CD2 4.16Å
119	F	91.7	Very high	89.5	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.009	26%	0.263	C	S	.	.	H	α-helix	trans	-94.5	-17	-169.9	-81.5	-93.5	0	0	0	114.2	I101 I103 L115 Y116 A121 F122 I125 V143 F145 A154 M158 V170	I101-F119 HydrophobicContact CD1-CD1 3.91Å; I101-F119 HydrophobicContact CD1-CE1 3.83Å; I103-F119 HydrophobicContact CD1-CD1 4.35Å; I103-F119 HydrophobicContact CD1-CD2 4.06Å; I103-F119 HydrophobicContact CD1-CE1 3.88Å; I103-F119 HydrophobicContact CD1-CE2 3.57Å; I103-F119 HydrophobicContact CD1-CG 4.43Å; I103-F119 HydrophobicContact CD1-CZ 3.47Å; I103-F119 VanDerWaalsContact CD1-CZ 3.47Å; I103-F119 HydrophobicContact CG1-CZ 4.16Å; L115-F119 HydrophobicContact CD1-CD2 3.89Å; L115-F119 HydrophobicContact CD1-CE2 3.88Å; L115-F119 WeakPolarHBondContact O-CD2 3.37Å; L115-F119 PolarHBondContact O-N 3.38Å; Y116-F119 PolarHBondContact O-N 3.36Å; Y116-F119 VanDerWaalsContact O-N 3.16Å; F119-A121 PolarHBondContact O-N 3.24Å; F119-F122 HydrophobicContact CD1-CD2 4.08Å; F119-F122 HydrophobicContact CD1-CE2 4.34Å; F119-F122 WeakPolarHBondContact O-CD2 3.42Å; F119-F122 PolarHBondContact O-N 2.75Å; F119-I125 HydrophobicContact CB-CD1 3.71Å; F119-V143 HydrophobicContact CB-CG1 4.41Å; F119-V143 HydrophobicContact CB-CG2 4.38Å; F119-V143 HydrophobicContact CG-CG2 4.31Å; F119-F145 HydrophobicContact CB-CZ 4.1Å; F119-F145 HydrophobicContact CD1-CZ 4.2Å; F119-F145 WeakPolarHBondContact O-CE1 3.49Å; F119-A154 HydrophobicContact CD1-CB 4.11Å; F119-A154 HydrophobicContact CE1-CB 4.29Å; F119-M158 HydrophobicContact CE1-CB 4.13Å; F119-M158 HydrophobicContact CE1-CG 3.87Å; F119-M158 HydrophobicContact CE2-CE 4.24Å; F119-M158 HydrophobicContact CZ-CB 4.15Å; F119-M158 HydrophobicContact CZ-CE 4.01Å; F119-M158 HydrophobicContact CZ-CG 4.08Å; F119-V170 HydrophobicContact CE1-CG1 4.46Å; F119-V170 HydrophobicContact CZ-CG2 4.27Å
120	S	92.8	Very high	89.6	Confident	50 Å²	50	42.2 Å²	42.2	35%	0.35	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-58.7	-28.1	177.8	60.2	0	0	0	0	112.8	Y116 D117 F122 G123	Y116-S120 WeakPolarHBondContact O-CB 3.4Å; Y116-S120 PolarHBondContact O-N 2.92Å; Y116-S120 PolarHBondContact O-OG 3.22Å; D117-S120 PolarHBondContact O-OG 2.89Å; S120-F122 PolarHBondContact O-N 3.17Å; S120-F122 VanDerWaalsContact O-N 3.12Å; S120-G123 PolarHBondContact O-N 2.84Å; S120-G123 VanDerWaalsContact O-N 3.11Å
121	A	92.1	Very high	89.6	Confident	87 Å²	87	43 Å²	43	72%	0.719	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-57.4	-22.2	173.8	0	0	0	0	0	114.5	F119	F119-A121 PolarHBondContact O-N 3.24Å
122	F	92.1	Very high	89.4	Confident	33 Å²	33	42.7 Å²	42.7	15%	0.145	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-90.2	-17	178.9	-59.6	-73.3	0	0	0	113.8	F119 S120 F145 A150 R153 A154 T157 M158	F119-F122 HydrophobicContact CD1-CD2 4.08Å; F119-F122 HydrophobicContact CD1-CE2 4.34Å; F119-F122 WeakPolarHBondContact O-CD2 3.42Å; F119-F122 PolarHBondContact O-N 2.75Å; S120-F122 PolarHBondContact O-N 3.17Å; S120-F122 VanDerWaalsContact O-N 3.12Å; F122-F145 HydrophobicContact CB-CE1 4.12Å; F122-F145 HydrophobicContact CB-CZ 4.03Å; F122-A150 WeakPolarHBondContact O-CB 3.46Å; F122-R153 HydrophobicContact CD1-CB 4.5Å; F122-R153 PolarHBondContact O-NH2 2.85Å; F122-A154 HydrophobicContact CB-CB 3.93Å; F122-A154 HydrophobicContact CD1-CB 4.41Å; F122-A154 HydrophobicContact CD2-CB 3.95Å; F122-A154 HydrophobicContact CG-CB 3.81Å; F122-T157 HydrophobicContact CE1-CG2 3.78Å; F122-T157 HydrophobicContact CZ-CG2 4.01Å; F122-M158 HydrophobicContact CE1-CG 4.45Å; F122-M158 HydrophobicContact CE2-CG 3.51Å; F122-M158 HydrophobicContact CE2-SD 3.78Å; F122-M158 HydrophobicContact CZ-CG 3.49Å; F122-M158 VanDerWaalsContact CZ-CG 3.49Å; F122-M158 HydrophobicContact CZ-SD 3.58Å; F122-M158 VanDerWaalsContact CZ-SD 3.58Å
123	G	89.6	Confident	89.1	Confident	22 Å²	22	46.8 Å²	46.8	23%	0.227	27%	0.268	C	S	.	.	S	Bend	trans	152.6	174	-179.4	0	0	0	0	0	112.7	S120 I125 F145	S120-G123 PolarHBondContact O-N 2.84Å; S120-G123 VanDerWaalsContact O-N 3.11Å; G123-I125 PolarHBondContact O-N 3.22Å; G123-F145 WeakPolarHBondContact O-CD1 3.33Å; G123-F145 WeakPolarHBondContact O-CE1 3.47Å
124	N	88.7	Confident	88.7	Confident	82 Å²	82	50.6 Å²	50.6	44%	0.439	29%	0.288	S	S	.	.			trans	-60.5	127.4	-178.2	-173.2	18.3	0	0	0	112.3	F145 E146	N124-F145 WeakPolarHBondContact O-CA 3.28Å; N124-E146 HydrophobicContact CB-CB 4.22Å; N124-E146 WeakPolarHBondContact CB-OE2 3.46Å; N124-E146 PolarHBondContact ND2-OE2 3.26Å; N124-E146 PolarHBondContact O-N 3.48Å
125	I	90.3	Very high	87.9	Confident	9 Å²	9	58.8 Å²	58.8	5%	0.046	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	110.3	178.8	-66.7	174.5	0	0	0	109.1	Y116 F119 G123 S127 C128 V143 F145	Y116-I125 HydrophobicContact CD2-CB 3.98Å; Y116-I125 HydrophobicContact CD2-CD1 4.16Å; Y116-I125 HydrophobicContact CD2-CG2 3.79Å; Y116-I125 HydrophobicContact CE2-CB 3.69Å; Y116-I125 HydrophobicContact CE2-CG2 3.86Å; F119-I125 HydrophobicContact CB-CD1 3.71Å; G123-I125 PolarHBondContact O-N 3.22Å; I125-S127 VanDerWaalsContact C-N 3.3Å; I125-S127 WeakPolarHBondContact CG2-O 3.24Å; I125-C128 HydrophobicContact CG2-CB 4.28Å; I125-V143 HydrophobicContact CB-CG1 4.46Å; I125-V143 HydrophobicContact CD1-CG1 3.73Å; I125-V143 HydrophobicContact CG1-CG1 3.75Å; I125-V143 HydrophobicContact CG2-CG1 3.92Å; I125-F145 HydrophobicContact CD1-CE1 4.24Å; I125-F145 HydrophobicContact CG1-CD1 3.85Å; I125-F145 HydrophobicContact CG1-CE1 3.63Å; I125-F145 HydrophobicContact CG1-CZ 4.36Å
126	L	86.9	Confident	87.4	Confident	48 Å²	48	60.5 Å²	60.5	25%	0.251	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	-30.1	171.4	-61.7	-179.5	0	0	0	112	M85 H144 E146	M85-L126 HydrophobicContact CE-CB 4.36Å; L126-H144 PolarHBondContact N-O 2.93Å; L126-E146 HydrophobicContact CD1-CB 4.29Å; L126-E146 HydrophobicContact CD2-CB 4.14Å; L126-E146 HydrophobicContact CD2-CG 4.4Å; L126-E146 HydrophobicContact CG-CB 4.02Å
127	S	86.3	Confident	87.2	Confident	6 Å²	6	57.7 Å²	57.7	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	147.1	172.9	-147.5	0	0	0	0	112.7	R83 M85 I125 V143 H144	R83-S127 WeakPolarHBondContact CD-OG 3.3Å; R83-S127 WeakPolarHBondContact CG-OG 3.42Å; R83-S127 PolarHBondContact NH1-OG 2.83Å; M85-S127 WeakPolarHBondContact CG-OG 3.43Å; I125-S127 VanDerWaalsContact C-N 3.3Å; I125-S127 WeakPolarHBondContact CG2-O 3.24Å; S127-V143 CarbonylContact O-C 3.58Å; S127-H144 PolarHBondContact N-O 2.92Å; S127-H144 PolarHBondContact O-N 3.36Å
128	C	89.9	Confident	87.1	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.02	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	166.5	161.9	81.6	0	0	0	0	111.7	Y74 R83 N112 L115 I125 F142 V143	Y74-C128 WeakPolarHBondContact CE1-O 3.45Å; Y74-C128 PolarHBondContact OH-N 3.14Å; Y74-C128 PolarHBondContact OH-SG 3.28Å; R83-C128 WeakPolarHBondContact CD-O 3.39Å; N112-C128 PolarHBondContact O-SG 3.42Å; L115-C128 HydrophobicContact CD2-CB 4.15Å; L115-C128 HydrophobicContact CG-CB 4.5Å; I125-C128 HydrophobicContact CG2-CB 4.28Å; C128-F142 CarbonylContact C-O 3.54Å; C128-F142 VanDerWaalsContact CA-O 3.28Å; C128-F142 WeakPolarHBondContact CA-O 3.44Å; C128-V143 HydrophobicContact CB-CB 4.42Å; C128-V143 HydrophobicContact CB-CG1 4.48Å; C128-V143 HydrophobicContact CB-CG2 3.86Å
129	K	88.8	Confident	86.9	Confident	64 Å²	64	55.6 Å²	55.6	28%	0.278	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	120.8	176.1	-174.8	174.3	-176.6	-179.5	0	112.5	D17 N112 G141 F142	D17-K129 IonicContact OD1-NZ 3.03Å; D17-K129 PolarHBondContact OD1-NZ 2.97Å; D17-K129 WeakPolarHBondContact OD2-CD 3.32Å; D17-K129 WeakPolarHBondContact OD2-CE 3.24Å; D17-K129 IonicContact OD2-NZ 3.33Å; D17-K129 PolarHBondContact OD2-NZ 2.78Å; N112-K129 WeakPolarHBondContact OD1-CA 3.41Å; K129-G141 CarbonylContact O-C 3.6Å; K129-G141 WeakPolarHBondContact O-CA 3.43Å; K129-F142 PolarHBondContact N-O 3.43Å; K129-F142 PolarHBondContact O-N 2.77Å
130	V	90.4	Very high	86.9	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.036	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	138.4	159.5	-177.7	0	0	0	0	108.8	M106 D111 N112 L115 S137	M106-V130 HydrophobicContact CE-CG1 4.11Å; M106-V130 HydrophobicContact CE-CG2 3.94Å; D111-V130 VanDerWaalsContact C-CG2 3.48Å; D111-V130 WeakPolarHBondContact O-CG2 3.48Å; N112-V130 PolarHBondContact OD1-N 3.07Å; L115-V130 HydrophobicContact CB-CG2 4.26Å; L115-V130 HydrophobicContact CD2-CG2 3.88Å; V130-S137 WeakPolarHBondContact CG1-OG 3.39Å
131	V	88.2	Confident	86.9	Confident	25 Å²	25	56.7 Å²	56.7	15%	0.152	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	114	175.4	-174.8	0	0	0	0	110.2	K138 Y140 F142	V131-K138 HydrophobicContact CB-CD 4.43Å; V131-K138 HydrophobicContact CG1-CD 3.79Å; V131-K138 VanDerWaalsContact O-CB 3.31Å; V131-K138 WeakPolarHBondContact O-CB 3.24Å; V131-K138 VanDerWaalsContact O-CG 3.32Å; V131-K138 WeakPolarHBondContact O-CG 3.4Å; V131-K138 PolarHBondContact O-N 3.41Å; V131-Y140 HydrophobicContact CB-CD2 4.19Å; V131-Y140 HydrophobicContact CB-CE2 3.68Å; V131-Y140 HydrophobicContact CG1-CE2 4.2Å; V131-Y140 HydrophobicContact CG2-CD2 4.02Å; V131-Y140 HydrophobicContact CG2-CE2 3.5Å; V131-Y140 VanDerWaalsContact CG2-CE2 3.5Å; V131-Y140 PolarHBondContact N-O 3.05Å; V131-F142 HydrophobicContact CG2-CD2 4.17Å; V131-F142 HydrophobicContact CG2-CE2 3.7Å
132	C	84.1	Confident	86.9	Confident	70 Å²	70	55 Å²	55	47%	0.473	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.7	175.1	-55.5	0	0	0	0	112.1	G136	C132-G136 CarbonylContact C-O 3.43Å; C132-G136 VanDerWaalsContact CA-O 3.23Å; C132-G136 WeakPolarHBondContact CA-O 3.49Å; C132-G136 WeakPolarHBondContact CB-O 3.45Å
133	D	81.8	Confident	86.9	Confident	100 Å²	100	53.5 Å²	53.5	54%	0.535	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	179.1	159.3	-93.3	-21.1	0	0	0	110	K135 G136 K138	D133-K135 PolarHBondContact O-N 3.01Å; D133-G136 PolarHBondContact N-O 2.75Å; D133-G136 PolarHBondContact O-N 3.36Å; D133-K138 WeakPolarHBondContact OD1-CE 3.39Å; D133-K138 IonicContact OD1-NZ 3.45Å; D133-K138 PolarHBondContact OD1-NZ 3.03Å; D133-K138 WeakPolarHBondContact OD2-CE 3.45Å; D133-K138 IonicContact OD2-NZ 3.6Å; D133-K138 PolarHBondContact OD2-NZ 3.17Å
134	E	77.9	Confident	86.9	Confident	207 Å²	207	54.1 Å²	54.1	97%	0.967	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-9.3	167.9	-58.6	176.2	162.3	0	0	114.7
135	K	74.3	Confident	87.1	Confident	208 Å²	208	50.2 Å²	50.2	90%	0.904	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	1.2	179.7	-62.4	-173.2	178.4	-175.6	0	114.4	D133	D133-K135 PolarHBondContact O-N 3.01Å
136	G	79.6	Confident	86.9	Confident	36 Å²	36	53.9 Å²	53.9	37%	0.371	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	114.5	-166.5	-175.1	0	0	0	0	0	113.7	C132 D133	C132-G136 CarbonylContact C-O 3.43Å; C132-G136 VanDerWaalsContact CA-O 3.23Å; C132-G136 WeakPolarHBondContact CA-O 3.49Å; C132-G136 WeakPolarHBondContact CB-O 3.45Å; D133-G136 PolarHBondContact N-O 2.75Å; D133-G136 PolarHBondContact O-N 3.36Å
137	S	85.7	Confident	87.1	Confident	18 Å²	18	54.2 Å²	54.2	13%	0.126	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	145.6	-179.1	175.3	0	0	0	0	112.4	E108 V130 G139	E108-S137 WeakPolarHBondContact O-CB 3.21Å; V130-S137 WeakPolarHBondContact CG1-OG 3.39Å; S137-G139 VanDerWaalsContact C-N 3.31Å; S137-G139 PolarHBondContact OG-N 2.92Å; S137-G139 VanDerWaalsContact OG-N 3.13Å
138	K	87.1	Confident	87.2	Confident	82 Å²	82	57.9 Å²	57.9	36%	0.357	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	9.2	172.2	-59.8	179.5	-165.2	-110.7	0	113	V131 D133 Y140	V131-K138 HydrophobicContact CB-CD 4.43Å; V131-K138 HydrophobicContact CG1-CD 3.79Å; V131-K138 VanDerWaalsContact O-CB 3.31Å; V131-K138 WeakPolarHBondContact O-CB 3.24Å; V131-K138 VanDerWaalsContact O-CG 3.32Å; V131-K138 WeakPolarHBondContact O-CG 3.4Å; V131-K138 PolarHBondContact O-N 3.41Å; D133-K138 WeakPolarHBondContact OD1-CE 3.39Å; D133-K138 IonicContact OD1-NZ 3.45Å; D133-K138 PolarHBondContact OD1-NZ 3.03Å; D133-K138 WeakPolarHBondContact OD2-CE 3.45Å; D133-K138 IonicContact OD2-NZ 3.6Å; D133-K138 PolarHBondContact OD2-NZ 3.17Å; K138-Y140 HydrophobicContact CB-CD1 3.63Å; K138-Y140 HydrophobicContact CB-CE1 3.52Å; K138-Y140 HydrophobicContact CD-CE1 3.6Å; K138-Y140 HydrophobicContact CG-CE1 4.23Å; K138-Y140 PolarHBondContact O-N 3.2Å
139	G	87.6	Confident	87.4	Confident	9 Å²	9	62.9 Å²	62.9	9%	0.093	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	64.9	23.9	-175.7	0	0	0	0	0	113.9	K104 N105 M106 S137	K104-G139 CarbonylContact C-O 3.55Å; N105-G139 WeakPolarHBondContact CA-O 3.4Å; N105-G139 PolarHBondContact N-O 3.05Å; M106-G139 PolarHBondContact N-O 3.45Å; M106-G139 WeakPolarHBondContact O-CA 3.35Å; S137-G139 VanDerWaalsContact C-N 3.31Å; S137-G139 PolarHBondContact OG-N 2.92Å; S137-G139 VanDerWaalsContact OG-N 3.13Å
140	Y	91.8	Very high	87.6	Confident	76 Å²	76	59.8 Å²	59.8	30%	0.298	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153.7	174	77.4	-100	0	0	0	112.4	F102 I103 V131 K138 F142	F102-Y140 AromaticContact CE2-CD2 3.82Å; F102-Y140 HydrophobicContact CE2-CD2 3.82Å; F102-Y140 HydrophobicContact CE2-CG 4.21Å; I103-Y140 CarbonylContact O-C 3.52Å; I103-Y140 VanDerWaalsContact O-CA 3.24Å; I103-Y140 WeakPolarHBondContact O-CA 3.19Å; I103-Y140 VanDerWaalsContact O-CB 3.32Å; I103-Y140 WeakPolarHBondContact O-CB 3.23Å; V131-Y140 HydrophobicContact CB-CD2 4.19Å; V131-Y140 HydrophobicContact CB-CE2 3.68Å; V131-Y140 HydrophobicContact CG1-CE2 4.2Å; V131-Y140 HydrophobicContact CG2-CD2 4.02Å; V131-Y140 HydrophobicContact CG2-CE2 3.5Å; V131-Y140 VanDerWaalsContact CG2-CE2 3.5Å; V131-Y140 PolarHBondContact N-O 3.05Å; K138-Y140 HydrophobicContact CB-CD1 3.63Å; K138-Y140 HydrophobicContact CB-CE1 3.52Å; K138-Y140 HydrophobicContact CD-CE1 3.6Å; K138-Y140 HydrophobicContact CG-CE1 4.23Å; K138-Y140 PolarHBondContact O-N 3.2Å; Y140-F142 HydrophobicContact CD2-CE2 4.45Å; Y140-F142 HydrophobicContact CD2-CZ 4.35Å; Y140-F142 HydrophobicContact CE2-CE2 4.17Å; Y140-F142 HydrophobicContact CE2-CZ 4.12Å
141	G	91.9	Very high	87.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	-175.5	-177.4	0	0	0	0	0	113.2	F102 I103 K129	F102-G141 WeakPolarHBondContact CD2-O 3.23Å; I103-G141 PolarHBondContact N-O 3.37Å; I103-G141 PolarHBondContact O-N 3.15Å; K129-G141 CarbonylContact O-C 3.6Å; K129-G141 WeakPolarHBondContact O-CA 3.43Å
142	F	92.3	Very high	88	Confident	51 Å²	51	60.6 Å²	60.6	22%	0.224	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.6	-179.7	-53	-76.1	0	0	0	109.2	I101 F102 C128 K129 V131 Y140 F173	I101-F142 WeakPolarHBondContact O-CA 3.43Å; F102-F142 HydrophobicContact CB-CD1 4.21Å; F102-F142 HydrophobicContact CB-CE1 4.32Å; F102-F142 AromaticContact CD2-CD1 3.82Å; F102-F142 HydrophobicContact CD2-CD1 3.82Å; F102-F142 AromaticContact CD2-CE1 3.4Å; F102-F142 HydrophobicContact CD2-CE1 3.4Å; F102-F142 VanDerWaalsContact CD2-CE1 3.4Å; F102-F142 HydrophobicContact CD2-CZ 4.18Å; F102-F142 HydrophobicContact CE2-CE1 4.11Å; F102-F142 HydrophobicContact CE2-CZ 4.48Å; F102-F142 HydrophobicContact CG-CD1 4.5Å; F102-F142 HydrophobicContact CG-CE1 4.22Å; C128-F142 CarbonylContact C-O 3.54Å; C128-F142 VanDerWaalsContact CA-O 3.28Å; C128-F142 WeakPolarHBondContact CA-O 3.44Å; K129-F142 PolarHBondContact N-O 3.43Å; K129-F142 PolarHBondContact O-N 2.77Å; V131-F142 HydrophobicContact CG2-CD2 4.17Å; V131-F142 HydrophobicContact CG2-CE2 3.7Å; Y140-F142 HydrophobicContact CD2-CE2 4.45Å; Y140-F142 HydrophobicContact CD2-CZ 4.35Å; Y140-F142 HydrophobicContact CE2-CE2 4.17Å; Y140-F142 HydrophobicContact CE2-CZ 4.12Å; F142-F173 AromaticContact CD1-CD2 3.57Å; F142-F173 HydrophobicContact CD1-CD2 3.57Å; F142-F173 AromaticContact CD1-CE2 3.81Å; F142-F173 HydrophobicContact CD1-CE2 3.81Å; F142-F173 AromaticContact CE1-CD2 3.62Å; F142-F173 HydrophobicContact CE1-CD2 3.62Å; F142-F173 AromaticContact CE1-CE2 3.56Å; F142-F173 HydrophobicContact CE1-CE2 3.56Å; F142-F173 HydrophobicContact CZ-CE2 4.28Å
143	V	92.3	Very high	88.4	Confident	2 Å²	2	62.7 Å²	62.7	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.3	168.9	179.2	0	0	0	0	107.1	I101 I103 L115 F119 I125 S127 C128 F145	I101-V143 HydrophobicContact CD1-CB 4Å; I101-V143 HydrophobicContact CD1-CG2 4.48Å; I101-V143 HydrophobicContact CG1-CB 3.67Å; I101-V143 WeakPolarHBondContact CG1-O 3.5Å; I101-V143 PolarHBondContact N-O 2.62Å; I101-V143 PolarHBondContact O-N 3.25Å; I101-V143 VanDerWaalsContact O-N 3.12Å; I103-V143 HydrophobicContact CD1-CB 4.5Å; I103-V143 HydrophobicContact CD1-CG2 3.64Å; L115-V143 HydrophobicContact CD2-CG2 4.04Å; L115-V143 HydrophobicContact CG-CG2 4.02Å; F119-V143 HydrophobicContact CB-CG1 4.41Å; F119-V143 HydrophobicContact CB-CG2 4.38Å; F119-V143 HydrophobicContact CG-CG2 4.31Å; I125-V143 HydrophobicContact CB-CG1 4.46Å; I125-V143 HydrophobicContact CD1-CG1 3.73Å; I125-V143 HydrophobicContact CG1-CG1 3.75Å; I125-V143 HydrophobicContact CG2-CG1 3.92Å; S127-V143 CarbonylContact O-C 3.58Å; C128-V143 HydrophobicContact CB-CB 4.42Å; C128-V143 HydrophobicContact CB-CG1 4.48Å; C128-V143 HydrophobicContact CB-CG2 3.86Å; V143-F145 HydrophobicContact CG1-CD2 4.18Å; V143-F145 HydrophobicContact CG1-CE1 4.45Å; V143-F145 HydrophobicContact CG1-CE2 3.87Å; V143-F145 HydrophobicContact CG1-CZ 4.02Å
144	H	90.3	Very high	89	Confident	35 Å²	35	57.9 Å²	57.9	16%	0.162	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	105.6	177.1	177.9	28	0	0	0	107.5	V98 N100 L126 S127	V98-H144 PolarHBondContact O-CE1 3.29Å; V98-H144 VanDerWaalsContact O-CE1 3.29Å; V98-H144 PolarHBondContact O-ND1 2.94Å; N100-H144 PolarHBondContact OD1-CE1 3.29Å; N100-H144 PolarHBondContact OD1-ND1 3.18Å; L126-H144 PolarHBondContact N-O 2.93Å; S127-H144 PolarHBondContact N-O 2.92Å; S127-H144 PolarHBondContact O-N 3.36Å
145	F	91.3	Very high	89.8	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	155.2	171.3	-68.1	-79.4	0	0	0	110.7	G99 I101 F119 F122 G123 N124 I125 V143 T147 A150 A151 A154	G99-F145 PolarHBondContact O-N 3.23Å; I101-F145 HydrophobicContact CD1-CE2 3.8Å; I101-F145 HydrophobicContact CG1-CE2 4.15Å; F119-F145 HydrophobicContact CB-CZ 4.1Å; F119-F145 HydrophobicContact CD1-CZ 4.2Å; F119-F145 WeakPolarHBondContact O-CE1 3.49Å; F122-F145 HydrophobicContact CB-CE1 4.12Å; F122-F145 HydrophobicContact CB-CZ 4.03Å; G123-F145 WeakPolarHBondContact O-CD1 3.33Å; G123-F145 WeakPolarHBondContact O-CE1 3.47Å; N124-F145 WeakPolarHBondContact O-CA 3.28Å; I125-F145 HydrophobicContact CD1-CE1 4.24Å; I125-F145 HydrophobicContact CG1-CD1 3.85Å; I125-F145 HydrophobicContact CG1-CE1 3.63Å; I125-F145 HydrophobicContact CG1-CZ 4.36Å; V143-F145 HydrophobicContact CG1-CD2 4.18Å; V143-F145 HydrophobicContact CG1-CE1 4.45Å; V143-F145 HydrophobicContact CG1-CE2 3.87Å; V143-F145 HydrophobicContact CG1-CZ 4.02Å; F145-T147 VanDerWaalsContact C-N 3.26Å; F145-T147 WeakPolarHBondContact CB-O 3.29Å; F145-T147 PolarHBondContact O-N 3.12Å; F145-A150 HydrophobicContact CB-CB 3.92Å; F145-A150 HydrophobicContact CD1-CB 3.72Å; F145-A150 HydrophobicContact CE1-CB 4.35Å; F145-A150 HydrophobicContact CG-CB 3.81Å; F145-A151 HydrophobicContact CD2-CB 3.92Å; F145-A154 HydrophobicContact CE2-CB 3.69Å; F145-A154 HydrophobicContact CZ-CB 3.82Å
146	E	87.2	Confident	90.7	Very high	85 Å²	85	46.6 Å²	46.6	40%	0.397	23%	0.229	S	C	.	.	S	Bend	trans	-64.3	-31.2	171.2	-175.9	175.3	-160.9	0	0	112.6	N124 L126	N124-E146 HydrophobicContact CB-CB 4.22Å; N124-E146 WeakPolarHBondContact CB-OE2 3.46Å; N124-E146 PolarHBondContact ND2-OE2 3.26Å; N124-E146 PolarHBondContact O-N 3.48Å; L126-E146 HydrophobicContact CD1-CB 4.29Å; L126-E146 HydrophobicContact CD2-CB 4.14Å; L126-E146 HydrophobicContact CD2-CG 4.4Å; L126-E146 HydrophobicContact CG-CB 4.02Å
147	T	89.6	Confident	91.3	Very high	56 Å²	56	48.4 Å²	48.4	34%	0.344	23%	0.232	S	C	.	.	S	Bend	trans	-123.1	148.3	-175.1	53.7	0	0	0	0	111.8	F145 E149 A150 A151	F145-T147 VanDerWaalsContact C-N 3.26Å; F145-T147 WeakPolarHBondContact CB-O 3.29Å; F145-T147 PolarHBondContact O-N 3.12Å; T147-E149 VanDerWaalsContact C-N 3.26Å; T147-E149 WeakPolarHBondContact CB-OE2 3.37Å; T147-E149 PolarHBondContact O-N 3.05Å; T147-A150 VanDerWaalsContact OG1-CB 3.31Å; T147-A150 WeakPolarHBondContact OG1-CB 3.21Å; T147-A151 PolarHBondContact O-N 3.19Å
148	Q	89.8	Confident	91.5	Very high	83 Å²	83	48.1 Å²	48.1	39%	0.388	23%	0.229	S	C	.	.	H	α-helix	trans	-70	-29.7	176.3	-172.4	166.3	-29.9	0	0	111.3	V98 A151 N152	V98-Q148 HydrophobicContact CG1-CB 3.95Å; Q148-A151 WeakPolarHBondContact O-CB 3.21Å; Q148-A151 PolarHBondContact O-N 3.43Å; Q148-N152 PolarHBondContact O-N 3.44Å; Q148-N152 PolarHBondContact O-OD1 2.85Å
149	E	92.8	Very high	91.7	Very high	107 Å²	107	47.7 Å²	47.7	50%	0.5	23%	0.231	S	C	.	.	H	α-helix	trans	-67.5	-38.3	-178.8	-61.8	62.3	-135.7	0	0	110.5	T147 N152 R153	T147-E149 VanDerWaalsContact C-N 3.26Å; T147-E149 WeakPolarHBondContact CB-OE2 3.37Å; T147-E149 PolarHBondContact O-N 3.05Å; E149-N152 PolarHBondContact O-N 3.15Å; E149-R153 WeakPolarHBondContact O-CG 3.5Å; E149-R153 PolarHBondContact O-N 2.91Å; E149-R153 PolarHBondContact O-NH1 2.85Å
150	A	93.4	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-42.6	171.3	0	0	0	0	0	112	F122 F145 T147 N152 R153 A154	F122-A150 WeakPolarHBondContact O-CB 3.46Å; F145-A150 HydrophobicContact CB-CB 3.92Å; F145-A150 HydrophobicContact CD1-CB 3.72Å; F145-A150 HydrophobicContact CE1-CB 4.35Å; F145-A150 HydrophobicContact CG-CB 3.81Å; T147-A150 VanDerWaalsContact OG1-CB 3.31Å; T147-A150 WeakPolarHBondContact OG1-CB 3.21Å; A150-N152 PolarHBondContact O-N 3.1Å; A150-R153 PolarHBondContact O-N 2.91Å; A150-A154 VanDerWaalsContact O-CB 3.32Å; A150-A154 WeakPolarHBondContact O-CB 3.05Å; A150-A154 PolarHBondContact O-N 3.42Å
151	A	92.9	Very high	91.6	Very high	1 Å²	1	50 Å²	50	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-42.8	174.4	0	0	0	0	0	112.5	I101 F145 T147 Q148 A154 I155	I101-A151 HydrophobicContact CG2-CB 3.58Å; F145-A151 HydrophobicContact CD2-CB 3.92Å; T147-A151 PolarHBondContact O-N 3.19Å; Q148-A151 WeakPolarHBondContact O-CB 3.21Å; Q148-A151 PolarHBondContact O-N 3.43Å; A151-A154 PolarHBondContact O-N 3.07Å; A151-I155 WeakPolarHBondContact O-CD1 3.34Å; A151-I155 VanDerWaalsContact O-CG1 3.23Å; A151-I155 WeakPolarHBondContact O-CG1 2.92Å; A151-I155 PolarHBondContact O-N 3.45Å
152	N	93.9	Very high	91.4	Very high	47 Å²	47	54.8 Å²	54.8	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-51.6	176.6	-66.3	-3.7	0	0	0	111.1	Q148 E149 A150 A154 I155 E156 H172	Q148-N152 PolarHBondContact O-N 3.44Å; Q148-N152 PolarHBondContact O-OD1 2.85Å; E149-N152 PolarHBondContact O-N 3.15Å; A150-N152 PolarHBondContact O-N 3.1Å; N152-A154 VanDerWaalsContact C-N 3.28Å; N152-A154 PolarHBondContact O-N 2.99Å; N152-I155 WeakPolarHBondContact O-CB 3.31Å; N152-I155 PolarHBondContact O-N 3.38Å; N152-E156 WeakPolarHBondContact O-CG 3.26Å; N152-E156 PolarHBondContact O-N 3.41Å; N152-H172 PolarHBondContact OD1-CE1 3.09Å; N152-H172 VanDerWaalsContact OD1-CE1 3.31Å
153	R	94.2	Very high	91	Very high	113 Å²	113	53.8 Å²	53.8	43%	0.426	28%	0.276	S	S	.	.	H	α-helix	trans	-57.3	-39.9	176.9	-71.2	-174.1	-56.1	-95.2	5.1	112.5	F122 E149 A150 T157	F122-R153 HydrophobicContact CD1-CB 4.5Å; F122-R153 PolarHBondContact O-NH2 2.85Å; E149-R153 WeakPolarHBondContact O-CG 3.5Å; E149-R153 PolarHBondContact O-N 2.91Å; E149-R153 PolarHBondContact O-NH1 2.85Å; A150-R153 PolarHBondContact O-N 2.91Å; R153-T157 VanDerWaalsContact O-CB 3.28Å; R153-T157 WeakPolarHBondContact O-CB 3.38Å; R153-T157 PolarHBondContact O-N 3.45Å; R153-T157 PolarHBondContact O-OG1 3Å
154	A	93.9	Very high	90.6	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-39.4	176.5	0	0	0	0	0	112.2	I101 F119 F122 F145 A150 A151 N152 M158	I101-A154 HydrophobicContact CD1-CB 4.26Å; F119-A154 HydrophobicContact CD1-CB 4.11Å; F119-A154 HydrophobicContact CE1-CB 4.29Å; F122-A154 HydrophobicContact CB-CB 3.93Å; F122-A154 HydrophobicContact CD1-CB 4.41Å; F122-A154 HydrophobicContact CD2-CB 3.95Å; F122-A154 HydrophobicContact CG-CB 3.81Å; F145-A154 HydrophobicContact CE2-CB 3.69Å; F145-A154 HydrophobicContact CZ-CB 3.82Å; A150-A154 VanDerWaalsContact O-CB 3.32Å; A150-A154 WeakPolarHBondContact O-CB 3.05Å; A150-A154 PolarHBondContact O-N 3.42Å; A151-A154 PolarHBondContact O-N 3.07Å; N152-A154 VanDerWaalsContact C-N 3.28Å; N152-A154 PolarHBondContact O-N 2.99Å; A154-M158 VanDerWaalsContact O-CB 3.22Å; A154-M158 WeakPolarHBondContact O-CB 3.28Å; A154-M158 WeakPolarHBondContact O-CG 3.34Å; A154-M158 PolarHBondContact O-N 2.99Å
155	I	93.8	Very high	90.3	Very high	24 Å²	24	63.9 Å²	63.9	12%	0.123	33%	0.331	C	S	.	.	H	α-helix	trans	-64.1	-52.9	173.7	-68.7	161.9	0	0	0	110.4	I101 A151 N152 T157 N159 V170	I101-I155 HydrophobicContact CG2-CD1 3.86Å; I101-I155 HydrophobicContact CG2-CG1 3.91Å; A151-I155 WeakPolarHBondContact O-CD1 3.34Å; A151-I155 VanDerWaalsContact O-CG1 3.23Å; A151-I155 WeakPolarHBondContact O-CG1 2.92Å; A151-I155 PolarHBondContact O-N 3.45Å; N152-I155 WeakPolarHBondContact O-CB 3.31Å; N152-I155 PolarHBondContact O-N 3.38Å; I155-T157 VanDerWaalsContact C-N 3.32Å; I155-T157 PolarHBondContact O-N 2.94Å; I155-N159 WeakPolarHBondContact O-CB 3.04Å; I155-N159 PolarHBondContact O-N 2.94Å; I155-N159 VanDerWaalsContact O-N 3.1Å; I155-V170 HydrophobicContact CB-CG1 4.5Å; I155-V170 HydrophobicContact CG1-CG1 3.95Å
156	E	93.2	Very high	90.1	Very high	154 Å²	154	67.4 Å²	67.4	72%	0.72	34%	0.344	S	S	*	.	H	α-helix	trans	-61	-39.2	-176.5	-71.7	166.2	-176.4	0	0	112.3	N152	N152-E156 WeakPolarHBondContact O-CG 3.26Å; N152-E156 PolarHBondContact O-N 3.41Å
157	T	91.6	Very high	90.2	Very high	73 Å²	73	69.8 Å²	69.8	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-79.7	-50.2	-179.2	-46.8	0	0	0	0	112.5	F122 R153 I155 M161	F122-T157 HydrophobicContact CE1-CG2 3.78Å; F122-T157 HydrophobicContact CZ-CG2 4.01Å; R153-T157 VanDerWaalsContact O-CB 3.28Å; R153-T157 WeakPolarHBondContact O-CB 3.38Å; R153-T157 PolarHBondContact O-N 3.45Å; R153-T157 PolarHBondContact O-OG1 3Å; I155-T157 VanDerWaalsContact C-N 3.32Å; I155-T157 PolarHBondContact O-N 2.94Å; T157-M161 HydrophobicContact CG2-SD 4.44Å; T157-M161 WeakPolarHBondContact O-CG 3.3Å
158	M	91.3	Very high	90.3	Very high	13 Å²	13	67.3 Å²	67.3	6%	0.064	34%	0.338	C	S	.	.	H	α-helix	trans	-91.1	-17.4	-165.9	-60.5	-68.7	-75.7	0	0	113.9	T118 F119 F122 A154 G160 M161 L163 V170	T118-M158 HydrophobicContact CG2-CE 3.65Å; F119-M158 HydrophobicContact CE1-CB 4.13Å; F119-M158 HydrophobicContact CE1-CG 3.87Å; F119-M158 HydrophobicContact CE2-CE 4.24Å; F119-M158 HydrophobicContact CZ-CB 4.15Å; F119-M158 HydrophobicContact CZ-CE 4.01Å; F119-M158 HydrophobicContact CZ-CG 4.08Å; F122-M158 HydrophobicContact CE1-CG 4.45Å; F122-M158 HydrophobicContact CE2-CG 3.51Å; F122-M158 HydrophobicContact CE2-SD 3.78Å; F122-M158 HydrophobicContact CZ-CG 3.49Å; F122-M158 VanDerWaalsContact CZ-CG 3.49Å; F122-M158 HydrophobicContact CZ-SD 3.58Å; F122-M158 VanDerWaalsContact CZ-SD 3.58Å; A154-M158 VanDerWaalsContact O-CB 3.22Å; A154-M158 WeakPolarHBondContact O-CB 3.28Å; A154-M158 WeakPolarHBondContact O-CG 3.34Å; A154-M158 PolarHBondContact O-N 2.99Å; M158-G160 PolarHBondContact O-N 3.17Å; M158-G160 VanDerWaalsContact O-N 3.1Å; M158-M161 WeakPolarHBondContact O-CB 3.3Å; M158-M161 PolarHBondContact O-N 2.96Å; M158-M161 VanDerWaalsContact O-N 3.12Å; M158-M161 HydrophobicContact SD-SD 3.77Å; M158-L163 HydrophobicContact CE-CD1 3.58Å; M158-V170 HydrophobicContact CB-CG2 3.82Å
159	N	91.4	Very high	90.4	Very high	73 Å²	73	68.4 Å²	68.4	39%	0.39	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	109.2	-176.2	-176	34.5	0	0	0	112	I155 F169 V170	I155-N159 WeakPolarHBondContact O-CB 3.04Å; I155-N159 PolarHBondContact O-N 2.94Å; I155-N159 VanDerWaalsContact O-N 3.1Å; N159-F169 WeakPolarHBondContact OD1-CA 3.38Å; N159-F169 VanDerWaalsContact OD1-CD2 3.3Å; N159-F169 WeakPolarHBondContact OD1-CD2 3.35Å; N159-V170 HydrophobicContact CB-CB 4.06Å; N159-V170 WeakPolarHBondContact CB-O 3.36Å; N159-V170 PolarHBondContact OD1-N 3.44Å; N159-V170 PolarHBondContact OD1-O 2.9Å
160	G	86.9	Confident	90.4	Very high	40 Å²	40	63.3 Å²	63.3	41%	0.412	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.8	-6.4	-176.5	0	0	0	0	0	114.6	M158 V168	M158-G160 PolarHBondContact O-N 3.17Å; M158-G160 VanDerWaalsContact O-N 3.1Å; G160-V168 WeakPolarHBondContact CA-O 3.34Å; G160-V168 PolarHBondContact N-O 2.91Å
161	M	89.3	Confident	90.4	Very high	92 Å²	92	63.9 Å²	63.9	45%	0.453	32%	0.323	S	S	.	.			trans	-66.2	158.2	172	-73.1	-165.5	78.5	0	0	112	T157 M158 K167 V168	T157-M161 HydrophobicContact CG2-SD 4.44Å; T157-M161 WeakPolarHBondContact O-CG 3.3Å; M158-M161 WeakPolarHBondContact O-CB 3.3Å; M158-M161 PolarHBondContact O-N 2.96Å; M158-M161 VanDerWaalsContact O-N 3.12Å; M158-M161 HydrophobicContact SD-SD 3.77Å; M161-K167 CarbonylContact O-C 3.58Å; M161-K167 VanDerWaalsContact O-CA 3.29Å; M161-K167 WeakPolarHBondContact O-CA 3.31Å; M161-V168 WeakPolarHBondContact O-CG2 3.3Å; M161-V168 PolarHBondContact O-N 3.49Å
162	L	87.4	Confident	90.2	Very high	101 Å²	101	68.8 Å²	68.8	53%	0.529	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.6	174.7	-70.2	158.4	0	0	0	109.7	D165 R166 K167	L162-D165 WeakPolarHBondContact CD2-O 3.41Å; L162-R166 WeakPolarHBondContact CA-O 3.46Å; L162-K167 HydrophobicContact CD2-CG 3.48Å; L162-K167 VanDerWaalsContact CD2-CG 3.48Å; L162-K167 HydrophobicContact CG-CG 4.07Å
163	L	84.6	Confident	89.9	Confident	31 Å²	31	70.2 Å²	70.2	16%	0.162	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122	164.1	-116.6	83.8	0	0	0	107.9	I110 T118 M158 D165 R166 V168	I110-L163 HydrophobicContact CD1-CB 4.25Å; I110-L163 HydrophobicContact CD1-CD2 3.73Å; T118-L163 HydrophobicContact CG2-CD1 4.4Å; T118-L163 HydrophobicContact CG2-CD2 4.16Å; M158-L163 HydrophobicContact CE-CD1 3.58Å; L163-D165 VanDerWaalsContact C-N 3.3Å; L163-D165 PolarHBondContact O-N 2.89Å; L163-R166 PolarHBondContact N-O 2.86Å; L163-R166 PolarHBondContact O-N 2.91Å; L163-V168 HydrophobicContact CB-CG1 3.95Å
164	N	84.1	Confident	89.3	Confident	94 Å²	94	69 Å²	69	50%	0.503	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	54.8	-174.8	-60.8	1.4	0	0	0	111.6	D107 S109 R166	D107-N164 HydrophobicContact CB-CB 3.89Å; S109-N164 PolarHBondContact OG-ND2 2.84Å; N164-R166 PolarHBondContact O-N 3.49Å
165	D	83.4	Confident	88.5	Confident	154 Å²	154	70.5 Å²	70.5	82%	0.824	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	-0.6	-176.7	-59	-43.1	0	0	0	117.3	L162 L163	L162-D165 WeakPolarHBondContact CD2-O 3.41Å; L163-D165 VanDerWaalsContact C-N 3.3Å; L163-D165 PolarHBondContact O-N 2.89Å
166	R	86.4	Confident	87.7	Confident	75 Å²	75	77.9 Å²	77.9	28%	0.283	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.5	172.2	-53.3	-161.1	-160	-173.3	10.6	110.9	N105 D107 E108 L162 L163 N164 V168	N105-R166 WeakPolarHBondContact O-CB 3.43Å; D107-R166 HydrophobicContact CB-CG 4.43Å; D107-R166 IonicContact OD1-NH2 3.68Å; D107-R166 PolarHBondContact OD1-NH2 2.99Å; D107-R166 IonicContact OD2-CZ 2.6Å; D107-R166 IonicContact OD2-NE 2.84Å; D107-R166 PolarHBondContact OD2-NE 2.84Å; D107-R166 IonicContact OD2-NH2 3.85Å; D107-R166 PolarHBondContact OD2-NH2 3.29Å; E108-R166 IonicContact OE1-CZ 3.81Å; E108-R166 IonicContact OE1-NH1 2.98Å; E108-R166 PolarHBondContact OE1-NH1 3.47Å; E108-R166 IonicContact OE1-NH2 2.62Å; E108-R166 PolarHBondContact OE1-NH2 3.12Å; L162-R166 WeakPolarHBondContact CA-O 3.46Å; L163-R166 PolarHBondContact N-O 2.86Å; L163-R166 PolarHBondContact O-N 2.91Å; N164-R166 PolarHBondContact O-N 3.49Å; R166-V168 PolarHBondContact O-N 2.85Å
167	K	89.7	Confident	86.8	Confident	135 Å²	135	78.3 Å²	78.3	59%	0.587	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	108.5	171.7	-70.9	-169.1	172.9	-173.5	0	109.9	N105 M161 L162	N105-K167 PolarHBondContact ND2-O 3.4Å; M161-K167 CarbonylContact O-C 3.58Å; M161-K167 VanDerWaalsContact O-CA 3.29Å; M161-K167 WeakPolarHBondContact O-CA 3.31Å; L162-K167 HydrophobicContact CD2-CG 3.48Å; L162-K167 VanDerWaalsContact CD2-CG 3.48Å; L162-K167 HydrophobicContact CG-CG 4.07Å
168	V	92.4	Very high	86.1	Confident	4 Å²	4	79.7 Å²	79.7	2%	0.024	39%	0.385	C	S	.	.			trans	-77.7	141.2	177.3	-67.5	0	0	0	0	110.6	I103 M106 G160 M161 L163 R166 V170	I103-V168 HydrophobicContact CG2-CB 4.42Å; M106-V168 HydrophobicContact CB-CG1 4.47Å; M106-V168 HydrophobicContact CG-CG1 4.12Å; G160-V168 WeakPolarHBondContact CA-O 3.34Å; G160-V168 PolarHBondContact N-O 2.91Å; M161-V168 WeakPolarHBondContact O-CG2 3.3Å; M161-V168 PolarHBondContact O-N 3.49Å; L163-V168 HydrophobicContact CB-CG1 3.95Å; R166-V168 PolarHBondContact O-N 2.85Å; V168-V170 HydrophobicContact CG2-CG2 4.38Å
169	F	92.4	Very high	85.2	Confident	105 Å²	105	83.3 Å²	83.3	46%	0.461	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	127.1	169.9	173.6	-89.5	0	0	0	108.5	I103 K104 N159	I103-F169 CarbonylContact C-O 3.5Å; I103-F169 WeakPolarHBondContact CA-O 3.37Å; K104-F169 HydrophobicContact CB-CB 4.39Å; K104-F169 HydrophobicContact CB-CD1 4.39Å; K104-F169 PolarHBondContact N-O 3.16Å; K104-F169 PolarHBondContact O-N 2.86Å; N159-F169 WeakPolarHBondContact OD1-CA 3.38Å; N159-F169 VanDerWaalsContact OD1-CD2 3.3Å; N159-F169 WeakPolarHBondContact OD1-CD2 3.35Å
170	V	93.2	Very high	84.1	Confident	1 Å²	1	85.6 Å²	85.6	1%	0.006	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	135.5	179.9	-169.8	0	0	0	0	108.9	I101 I103 F119 I155 M158 N159 V168	I101-V170 HydrophobicContact CB-CG1 4.5Å; I101-V170 HydrophobicContact CD1-CG1 3.76Å; I103-V170 HydrophobicContact CG1-CG1 4.15Å; I103-V170 HydrophobicContact CG1-CG2 4.3Å; I103-V170 HydrophobicContact CG2-CG2 4.19Å; F119-V170 HydrophobicContact CE1-CG1 4.46Å; F119-V170 HydrophobicContact CZ-CG2 4.27Å; I155-V170 HydrophobicContact CB-CG1 4.5Å; I155-V170 HydrophobicContact CG1-CG1 3.95Å; M158-V170 HydrophobicContact CB-CG2 3.82Å; N159-V170 HydrophobicContact CB-CB 4.06Å; N159-V170 WeakPolarHBondContact CB-O 3.36Å; N159-V170 PolarHBondContact OD1-N 3.44Å; N159-V170 PolarHBondContact OD1-O 2.9Å; V168-V170 HydrophobicContact CG2-CG2 4.38Å
171	G	91.7	Very high	83.2	Confident	11 Å²	11	88.6 Å²	88.6	11%	0.113	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	173.2	178.4	0	0	0	0	0	112	I101 F102	I101-G171 CarbonylContact C-O 3.6Å; I101-G171 WeakPolarHBondContact CA-O 3.38Å; F102-G171 PolarHBondContact N-O 3.08Å; F102-G171 PolarHBondContact O-N 2.78Å; F102-G171 VanDerWaalsContact O-N 3.09Å
172	H	90.3	Very high	82	Confident	105 Å²	105	86.8 Å²	86.8	49%	0.486	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	140.9	176.4	-65.8	-72.1	0	0	0	112.2	N152 K174	N152-H172 PolarHBondContact OD1-CE1 3.09Å; N152-H172 VanDerWaalsContact OD1-CE1 3.31Å; H172-K174 PolarHBondContact O-N 3.17Å
173	F	86.8	Confident	80.5	Confident	76 Å²	76	88.6 Å²	88.6	33%	0.333	41%	0.411	S	S	.	.			trans	-62.3	134.7	169.9	176.7	-101.1	0	0	0	110.5	N100 F142	N100-F173 HydrophobicContact CB-CB 3.57Å; N100-F173 HydrophobicContact CB-CD1 4.34Å; N100-F173 HydrophobicContact CB-CG 4.15Å; N100-F173 WeakPolarHBondContact O-CB 3.36Å; N100-F173 PolarHBondContact O-N 3.13Å; F142-F173 AromaticContact CD1-CD2 3.57Å; F142-F173 HydrophobicContact CD1-CD2 3.57Å; F142-F173 AromaticContact CD1-CE2 3.81Å; F142-F173 HydrophobicContact CD1-CE2 3.81Å; F142-F173 AromaticContact CE1-CD2 3.62Å; F142-F173 HydrophobicContact CE1-CD2 3.62Å; F142-F173 AromaticContact CE1-CE2 3.56Å; F142-F173 HydrophobicContact CE1-CE2 3.56Å; F142-F173 HydrophobicContact CZ-CE2 4.28Å
174	K	82.4	Confident	79.1	Confident	89 Å²	89	88.6 Å²	88.6	39%	0.387	42%	0.418	S	S	.	.			trans	-123.8	134	168.4	-70.3	179.7	172.3	178.8	0	108.5	H172 E178 R179 E182	H172-K174 PolarHBondContact O-N 3.17Å; K174-E178 WeakPolarHBondContact CA-OE2 3.22Å; K174-E178 HydrophobicContact CB-CB 4.43Å; K174-R179 HydrophobicContact CB-CG 3.67Å; K174-R179 PolarHBondContact O-NE 2.93Å; K174-E182 IonicContact NZ-OE1 2.63Å; K174-E182 IonicContact NZ-OE2 3.36Å; K174-E182 PolarHBondContact NZ-OE2 2.84Å
175	S	77	Confident	77.9	Confident	31 Å²	31	87 Å²	87	22%	0.217	42%	0.415	C	S	.	.			trans	-61	164.8	-180	89.8	0	0	0	0	111.1	K177 E178 R179	S175-K177 PolarHBondContact O-N 2.89Å; S175-K177 PolarHBondContact OG-N 3.41Å; S175-E178 WeakPolarHBondContact CB-OE1 3.25Å; S175-E178 PolarHBondContact N-OE2 3.38Å; S175-E178 PolarHBondContact OG-N 3.46Å; S175-E178 PolarHBondContact OG-OE1 3.15Å; S175-R179 WeakPolarHBondContact O-CB 3.43Å; S175-R179 WeakPolarHBondContact O-CG 3.3Å; S175-R179 PolarHBondContact O-N 2.99Å; S175-R179 PolarHBondContact O-NE 3.03Å
176	R	76.3	Confident	76.5	Confident	179 Å²	179	85.2 Å²	85.2	68%	0.675	40%	0.4	S	S	*	.	H	α-helix	trans	-58.4	-40.1	175	-174.6	-175.9	-65.7	-166	1.6	110.8	R179 E180	R176-R179 PolarHBondContact O-N 2.89Å; R176-E180 VanDerWaalsContact CD-OE1 3.24Å; R176-E180 WeakPolarHBondContact CD-OE1 3.49Å; R176-E180 HydrophobicContact CG-CG 4.3Å; R176-E180 WeakPolarHBondContact CG-OE1 3.33Å; R176-E180 WeakPolarHBondContact O-CB 3.15Å; R176-E180 VanDerWaalsContact O-CG 3.31Å; R176-E180 WeakPolarHBondContact O-CG 3.35Å; R176-E180 PolarHBondContact O-N 2.87Å
177	K	74.8	Confident	75	Confident	163 Å²	163	84.8 Å²	84.8	71%	0.709	41%	0.412	S	S	*	.	H	α-helix	trans	-67.5	-46	-177.4	-167.5	-179.9	-179.8	-174.8	0	111.8	S175 R179 E180 V181	S175-K177 PolarHBondContact O-N 2.89Å; S175-K177 PolarHBondContact OG-N 3.41Å; K177-R179 VanDerWaalsContact C-N 3.35Å; K177-R179 PolarHBondContact O-N 2.72Å; K177-E180 PolarHBondContact O-N 2.71Å; K177-V181 WeakPolarHBondContact O-CG2 3.49Å; K177-V181 PolarHBondContact O-N 3.22Å
178	E	76.4	Confident	73.6	Confident	102 Å²	102	84.2 Å²	84.2	48%	0.477	41%	0.413	S	S	.	.	H	α-helix	trans	-60.6	-45	173	-70.4	119.1	-115.2	0	0	111.4	K174 S175 E180 V181 E182	K174-E178 WeakPolarHBondContact CA-OE2 3.22Å; K174-E178 HydrophobicContact CB-CB 4.43Å; S175-E178 WeakPolarHBondContact CB-OE1 3.25Å; S175-E178 PolarHBondContact N-OE2 3.38Å; S175-E178 PolarHBondContact OG-N 3.46Å; S175-E178 PolarHBondContact OG-OE1 3.15Å; E178-E180 VanDerWaalsContact C-N 3.3Å; E178-E180 PolarHBondContact O-N 2.73Å; E178-V181 PolarHBondContact O-N 2.73Å; E178-E182 WeakPolarHBondContact O-CB 3.26Å; E178-E182 PolarHBondContact O-N 2.73Å
179	R	73.2	Confident	72.5	Confident	89 Å²	89	90.3 Å²	90.3	34%	0.336	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-33.9	178.9	-74.6	-173.7	-74.3	126.9	-8.5	112.3	K174 S175 R176 K177 F183	K174-R179 HydrophobicContact CB-CG 3.67Å; K174-R179 PolarHBondContact O-NE 2.93Å; S175-R179 WeakPolarHBondContact O-CB 3.43Å; S175-R179 WeakPolarHBondContact O-CG 3.3Å; S175-R179 PolarHBondContact O-N 2.99Å; S175-R179 PolarHBondContact O-NE 3.03Å; R176-R179 PolarHBondContact O-N 2.89Å; K177-R179 VanDerWaalsContact C-N 3.35Å; K177-R179 PolarHBondContact O-N 2.72Å; R179-F183 VanDerWaalsContact O-CB 3.23Å; R179-F183 WeakPolarHBondContact O-CB 3.41Å; R179-F183 PolarHBondContact O-N 2.98Å
180	E	67.8	Low	72	Confident	120 Å²	120	86.7 Å²	86.7	56%	0.561	42%	0.423	S	S	*	.	H	α-helix	trans	-71.3	-30.7	174.5	-77.1	166.2	178.9	0	0	112.4	R176 K177 E178 G184	R176-E180 VanDerWaalsContact CD-OE1 3.24Å; R176-E180 WeakPolarHBondContact CD-OE1 3.49Å; R176-E180 HydrophobicContact CG-CG 4.3Å; R176-E180 WeakPolarHBondContact CG-OE1 3.33Å; R176-E180 WeakPolarHBondContact O-CB 3.15Å; R176-E180 VanDerWaalsContact O-CG 3.31Å; R176-E180 WeakPolarHBondContact O-CG 3.35Å; R176-E180 PolarHBondContact O-N 2.87Å; K177-E180 PolarHBondContact O-N 2.71Å; E178-E180 VanDerWaalsContact C-N 3.3Å; E178-E180 PolarHBondContact O-N 2.73Å; E180-G184 WeakPolarHBondContact O-CA 3.37Å; E180-G184 PolarHBondContact O-N 2.92Å
181	V	68.8	Low	71.7	Confident	104 Å²	104	88.8 Å²	88.8	63%	0.63	44%	0.436	S	S	*	.	H	α-helix	trans	-73.2	-44.4	170.5	173.7	0	0	0	0	111.6	K177 E178 S185	K177-V181 WeakPolarHBondContact O-CG2 3.49Å; K177-V181 PolarHBondContact O-N 3.22Å; E178-V181 PolarHBondContact O-N 2.73Å; V181-S185 WeakPolarHBondContact O-CB 3.49Å; V181-S185 PolarHBondContact O-N 3.44Å; V181-S185 PolarHBondContact O-OG 3.3Å
182	E	63.1	Low	71.7	Confident	54 Å²	54	91.8 Å²	91.8	25%	0.252	45%	0.45	S	S	.	.	H	α-helix	trans	-71.7	-44.3	-178.9	-163	-168.5	147	0	0	112.3	K174 E178 S185 K186	K174-E182 IonicContact NZ-OE1 2.63Å; K174-E182 IonicContact NZ-OE2 3.36Å; K174-E182 PolarHBondContact NZ-OE2 2.84Å; E178-E182 WeakPolarHBondContact O-CB 3.26Å; E178-E182 PolarHBondContact O-N 2.73Å; E182-S185 PolarHBondContact O-OG 2.94Å; E182-S185 VanDerWaalsContact O-OG 3.05Å; E182-K186 HydrophobicContact CG-CD 4.3Å; E182-K186 VanDerWaalsContact O-CB 3.29Å; E182-K186 WeakPolarHBondContact O-CB 3.37Å; E182-K186 WeakPolarHBondContact O-CG 3.4Å; E182-K186 PolarHBondContact O-N 2.82Å; E182-K186 IonicContact OE1-NZ 3.6Å; E182-K186 PolarHBondContact OE1-NZ 3.14Å
183	F	55.8	Low	71.8	Confident	139 Å²	139	86.8 Å²	86.8	61%	0.61	43%	0.427	S	S	*	.	H	α-helix	trans	-76.1	-28.9	172.2	-82.6	-96.2	0	0	0	112.5	R179 K186 A187	R179-F183 VanDerWaalsContact O-CB 3.23Å; R179-F183 WeakPolarHBondContact O-CB 3.41Å; R179-F183 PolarHBondContact O-N 2.98Å; F183-K186 PolarHBondContact O-N 3.34Å; F183-A187 WeakPolarHBondContact O-CB 3.45Å; F183-A187 PolarHBondContact O-N 3.49Å
184	G	56.4	Low	72.1	Confident	30 Å²	30	84.2 Å²	84.2	31%	0.309	42%	0.415	S	S	.	.	H	α-helix	trans	-61.9	-53.2	173.3	0	0	0	0	0	110.9	E180 K186 A187 M188	E180-G184 WeakPolarHBondContact O-CA 3.37Å; E180-G184 PolarHBondContact O-N 2.92Å; G184-K186 PolarHBondContact O-N 3.18Å; G184-A187 PolarHBondContact O-N 2.97Å; G184-M188 WeakPolarHBondContact O-CG 3.45Å; G184-M188 PolarHBondContact O-N 3.33Å
185	S	57.9	Low	72.5	Confident	62 Å²	62	80 Å²	80	43%	0.434	40%	0.396	S	S	.	.	H	α-helix	trans	-60.9	-42.4	174.2	55.5	0	0	0	0	112.4	V181 E182 A187 M188 K189	V181-S185 WeakPolarHBondContact O-CB 3.49Å; V181-S185 PolarHBondContact O-N 3.44Å; V181-S185 PolarHBondContact O-OG 3.3Å; E182-S185 PolarHBondContact O-OG 2.94Å; E182-S185 VanDerWaalsContact O-OG 3.05Å; S185-A187 VanDerWaalsContact C-N 3.35Å; S185-A187 PolarHBondContact O-N 2.88Å; S185-M188 PolarHBondContact O-N 3.01Å; S185-K189 WeakPolarHBondContact O-CG 3.44Å; S185-K189 PolarHBondContact O-N 3.25Å
186	K	53.3	Low	73.2	Confident	116 Å²	116	83.5 Å²	83.5	50%	0.504	41%	0.408	S	S	.	.	H	α-helix	trans	-69	-24.3	175.1	-72.1	171.9	178.7	177.1	0	114.5	E182 F183 G184	E182-K186 HydrophobicContact CG-CD 4.3Å; E182-K186 VanDerWaalsContact O-CB 3.29Å; E182-K186 WeakPolarHBondContact O-CB 3.37Å; E182-K186 WeakPolarHBondContact O-CG 3.4Å; E182-K186 PolarHBondContact O-N 2.82Å; E182-K186 IonicContact OE1-NZ 3.6Å; E182-K186 PolarHBondContact OE1-NZ 3.14Å; F183-K186 PolarHBondContact O-N 3.34Å; G184-K186 PolarHBondContact O-N 3.18Å
187	A	55.3	Low	73.8	Confident	66 Å²	66	78.2 Å²	78.2	55%	0.545	39%	0.393	S	S	.	.	H	α-helix	trans	-86.9	-21	175.9	0	0	0	0	0	113.2	F183 G184 S185	F183-A187 WeakPolarHBondContact O-CB 3.45Å; F183-A187 PolarHBondContact O-N 3.49Å; G184-A187 PolarHBondContact O-N 2.97Å; S185-A187 VanDerWaalsContact C-N 3.35Å; S185-A187 PolarHBondContact O-N 2.88Å
188	M	59.9	Low	74.3	Confident	123 Å²	123	70.5 Å²	70.5	61%	0.606	36%	0.359	S	S	*	.	H	α-helix	trans	-76.5	-26.3	165.9	-64.7	-55.2	172	0	0	112.1	G184 S185 F190 H241	G184-M188 WeakPolarHBondContact O-CG 3.45Å; G184-M188 PolarHBondContact O-N 3.33Å; S185-M188 PolarHBondContact O-N 3.01Å; M188-F190 VanDerWaalsContact O-CD1 3.29Å; M188-F190 WeakPolarHBondContact O-CD1 3.5Å; M188-F190 PolarHBondContact O-N 3.35Å; M188-H241 PolarHBondContact O-CE1 3.02Å
189	K	70.4	Confident	74.6	Confident	131 Å²	131	65.9 Å²	65.9	57%	0.57	34%	0.339	S	S	*	.			trans	-68.3	97.6	172.2	-70.8	-176	178.1	-162.3	0	111.6	S185 H241	S185-K189 WeakPolarHBondContact O-CG 3.44Å; S185-K189 PolarHBondContact O-N 3.25Å; K189-H241 HydrophobicContact CB-CB 4.13Å; K189-H241 HydrophobicContact CG-CB 4.31Å
190	F	81.3	Confident	75	Confident	30 Å²	30	67.5 Å²	67.5	13%	0.132	35%	0.351	C	S	.	.			trans	-107.5	140.3	170.7	65.4	-90.7	0	0	0	111.6	M188 V193 H241 A244 Q245 V248 R265	M188-F190 VanDerWaalsContact O-CD1 3.29Å; M188-F190 WeakPolarHBondContact O-CD1 3.5Å; M188-F190 PolarHBondContact O-N 3.35Å; F190-V193 HydrophobicContact CE2-CG2 4.22Å; F190-H241 AromaticContact CD1-CE1 3.88Å; F190-H241 AromaticContact CE1-CE1 3.81Å; F190-H241 PolarHBondContact N-ND1 3.31Å; F190-H241 VanDerWaalsContact N-ND1 3.16Å; F190-H241 WeakPolarHBondContact O-CA 3.36Å; F190-H241 PolarHBondContact O-ND1 2.9Å; F190-A244 HydrophobicContact CD2-CB 4.06Å; F190-A244 HydrophobicContact CE2-CB 3.96Å; F190-A244 WeakPolarHBondContact O-CB 2.83Å; F190-Q245 VanDerWaalsContact CE1-OE1 3.22Å; F190-Q245 VanDerWaalsContact CZ-OE1 3.26Å; F190-V248 HydrophobicContact CE2-CG2 3.86Å; F190-V248 HydrophobicContact CZ-CB 4.48Å; F190-V248 HydrophobicContact CZ-CG2 3.94Å; F190-R265 HydrophobicContact CB-CG 3.76Å; F190-R265 HydrophobicContact CD1-CB 4.03Å; F190-R265 HydrophobicContact CD1-CG 3.83Å; F190-R265 HydrophobicContact CD2-CB 4.27Å; F190-R265 HydrophobicContact CD2-CG 4.15Å; F190-R265 HydrophobicContact CE1-CB 4.23Å; F190-R265 HydrophobicContact CE2-CB 4.47Å; F190-R265 HydrophobicContact CG-CB 4.08Å; F190-R265 HydrophobicContact CG-CG 3.63Å; F190-R265 HydrophobicContact CZ-CB 4.46Å
191	T	87.2	Confident	75.6	Confident	44 Å²	44	66.5 Å²	66.5	27%	0.27	35%	0.349	S	S	.	.			trans	-102.7	-20	168.3	60.6	0	0	0	0	112.7	N237 Y238	T191-N237 VanDerWaalsContact CB-OD1 3.3Å; T191-N237 WeakPolarHBondContact CB-OD1 3.43Å; T191-N237 WeakPolarHBondContact O-CA 3.31Å; T191-N237 PolarHBondContact OG1-OD1 3.34Å; T191-Y238 WeakPolarHBondContact CB-O 3.24Å; T191-Y238 PolarHBondContact O-N 2.93Å
192	N	90.6	Very high	76.3	Confident	75 Å²	75	62.3 Å²	62.3	40%	0.401	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	117.1	-178	-67.9	-73.3	0	0	0	110.8	V236 N237 A266	N192-V236 CarbonylContact C-O 3.59Å; N192-V236 WeakPolarHBondContact CA-O 3.32Å; N192-N237 VanDerWaalsContact OD1-CB 3.28Å; N192-N237 WeakPolarHBondContact OD1-CB 3.2Å; N192-N237 VanDerWaalsContact OD1-CG 3.26Å; N192-N237 PolarHBondContact OD1-OD1 3.47Å; N192-A266 HydrophobicContact CB-CB 3.69Å; N192-A266 VanDerWaalsContact O-CB 3.29Å; N192-A266 WeakPolarHBondContact O-CB 3.43Å; N192-A266 PolarHBondContact O-N 2.67Å
193	V	92.8	Very high	77.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138.4	174.9	-177.1	0	0	0	0	109.3	F190 I195 F235 V236 Y238 A244 V248 V263	F190-V193 HydrophobicContact CE2-CG2 4.22Å; V193-I195 HydrophobicContact CG1-CG1 4.07Å; V193-F235 VanDerWaalsContact O-CA 3.3Å; V193-F235 WeakPolarHBondContact O-CA 3.23Å; V193-V236 HydrophobicContact CB-CB 4.5Å; V193-V236 PolarHBondContact N-O 2.64Å; V193-V236 PolarHBondContact O-N 2.83Å; V193-Y238 HydrophobicContact CG2-CD2 4.04Å; V193-Y238 HydrophobicContact CG2-CE2 3.81Å; V193-A244 HydrophobicContact CG2-CB 3.74Å; V193-V248 HydrophobicContact CG1-CG2 3.96Å; V193-V248 HydrophobicContact CG2-CG2 4.18Å; V193-V263 HydrophobicContact CG1-CG1 3.35Å
194	Y	92.6	Very high	79	Confident	22 Å²	22	57.1 Å²	57.1	9%	0.086	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.9	170.9	167.5	-100.8	0	0	0	108.8	K196 F233 F235 Y262 V263 G264	Y194-K196 HydrophobicContact CE1-CB 3.89Å; Y194-F233 HydrophobicContact CD2-CD2 4.38Å; Y194-F233 HydrophobicContact CE2-CB 4.07Å; Y194-F233 AromaticContact CE2-CD2 3.55Å; Y194-F233 HydrophobicContact CE2-CD2 3.55Å; Y194-F233 HydrophobicContact CE2-CE2 4.24Å; Y194-F233 HydrophobicContact CE2-CG 4.08Å; Y194-F235 HydrophobicContact CD2-CD1 4.12Å; Y194-F235 AromaticContact CD2-CE1 3.58Å; Y194-F235 HydrophobicContact CD2-CE1 3.58Å; Y194-F235 AromaticContact CD2-CZ 3.87Å; Y194-F235 HydrophobicContact CD2-CZ 3.87Å; Y194-F235 HydrophobicContact CE2-CE1 4.49Å; Y194-F235 HydrophobicContact CE2-CZ 4.37Å; Y194-F235 HydrophobicContact CG-CE1 4.32Å; Y194-Y262 HydrophobicContact CD1-CD1 4.13Å; Y194-Y262 AromaticContact CD1-CE1 3.94Å; Y194-Y262 HydrophobicContact CD1-CE1 3.94Å; Y194-Y262 HydrophobicContact CE1-CD1 4.01Å; Y194-Y262 HydrophobicContact CE1-CE1 4.08Å; Y194-V263 WeakPolarHBondContact O-CA 3.26Å; Y194-G264 PolarHBondContact N-O 3.36Å; Y194-G264 PolarHBondContact O-N 3.49Å
195	I	91.6	Very high	80.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	133.1	-174.6	-45	175.2	0	0	0	107.7	V193 F198 L207 F211 F233 G234 V236 Y262 V263	V193-I195 HydrophobicContact CG1-CG1 4.07Å; I195-F198 HydrophobicContact CB-CD1 4.26Å; I195-F198 HydrophobicContact CB-CE1 4.21Å; I195-F198 HydrophobicContact CG2-CD1 3.67Å; I195-F198 HydrophobicContact CG2-CE1 4.12Å; I195-L207 HydrophobicContact CD1-CD1 3.94Å; I195-L207 HydrophobicContact CD1-CD2 4.25Å; I195-L207 HydrophobicContact CD1-CG 4.24Å; I195-L207 HydrophobicContact CG2-CD1 4.42Å; I195-F211 HydrophobicContact CD1-CD1 3.87Å; I195-F211 HydrophobicContact CD1-CD2 3.79Å; I195-F211 HydrophobicContact CD1-CE1 3.73Å; I195-F211 HydrophobicContact CD1-CE2 3.66Å; I195-F211 HydrophobicContact CD1-CG 3.9Å; I195-F211 HydrophobicContact CD1-CZ 3.62Å; I195-F211 HydrophobicContact CG1-CE1 4.39Å; I195-F211 HydrophobicContact CG1-CZ 4.3Å; I195-F211 HydrophobicContact CG2-CE2 4.28Å; I195-F211 HydrophobicContact CG2-CZ 4.04Å; I195-F233 CarbonylContact O-C 3.49Å; I195-F233 WeakPolarHBondContact O-CA 3.31Å; I195-F233 WeakPolarHBondContact O-CB 3.18Å; I195-G234 PolarHBondContact N-O 3.36Å; I195-G234 PolarHBondContact O-N 3.13Å; I195-V236 HydrophobicContact CD1-CB 4.31Å; I195-V236 HydrophobicContact CD1-CG2 3.47Å; I195-V236 VanDerWaalsContact CD1-CG2 3.47Å; I195-Y262 CarbonylContact C-O 3.47Å; I195-Y262 WeakPolarHBondContact CA-O 3.18Å; I195-V263 HydrophobicContact CG1-CG1 4.38Å; I195-V263 HydrophobicContact CG2-CG2 4.21Å
196	K	91.3	Very high	82.1	Confident	104 Å²	104	63.3 Å²	63.3	45%	0.452	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.5	-177.7	-165.5	-157.3	173	-161.5	0	110.9	Y194 G232 F233 I261 Y262	Y194-K196 HydrophobicContact CE1-CB 3.89Å; K196-G232 CarbonylContact C-O 3.51Å; K196-G232 WeakPolarHBondContact CA-O 3.3Å; K196-F233 HydrophobicContact CB-CB 4.23Å; K196-F233 HydrophobicContact CG-CB 4.03Å; K196-I261 WeakPolarHBondContact O-CA 3.29Å; K196-Y262 HydrophobicContact CB-CD1 4.41Å; K196-Y262 PolarHBondContact N-O 3.35Å; K196-Y262 PolarHBondContact O-N 2.88Å
197	N	88.8	Confident	83.8	Confident	69 Å²	69	57.9 Å²	57.9	37%	0.369	29%	0.294	S	S	.	.			trans	73	18.4	171.1	-154	47.5	0	0	0	115.6	G199 G232 K259 T260	N197-G199 PolarHBondContact O-N 2.71Å; N197-G232 PolarHBondContact N-O 2.68Å; N197-K259 VanDerWaalsContact O-CB 3.29Å; N197-K259 WeakPolarHBondContact O-CB 3.32Å; N197-T260 WeakPolarHBondContact CB-O 3.39Å; N197-T260 PolarHBondContact ND2-O 2.79Å
198	F	86.4	Confident	85.5	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-73.4	-2.8	174.6	51.9	-113.7	0	0	0	114.7	I195 F202 L207 V222 F233 I261	I195-F198 HydrophobicContact CB-CD1 4.26Å; I195-F198 HydrophobicContact CB-CE1 4.21Å; I195-F198 HydrophobicContact CG2-CD1 3.67Å; I195-F198 HydrophobicContact CG2-CE1 4.12Å; F198-F202 HydrophobicContact CB-CD2 4.21Å; F198-F202 HydrophobicContact CB-CG 4.42Å; F198-F202 HydrophobicContact CD2-CB 3.55Å; F198-F202 HydrophobicContact CD2-CD2 4.22Å; F198-F202 HydrophobicContact CD2-CG 4.01Å; F198-F202 HydrophobicContact CE2-CB 3.83Å; F198-F202 HydrophobicContact CG-CB 4.41Å; F198-F202 HydrophobicContact CG-CG 4.48Å; F198-F202 WeakPolarHBondContact O-CD2 3.42Å; F198-F202 VanDerWaalsContact O-CE2 3.28Å; F198-F202 WeakPolarHBondContact O-CE2 3.41Å; F198-L207 HydrophobicContact CD1-CD1 4.15Å; F198-L207 HydrophobicContact CE1-CD1 4.21Å; F198-L207 HydrophobicContact CE1-CD2 4.11Å; F198-L207 HydrophobicContact CZ-CD2 4.29Å; F198-V222 HydrophobicContact CE2-CG1 4.39Å; F198-V222 HydrophobicContact CE2-CG2 4.46Å; F198-V222 HydrophobicContact CZ-CG1 4.25Å; F198-V222 HydrophobicContact CZ-CG2 4.13Å; F198-F233 VanDerWaalsContact CZ-C 3.43Å; F198-I261 HydrophobicContact CB-CG2 4.01Å
199	G	81.8	Confident	87	Confident	6 Å²	6	61 Å²	61	6%	0.062	29%	0.294	C	S	.	.			trans	93.4	-173.7	-175.6	0	0	0	0	0	113.8	N197 G232	N197-G199 PolarHBondContact O-N 2.71Å; G199-G232 WeakPolarHBondContact O-CA 3.39Å
200	E	81.6	Confident	87.9	Confident	123 Å²	123	57 Å²	57	58%	0.575	28%	0.28	S	S	*	.	S	Bend	trans	-100.1	-21.1	-174.1	-66	176.4	-146.9	0	0	111.9	F202 S230	E200-F202 PolarHBondContact O-N 2.93Å; E200-S230 WeakPolarHBondContact O-CB 3.44Å
201	D	80.3	Confident	88.3	Confident	98 Å²	98	55.6 Å²	55.6	52%	0.524	27%	0.274	S	S	.	.	S	Bend	trans	-76.6	-6.8	-174.8	-36.2	-86.9	0	0	0	114	K206	D201-K206 PolarHBondContact O-NZ 3.18Å
202	F	83	Confident	88.5	Confident	17 Å²	17	56.4 Å²	56.4	8%	0.075	28%	0.282	C	S	.	.			trans	-87.5	114.4	176.6	-83.2	-97.9	0	0	0	110.8	F198 E200 K206 V210 L256	F198-F202 HydrophobicContact CB-CD2 4.21Å; F198-F202 HydrophobicContact CB-CG 4.42Å; F198-F202 HydrophobicContact CD2-CB 3.55Å; F198-F202 HydrophobicContact CD2-CD2 4.22Å; F198-F202 HydrophobicContact CD2-CG 4.01Å; F198-F202 HydrophobicContact CE2-CB 3.83Å; F198-F202 HydrophobicContact CG-CB 4.41Å; F198-F202 HydrophobicContact CG-CG 4.48Å; F198-F202 WeakPolarHBondContact O-CD2 3.42Å; F198-F202 VanDerWaalsContact O-CE2 3.28Å; F198-F202 WeakPolarHBondContact O-CE2 3.41Å; E200-F202 PolarHBondContact O-N 2.93Å; F202-K206 HydrophobicContact CD1-CB 3.91Å; F202-K206 HydrophobicContact CE1-CB 4.4Å; F202-V210 HydrophobicContact CE1-CG2 4.41Å; F202-L256 HydrophobicContact CE1-CD1 4.42Å; F202-L256 HydrophobicContact CZ-CB 4.35Å; F202-L256 HydrophobicContact CZ-CD1 4.03Å
203	T	87.8	Confident	88.6	Confident	51 Å²	51	56.9 Å²	56.9	31%	0.313	30%	0.296	S	S	.	.			trans	-87.6	173.6	168.8	66.5	0	0	0	0	110.9	E205 K206 L207	T203-E205 WeakPolarHBondContact CB-OE2 3.06Å; T203-E205 PolarHBondContact O-N 3.38Å; T203-E205 PolarHBondContact OG1-OE2 2.59Å; T203-K206 PolarHBondContact O-N 3.44Å; T203-L207 WeakPolarHBondContact O-CB 3.22Å; T203-L207 PolarHBondContact O-N 3.15Å; T203-L207 VanDerWaalsContact O-N 3.09Å
204	D	88.9	Confident	88.5	Confident	32 Å²	32	58.3 Å²	58.3	17%	0.171	30%	0.302	C	S	.	.	H	α-helix	trans	-59.2	-32.5	179.6	-56	-92	0	0	0	112.1	K208 R221 V222 K224	D204-K208 VanDerWaalsContact O-CB 3.28Å; D204-K208 WeakPolarHBondContact O-CB 3.49Å; D204-K208 PolarHBondContact O-N 3.34Å; D204-R221 WeakPolarHBondContact OD1-CA 3.25Å; D204-V222 PolarHBondContact OD1-N 2.9Å; D204-K224 WeakPolarHBondContact OD2-CE 3.2Å; D204-K224 IonicContact OD2-NZ 3.35Å; D204-K224 PolarHBondContact OD2-NZ 3.44Å
205	E	89.9	Confident	88.3	Confident	125 Å²	125	58.3 Å²	58.3	58%	0.584	31%	0.309	S	S	*	.	H	α-helix	trans	-72.9	-51.2	180	-53.2	70.1	-147.7	0	0	111.5	T203 L207 K208 E209	T203-E205 WeakPolarHBondContact CB-OE2 3.06Å; T203-E205 PolarHBondContact O-N 3.38Å; T203-E205 PolarHBondContact OG1-OE2 2.59Å; E205-L207 VanDerWaalsContact C-N 3.29Å; E205-L207 PolarHBondContact O-N 3.48Å; E205-K208 WeakPolarHBondContact O-CA 3.47Å; E205-K208 WeakPolarHBondContact O-CB 3.39Å; E205-K208 PolarHBondContact O-N 3.36Å; E205-K208 VanDerWaalsContact O-N 3.07Å; E205-E209 PolarHBondContact O-N 3.45Å
206	K	88.6	Confident	88.3	Confident	98 Å²	98	67.1 Å²	67.1	43%	0.426	34%	0.342	S	S	.	.	H	α-helix	trans	-60.2	-39.8	177.2	-64.3	-178.7	-173.9	174.8	0	111.7	D201 F202 T203 K208 E209 V210	D201-K206 PolarHBondContact O-NZ 3.18Å; F202-K206 HydrophobicContact CD1-CB 3.91Å; F202-K206 HydrophobicContact CE1-CB 4.4Å; T203-K206 PolarHBondContact O-N 3.44Å; K206-K208 VanDerWaalsContact C-N 3.33Å; K206-E209 PolarHBondContact O-N 3.31Å; K206-V210 WeakPolarHBondContact O-CG2 3.17Å; K206-V210 PolarHBondContact O-N 3.03Å
207	L	89.2	Confident	88.3	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-67.8	-36.2	176.6	-168.5	67.5	0	0	0	111.1	I195 F198 T203 E205 F211 V220 V222	I195-L207 HydrophobicContact CD1-CD1 3.94Å; I195-L207 HydrophobicContact CD1-CD2 4.25Å; I195-L207 HydrophobicContact CD1-CG 4.24Å; I195-L207 HydrophobicContact CG2-CD1 4.42Å; F198-L207 HydrophobicContact CD1-CD1 4.15Å; F198-L207 HydrophobicContact CE1-CD1 4.21Å; F198-L207 HydrophobicContact CE1-CD2 4.11Å; F198-L207 HydrophobicContact CZ-CD2 4.29Å; T203-L207 WeakPolarHBondContact O-CB 3.22Å; T203-L207 PolarHBondContact O-N 3.15Å; T203-L207 VanDerWaalsContact O-N 3.09Å; E205-L207 VanDerWaalsContact C-N 3.29Å; E205-L207 PolarHBondContact O-N 3.48Å; L207-F211 HydrophobicContact CD1-CD2 3.78Å; L207-F211 HydrophobicContact CD1-CE2 3.79Å; L207-F211 HydrophobicContact CG-CD2 4.33Å; L207-F211 WeakPolarHBondContact O-CB 3.29Å; L207-F211 WeakPolarHBondContact O-CD2 3.4Å; L207-F211 PolarHBondContact O-N 3.01Å; L207-F211 VanDerWaalsContact O-N 3.14Å; L207-V220 HydrophobicContact CB-CG1 4.06Å; L207-V220 HydrophobicContact CD2-CG1 3.98Å; L207-V220 HydrophobicContact CG-CG1 4.03Å; L207-V222 HydrophobicContact CB-CG2 4.36Å; L207-V222 HydrophobicContact CD2-CG2 3.83Å
208	K	91.6	Very high	88.4	Confident	114 Å²	114	65.1 Å²	65.1	50%	0.496	34%	0.337	S	S	.	.	H	α-helix	trans	-67.8	-41.6	175.1	-178.2	-176.4	175.8	-170.4	0	112.3	D204 E205 K206 S212 V220	D204-K208 VanDerWaalsContact O-CB 3.28Å; D204-K208 WeakPolarHBondContact O-CB 3.49Å; D204-K208 PolarHBondContact O-N 3.34Å; E205-K208 WeakPolarHBondContact O-CA 3.47Å; E205-K208 WeakPolarHBondContact O-CB 3.39Å; E205-K208 PolarHBondContact O-N 3.36Å; E205-K208 VanDerWaalsContact O-N 3.07Å; K206-K208 VanDerWaalsContact C-N 3.33Å; K208-S212 WeakPolarHBondContact O-CB 3.4Å; K208-S212 PolarHBondContact O-N 2.85Å; K208-S212 PolarHBondContact O-OG 3.16Å; K208-V220 HydrophobicContact CB-CB 4.01Å; K208-V220 HydrophobicContact CB-CG1 4.14Å; K208-V220 HydrophobicContact CB-CG2 3.84Å; K208-V220 HydrophobicContact CG-CB 4.46Å; K208-V220 HydrophobicContact CG-CG2 3.89Å
209	E	90.8	Very high	88.5	Confident	140 Å²	140	68.5 Å²	68.5	65%	0.654	36%	0.36	S	S	*	.	H	α-helix	trans	-56.4	-60.9	176.4	-177.7	176.9	-163.9	0	0	110.4	E205 K206 F211 S212	E205-E209 PolarHBondContact O-N 3.45Å; K206-E209 PolarHBondContact O-N 3.31Å; E209-F211 VanDerWaalsContact C-N 3.33Å; E209-F211 PolarHBondContact O-N 2.77Å; E209-S212 PolarHBondContact O-N 3.33Å; E209-S212 VanDerWaalsContact O-N 3.15Å; E209-S212 PolarHBondContact O-OG 3.45Å
210	V	89.7	Confident	89	Confident	47 Å²	47	69.3 Å²	69.3	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-55.7	-43.8	179.9	173.6	0	0	0	0	112.4	F202 K206 F214 M251	F202-V210 HydrophobicContact CE1-CG2 4.41Å; K206-V210 WeakPolarHBondContact O-CG2 3.17Å; K206-V210 PolarHBondContact O-N 3.03Å; V210-F214 WeakPolarHBondContact O-CE2 3.4Å; V210-M251 HydrophobicContact CG1-CE 3.61Å
211	F	90.2	Very high	89.5	Confident	1 Å²	1	71.2 Å²	71.2	0%	0.004	37%	0.366	C	S	.	.	H	α-helix	trans	-86.4	-8.2	-176.6	-77.3	-93.5	0	0	0	114.1	I195 L207 E209 A213 F214 V236 Y238 A247 M251 I261 V263	I195-F211 HydrophobicContact CD1-CD1 3.87Å; I195-F211 HydrophobicContact CD1-CD2 3.79Å; I195-F211 HydrophobicContact CD1-CE1 3.73Å; I195-F211 HydrophobicContact CD1-CE2 3.66Å; I195-F211 HydrophobicContact CD1-CG 3.9Å; I195-F211 HydrophobicContact CD1-CZ 3.62Å; I195-F211 HydrophobicContact CG1-CE1 4.39Å; I195-F211 HydrophobicContact CG1-CZ 4.3Å; I195-F211 HydrophobicContact CG2-CE2 4.28Å; I195-F211 HydrophobicContact CG2-CZ 4.04Å; L207-F211 HydrophobicContact CD1-CD2 3.78Å; L207-F211 HydrophobicContact CD1-CE2 3.79Å; L207-F211 HydrophobicContact CG-CD2 4.33Å; L207-F211 WeakPolarHBondContact O-CB 3.29Å; L207-F211 WeakPolarHBondContact O-CD2 3.4Å; L207-F211 PolarHBondContact O-N 3.01Å; L207-F211 VanDerWaalsContact O-N 3.14Å; E209-F211 VanDerWaalsContact C-N 3.33Å; E209-F211 PolarHBondContact O-N 2.77Å; F211-A213 VanDerWaalsContact C-N 3.27Å; F211-A213 PolarHBondContact O-N 2.82Å; F211-F214 HydrophobicContact CD1-CD2 4.1Å; F211-F214 HydrophobicContact CD1-CE2 4.26Å; F211-V236 HydrophobicContact CB-CG1 4.48Å; F211-V236 HydrophobicContact CB-CG2 4.12Å; F211-V236 HydrophobicContact CG-CG2 4.31Å; F211-Y238 PolarHBondContact O-OH 3Å; F211-A247 HydrophobicContact CD1-CB 4.24Å; F211-A247 HydrophobicContact CE1-CB 4.49Å; F211-M251 HydrophobicContact CE1-CB 4.05Å; F211-M251 HydrophobicContact CE1-CG 4.03Å; F211-M251 HydrophobicContact CE2-CE 4.24Å; F211-M251 HydrophobicContact CZ-CB 4.06Å; F211-M251 HydrophobicContact CZ-CE 4.03Å; F211-M251 HydrophobicContact CZ-CG 4.15Å; F211-I261 HydrophobicContact CZ-CD1 4.34Å; F211-V263 HydrophobicContact CE1-CG1 4.2Å; F211-V263 HydrophobicContact CZ-CG2 4.3Å
212	S	91.7	Very high	90.1	Very high	62 Å²	62	66.8 Å²	66.8	43%	0.434	34%	0.342	S	S	.	.	H	α-helix	trans	-70.3	-23	172.6	67.9	0	0	0	0	113.3	K208 E209 F214 G215	K208-S212 WeakPolarHBondContact O-CB 3.4Å; K208-S212 PolarHBondContact O-N 2.85Å; K208-S212 PolarHBondContact O-OG 3.16Å; E209-S212 PolarHBondContact O-N 3.33Å; E209-S212 VanDerWaalsContact O-N 3.15Å; E209-S212 PolarHBondContact O-OG 3.45Å; S212-F214 PolarHBondContact O-N 3.03Å; S212-G215 PolarHBondContact O-N 2.73Å
213	A	91.7	Very high	90.4	Very high	85 Å²	85	68.6 Å²	68.6	70%	0.702	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.7	178.3	0	0	0	0	0	113.7	F211	F211-A213 VanDerWaalsContact C-N 3.27Å; F211-A213 PolarHBondContact O-N 2.82Å
214	F	90.6	Very high	90.5	Very high	29 Å²	29	70.6 Å²	70.6	13%	0.127	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-11.1	-178.1	-51.6	-70	0	0	0	113.9	V210 F211 S212 Y238 A247 E250 M251	V210-F214 WeakPolarHBondContact O-CE2 3.4Å; F211-F214 HydrophobicContact CD1-CD2 4.1Å; F211-F214 HydrophobicContact CD1-CE2 4.26Å; S212-F214 PolarHBondContact O-N 3.03Å; F214-Y238 HydrophobicContact CB-CE1 4.48Å; F214-A247 HydrophobicContact CB-CB 3.86Å; F214-A247 HydrophobicContact CD2-CB 4.02Å; F214-A247 HydrophobicContact CG-CB 3.95Å; F214-E250 HydrophobicContact CE1-CB 4.32Å; F214-M251 HydrophobicContact CD2-CG 4.44Å; F214-M251 HydrophobicContact CE1-CG 4.15Å; F214-M251 HydrophobicContact CE2-CE 4.45Å; F214-M251 HydrophobicContact CE2-CG 3.51Å; F214-M251 HydrophobicContact CE2-SD 4.01Å; F214-M251 HydrophobicContact CZ-CE 4.46Å; F214-M251 HydrophobicContact CZ-CG 3.35Å; F214-M251 HydrophobicContact CZ-SD 3.53Å; F214-M251 VanDerWaalsContact CZ-SD 3.53Å
215	G	89.9	Confident	90.5	Very high	22 Å²	22	72.6 Å²	72.6	23%	0.227	37%	0.367	C	S	.	.	S	Bend	trans	148.5	-171.1	177.7	0	0	0	0	0	114.8	S212 T217 D243	S212-G215 PolarHBondContact O-N 2.73Å; G215-T217 PolarHBondContact O-N 2.84Å; G215-D243 WeakPolarHBondContact CA-OD2 3.43Å
216	R	91.5	Very high	90.3	Very high	185 Å²	185	76.2 Å²	76.2	70%	0.698	38%	0.384	S	S	*	.			trans	-78.3	99.8	-166.5	-173.9	178.1	-178.7	178.7	1.5	111.5	Y238 A239 D243	R216-Y238 CarbonylContact O-C 3.59Å; R216-Y238 WeakPolarHBondContact O-CA 3.34Å; R216-A239 HydrophobicContact CB-CB 4.09Å; R216-A239 HydrophobicContact CG-CB 4.29Å; R216-A239 PolarHBondContact O-N 2.82Å; R216-D243 PolarHBondContact N-OD2 2.9Å
217	T	91.2	Very high	90	Very high	25 Å²	25	79.9 Å²	79.9	15%	0.153	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	125.5	174	58.4	0	0	0	0	111.6	G215 V220 V236 N237 Y238	G215-T217 PolarHBondContact O-N 2.84Å; T217-V220 HydrophobicContact CG2-CG2 4.28Å; T217-V236 HydrophobicContact CG2-CG1 3.51Å; T217-N237 CarbonylContact C-O 3.55Å; T217-Y238 HydrophobicContact CG2-CD1 3.91Å; T217-Y238 HydrophobicContact CG2-CE1 3.53Å
218	L	90	Very high	89.6	Confident	107 Å²	107	82 Å²	82	56%	0.56	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	-35.3	173.7	-67	-179.3	0	0	0	112.1	N237 A239	L218-N237 PolarHBondContact N-O 2.9Å; L218-A239 HydrophobicContact CD2-CB 4.24Å; L218-A239 HydrophobicContact CG-CB 4.23Å
219	S	89.4	Confident	89.2	Confident	70 Å²	70	82.2 Å²	82.2	49%	0.49	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	138.9	-178.9	-171.1	0	0	0	0	109.8	V236 N237	S219-V236 CarbonylContact O-C 3.53Å; S219-V236 WeakPolarHBondContact O-CA 3.34Å; S219-N237 PolarHBondContact N-O 3.02Å; S219-N237 PolarHBondContact O-N 2.66Å
220	V	92.3	Very high	89	Confident	24 Å²	24	76.2 Å²	76.2	15%	0.145	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.7	174	-178.8	0	0	0	0	107.4	L207 K208 T217 F235 V236	L207-V220 HydrophobicContact CB-CG1 4.06Å; L207-V220 HydrophobicContact CD2-CG1 3.98Å; L207-V220 HydrophobicContact CG-CG1 4.03Å; K208-V220 HydrophobicContact CB-CB 4.01Å; K208-V220 HydrophobicContact CB-CG1 4.14Å; K208-V220 HydrophobicContact CB-CG2 3.84Å; K208-V220 HydrophobicContact CG-CB 4.46Å; K208-V220 HydrophobicContact CG-CG2 3.89Å; T217-V220 HydrophobicContact CG2-CG2 4.28Å; V220-F235 WeakPolarHBondContact CA-O 3.39Å; V220-V236 HydrophobicContact CB-CG2 4.44Å; V220-V236 HydrophobicContact CG1-CG2 3.95Å; V220-V236 HydrophobicContact CG2-CG1 4.18Å; V220-V236 HydrophobicContact CG2-CG2 4.01Å
221	R	91.7	Very high	88.8	Confident	163 Å²	163	80.3 Å²	80.3	62%	0.615	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.4	119	-179.7	-169.1	174.2	-175.4	173.2	3.6	112.5	D204 G234 F235	D204-R221 WeakPolarHBondContact OD1-CA 3.25Å; R221-G234 CarbonylContact O-C 3.47Å; R221-G234 WeakPolarHBondContact O-CA 3.47Å; R221-F235 PolarHBondContact N-O 2.86Å; R221-F235 PolarHBondContact O-N 2.76Å
222	V	91.6	Very high	88.6	Confident	4 Å²	4	80.9 Å²	80.9	2%	0.024	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	132.9	165.9	175.5	0	0	0	0	108.7	F198 D204 L207 K224 S230	F198-V222 HydrophobicContact CE2-CG1 4.39Å; F198-V222 HydrophobicContact CE2-CG2 4.46Å; F198-V222 HydrophobicContact CZ-CG1 4.25Å; F198-V222 HydrophobicContact CZ-CG2 4.13Å; D204-V222 PolarHBondContact OD1-N 2.9Å; L207-V222 HydrophobicContact CB-CG2 4.36Å; L207-V222 HydrophobicContact CD2-CG2 3.83Å; V222-K224 HydrophobicContact CG1-CG 4.4Å; V222-K224 PolarHBondContact O-N 2.97Å; V222-S230 WeakPolarHBondContact CG1-OG 3.45Å
223	M	90.3	Very high	88.6	Confident	56 Å²	56	80 Å²	80	28%	0.276	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	109.4	174.2	-70.7	-57.8	-57.9	0	0	109.4	R231 F233 F235	M223-R231 WeakPolarHBondContact O-CB 3.47Å; M223-R231 VanDerWaalsContact O-CG 3.27Å; M223-R231 WeakPolarHBondContact O-CG 3.32Å; M223-R231 PolarHBondContact O-N 3.4Å; M223-F233 HydrophobicContact CB-CD2 3.93Å; M223-F233 HydrophobicContact CB-CE1 4.19Å; M223-F233 HydrophobicContact CB-CE2 3.56Å; M223-F233 HydrophobicContact CB-CG 4.45Å; M223-F233 HydrophobicContact CB-CZ 3.68Å; M223-F233 HydrophobicContact CG-CD2 3.93Å; M223-F233 HydrophobicContact CG-CE2 3.43Å; M223-F233 VanDerWaalsContact CG-CE2 3.43Å; M223-F233 HydrophobicContact CG-CZ 3.97Å; M223-F233 PolarHBondContact N-O 3.46Å; M223-F235 HydrophobicContact CG-CD2 4.13Å; M223-F235 HydrophobicContact CG-CE2 3.82Å; M223-F235 HydrophobicContact SD-CE2 4.38Å
224	K	90.4	Very high	88.6	Confident	93 Å²	93	76 Å²	76	40%	0.404	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	156.7	175	-67	161.4	-179.3	164.9	0	110.2	D204 V222 G228 Q229 R231	D204-K224 WeakPolarHBondContact OD2-CE 3.2Å; D204-K224 IonicContact OD2-NZ 3.35Å; D204-K224 PolarHBondContact OD2-NZ 3.44Å; V222-K224 HydrophobicContact CG1-CG 4.4Å; V222-K224 PolarHBondContact O-N 2.97Å; K224-G228 WeakPolarHBondContact CB-O 3.23Å; K224-G228 WeakPolarHBondContact CG-O 3.48Å; K224-Q229 CarbonylContact C-O 3.47Å; K224-Q229 WeakPolarHBondContact CA-O 3.39Å; K224-R231 WeakPolarHBondContact O-CD 3.38Å
225	D	87.6	Confident	88.7	Confident	73 Å²	73	78.3 Å²	78.3	39%	0.39	38%	0.38	S	S	.	.			trans	-91.2	179.7	178.5	-147.8	47.6	0	0	0	111.7	K227 G228 Q229 R231	D225-K227 PolarHBondContact O-N 3.21Å; D225-K227 VanDerWaalsContact O-N 3.08Å; D225-G228 PolarHBondContact O-N 3.03Å; D225-Q229 PolarHBondContact N-O 3.01Å; D225-R231 HydrophobicContact CB-CG 3.75Å; D225-R231 WeakPolarHBondContact OD1-CD 3.39Å; D225-R231 IonicContact OD1-CZ 3.49Å; D225-R231 VanDerWaalsContact OD1-CZ 3.3Å; D225-R231 IonicContact OD1-NE 3.88Å; D225-R231 PolarHBondContact OD1-NE 3.04Å; D225-R231 IonicContact OD1-NH1 3.3Å; D225-R231 PolarHBondContact OD1-NH1 3.42Å; D225-R231 IonicContact OD1-NH2 2.68Å
226	E	86.2	Confident	88.9	Confident	201 Å²	201	77.2 Å²	77.2	94%	0.939	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.4	-178.9	-64.7	180	173.7	0	0	112.9
227	K	83.3	Confident	88.9	Confident	175 Å²	175	70.2 Å²	70.2	76%	0.761	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	9.3	174.4	-56.5	-176.7	-175	179.6	0	114.2	D225 Q229	D225-K227 PolarHBondContact O-N 3.21Å; D225-K227 VanDerWaalsContact O-N 3.08Å; K227-Q229 PolarHBondContact O-N 3.47Å; K227-Q229 VanDerWaalsContact O-N 3.12Å
228	G	80.2	Confident	89	Confident	47 Å²	47	69.1 Å²	69.1	49%	0.485	34%	0.338	S	S	.	.	S	Bend	trans	75.7	-12.2	-178.5	0	0	0	0	0	115.9	K224 D225	K224-G228 WeakPolarHBondContact CB-O 3.23Å; K224-G228 WeakPolarHBondContact CG-O 3.48Å; D225-G228 PolarHBondContact O-N 3.03Å
229	Q	82.7	Confident	89	Confident	117 Å²	117	65.5 Å²	65.5	55%	0.547	32%	0.324	S	S	.	.			trans	-64.1	144.6	176.4	-67.2	175.4	-51.3	0	0	111.8	K224 D225 K227	K224-Q229 CarbonylContact C-O 3.47Å; K224-Q229 WeakPolarHBondContact CA-O 3.39Å; D225-Q229 PolarHBondContact N-O 3.01Å; K227-Q229 PolarHBondContact O-N 3.47Å; K227-Q229 VanDerWaalsContact O-N 3.12Å
230	S	86.6	Confident	89	Confident	14 Å²	14	67.6 Å²	67.6	10%	0.098	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	134.7	176.8	174.5	0	0	0	0	111	E200 V222 G232	E200-S230 WeakPolarHBondContact O-CB 3.44Å; V222-S230 WeakPolarHBondContact CG1-OG 3.45Å; S230-G232 PolarHBondContact O-N 2.82Å; S230-G232 PolarHBondContact OG-N 3.5Å
231	R	86.3	Confident	88.8	Confident	134 Å²	134	68.5 Å²	68.5	51%	0.506	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	13.4	176.7	-58	172.8	68	154.3	10.1	112.8	M223 K224 D225 F233	M223-R231 WeakPolarHBondContact O-CB 3.47Å; M223-R231 VanDerWaalsContact O-CG 3.27Å; M223-R231 WeakPolarHBondContact O-CG 3.32Å; M223-R231 PolarHBondContact O-N 3.4Å; K224-R231 WeakPolarHBondContact O-CD 3.38Å; D225-R231 HydrophobicContact CB-CG 3.75Å; D225-R231 WeakPolarHBondContact OD1-CD 3.39Å; D225-R231 IonicContact OD1-CZ 3.49Å; D225-R231 VanDerWaalsContact OD1-CZ 3.3Å; D225-R231 IonicContact OD1-NE 3.88Å; D225-R231 PolarHBondContact OD1-NE 3.04Å; D225-R231 IonicContact OD1-NH1 3.3Å; D225-R231 PolarHBondContact OD1-NH1 3.42Å; D225-R231 IonicContact OD1-NH2 2.68Å; R231-F233 HydrophobicContact CB-CD1 3.79Å; R231-F233 HydrophobicContact CB-CE1 3.69Å; R231-F233 WeakPolarHBondContact O-CD1 3.29Å; R231-F233 PolarHBondContact O-N 2.89Å
232	G	85.1	Confident	88.7	Confident	12 Å²	12	66.8 Å²	66.8	12%	0.124	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	63.3	23.9	-176.7	0	0	0	0	0	114.1	K196 N197 G199 S230	K196-G232 CarbonylContact C-O 3.51Å; K196-G232 WeakPolarHBondContact CA-O 3.3Å; N197-G232 PolarHBondContact N-O 2.68Å; G199-G232 WeakPolarHBondContact O-CA 3.39Å; S230-G232 PolarHBondContact O-N 2.82Å; S230-G232 PolarHBondContact OG-N 3.5Å
233	F	91.1	Very high	88.8	Confident	45 Å²	45	67.5 Å²	67.5	20%	0.197	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	157	172.8	77.8	-93.5	0	0	0	112.7	Y194 I195 K196 F198 M223 R231 F235	Y194-F233 HydrophobicContact CD2-CD2 4.38Å; Y194-F233 HydrophobicContact CE2-CB 4.07Å; Y194-F233 AromaticContact CE2-CD2 3.55Å; Y194-F233 HydrophobicContact CE2-CD2 3.55Å; Y194-F233 HydrophobicContact CE2-CE2 4.24Å; Y194-F233 HydrophobicContact CE2-CG 4.08Å; I195-F233 CarbonylContact O-C 3.49Å; I195-F233 WeakPolarHBondContact O-CA 3.31Å; I195-F233 WeakPolarHBondContact O-CB 3.18Å; K196-F233 HydrophobicContact CB-CB 4.23Å; K196-F233 HydrophobicContact CG-CB 4.03Å; F198-F233 VanDerWaalsContact CZ-C 3.43Å; M223-F233 HydrophobicContact CB-CD2 3.93Å; M223-F233 HydrophobicContact CB-CE1 4.19Å; M223-F233 HydrophobicContact CB-CE2 3.56Å; M223-F233 HydrophobicContact CB-CG 4.45Å; M223-F233 HydrophobicContact CB-CZ 3.68Å; M223-F233 HydrophobicContact CG-CD2 3.93Å; M223-F233 HydrophobicContact CG-CE2 3.43Å; M223-F233 VanDerWaalsContact CG-CE2 3.43Å; M223-F233 HydrophobicContact CG-CZ 3.97Å; M223-F233 PolarHBondContact N-O 3.46Å; R231-F233 HydrophobicContact CB-CD1 3.79Å; R231-F233 HydrophobicContact CB-CE1 3.69Å; R231-F233 WeakPolarHBondContact O-CD1 3.29Å; R231-F233 PolarHBondContact O-N 2.89Å; F233-F235 HydrophobicContact CD2-CE2 4.34Å; F233-F235 HydrophobicContact CE2-CE2 4.08Å; F233-F235 HydrophobicContact CE2-CZ 4.43Å
234	G	92	Very high	88.8	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	-178.2	-177.5	0	0	0	0	0	112.6	I195 R221	I195-G234 PolarHBondContact N-O 3.36Å; I195-G234 PolarHBondContact O-N 3.13Å; R221-G234 CarbonylContact O-C 3.47Å; R221-G234 WeakPolarHBondContact O-CA 3.47Å
235	F	93.4	Very high	88.8	Confident	77 Å²	77	63.3 Å²	63.3	34%	0.338	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	143.2	-179.9	-60.1	-87.8	0	0	0	110.5	V193 Y194 V220 R221 M223 F233 A266	V193-F235 VanDerWaalsContact O-CA 3.3Å; V193-F235 WeakPolarHBondContact O-CA 3.23Å; Y194-F235 HydrophobicContact CD2-CD1 4.12Å; Y194-F235 AromaticContact CD2-CE1 3.58Å; Y194-F235 HydrophobicContact CD2-CE1 3.58Å; Y194-F235 AromaticContact CD2-CZ 3.87Å; Y194-F235 HydrophobicContact CD2-CZ 3.87Å; Y194-F235 HydrophobicContact CE2-CE1 4.49Å; Y194-F235 HydrophobicContact CE2-CZ 4.37Å; Y194-F235 HydrophobicContact CG-CE1 4.32Å; V220-F235 WeakPolarHBondContact CA-O 3.39Å; R221-F235 PolarHBondContact N-O 2.86Å; R221-F235 PolarHBondContact O-N 2.76Å; M223-F235 HydrophobicContact CG-CD2 4.13Å; M223-F235 HydrophobicContact CG-CE2 3.82Å; M223-F235 HydrophobicContact SD-CE2 4.38Å; F233-F235 HydrophobicContact CD2-CE2 4.34Å; F233-F235 HydrophobicContact CE2-CE2 4.08Å; F233-F235 HydrophobicContact CE2-CZ 4.43Å; F235-A266 HydrophobicContact CD1-CB 3.92Å; F235-A266 HydrophobicContact CE1-CB 4.13Å
236	V	94.1	Very high	89	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128.3	171.3	174.2	0	0	0	0	107.7	N192 V193 I195 F211 T217 S219 V220 Y238	N192-V236 CarbonylContact C-O 3.59Å; N192-V236 WeakPolarHBondContact CA-O 3.32Å; V193-V236 HydrophobicContact CB-CB 4.5Å; V193-V236 PolarHBondContact N-O 2.64Å; V193-V236 PolarHBondContact O-N 2.83Å; I195-V236 HydrophobicContact CD1-CB 4.31Å; I195-V236 HydrophobicContact CD1-CG2 3.47Å; I195-V236 VanDerWaalsContact CD1-CG2 3.47Å; F211-V236 HydrophobicContact CB-CG1 4.48Å; F211-V236 HydrophobicContact CB-CG2 4.12Å; F211-V236 HydrophobicContact CG-CG2 4.31Å; T217-V236 HydrophobicContact CG2-CG1 3.51Å; S219-V236 CarbonylContact O-C 3.53Å; S219-V236 WeakPolarHBondContact O-CA 3.34Å; V220-V236 HydrophobicContact CB-CG2 4.44Å; V220-V236 HydrophobicContact CG1-CG2 3.95Å; V220-V236 HydrophobicContact CG2-CG1 4.18Å; V220-V236 HydrophobicContact CG2-CG2 4.01Å; V236-Y238 HydrophobicContact CB-CE2 4.28Å; V236-Y238 HydrophobicContact CG1-CD2 3.88Å; V236-Y238 HydrophobicContact CG1-CE1 4.36Å; V236-Y238 HydrophobicContact CG1-CE2 3.43Å; V236-Y238 VanDerWaalsContact CG1-CE2 3.43Å
237	N	92.3	Very high	89.3	Confident	38 Å²	38	55.5 Å²	55.5	20%	0.203	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.1	171.4	-174.2	31.1	0	0	0	109	T191 N192 T217 L218 S219	T191-N237 VanDerWaalsContact CB-OD1 3.3Å; T191-N237 WeakPolarHBondContact CB-OD1 3.43Å; T191-N237 WeakPolarHBondContact O-CA 3.31Å; T191-N237 PolarHBondContact OG1-OD1 3.34Å; N192-N237 VanDerWaalsContact OD1-CB 3.28Å; N192-N237 WeakPolarHBondContact OD1-CB 3.2Å; N192-N237 VanDerWaalsContact OD1-CG 3.26Å; N192-N237 PolarHBondContact OD1-OD1 3.47Å; T217-N237 CarbonylContact C-O 3.55Å; L218-N237 PolarHBondContact N-O 2.9Å; S219-N237 PolarHBondContact N-O 3.02Å; S219-N237 PolarHBondContact O-N 2.66Å
238	Y	93.1	Very high	89.8	Confident	1 Å²	1	48 Å²	48	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	163.7	175.2	-70.2	-88.3	0	0	0	112.3	T191 V193 F211 F214 R216 T217 V236 H240 D243 A244 A247	T191-Y238 WeakPolarHBondContact CB-O 3.24Å; T191-Y238 PolarHBondContact O-N 2.93Å; V193-Y238 HydrophobicContact CG2-CD2 4.04Å; V193-Y238 HydrophobicContact CG2-CE2 3.81Å; F211-Y238 PolarHBondContact O-OH 3Å; F214-Y238 HydrophobicContact CB-CE1 4.48Å; R216-Y238 CarbonylContact O-C 3.59Å; R216-Y238 WeakPolarHBondContact O-CA 3.34Å; T217-Y238 HydrophobicContact CG2-CD1 3.91Å; T217-Y238 HydrophobicContact CG2-CE1 3.53Å; V236-Y238 HydrophobicContact CB-CE2 4.28Å; V236-Y238 HydrophobicContact CG1-CD2 3.88Å; V236-Y238 HydrophobicContact CG1-CE1 4.36Å; V236-Y238 HydrophobicContact CG1-CE2 3.43Å; V236-Y238 VanDerWaalsContact CG1-CE2 3.43Å; Y238-H240 VanDerWaalsContact C-N 3.34Å; Y238-H240 WeakPolarHBondContact CB-O 3.03Å; Y238-D243 HydrophobicContact CD1-CB 3.48Å; Y238-D243 VanDerWaalsContact CD1-CB 3.48Å; Y238-D243 HydrophobicContact CE1-CB 4.09Å; Y238-D243 HydrophobicContact CG-CB 3.81Å; Y238-A244 HydrophobicContact CD2-CB 3.61Å; Y238-A244 HydrophobicContact CE2-CB 4.31Å; Y238-A244 HydrophobicContact CG-CB 4.21Å; Y238-A247 HydrophobicContact CE2-CB 3.87Å; Y238-A247 WeakPolarHBondContact OH-CB 3.48Å
239	A	89.1	Confident	90.3	Very high	32 Å²	32	51 Å²	51	26%	0.264	25%	0.246	S	C	.	.	S	Bend	trans	-70.7	-32.4	169.6	0	0	0	0	0	112.1	R216 L218	R216-A239 HydrophobicContact CB-CB 4.09Å; R216-A239 HydrophobicContact CG-CB 4.29Å; R216-A239 PolarHBondContact O-N 2.82Å; L218-A239 HydrophobicContact CD2-CB 4.24Å; L218-A239 HydrophobicContact CG-CB 4.23Å
240	H	88.9	Confident	90.7	Very high	113 Å²	113	50.5 Å²	50.5	52%	0.523	24%	0.243	S	C	.	.	S	Bend	trans	-127.1	154.1	-175.9	-55	-64.1	0	0	0	111.7	Y238 D243	Y238-H240 VanDerWaalsContact C-N 3.34Å; Y238-H240 WeakPolarHBondContact CB-O 3.03Å; H240-D243 IonicContact CD2-OD2 3.37Å
241	H	88.7	Confident	90.9	Very high	44 Å²	44	50.3 Å²	50.3	20%	0.204	24%	0.241	C	C	.	.	H	α-helix	trans	-69.7	-35.3	177.1	166.1	52.6	0	0	0	112.3	M188 K189 F190 D243 A244 Q245	M188-H241 PolarHBondContact O-CE1 3.02Å; K189-H241 HydrophobicContact CB-CB 4.13Å; K189-H241 HydrophobicContact CG-CB 4.31Å; F190-H241 AromaticContact CD1-CE1 3.88Å; F190-H241 AromaticContact CE1-CE1 3.81Å; F190-H241 PolarHBondContact N-ND1 3.31Å; F190-H241 VanDerWaalsContact N-ND1 3.16Å; F190-H241 WeakPolarHBondContact O-CA 3.36Å; F190-H241 PolarHBondContact O-ND1 2.9Å; H241-D243 VanDerWaalsContact C-N 3.35Å; H241-D243 PolarHBondContact O-N 3.17Å; H241-A244 CarbonylContact O-C 3.57Å; H241-A244 WeakPolarHBondContact O-CB 3.24Å; H241-A244 PolarHBondContact O-N 3.49Å; H241-A244 VanDerWaalsContact O-N 3.14Å; H241-Q245 WeakPolarHBondContact O-CB 3.34Å; H241-Q245 PolarHBondContact O-N 2.81Å
242	E	90.1	Very high	91.2	Very high	127 Å²	127	47.6 Å²	47.6	59%	0.593	24%	0.237	S	C	*	.	H	α-helix	trans	-64	-40.6	-176.8	-68.8	163.5	-143.6	0	0	111.6	Q245 K246	E242-Q245 PolarHBondContact O-N 2.83Å; E242-K246 WeakPolarHBondContact O-CD 3.34Å; E242-K246 VanDerWaalsContact O-CG 3.25Å; E242-K246 WeakPolarHBondContact O-CG 3.24Å; E242-K246 PolarHBondContact O-N 2.83Å
243	D	92.4	Very high	91.3	Very high	19 Å²	19	49.3 Å²	49.3	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-58.3	-47.1	171.3	-55.2	2.1	0	0	0	111.3	G215 R216 Y238 H240 H241 Q245 K246 A247	G215-D243 WeakPolarHBondContact CA-OD2 3.43Å; R216-D243 PolarHBondContact N-OD2 2.9Å; Y238-D243 HydrophobicContact CD1-CB 3.48Å; Y238-D243 VanDerWaalsContact CD1-CB 3.48Å; Y238-D243 HydrophobicContact CE1-CB 4.09Å; Y238-D243 HydrophobicContact CG-CB 3.81Å; H240-D243 IonicContact CD2-OD2 3.37Å; H241-D243 VanDerWaalsContact C-N 3.35Å; H241-D243 PolarHBondContact O-N 3.17Å; D243-Q245 VanDerWaalsContact C-N 3.32Å; D243-Q245 PolarHBondContact O-N 2.79Å; D243-K246 PolarHBondContact O-N 3.18Å; D243-A247 WeakPolarHBondContact O-CB 3.45Å; D243-A247 PolarHBondContact O-N 3.03Å
244	A	90.9	Very high	91.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.2	-33	178.6	0	0	0	0	0	112.9	F190 V193 Y238 H241 V248	F190-A244 HydrophobicContact CD2-CB 4.06Å; F190-A244 HydrophobicContact CE2-CB 3.96Å; F190-A244 WeakPolarHBondContact O-CB 2.83Å; V193-A244 HydrophobicContact CG2-CB 3.74Å; Y238-A244 HydrophobicContact CD2-CB 3.61Å; Y238-A244 HydrophobicContact CE2-CB 4.31Å; Y238-A244 HydrophobicContact CG-CB 4.21Å; H241-A244 CarbonylContact O-C 3.57Å; H241-A244 WeakPolarHBondContact O-CB 3.24Å; H241-A244 PolarHBondContact O-N 3.49Å; H241-A244 VanDerWaalsContact O-N 3.14Å; A244-V248 WeakPolarHBondContact O-CG2 3.38Å; A244-V248 PolarHBondContact O-N 2.83Å
245	Q	91	Very high	90.8	Very high	61 Å²	61	57.5 Å²	57.5	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-72.4	-48.9	176.7	-173.3	61.2	41.3	0	0	110.7	F190 H241 E242 D243 A247 V248 D249	F190-Q245 VanDerWaalsContact CE1-OE1 3.22Å; F190-Q245 VanDerWaalsContact CZ-OE1 3.26Å; H241-Q245 WeakPolarHBondContact O-CB 3.34Å; H241-Q245 PolarHBondContact O-N 2.81Å; E242-Q245 PolarHBondContact O-N 2.83Å; D243-Q245 VanDerWaalsContact C-N 3.32Å; D243-Q245 PolarHBondContact O-N 2.79Å; Q245-A247 VanDerWaalsContact C-N 3.3Å; Q245-A247 PolarHBondContact O-N 3.4Å; Q245-V248 WeakPolarHBondContact O-CB 3.45Å; Q245-V248 PolarHBondContact O-N 2.66Å; Q245-D249 WeakPolarHBondContact CG-OD2 3Å; Q245-D249 PolarHBondContact NE2-OD1 2.87Å; Q245-D249 PolarHBondContact NE2-OD2 3Å; Q245-D249 PolarHBondContact O-N 3.14Å
246	K	92.3	Very high	90.1	Very high	109 Å²	109	55.6 Å²	55.6	47%	0.474	29%	0.285	S	S	.	.	H	α-helix	trans	-53.7	-46.6	172.9	-68.9	162.2	-170.6	166.1	0	111.5	E242 D243 V248 D249 E250	E242-K246 WeakPolarHBondContact O-CD 3.34Å; E242-K246 VanDerWaalsContact O-CG 3.25Å; E242-K246 WeakPolarHBondContact O-CG 3.24Å; E242-K246 PolarHBondContact O-N 2.83Å; D243-K246 PolarHBondContact O-N 3.18Å; K246-V248 VanDerWaalsContact C-N 3.28Å; K246-V248 PolarHBondContact O-N 3.05Å; K246-D249 PolarHBondContact O-N 3.44Å; K246-E250 WeakPolarHBondContact O-CB 3.44Å; K246-E250 PolarHBondContact O-N 2.87Å
247	A	92.8	Very high	88.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-31.4	177.5	0	0	0	0	0	113.4	F211 F214 Y238 D243 Q245 M251 V263	F211-A247 HydrophobicContact CD1-CB 4.24Å; F211-A247 HydrophobicContact CE1-CB 4.49Å; F214-A247 HydrophobicContact CB-CB 3.86Å; F214-A247 HydrophobicContact CD2-CB 4.02Å; F214-A247 HydrophobicContact CG-CB 3.95Å; Y238-A247 HydrophobicContact CE2-CB 3.87Å; Y238-A247 WeakPolarHBondContact OH-CB 3.48Å; D243-A247 WeakPolarHBondContact O-CB 3.45Å; D243-A247 PolarHBondContact O-N 3.03Å; Q245-A247 VanDerWaalsContact C-N 3.3Å; Q245-A247 PolarHBondContact O-N 3.4Å; A247-M251 VanDerWaalsContact O-CB 3.31Å; A247-M251 WeakPolarHBondContact O-CB 3.46Å; A247-M251 PolarHBondContact O-N 3.3Å; A247-V263 WeakPolarHBondContact O-CG1 3.48Å
248	V	92.6	Very high	88.1	Confident	18 Å²	18	62.3 Å²	62.3	11%	0.109	34%	0.337	C	S	.	.	H	α-helix	trans	-73.4	-52.5	172.9	166.7	0	0	0	0	110.5	F190 V193 A244 Q245 K246 E250 N252 V263	F190-V248 HydrophobicContact CE2-CG2 3.86Å; F190-V248 HydrophobicContact CZ-CB 4.48Å; F190-V248 HydrophobicContact CZ-CG2 3.94Å; V193-V248 HydrophobicContact CG1-CG2 3.96Å; V193-V248 HydrophobicContact CG2-CG2 4.18Å; A244-V248 WeakPolarHBondContact O-CG2 3.38Å; A244-V248 PolarHBondContact O-N 2.83Å; Q245-V248 WeakPolarHBondContact O-CB 3.45Å; Q245-V248 PolarHBondContact O-N 2.66Å; K246-V248 VanDerWaalsContact C-N 3.28Å; K246-V248 PolarHBondContact O-N 3.05Å; V248-E250 VanDerWaalsContact C-N 3.35Å; V248-E250 PolarHBondContact O-N 2.77Å; V248-N252 WeakPolarHBondContact O-CB 3.44Å; V248-N252 PolarHBondContact O-N 2.95Å; V248-V263 HydrophobicContact CG2-CG1 4.15Å
249	D	90.8	Very high	87.5	Confident	110 Å²	110	66.5 Å²	66.5	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-68.8	-32.3	-171.1	-63.8	-26.8	0	0	0	112.7	Q245 K246	Q245-D249 WeakPolarHBondContact CG-OD2 3Å; Q245-D249 PolarHBondContact NE2-OD1 2.87Å; Q245-D249 PolarHBondContact NE2-OD2 3Å; Q245-D249 PolarHBondContact O-N 3.14Å; K246-D249 PolarHBondContact O-N 3.44Å
250	E	91.4	Very high	87.5	Confident	107 Å²	107	68.6 Å²	68.6	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-93.4	-24.4	-178.2	-147.7	-152.1	115.2	0	0	114.3	F214 K246 V248 K254	F214-E250 HydrophobicContact CE1-CB 4.32Å; K246-E250 WeakPolarHBondContact O-CB 3.44Å; K246-E250 PolarHBondContact O-N 2.87Å; V248-E250 VanDerWaalsContact C-N 3.35Å; V248-E250 PolarHBondContact O-N 2.77Å; E250-K254 VanDerWaalsContact O-CD 3.26Å; E250-K254 WeakPolarHBondContact O-CD 3.43Å; E250-K254 WeakPolarHBondContact O-CE 3.38Å; E250-K254 PolarHBondContact O-NZ 3.1Å; E250-K254 IonicContact OE1-NZ 2.63Å; E250-K254 PolarHBondContact OE1-NZ 3.31Å
251	M	91.1	Very high	87.6	Confident	10 Å²	10	63.3 Å²	63.3	5%	0.049	34%	0.34	C	S	.	.	H	α-helix	trans	-104.8	-17.9	-177.8	-64.8	-68.6	-79.3	0	0	114.2	V210 F211 F214 A247 G253 K254 L256 I261 V263	V210-M251 HydrophobicContact CG1-CE 3.61Å; F211-M251 HydrophobicContact CE1-CB 4.05Å; F211-M251 HydrophobicContact CE1-CG 4.03Å; F211-M251 HydrophobicContact CE2-CE 4.24Å; F211-M251 HydrophobicContact CZ-CB 4.06Å; F211-M251 HydrophobicContact CZ-CE 4.03Å; F211-M251 HydrophobicContact CZ-CG 4.15Å; F214-M251 HydrophobicContact CD2-CG 4.44Å; F214-M251 HydrophobicContact CE1-CG 4.15Å; F214-M251 HydrophobicContact CE2-CE 4.45Å; F214-M251 HydrophobicContact CE2-CG 3.51Å; F214-M251 HydrophobicContact CE2-SD 4.01Å; F214-M251 HydrophobicContact CZ-CE 4.46Å; F214-M251 HydrophobicContact CZ-CG 3.35Å; F214-M251 HydrophobicContact CZ-SD 3.53Å; F214-M251 VanDerWaalsContact CZ-SD 3.53Å; A247-M251 VanDerWaalsContact O-CB 3.31Å; A247-M251 WeakPolarHBondContact O-CB 3.46Å; A247-M251 PolarHBondContact O-N 3.3Å; M251-G253 PolarHBondContact O-N 2.95Å; M251-K254 PolarHBondContact O-N 3.12Å; M251-K254 HydrophobicContact SD-CD 3.71Å; M251-L256 HydrophobicContact CE-CD1 4.33Å; M251-I261 HydrophobicContact CB-CD1 4.21Å; M251-I261 HydrophobicContact CE-CD1 4.01Å; M251-I261 WeakPolarHBondContact O-CD1 3.43Å; M251-I261 VanDerWaalsContact O-CG1 3.26Å; M251-I261 WeakPolarHBondContact O-CG1 3.17Å; M251-V263 HydrophobicContact CB-CG2 3.86Å
252	N	92.1	Very high	87.8	Confident	77 Å²	77	66.5 Å²	66.5	41%	0.412	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	115.8	178	-177.5	50.2	0	0	0	111.7	V248 Y262 V263	V248-N252 WeakPolarHBondContact O-CB 3.44Å; V248-N252 PolarHBondContact O-N 2.95Å; N252-Y262 WeakPolarHBondContact OD1-CD2 3.29Å; N252-V263 HydrophobicContact CB-CB 3.96Å; N252-V263 WeakPolarHBondContact CB-O 3.32Å; N252-V263 VanDerWaalsContact CG-O 3.25Å; N252-V263 PolarHBondContact OD1-N 2.84Å; N252-V263 PolarHBondContact OD1-O 3.02Å
253	G	86.8	Confident	87.9	Confident	47 Å²	47	60.5 Å²	60.5	49%	0.485	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.7	-6.6	179.8	0	0	0	0	0	115.3	M251 I261	M251-G253 PolarHBondContact O-N 2.95Å; G253-I261 WeakPolarHBondContact CA-O 3.44Å; G253-I261 PolarHBondContact N-O 3.22Å
254	K	88.4	Confident	87.8	Confident	84 Å²	84	59.8 Å²	59.8	37%	0.365	32%	0.32	S	S	.	.			trans	-65.6	157.9	169.2	-80.1	-176.1	179.6	155.2	0	111.1	E250 M251 T260 I261	E250-K254 VanDerWaalsContact O-CD 3.26Å; E250-K254 WeakPolarHBondContact O-CD 3.43Å; E250-K254 WeakPolarHBondContact O-CE 3.38Å; E250-K254 PolarHBondContact O-NZ 3.1Å; E250-K254 IonicContact OE1-NZ 2.63Å; E250-K254 PolarHBondContact OE1-NZ 3.31Å; M251-K254 PolarHBondContact O-N 3.12Å; M251-K254 HydrophobicContact SD-CD 3.71Å; K254-T260 CarbonylContact O-C 3.52Å; K254-T260 WeakPolarHBondContact O-CA 3.2Å; K254-I261 WeakPolarHBondContact O-CG1 3.43Å; K254-I261 PolarHBondContact O-N 3.35Å
255	E	85.5	Confident	87.7	Confident	134 Å²	134	63.4 Å²	63.4	63%	0.626	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.9	172.7	-64.4	-168.4	156.9	0	0	111.4	K259 T260	E255-K259 WeakPolarHBondContact CA-O 3.39Å; E255-T260 HydrophobicContact CG-CG2 3.66Å
256	L	77.3	Confident	87.4	Confident	37 Å²	37	61.6 Å²	61.6	19%	0.194	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.2	164.2	-65.3	-178.7	0	0	0	107.9	F202 M251 G258 K259 I261	F202-L256 HydrophobicContact CE1-CD1 4.42Å; F202-L256 HydrophobicContact CZ-CB 4.35Å; F202-L256 HydrophobicContact CZ-CD1 4.03Å; M251-L256 HydrophobicContact CE-CD1 4.33Å; L256-G258 PolarHBondContact O-N 3.02Å; L256-K259 PolarHBondContact N-O 2.84Å; L256-K259 PolarHBondContact O-N 3.1Å; L256-K259 VanDerWaalsContact O-O 3.12Å; L256-I261 HydrophobicContact CB-CG2 3.98Å; L256-I261 HydrophobicContact CD1-CD1 3.87Å; L256-I261 HydrophobicContact CD1-CG2 4.14Å; L256-I261 HydrophobicContact CG-CD1 4.24Å; L256-I261 HydrophobicContact CG-CG2 4.11Å
257	N	69.4	Low	86.9	Confident	111 Å²	111	58.5 Å²	58.5	59%	0.594	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	41.9	-178.5	-60.7	8	0	0	0	113.8	K259	N257-K259 VanDerWaalsContact C-N 3.27Å; N257-K259 PolarHBondContact O-N 3.09Å
258	G	75.9	Confident	86.1	Confident	68 Å²	68	66.4 Å²	66.4	70%	0.701	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	19.1	-179.1	0	0	0	0	0	114.9	L256	L256-G258 PolarHBondContact O-N 3.02Å
259	K	80.3	Confident	85.3	Confident	88 Å²	88	76.2 Å²	76.2	38%	0.383	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.2	177.9	-64.9	172.9	-176.4	168.6	0	109.8	N197 E255 L256 N257 I261	N197-K259 VanDerWaalsContact O-CB 3.29Å; N197-K259 WeakPolarHBondContact O-CB 3.32Å; E255-K259 WeakPolarHBondContact CA-O 3.39Å; L256-K259 PolarHBondContact N-O 2.84Å; L256-K259 PolarHBondContact O-N 3.1Å; L256-K259 VanDerWaalsContact O-O 3.12Å; N257-K259 VanDerWaalsContact C-N 3.27Å; N257-K259 PolarHBondContact O-N 3.09Å; K259-I261 PolarHBondContact O-N 3.46Å
260	T	88.5	Confident	84.4	Confident	76 Å²	76	77.8 Å²	77.8	47%	0.466	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	115.1	174	39.6	0	0	0	0	110.2	N197 K254 E255	N197-T260 WeakPolarHBondContact CB-O 3.39Å; N197-T260 PolarHBondContact ND2-O 2.79Å; K254-T260 CarbonylContact O-C 3.52Å; K254-T260 WeakPolarHBondContact O-CA 3.2Å; E255-T260 HydrophobicContact CG-CG2 3.66Å
261	I	92.1	Very high	83.6	Confident	3 Å²	3	75.8 Å²	75.8	2%	0.015	39%	0.385	C	S	.	.			trans	-82.4	144	-179.4	69.9	171.3	0	0	0	110.7	K196 F198 F211 M251 G253 K254 L256 K259 V263	K196-I261 WeakPolarHBondContact O-CA 3.29Å; F198-I261 HydrophobicContact CB-CG2 4.01Å; F211-I261 HydrophobicContact CZ-CD1 4.34Å; M251-I261 HydrophobicContact CB-CD1 4.21Å; M251-I261 HydrophobicContact CE-CD1 4.01Å; M251-I261 WeakPolarHBondContact O-CD1 3.43Å; M251-I261 VanDerWaalsContact O-CG1 3.26Å; M251-I261 WeakPolarHBondContact O-CG1 3.17Å; G253-I261 WeakPolarHBondContact CA-O 3.44Å; G253-I261 PolarHBondContact N-O 3.22Å; K254-I261 WeakPolarHBondContact O-CG1 3.43Å; K254-I261 PolarHBondContact O-N 3.35Å; L256-I261 HydrophobicContact CB-CG2 3.98Å; L256-I261 HydrophobicContact CD1-CD1 3.87Å; L256-I261 HydrophobicContact CD1-CG2 4.14Å; L256-I261 HydrophobicContact CG-CD1 4.24Å; L256-I261 HydrophobicContact CG-CG2 4.11Å; K259-I261 PolarHBondContact O-N 3.46Å; I261-V263 HydrophobicContact CD1-CG2 3.83Å; I261-V263 HydrophobicContact CG1-CG2 4.04Å
262	Y	91.8	Very high	82.7	Confident	111 Å²	111	79.2 Å²	79.2	44%	0.435	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.6	170.9	172.4	-99.6	0	0	0	109.4	Y194 I195 K196 N252	Y194-Y262 HydrophobicContact CD1-CD1 4.13Å; Y194-Y262 AromaticContact CD1-CE1 3.94Å; Y194-Y262 HydrophobicContact CD1-CE1 3.94Å; Y194-Y262 HydrophobicContact CE1-CD1 4.01Å; Y194-Y262 HydrophobicContact CE1-CE1 4.08Å; I195-Y262 CarbonylContact C-O 3.47Å; I195-Y262 WeakPolarHBondContact CA-O 3.18Å; K196-Y262 HydrophobicContact CB-CD1 4.41Å; K196-Y262 PolarHBondContact N-O 3.35Å; K196-Y262 PolarHBondContact O-N 2.88Å; N252-Y262 WeakPolarHBondContact OD1-CD2 3.29Å
263	V	92.4	Very high	81.6	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.006	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133	-178.8	-166.4	0	0	0	0	108.4	V193 Y194 I195 F211 A247 V248 M251 N252 I261	V193-V263 HydrophobicContact CG1-CG1 3.35Å; Y194-V263 WeakPolarHBondContact O-CA 3.26Å; I195-V263 HydrophobicContact CG1-CG1 4.38Å; I195-V263 HydrophobicContact CG2-CG2 4.21Å; F211-V263 HydrophobicContact CE1-CG1 4.2Å; F211-V263 HydrophobicContact CZ-CG2 4.3Å; A247-V263 WeakPolarHBondContact O-CG1 3.48Å; V248-V263 HydrophobicContact CG2-CG1 4.15Å; M251-V263 HydrophobicContact CB-CG2 3.86Å; N252-V263 HydrophobicContact CB-CB 3.96Å; N252-V263 WeakPolarHBondContact CB-O 3.32Å; N252-V263 VanDerWaalsContact CG-O 3.25Å; N252-V263 PolarHBondContact OD1-N 2.84Å; N252-V263 PolarHBondContact OD1-O 3.02Å; I261-V263 HydrophobicContact CD1-CG2 3.83Å; I261-V263 HydrophobicContact CG1-CG2 4.04Å
264	G	90.4	Very high	81	Confident	4 Å²	4	81 Å²	81	4%	0.041	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	176.1	-177.1	0	0	0	0	0	113.6	Y194 A266	Y194-G264 PolarHBondContact N-O 3.36Å; Y194-G264 PolarHBondContact O-N 3.49Å; G264-A266 PolarHBondContact O-N 2.7Å
265	R	89.4	Confident	80.5	Confident	75 Å²	75	80.1 Å²	80.1	28%	0.283	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55	131.4	177.6	-175.6	172.1	90	-154.9	2.8	111.5	F190 Q267 E271 E275	F190-R265 HydrophobicContact CB-CG 3.76Å; F190-R265 HydrophobicContact CD1-CB 4.03Å; F190-R265 HydrophobicContact CD1-CG 3.83Å; F190-R265 HydrophobicContact CD2-CB 4.27Å; F190-R265 HydrophobicContact CD2-CG 4.15Å; F190-R265 HydrophobicContact CE1-CB 4.23Å; F190-R265 HydrophobicContact CE2-CB 4.47Å; F190-R265 HydrophobicContact CG-CB 4.08Å; F190-R265 HydrophobicContact CG-CG 3.63Å; F190-R265 HydrophobicContact CZ-CB 4.46Å; R265-Q267 PolarHBondContact O-N 2.88Å; R265-E271 IonicContact CZ-OE1 3.64Å; R265-E271 IonicContact NE-OE1 3.14Å; R265-E271 IonicContact NH2-OE1 2.67Å; R265-E271 PolarHBondContact NH2-OE1 2.93Å; R265-E275 IonicContact NH2-OE1 2.7Å
266	A	85.1	Confident	80	Confident	24 Å²	24	78.3 Å²	78.3	20%	0.198	39%	0.391	C	S	.	.			trans	-72.7	87.8	172.9	0	0	0	0	0	111.5	N192 F235 G264	N192-A266 HydrophobicContact CB-CB 3.69Å; N192-A266 VanDerWaalsContact O-CB 3.29Å; N192-A266 WeakPolarHBondContact O-CB 3.43Å; N192-A266 PolarHBondContact O-N 2.67Å; F235-A266 HydrophobicContact CD1-CB 3.92Å; F235-A266 HydrophobicContact CE1-CB 4.13Å; G264-A266 PolarHBondContact O-N 2.7Å
267	Q	80.1	Confident	80.1	Confident	44 Å²	44	82.8 Å²	82.8	21%	0.206	41%	0.409	C	S	.	.			trans	-72.3	144.7	175	-62.3	177.9	-39.5	0	0	112.1	R265 E271 R272 E275	R265-Q267 PolarHBondContact O-N 2.88Å; Q267-E271 WeakPolarHBondContact CA-OE2 3.47Å; Q267-E271 HydrophobicContact CB-CG 4.42Å; Q267-R272 HydrophobicContact CB-CB 4.08Å; Q267-E275 PolarHBondContact NE2-OE1 3.16Å; Q267-E275 PolarHBondContact NE2-OE2 3.45Å
268	K	77.4	Confident	80.5	Confident	165 Å²	165	86.7 Å²	86.7	72%	0.717	42%	0.415	S	S	*	.			trans	-69.5	150.7	170.4	-67.6	-177.4	179.6	178.8	0	110.5	L270 E271 R272	K268-L270 VanDerWaalsContact C-N 3.27Å; K268-L270 PolarHBondContact O-N 3.37Å; K268-E271 HydrophobicContact CB-CB 4.23Å; K268-E271 PolarHBondContact N-OE2 3.03Å; K268-E271 WeakPolarHBondContact O-CB 3.22Å; K268-E271 PolarHBondContact O-N 3.45Å; K268-E271 VanDerWaalsContact O-N 3.13Å; K268-R272 PolarHBondContact O-N 3.17Å
269	R	74.3	Confident	80.7	Confident	224 Å²	224	89.2 Å²	89.2	85%	0.845	41%	0.407	S	S	*	.	H	α-helix	trans	-53.3	-41.6	-177.1	-176.2	176.5	176.6	176.5	-0.5	113.3	Q273	R269-Q273 WeakPolarHBondContact O-CB 3.28Å; R269-Q273 PolarHBondContact O-N 3.4Å
270	L	72.3	Confident	80.6	Confident	144 Å²	144	91.3 Å²	91.3	75%	0.754	42%	0.416	S	S	*	.	H	α-helix	trans	-70.9	-42	179.4	-175.1	65.2	0	0	0	112.7	K268 Q273 G274	K268-L270 VanDerWaalsContact C-N 3.27Å; K268-L270 PolarHBondContact O-N 3.37Å; L270-Q273 PolarHBondContact O-N 3.07Å; L270-G274 PolarHBondContact O-N 2.57Å
271	E	74.6	Confident	80.1	Confident	64 Å²	64	91.6 Å²	91.6	30%	0.299	42%	0.415	S	S	.	.	H	α-helix	trans	-59.7	-53.7	175.2	173.6	-163.5	169.5	0	0	110.3	R265 Q267 K268 Q273 G274 E275	R265-E271 IonicContact CZ-OE1 3.64Å; R265-E271 IonicContact NE-OE1 3.14Å; R265-E271 IonicContact NH2-OE1 2.67Å; R265-E271 PolarHBondContact NH2-OE1 2.93Å; Q267-E271 WeakPolarHBondContact CA-OE2 3.47Å; Q267-E271 HydrophobicContact CB-CG 4.42Å; K268-E271 HydrophobicContact CB-CB 4.23Å; K268-E271 PolarHBondContact N-OE2 3.03Å; K268-E271 WeakPolarHBondContact O-CB 3.22Å; K268-E271 PolarHBondContact O-N 3.45Å; K268-E271 VanDerWaalsContact O-N 3.13Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; E271-Q273 PolarHBondContact O-N 3.35Å; E271-G274 PolarHBondContact O-N 2.92Å; E271-G274 VanDerWaalsContact O-N 3.09Å; E271-E275 PolarHBondContact O-N 3.2Å
272	R	72.2	Confident	79.5	Confident	82 Å²	82	97 Å²	97	31%	0.309	44%	0.44	S	S	.	.	H	α-helix	trans	-57.2	-42.4	176	-179	175	-74.7	177.2	-4.8	112	Q267 K268 G274 L276	Q267-R272 HydrophobicContact CB-CB 4.08Å; K268-R272 PolarHBondContact O-N 3.17Å; R272-G274 VanDerWaalsContact C-N 3.35Å; R272-L276 WeakPolarHBondContact O-CB 3.44Å; R272-L276 PolarHBondContact O-N 3.02Å
273	Q	69.9	Low	79	Confident	129 Å²	129	96.8 Å²	96.8	60%	0.603	45%	0.445	S	S	*	.	H	α-helix	trans	-66.2	-37.1	177.3	-170.6	174.5	12.8	0	0	112.1	R269 L270 E271 K277	R269-Q273 WeakPolarHBondContact O-CB 3.28Å; R269-Q273 PolarHBondContact O-N 3.4Å; L270-Q273 PolarHBondContact O-N 3.07Å; E271-Q273 VanDerWaalsContact C-N 3.32Å; E271-Q273 PolarHBondContact O-N 3.35Å; Q273-K277 VanDerWaalsContact O-CB 3.24Å; Q273-K277 WeakPolarHBondContact O-CB 3.48Å; Q273-K277 PolarHBondContact O-N 3.49Å
274	G	74.6	Confident	78.5	Confident	34 Å²	34	101.5 Å²	101.5	35%	0.351	47%	0.466	S	S	.	.	H	α-helix	trans	-66.6	-46.7	174.7	0	0	0	0	0	113.1	L270 E271 R272 R278	L270-G274 PolarHBondContact O-N 2.57Å; E271-G274 PolarHBondContact O-N 2.92Å; E271-G274 VanDerWaalsContact O-N 3.09Å; R272-G274 VanDerWaalsContact C-N 3.35Å; G274-R278 WeakPolarHBondContact O-CG 3.41Å; G274-R278 PolarHBondContact O-N 2.98Å
275	E	76.6	Confident	77.8	Confident	64 Å²	64	106.5 Å²	106.5	30%	0.299	49%	0.488	S	S	.	.	H	α-helix	trans	-64.1	-45.1	174.9	-75.7	-171.6	-165.5	0	0	112.5	R265 Q267 E271 K277 R278 K279	R265-E275 IonicContact NH2-OE1 2.7Å; Q267-E275 PolarHBondContact NE2-OE1 3.16Å; Q267-E275 PolarHBondContact NE2-OE2 3.45Å; E271-E275 PolarHBondContact O-N 3.2Å; E275-K277 VanDerWaalsContact C-N 3.32Å; E275-K277 PolarHBondContact O-N 3.19Å; E275-R278 WeakPolarHBondContact O-CB 3.22Å; E275-R278 PolarHBondContact O-N 2.6Å; E275-R278 VanDerWaalsContact O-N 3.17Å; E275-K279 PolarHBondContact O-N 3.47Å
276	L	74.9	Confident	77.5	Confident	97 Å²	97	106.5 Å²	106.5	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-39.1	-179.9	-159.2	75.1	0	0	0	110.6	R272 K279 F280	R272-L276 WeakPolarHBondContact O-CB 3.44Å; R272-L276 PolarHBondContact O-N 3.02Å; L276-K279 PolarHBondContact O-N 2.84Å; L276-F280 HydrophobicContact CD2-CE2 4.01Å; L276-F280 HydrophobicContact CG-CD2 4.04Å; L276-F280 HydrophobicContact CG-CE2 3.83Å; L276-F280 VanDerWaalsContact O-CD2 3.23Å; L276-F280 WeakPolarHBondContact O-CD2 3.28Å; L276-F280 PolarHBondContact O-N 3.37Å
277	K	79.5	Confident	77.2	Confident	131 Å²	131	113.3 Å²	113.3	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-59.2	-49	170	178.7	175.9	175.8	-175.2	0	111.3	Q273 E275 K279 F280 D281	Q273-K277 VanDerWaalsContact O-CB 3.24Å; Q273-K277 WeakPolarHBondContact O-CB 3.48Å; Q273-K277 PolarHBondContact O-N 3.49Å; E275-K277 VanDerWaalsContact C-N 3.32Å; E275-K277 PolarHBondContact O-N 3.19Å; K277-K279 VanDerWaalsContact C-N 3.32Å; K277-K279 PolarHBondContact O-N 2.99Å; K277-F280 PolarHBondContact O-N 2.83Å; K277-F280 VanDerWaalsContact O-N 3.16Å; K277-D281 WeakPolarHBondContact CE-OD2 3.28Å; K277-D281 WeakPolarHBondContact CG-OD2 3.4Å; K277-D281 WeakPolarHBondContact O-CB 3.48Å; K277-D281 PolarHBondContact O-N 2.69Å
278	R	79.1	Confident	77	Confident	192 Å²	192	113.6 Å²	113.6	73%	0.725	52%	0.516	S	S	*	.	H	α-helix	trans	-57.3	-42.9	176.9	-75.3	174.8	178.8	-179.3	-0.3	112.2	G274 E275 D281 Q282	G274-R278 WeakPolarHBondContact O-CG 3.41Å; G274-R278 PolarHBondContact O-N 2.98Å; E275-R278 WeakPolarHBondContact O-CB 3.22Å; E275-R278 PolarHBondContact O-N 2.6Å; E275-R278 VanDerWaalsContact O-N 3.17Å; R278-D281 PolarHBondContact O-N 3.22Å; R278-Q282 VanDerWaalsContact O-CB 3.26Å; R278-Q282 WeakPolarHBondContact O-CB 3.23Å; R278-Q282 PolarHBondContact O-N 3.01Å
279	K	79.5	Confident	77.2	Confident	122 Å²	122	112.1 Å²	112.1	53%	0.53	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-40.2	175.7	-73.6	-179.5	175.9	177.8	0	112.3	E275 L276 K277 Q282 I283	E275-K279 PolarHBondContact O-N 3.47Å; L276-K279 PolarHBondContact O-N 2.84Å; K277-K279 VanDerWaalsContact C-N 3.32Å; K277-K279 PolarHBondContact O-N 2.99Å; K279-Q282 PolarHBondContact O-N 2.82Å; K279-I283 WeakPolarHBondContact O-CB 3.35Å; K279-I283 WeakPolarHBondContact O-CD1 3.07Å; K279-I283 VanDerWaalsContact O-CG1 3.23Å; K279-I283 WeakPolarHBondContact O-CG1 3.47Å; K279-I283 PolarHBondContact O-N 2.84Å
280	F	77.1	Confident	77.4	Confident	132 Å²	132	110.2 Å²	110.2	58%	0.579	51%	0.505	S	S	*	.	H	α-helix	trans	-67.8	-41.5	173.9	-84.5	-61.7	0	0	0	113.1	L276 K277 Q282 I283 K284	L276-F280 HydrophobicContact CD2-CE2 4.01Å; L276-F280 HydrophobicContact CG-CD2 4.04Å; L276-F280 HydrophobicContact CG-CE2 3.83Å; L276-F280 VanDerWaalsContact O-CD2 3.23Å; L276-F280 WeakPolarHBondContact O-CD2 3.28Å; L276-F280 PolarHBondContact O-N 3.37Å; K277-F280 PolarHBondContact O-N 2.83Å; K277-F280 VanDerWaalsContact O-N 3.16Å; F280-Q282 VanDerWaalsContact C-N 3.33Å; F280-I283 PolarHBondContact O-N 3.45Å; F280-K284 VanDerWaalsContact O-CB 3.24Å; F280-K284 WeakPolarHBondContact O-CB 3.39Å; F280-K284 PolarHBondContact O-N 2.84Å
281	D	79.2	Confident	77.8	Confident	82 Å²	82	108.1 Å²	108.1	44%	0.439	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-39	175.6	-71.9	-26.8	0	0	0	110.5	K277 R278 K284 Q285	K277-D281 WeakPolarHBondContact CE-OD2 3.28Å; K277-D281 WeakPolarHBondContact CG-OD2 3.4Å; K277-D281 WeakPolarHBondContact O-CB 3.48Å; K277-D281 PolarHBondContact O-N 2.69Å; R278-D281 PolarHBondContact O-N 3.22Å; D281-K284 WeakPolarHBondContact O-CB 3.47Å; D281-K284 PolarHBondContact O-N 3.12Å; D281-Q285 WeakPolarHBondContact O-CB 3.34Å; D281-Q285 PolarHBondContact O-N 3.07Å
282	Q	79.6	Confident	78.1	Confident	116 Å²	116	111.6 Å²	111.6	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-51.6	173.5	-173.5	170.8	15.2	0	0	112.1	R278 K279 F280 K284 Q285 D286	R278-Q282 VanDerWaalsContact O-CB 3.26Å; R278-Q282 WeakPolarHBondContact O-CB 3.23Å; R278-Q282 PolarHBondContact O-N 3.01Å; K279-Q282 PolarHBondContact O-N 2.82Å; F280-Q282 VanDerWaalsContact C-N 3.33Å; Q282-K284 PolarHBondContact O-N 3Å; Q282-Q285 CarbonylContact O-C 3.56Å; Q282-Q285 WeakPolarHBondContact O-CA 3.05Å; Q282-Q285 WeakPolarHBondContact O-CB 3.48Å; Q282-Q285 PolarHBondContact O-N 2.97Å; Q282-D286 PolarHBondContact O-N 2.79Å
283	I	80.8	Confident	78.6	Confident	107 Å²	107	108.9 Å²	108.9	55%	0.549	50%	0.502	S	S	.	.	H	α-helix	trans	-59.2	-34.5	175.3	-68.4	162.6	0	0	0	111.2	K279 F280 R287	K279-I283 WeakPolarHBondContact O-CB 3.35Å; K279-I283 WeakPolarHBondContact O-CD1 3.07Å; K279-I283 VanDerWaalsContact O-CG1 3.23Å; K279-I283 WeakPolarHBondContact O-CG1 3.47Å; K279-I283 PolarHBondContact O-N 2.84Å; F280-I283 PolarHBondContact O-N 3.45Å; I283-R287 VanDerWaalsContact O-CB 3.24Å; I283-R287 WeakPolarHBondContact O-CB 3.41Å; I283-R287 PolarHBondContact O-N 3.47Å; I283-R287 VanDerWaalsContact O-N 3.12Å
284	K	81.8	Confident	79.5	Confident	99 Å²	99	103.5 Å²	103.5	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-40.5	172.4	-174.7	179.1	-179.3	179.7	0	111.2	F280 D281 Q282 R287 I288 E372	F280-K284 VanDerWaalsContact O-CB 3.24Å; F280-K284 WeakPolarHBondContact O-CB 3.39Å; F280-K284 PolarHBondContact O-N 2.84Å; D281-K284 WeakPolarHBondContact O-CB 3.47Å; D281-K284 PolarHBondContact O-N 3.12Å; Q282-K284 PolarHBondContact O-N 3Å; K284-R287 CarbonylContact O-C 3.56Å; K284-I288 HydrophobicContact CG-CD1 4.43Å; K284-I288 VanDerWaalsContact O-CG1 3.3Å; K284-I288 WeakPolarHBondContact O-CG1 3.09Å; K284-I288 PolarHBondContact O-N 2.51Å; K284-E372 IonicContact NZ-OE2 3.85Å
285	Q	76.5	Confident	80.4	Confident	110 Å²	110	103.5 Å²	103.5	51%	0.514	47%	0.469	S	S	.	.	H	α-helix	trans	-70.6	-46.8	179.1	-166.5	69.4	4.2	0	0	112.4	D281 Q282 R287 I288 Q289	D281-Q285 WeakPolarHBondContact O-CB 3.34Å; D281-Q285 PolarHBondContact O-N 3.07Å; Q282-Q285 CarbonylContact O-C 3.56Å; Q282-Q285 WeakPolarHBondContact O-CA 3.05Å; Q282-Q285 WeakPolarHBondContact O-CB 3.48Å; Q282-Q285 PolarHBondContact O-N 2.97Å; Q285-R287 PolarHBondContact O-N 2.76Å; Q285-I288 CarbonylContact O-C 3.54Å; Q285-I288 WeakPolarHBondContact O-CA 3.33Å; Q285-I288 VanDerWaalsContact O-CB 3.31Å; Q285-I288 WeakPolarHBondContact O-CB 3.46Å; Q285-I288 PolarHBondContact O-N 3.22Å; Q285-Q289 PolarHBondContact O-N 3.38Å
286	D	81.9	Confident	81.2	Confident	74 Å²	74	100.4 Å²	100.4	40%	0.396	46%	0.455	S	S	.	.	H	α-helix	trans	-58.7	-38.9	174.9	-56.7	-19.8	0	0	0	110.4	Q282 I288 Q289 R290	Q282-D286 PolarHBondContact O-N 2.79Å; D286-I288 VanDerWaalsContact C-N 3.34Å; D286-Q289 PolarHBondContact O-N 2.86Å; D286-R290 VanDerWaalsContact O-CB 3.22Å; D286-R290 WeakPolarHBondContact O-CB 3.37Å; D286-R290 PolarHBondContact O-N 2.92Å
287	R	78.6	Confident	82.1	Confident	167 Å²	167	97.6 Å²	97.6	63%	0.63	44%	0.438	S	S	*	.	H	α-helix	trans	-75.6	-14.9	172.9	-164.4	178.9	177.9	-161.7	0.7	113.7	I283 K284 Q285 Y291 R370	I283-R287 VanDerWaalsContact O-CB 3.24Å; I283-R287 WeakPolarHBondContact O-CB 3.41Å; I283-R287 PolarHBondContact O-N 3.47Å; I283-R287 VanDerWaalsContact O-N 3.12Å; K284-R287 CarbonylContact O-C 3.56Å; Q285-R287 PolarHBondContact O-N 2.76Å; R287-Y291 HydrophobicContact CG-CD2 4.08Å; R287-Y291 HydrophobicContact CG-CE2 3.98Å; R287-Y291 WeakPolarHBondContact O-CD2 3.14Å; R287-R370 VanDerWaalsContact C-NH2 3.35Å; R287-R370 PolarHBondContact O-NH2 3.44Å
288	I	77.6	Confident	82.8	Confident	50 Å²	50	91.4 Å²	91.4	26%	0.256	41%	0.411	S	S	.	.	H	α-helix	trans	-75.9	-57.6	165.1	-72.5	160.1	0	0	0	107.9	K284 Q285 D286 R290 Y291 Q292	K284-I288 HydrophobicContact CG-CD1 4.43Å; K284-I288 VanDerWaalsContact O-CG1 3.3Å; K284-I288 WeakPolarHBondContact O-CG1 3.09Å; K284-I288 PolarHBondContact O-N 2.51Å; Q285-I288 CarbonylContact O-C 3.54Å; Q285-I288 WeakPolarHBondContact O-CA 3.33Å; Q285-I288 VanDerWaalsContact O-CB 3.31Å; Q285-I288 WeakPolarHBondContact O-CB 3.46Å; Q285-I288 PolarHBondContact O-N 3.22Å; D286-I288 VanDerWaalsContact C-N 3.34Å; I288-R290 PolarHBondContact O-N 3.41Å; I288-Y291 CarbonylContact O-C 3.48Å; I288-Y291 PolarHBondContact O-N 2.63Å; I288-Y291 VanDerWaalsContact O-N 3.09Å; I288-Q292 PolarHBondContact O-N 2.85Å; I288-Q292 VanDerWaalsContact O-N 3.08Å
289	Q	80.3	Confident	83.4	Confident	135 Å²	135	87.2 Å²	87.2	63%	0.631	40%	0.398	S	S	*	.	H	α-helix	trans	-59.7	-44.2	-173.1	-166.2	171.4	7.1	0	0	112.7	Q285 D286 Y291 Q292	Q285-Q289 PolarHBondContact O-N 3.38Å; D286-Q289 PolarHBondContact O-N 2.86Å; Q289-Y291 PolarHBondContact O-N 3.36Å; Q289-Y291 VanDerWaalsContact O-N 3.13Å; Q289-Q292 WeakPolarHBondContact O-CB 3.47Å; Q289-Q292 PolarHBondContact O-N 3.31Å
290	R	79.9	Confident	84	Confident	184 Å²	184	84.7 Å²	84.7	69%	0.694	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.8	177.2	-174.2	-178.2	-61.1	-169.9	0.1	114.2	D286 I288 V294	D286-R290 VanDerWaalsContact O-CB 3.22Å; D286-R290 WeakPolarHBondContact O-CB 3.37Å; D286-R290 PolarHBondContact O-N 2.92Å; I288-R290 PolarHBondContact O-N 3.41Å; R290-V294 VanDerWaalsContact O-CG2 3.25Å; R290-V294 WeakPolarHBondContact O-CG2 3.22Å
291	Y	79.2	Confident	84.7	Confident	100 Å²	100	78.5 Å²	78.5	39%	0.392	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	6.9	-178.2	-64.2	-59.8	0	0	0	113.3	R287 I288 Q289	R287-Y291 HydrophobicContact CG-CD2 4.08Å; R287-Y291 HydrophobicContact CG-CE2 3.98Å; R287-Y291 WeakPolarHBondContact O-CD2 3.14Å; I288-Y291 CarbonylContact O-C 3.48Å; I288-Y291 PolarHBondContact O-N 2.63Å; I288-Y291 VanDerWaalsContact O-N 3.09Å; Q289-Y291 PolarHBondContact O-N 3.36Å; Q289-Y291 VanDerWaalsContact O-N 3.13Å
292	Q	81.1	Confident	85.2	Confident	137 Å²	137	76.1 Å²	76.1	64%	0.64	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	128.7	178.2	-171.6	169.8	-5.8	0	0	109.6	I288 Q289 V294	I288-Q292 PolarHBondContact O-N 2.85Å; I288-Q292 VanDerWaalsContact O-N 3.08Å; Q289-Q292 WeakPolarHBondContact O-CB 3.47Å; Q289-Q292 PolarHBondContact O-N 3.31Å; Q292-V294 PolarHBondContact O-N 3.2Å
293	G	82.5	Confident	85.5	Confident	25 Å²	25	75.4 Å²	75.4	26%	0.258	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	-34	-177.1	0	0	0	0	0	115.5	A346 L367	G293-A346 VanDerWaalsContact O-CB 3.3Å; G293-A346 WeakPolarHBondContact O-CB 3.44Å; G293-L367 VanDerWaalsContact O-CD2 3.3Å; G293-L367 WeakPolarHBondContact O-CD2 3.17Å
294	V	90.4	Very high	85.7	Confident	15 Å²	15	72.4 Å²	72.4	9%	0.091	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-21	-175.7	-59.7	0	0	0	0	115.2	R290 Q292 C339 F340 P343	R290-V294 VanDerWaalsContact O-CG2 3.25Å; R290-V294 WeakPolarHBondContact O-CG2 3.22Å; Q292-V294 PolarHBondContact O-N 3.2Å; V294-C339 WeakPolarHBondContact O-CA 3.38Å; V294-F340 PolarHBondContact O-N 2.85Å; V294-P343 HydrophobicContact CG1-CB 4.32Å
295	N	92.6	Very high	86	Confident	34 Å²	34	67.9 Å²	67.9	18%	0.182	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.7	-175.4	-172.9	38.1	0	0	0	111.7	C339 A368	N295-C339 HydrophobicContact CB-CB 4.4Å; N295-A368 HydrophobicContact CB-CB 4.21Å; N295-A368 WeakPolarHBondContact ND2-CB 3.06Å; N295-A368 WeakPolarHBondContact O-CB 3.34Å; N295-A368 PolarHBondContact O-N 3.39Å
296	L	92.8	Very high	86.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	146.6	179.5	-54.8	-169.3	0	0	0	111.7	F314 F337 V338 F340 A346 A349 V350 V365 A366 L367	L296-F314 HydrophobicContact CD1-CE1 4.47Å; L296-F337 WeakPolarHBondContact O-CA 3.21Å; L296-V338 WeakPolarHBondContact CB-O 3.33Å; L296-V338 PolarHBondContact N-O 2.89Å; L296-V338 PolarHBondContact O-N 3.22Å; L296-F340 HydrophobicContact CD1-CD2 4.25Å; L296-F340 HydrophobicContact CD1-CE2 3.77Å; L296-F340 HydrophobicContact CG-CD2 4.41Å; L296-F340 HydrophobicContact CG-CE2 4.34Å; L296-A346 HydrophobicContact CD2-CB 3.95Å; L296-A346 HydrophobicContact CG-CB 4.35Å; L296-A349 HydrophobicContact CD1-CB 3.78Å; L296-V350 HydrophobicContact CD1-CG2 3.99Å; L296-V350 HydrophobicContact CD2-CG2 3.45Å; L296-V350 VanDerWaalsContact CD2-CG2 3.45Å; L296-V350 HydrophobicContact CG-CG2 4.34Å; L296-V365 HydrophobicContact CB-CG1 4.39Å; L296-V365 HydrophobicContact CD1-CG1 3.79Å; L296-A366 CarbonylContact C-O 3.51Å; L296-A366 WeakPolarHBondContact CA-O 3.45Å; L296-L367 HydrophobicContact CD2-CD2 3.77Å
297	Y	93.7	Very high	87.3	Confident	38 Å²	38	67.4 Å²	67.4	15%	0.149	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.6	167.6	173	-104.3	0	0	0	108.2	K299 F335 F337 Y364 A366	Y297-K299 HydrophobicContact CD1-CB 4.46Å; Y297-K299 HydrophobicContact CE1-CB 3.69Å; Y297-K299 HydrophobicContact CE1-CD 4.37Å; Y297-K299 HydrophobicContact CE1-CG 4.15Å; Y297-K299 WeakPolarHBondContact OH-CG 3.37Å; Y297-F335 HydrophobicContact CD2-CD2 4.23Å; Y297-F335 HydrophobicContact CE2-CB 4.12Å; Y297-F335 AromaticContact CE2-CD2 3.44Å; Y297-F335 HydrophobicContact CE2-CD2 3.44Å; Y297-F335 VanDerWaalsContact CE2-CD2 3.44Å; Y297-F335 AromaticContact CE2-CE2 3.98Å; Y297-F335 HydrophobicContact CE2-CE2 3.98Å; Y297-F335 AromaticContact CE2-CG 3.93Å; Y297-F335 HydrophobicContact CE2-CG 3.93Å; Y297-F337 HydrophobicContact CD2-CD1 4.34Å; Y297-F337 AromaticContact CD2-CE1 3.71Å; Y297-F337 HydrophobicContact CD2-CE1 3.71Å; Y297-F337 AromaticContact CD2-CZ 3.97Å; Y297-F337 HydrophobicContact CD2-CZ 3.97Å; Y297-F337 HydrophobicContact CG-CE1 4.48Å; Y297-Y364 HydrophobicContact CD1-CD1 4.41Å; Y297-Y364 HydrophobicContact CD1-CE1 4.24Å; Y297-Y364 HydrophobicContact CE1-CD1 4.37Å; Y297-Y364 HydrophobicContact CE1-CE1 4.35Å; Y297-A366 PolarHBondContact N-O 2.92Å; Y297-A366 PolarHBondContact O-N 3.36Å; Y297-A366 VanDerWaalsContact O-N 3.12Å
298	V	94	Very high	87.9	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.5	178.7	-174.2	0	0	0	0	108.1	L301 L310 F314 F335 G336 V338 L363 Y364 V365	V298-L301 HydrophobicContact CG1-CD2 3.61Å; V298-L301 HydrophobicContact CG1-CG 4.22Å; V298-L310 HydrophobicContact CG1-CD1 4.31Å; V298-F314 HydrophobicContact CB-CZ 4.47Å; V298-F314 HydrophobicContact CG1-CE2 4.24Å; V298-F314 HydrophobicContact CG1-CZ 4Å; V298-F314 HydrophobicContact CG2-CE1 3.99Å; V298-F314 HydrophobicContact CG2-CE2 4.17Å; V298-F314 HydrophobicContact CG2-CZ 3.58Å; V298-F335 CarbonylContact O-C 3.58Å; V298-F335 WeakPolarHBondContact O-CA 3.32Å; V298-F335 VanDerWaalsContact O-CB 3.3Å; V298-F335 WeakPolarHBondContact O-CB 3.37Å; V298-G336 PolarHBondContact N-O 3.5Å; V298-G336 PolarHBondContact O-N 2.95Å; V298-V338 HydrophobicContact CG2-CG2 4.04Å; V298-L363 HydrophobicContact CG1-CD1 4.16Å; V298-Y364 CarbonylContact C-O 3.57Å; V298-Y364 WeakPolarHBondContact CA-O 3.36Å; V298-V365 HydrophobicContact CG1-CG2 4.28Å; V298-V365 HydrophobicContact CG2-CG1 4.39Å; V298-V365 HydrophobicContact CG2-CG2 4.43Å
299	K	92.9	Very high	88.6	Confident	105 Å²	105	70.3 Å²	70.3	46%	0.457	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	163.8	179.7	-158.1	-155	170.7	-164.2	0	110.3	Y297 G334 F335 Y364	Y297-K299 HydrophobicContact CD1-CB 4.46Å; Y297-K299 HydrophobicContact CE1-CB 3.69Å; Y297-K299 HydrophobicContact CE1-CD 4.37Å; Y297-K299 HydrophobicContact CE1-CG 4.15Å; Y297-K299 WeakPolarHBondContact OH-CG 3.37Å; K299-G334 CarbonylContact C-O 3.46Å; K299-F335 HydrophobicContact CB-CB 4.21Å; K299-F335 HydrophobicContact CG-CB 3.91Å; K299-Y364 HydrophobicContact CB-CD1 4.05Å; K299-Y364 PolarHBondContact N-O 3.21Å; K299-Y364 PolarHBondContact O-N 3.29Å
300	N	91.1	Very high	89.2	Confident	69 Å²	69	64 Å²	64	37%	0.369	31%	0.313	S	S	.	.	S	Bend	trans	65.2	32	-175.5	-149.2	48.8	0	0	0	111.9	G334 K361 P362	N300-G334 PolarHBondContact N-O 2.94Å; N300-K361 WeakPolarHBondContact O-CB 3.46Å; N300-P362 WeakPolarHBondContact CB-O 3.34Å; N300-P362 PolarHBondContact ND2-O 3.11Å
301	L	91.6	Very high	89.9	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	30%	0.3	C	S	.	.			trans	-59.2	144.2	165.3	-64	176.5	0	0	0	109	V298 I305 L310 V325 G334 L363	V298-L301 HydrophobicContact CG1-CD2 3.61Å; V298-L301 HydrophobicContact CG1-CG 4.22Å; L301-I305 HydrophobicContact CB-CD1 4.41Å; L301-I305 HydrophobicContact CD2-CD1 4.19Å; L301-I305 HydrophobicContact CD2-CG2 4.28Å; L301-L310 HydrophobicContact CD1-CD2 4.46Å; L301-L310 HydrophobicContact CD2-CD1 3.89Å; L301-V325 HydrophobicContact CD1-CG1 4.09Å; L301-V325 HydrophobicContact CD1-CG2 3.97Å; L301-G334 PolarHBondContact N-O 3.5Å; L301-G334 VanDerWaalsContact N-O 3.09Å; L301-L363 HydrophobicContact CD2-CD2 3.92Å
302	D	89.8	Confident	90.6	Very high	32 Å²	32	63.6 Å²	63.6	17%	0.171	32%	0.315	C	S	.	.			trans	-74.1	154.7	166.3	-170.7	-115.9	0	0	0	111.9	G304 I305 A359 T360 K361	D302-G304 PolarHBondContact O-N 2.85Å; D302-I305 HydrophobicContact CB-CD1 4.03Å; D302-I305 HydrophobicContact CB-CG1 4.08Å; D302-I305 WeakPolarHBondContact O-CB 3.39Å; D302-I305 WeakPolarHBondContact O-CG1 3.49Å; D302-I305 PolarHBondContact O-N 2.86Å; D302-A359 HydrophobicContact CB-CB 4.14Å; D302-T360 PolarHBondContact OD2-OG1 3.29Å; D302-T360 VanDerWaalsContact OD2-OG1 3.11Å; D302-K361 HydrophobicContact CB-CD 4.11Å; D302-K361 VanDerWaalsContact OD2-CE 3.24Å; D302-K361 WeakPolarHBondContact OD2-CE 3.33Å; D302-K361 IonicContact OD2-NZ 2.63Å; D302-K361 PolarHBondContact OD2-NZ 3.25Å
303	D	85.9	Confident	91.2	Very high	100 Å²	100	59.5 Å²	59.5	54%	0.535	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-18.8	-165.2	-49.8	-51.4	0	0	0	111.4	K361	D303-K361 VanDerWaalsContact CG-NZ 3.32Å; D303-K361 IonicContact OD1-NZ 2.7Å; D303-K361 PolarHBondContact OD1-NZ 3.34Å; D303-K361 IonicContact OD2-NZ 2.72Å; D303-K361 PolarHBondContact OD2-NZ 3.25Å
304	G	85.1	Confident	91.7	Very high	45 Å²	45	58.3 Å²	58.3	46%	0.464	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	16.9	167.8	0	0	0	0	0	115.6	D302	D302-G304 PolarHBondContact O-N 2.85Å
305	I	89.3	Confident	91.9	Very high	3 Å²	3	60.3 Å²	60.3	2%	0.015	30%	0.299	C	S	.	.			trans	-98.1	105.9	173.2	-55.6	-179.5	0	0	0	110	L301 D302 R309 L310 V358	L301-I305 HydrophobicContact CB-CD1 4.41Å; L301-I305 HydrophobicContact CD2-CD1 4.19Å; L301-I305 HydrophobicContact CD2-CG2 4.28Å; D302-I305 HydrophobicContact CB-CD1 4.03Å; D302-I305 HydrophobicContact CB-CG1 4.08Å; D302-I305 WeakPolarHBondContact O-CB 3.39Å; D302-I305 WeakPolarHBondContact O-CG1 3.49Å; D302-I305 PolarHBondContact O-N 2.86Å; I305-R309 HydrophobicContact CG2-CB 4.26Å; I305-R309 HydrophobicContact CG2-CG 4.42Å; I305-L310 HydrophobicContact CG2-CB 4.15Å; I305-V358 HydrophobicContact CD1-CB 4.5Å; I305-V358 HydrophobicContact CD1-CG1 3.84Å
306	N	91.5	Very high	92.1	Very high	115 Å²	115	63 Å²	63	62%	0.615	32%	0.318	S	S	*	.			trans	-90	168	172.9	-65	-16.3	0	0	0	112.1	E308 R309 L310	N306-E308 VanDerWaalsContact C-N 3.28Å; N306-E308 PolarHBondContact O-N 3.2Å; N306-R309 PolarHBondContact O-N 3.46Å; N306-L310 PolarHBondContact O-N 2.92Å
307	D	93.2	Very high	92	Very high	60 Å²	60	64.3 Å²	64.3	32%	0.321	32%	0.323	S	S	.	.	H	α-helix	trans	-46.9	-45	179.5	-69.5	14.1	0	0	0	113.5	L310 R311 V325	D307-L310 PolarHBondContact O-N 3.49Å; D307-R311 WeakPolarHBondContact O-CB 3.36Å; D307-R311 PolarHBondContact O-N 3.42Å; D307-V325 VanDerWaalsContact OD1-CB 3.31Å; D307-V325 WeakPolarHBondContact OD1-CB 3.47Å; D307-V325 WeakPolarHBondContact OD1-CG2 3.5Å; D307-V325 PolarHBondContact OD1-N 3.06Å
308	E	92.4	Very high	92	Very high	168 Å²	168	63.5 Å²	63.5	79%	0.785	33%	0.326	S	S	*	.	H	α-helix	trans	-65.4	-42	179	-62.6	178	169.2	0	0	112.9	N306 R311 K312	N306-E308 VanDerWaalsContact C-N 3.28Å; N306-E308 PolarHBondContact O-N 3.2Å; E308-R311 WeakPolarHBondContact O-CB 3.42Å; E308-R311 PolarHBondContact O-N 2.84Å; E308-K312 PolarHBondContact O-N 3.28Å
309	R	91.6	Very high	92	Very high	110 Å²	110	68.2 Å²	68.2	42%	0.415	36%	0.355	S	S	.	.	H	α-helix	trans	-69.1	-43.6	177.7	-170.4	174.6	-174.4	171.4	4.9	110.1	I305 N306 R311 K312 E313	I305-R309 HydrophobicContact CG2-CB 4.26Å; I305-R309 HydrophobicContact CG2-CG 4.42Å; N306-R309 PolarHBondContact O-N 3.46Å; R309-R311 VanDerWaalsContact C-N 3.26Å; R309-R311 PolarHBondContact O-N 3.02Å; R309-K312 PolarHBondContact O-N 2.84Å; R309-K312 VanDerWaalsContact O-N 3.1Å; R309-E313 HydrophobicContact CG-CG 4.41Å; R309-E313 IonicContact NE-OE1 3.38Å; R309-E313 WeakPolarHBondContact O-CG 3.32Å; R309-E313 PolarHBondContact O-N 2.82Å
310	L	93.3	Very high	92.1	Very high	2 Å²	2	63.4 Å²	63.4	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-56.3	-41.8	172	-178.4	62.2	0	0	0	111.5	V298 L301 I305 N306 D307 F314 V325 V338	V298-L310 HydrophobicContact CG1-CD1 4.31Å; L301-L310 HydrophobicContact CD1-CD2 4.46Å; L301-L310 HydrophobicContact CD2-CD1 3.89Å; I305-L310 HydrophobicContact CG2-CB 4.15Å; N306-L310 PolarHBondContact O-N 2.92Å; D307-L310 PolarHBondContact O-N 3.49Å; L310-F314 HydrophobicContact CD1-CD2 3.75Å; L310-F314 HydrophobicContact CD1-CE2 3.64Å; L310-F314 WeakPolarHBondContact O-CD2 3.44Å; L310-F314 PolarHBondContact O-N 3.39Å; L310-V325 HydrophobicContact CB-CG2 4.33Å; L310-V325 HydrophobicContact CD2-CG2 3.84Å; L310-V338 HydrophobicContact CD1-CG2 3.97Å; L310-V338 HydrophobicContact CD2-CG2 3.86Å; L310-V338 HydrophobicContact CG-CG2 3.73Å
311	R	94.8	Very high	92.1	Very high	114 Å²	114	64.1 Å²	64.1	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-61.7	-44.2	174.5	-159.5	-171.1	-147.8	-62	-6.2	111.9	D307 E308 R309 F314 S315 I320 A323	D307-R311 WeakPolarHBondContact O-CB 3.36Å; D307-R311 PolarHBondContact O-N 3.42Å; E308-R311 WeakPolarHBondContact O-CB 3.42Å; E308-R311 PolarHBondContact O-N 2.84Å; R309-R311 VanDerWaalsContact C-N 3.26Å; R309-R311 PolarHBondContact O-N 3.02Å; R311-F314 PolarHBondContact O-N 3.42Å; R311-S315 WeakPolarHBondContact O-CB 3.45Å; R311-S315 PolarHBondContact O-N 2.91Å; R311-S315 PolarHBondContact O-OG 3.29Å; R311-I320 HydrophobicContact CB-CD1 4.48Å; R311-I320 HydrophobicContact CG-CB 4.42Å; R311-I320 HydrophobicContact CG-CD1 3.9Å; R311-I320 HydrophobicContact CG-CG2 4.22Å; R311-I320 PolarHBondContact NH2-O 2.78Å; R311-I320 WeakPolarHBondContact O-CD1 3.48Å; R311-A323 HydrophobicContact CB-CB 4.06Å; R311-A323 HydrophobicContact CG-CB 4.3Å
312	K	93.8	Very high	92.1	Very high	161 Å²	161	67.2 Å²	67.2	70%	0.7	36%	0.364	S	S	*	.	H	α-helix	trans	-68.4	-39.9	-178.2	-173.5	175.9	179.6	178	0	113.4	E308 R309 F314 S315	E308-K312 PolarHBondContact O-N 3.28Å; R309-K312 PolarHBondContact O-N 2.84Å; R309-K312 VanDerWaalsContact O-N 3.1Å; K312-F314 VanDerWaalsContact C-N 3.29Å; K312-F314 PolarHBondContact O-N 3.33Å; K312-S315 PolarHBondContact O-OG 2.91Å; K312-S315 VanDerWaalsContact O-OG 3.07Å
313	E	92.4	Very high	92.3	Very high	51 Å²	51	66.5 Å²	66.5	24%	0.238	36%	0.362	C	S	.	.	H	α-helix	trans	-68.6	-28.7	177.3	-60	-67.2	167.4	0	0	111.9	R309 M353 V358	R309-E313 HydrophobicContact CG-CG 4.41Å; R309-E313 IonicContact NE-OE1 3.38Å; R309-E313 WeakPolarHBondContact O-CG 3.32Å; R309-E313 PolarHBondContact O-N 2.82Å; E313-M353 HydrophobicContact CB-CE 4.04Å; E313-M353 WeakPolarHBondContact O-CE 3.43Å; E313-V358 HydrophobicContact CG-CG1 4.05Å
314	F	94.5	Very high	92.7	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-97.7	-15.6	-178.2	-80.7	-102.7	0	0	0	114.7	L296 V298 L310 R311 K312 Y317 I320 V338 F340 A349 M353 L363 V365	L296-F314 HydrophobicContact CD1-CE1 4.47Å; V298-F314 HydrophobicContact CB-CZ 4.47Å; V298-F314 HydrophobicContact CG1-CE2 4.24Å; V298-F314 HydrophobicContact CG1-CZ 4Å; V298-F314 HydrophobicContact CG2-CE1 3.99Å; V298-F314 HydrophobicContact CG2-CE2 4.17Å; V298-F314 HydrophobicContact CG2-CZ 3.58Å; L310-F314 HydrophobicContact CD1-CD2 3.75Å; L310-F314 HydrophobicContact CD1-CE2 3.64Å; L310-F314 WeakPolarHBondContact O-CD2 3.44Å; L310-F314 PolarHBondContact O-N 3.39Å; R311-F314 PolarHBondContact O-N 3.42Å; K312-F314 VanDerWaalsContact C-N 3.29Å; K312-F314 PolarHBondContact O-N 3.33Å; F314-Y317 WeakPolarHBondContact O-CD2 3.2Å; F314-Y317 PolarHBondContact O-N 3.34Å; F314-I320 HydrophobicContact CB-CD1 3.66Å; F314-V338 HydrophobicContact CB-CG1 4.08Å; F314-V338 HydrophobicContact CD1-CG1 4.33Å; F314-V338 HydrophobicContact CD1-CG2 4.38Å; F314-V338 HydrophobicContact CD2-CG2 4.38Å; F314-V338 HydrophobicContact CG-CG1 4.32Å; F314-V338 HydrophobicContact CG-CG2 4.19Å; F314-F340 HydrophobicContact CB-CZ 4.22Å; F314-F340 HydrophobicContact CD1-CE2 4.41Å; F314-F340 HydrophobicContact CD1-CZ 4.23Å; F314-A349 HydrophobicContact CD1-CB 4.34Å; F314-M353 HydrophobicContact CD1-CG 4.34Å; F314-M353 HydrophobicContact CD2-CE 3.88Å; F314-M353 HydrophobicContact CE1-CB 3.9Å; F314-M353 HydrophobicContact CE1-CE 4.48Å; F314-M353 HydrophobicContact CE1-CG 3.97Å; F314-M353 HydrophobicContact CE2-CE 3.62Å; F314-M353 HydrophobicContact CG-CE 4.43Å; F314-M353 HydrophobicContact CZ-CB 3.91Å; F314-M353 HydrophobicContact CZ-CE 3.95Å; F314-M353 HydrophobicContact CZ-CG 4.16Å; F314-L363 HydrophobicContact CE2-CD1 4.02Å; F314-L363 HydrophobicContact CZ-CD1 4.25Å; F314-V365 HydrophobicContact CE1-CG1 4.12Å; F314-V365 HydrophobicContact CE1-CG2 4.25Å; F314-V365 HydrophobicContact CZ-CG1 4.48Å; F314-V365 HydrophobicContact CZ-CG2 3.86Å
315	S	94.4	Very high	93.1	Very high	58 Å²	58	65.4 Å²	65.4	41%	0.406	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-62.4	-25.1	-179.8	50.7	0	0	0	0	116.7	R311 K312 Y317 G318	R311-S315 WeakPolarHBondContact O-CB 3.45Å; R311-S315 PolarHBondContact O-N 2.91Å; R311-S315 PolarHBondContact O-OG 3.29Å; K312-S315 PolarHBondContact O-OG 2.91Å; K312-S315 VanDerWaalsContact O-OG 3.07Å; S315-Y317 PolarHBondContact O-N 3.16Å; S315-Y317 VanDerWaalsContact O-N 3.15Å; S315-G318 PolarHBondContact O-N 3.27Å
316	P	95.1	Very high	93.2	Very high	91 Å²	91	68.4 Å²	68.4	59%	0.591	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-63.9	-14.2	173.5	-23.7	35.7	0	0	0	114.7
317	Y	92.8	Very high	93.1	Very high	26 Å²	26	66.8 Å²	66.8	10%	0.102	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-100.1	-9.6	-174.2	-55.9	-75.1	0	0	0	113.9	F314 S315 E345 K348 A349 E352 M353 R356	F314-Y317 WeakPolarHBondContact O-CD2 3.2Å; F314-Y317 PolarHBondContact O-N 3.34Å; S315-Y317 PolarHBondContact O-N 3.16Å; S315-Y317 VanDerWaalsContact O-N 3.15Å; Y317-E345 WeakPolarHBondContact O-CB 3.4Å; Y317-K348 HydrophobicContact CD1-CG 4.4Å; Y317-A349 HydrophobicContact CG-CB 4.15Å; Y317-E352 HydrophobicContact CD1-CB 4.25Å; Y317-E352 HydrophobicContact CE1-CB 3.57Å; Y317-E352 HydrophobicContact CE1-CG 4.16Å; Y317-E352 WeakPolarHBondContact CE1-OE2 3.36Å; Y317-M353 HydrophobicContact CD2-CG 3.97Å; Y317-M353 HydrophobicContact CD2-SD 4.38Å; Y317-M353 HydrophobicContact CE2-CE 4.37Å; Y317-M353 HydrophobicContact CE2-CG 3.5Å; Y317-M353 HydrophobicContact CE2-SD 3.42Å; Y317-M353 WeakPolarHBondContact CE2-SD 3.44Å; Y317-R356 PolarHBondContact OH-NH1 2.99Å
318	G	92.1	Very high	92.8	Very high	21 Å²	21	70.2 Å²	70.2	22%	0.216	36%	0.363	C	S	.	.	S	Bend	trans	160.2	177.9	-179.3	0	0	0	0	0	114.8	S315 I320 E345	S315-G318 PolarHBondContact O-N 3.27Å; G318-I320 PolarHBondContact O-N 2.87Å; G318-E345 VanDerWaalsContact C-OE2 3.31Å; G318-E345 WeakPolarHBondContact CA-OE2 3.35Å
319	T	94.1	Very high	92.2	Very high	100 Å²	100	66.4 Å²	66.4	61%	0.613	37%	0.369	S	S	*	.			trans	-81.6	97	178.9	-56.6	0	0	0	0	110	T321 F340 S341 E345	T319-T321 PolarHBondContact O-N 3.22Å; T319-F340 CarbonylContact O-C 3.42Å; T319-S341 WeakPolarHBondContact CB-OG 3.47Å; T319-S341 PolarHBondContact O-N 3.48Å; T319-S341 PolarHBondContact O-OG 2.93Å; T319-E345 PolarHBondContact N-OE2 3.39Å
320	I	94.8	Very high	91.5	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.021	38%	0.384	C	S	.	.			trans	-64	121.2	175	-62	173	0	0	0	109.8	R311 F314 G318 S322 A323 V338 C339 F340	R311-I320 HydrophobicContact CB-CD1 4.48Å; R311-I320 HydrophobicContact CG-CB 4.42Å; R311-I320 HydrophobicContact CG-CD1 3.9Å; R311-I320 HydrophobicContact CG-CG2 4.22Å; R311-I320 PolarHBondContact NH2-O 2.78Å; R311-I320 WeakPolarHBondContact O-CD1 3.48Å; F314-I320 HydrophobicContact CB-CD1 3.66Å; G318-I320 PolarHBondContact O-N 2.87Å; I320-S322 VanDerWaalsContact CG2-C 3.46Å; I320-S322 WeakPolarHBondContact CG2-O 3.37Å; I320-A323 HydrophobicContact CG2-CB 4Å; I320-V338 HydrophobicContact CD1-CG1 3.88Å; I320-V338 HydrophobicContact CG1-CG1 3.88Å; I320-V338 HydrophobicContact CG2-CG1 4.14Å; I320-C339 CarbonylContact C-O 3.53Å; I320-C339 WeakPolarHBondContact CA-O 3.49Å; I320-F340 HydrophobicContact CG1-CD1 4.18Å; I320-F340 HydrophobicContact CG1-CE1 3.76Å; I320-F340 HydrophobicContact CG1-CZ 4.18Å
321	T	91.9	Very high	90.9	Very high	83 Å²	83	71.8 Å²	71.8	51%	0.509	42%	0.418	S	S	.	.	S	Bend	trans	-84.9	-32.5	171.3	56.6	0	0	0	0	111.6	T319 C339 F340	T319-T321 PolarHBondContact O-N 3.22Å; T321-C339 PolarHBondContact N-O 3.29Å; T321-C339 PolarHBondContact OG1-O 3.03Å; T321-C339 VanDerWaalsContact OG1-O 3.07Å; T321-C339 PolarHBondContact OG1-SG 3.18Å; T321-F340 PolarHBondContact OG1-O 3.12Å
322	S	91.2	Very high	90.6	Very high	68 Å²	68	67.6 Å²	67.6	48%	0.476	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	136.3	173.2	-170.6	0	0	0	0	111.2	I320 V338 C339	I320-S322 VanDerWaalsContact CG2-C 3.46Å; I320-S322 WeakPolarHBondContact CG2-O 3.37Å; S322-V338 CarbonylContact O-C 3.55Å; S322-V338 WeakPolarHBondContact O-CA 3.36Å; S322-C339 PolarHBondContact N-O 3.31Å; S322-C339 PolarHBondContact O-N 3.33Å
323	A	94.1	Very high	90.4	Very high	16 Å²	16	64 Å²	64	13%	0.132	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.3	166.7	0	0	0	0	0	108.1	R311 I320 F337 V338	R311-A323 HydrophobicContact CB-CB 4.06Å; R311-A323 HydrophobicContact CG-CB 4.3Å; I320-A323 HydrophobicContact CG2-CB 4Å; A323-F337 WeakPolarHBondContact CA-O 3.2Å; A323-V338 HydrophobicContact CB-CG2 4.27Å
324	K	94.1	Very high	90.2	Very high	117 Å²	117	62.2 Å²	62.2	51%	0.509	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	125.8	179.7	-179.8	155.4	-171.5	155.8	0	113.1	G336 F337	K324-G336 CarbonylContact O-C 3.51Å; K324-G336 WeakPolarHBondContact O-CA 3.44Å; K324-F337 PolarHBondContact N-O 3.22Å; K324-F337 PolarHBondContact O-N 3.15Å
325	V	93.4	Very high	90.1	Very high	5 Å²	5	64.4 Å²	64.4	3%	0.03	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	141.8	169.2	-176	0	0	0	0	109	L301 D307 L310 S332	L301-V325 HydrophobicContact CD1-CG1 4.09Å; L301-V325 HydrophobicContact CD1-CG2 3.97Å; D307-V325 VanDerWaalsContact OD1-CB 3.31Å; D307-V325 WeakPolarHBondContact OD1-CB 3.47Å; D307-V325 WeakPolarHBondContact OD1-CG2 3.5Å; D307-V325 PolarHBondContact OD1-N 3.06Å; L310-V325 HydrophobicContact CB-CG2 4.33Å; L310-V325 HydrophobicContact CD2-CG2 3.84Å; V325-S332 WeakPolarHBondContact CG1-OG 3.36Å
326	M	91.6	Very high	90.1	Very high	67 Å²	67	61.7 Å²	61.7	33%	0.33	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	112	177.1	-68.2	-59	-54.7	0	0	109.7	K333 F335 F337	M326-K333 HydrophobicContact CB-CD 4.47Å; M326-K333 VanDerWaalsContact O-CB 3.3Å; M326-K333 WeakPolarHBondContact O-CB 3.45Å; M326-K333 WeakPolarHBondContact O-CG 3.43Å; M326-K333 PolarHBondContact O-N 3.42Å; M326-F335 HydrophobicContact CB-CD2 4.11Å; M326-F335 HydrophobicContact CB-CE1 4.46Å; M326-F335 HydrophobicContact CB-CE2 3.74Å; M326-F335 HydrophobicContact CB-CZ 3.92Å; M326-F335 HydrophobicContact CG-CD2 3.99Å; M326-F335 HydrophobicContact CG-CE2 3.5Å; M326-F335 HydrophobicContact CG-CZ 4.09Å; M326-F335 PolarHBondContact N-O 3.21Å; M326-F337 HydrophobicContact CG-CD2 4.16Å; M326-F337 HydrophobicContact CG-CE2 3.89Å; M326-F337 HydrophobicContact SD-CD2 4.43Å; M326-F337 HydrophobicContact SD-CE2 4.28Å
327	T	90.4	Very high	90.1	Very high	80 Å²	80	60.4 Å²	60.4	49%	0.491	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	161.7	177.9	54.6	0	0	0	0	112.6	Q331	T327-Q331 CarbonylContact C-O 3.51Å; T327-Q331 WeakPolarHBondContact CA-O 3.14Å; T327-Q331 VanDerWaalsContact CB-O 3.32Å; T327-Q331 WeakPolarHBondContact CB-O 3.36Å
328	E	85.9	Confident	90.2	Very high	132 Å²	132	59.2 Å²	59.2	62%	0.617	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.7	129.3	173.3	171.8	164.3	-88.5	0	0	108.7	G330 Q331 K333	E328-G330 PolarHBondContact O-N 2.8Å; E328-G330 VanDerWaalsContact O-N 3.1Å; E328-Q331 PolarHBondContact N-O 3.19Å; E328-Q331 PolarHBondContact O-N 2.69Å; E328-K333 HydrophobicContact CB-CG 4.33Å; E328-K333 IonicContact OE1-NZ 2.66Å; E328-K333 PolarHBondContact OE1-NZ 2.95Å; E328-K333 IonicContact OE2-NZ 2.66Å; E328-K333 PolarHBondContact OE2-NZ 3.29Å
329	G	79.3	Confident	90.2	Very high	89 Å²	89	58.4 Å²	58.4	92%	0.918	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	18.3	-170.5	0	0	0	0	0	114.6	Q331	G329-Q331 VanDerWaalsContact C-N 3.31Å
330	G	78	Confident	90.2	Very high	70 Å²	70	53.7 Å²	53.7	72%	0.722	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-13.1	-172.1	0	0	0	0	0	115	E328	E328-G330 PolarHBondContact O-N 2.8Å; E328-G330 VanDerWaalsContact O-N 3.1Å
331	Q	81.1	Confident	90.1	Very high	154 Å²	154	56.6 Å²	56.6	72%	0.72	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	148	177.2	-65.1	-179.1	-10.4	0	0	111.4	T327 E328 G329	T327-Q331 CarbonylContact C-O 3.51Å; T327-Q331 WeakPolarHBondContact CA-O 3.14Å; T327-Q331 VanDerWaalsContact CB-O 3.32Å; T327-Q331 WeakPolarHBondContact CB-O 3.36Å; E328-Q331 PolarHBondContact N-O 3.19Å; E328-Q331 PolarHBondContact O-N 2.69Å; G329-Q331 VanDerWaalsContact C-N 3.31Å
332	S	88.3	Confident	90.1	Very high	27 Å²	27	54.1 Å²	54.1	19%	0.189	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	137.3	174.7	-178.2	0	0	0	0	111.2	V325 G334	V325-S332 WeakPolarHBondContact CG1-OG 3.36Å; S332-G334 PolarHBondContact O-N 2.97Å; S332-G334 PolarHBondContact OG-N 3.46Å; S332-G334 VanDerWaalsContact OG-N 3.14Å
333	K	88.6	Confident	90.2	Very high	86 Å²	86	53.9 Å²	53.9	37%	0.374	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	9.6	168.8	-63.6	-173	-174.2	-107.7	0	113.1	M326 E328 F335	M326-K333 HydrophobicContact CB-CD 4.47Å; M326-K333 VanDerWaalsContact O-CB 3.3Å; M326-K333 WeakPolarHBondContact O-CB 3.45Å; M326-K333 WeakPolarHBondContact O-CG 3.43Å; M326-K333 PolarHBondContact O-N 3.42Å; E328-K333 HydrophobicContact CB-CG 4.33Å; E328-K333 IonicContact OE1-NZ 2.66Å; E328-K333 PolarHBondContact OE1-NZ 2.95Å; E328-K333 IonicContact OE2-NZ 2.66Å; E328-K333 PolarHBondContact OE2-NZ 3.29Å; K333-F335 HydrophobicContact CB-CD1 3.62Å; K333-F335 HydrophobicContact CB-CE1 3.55Å; K333-F335 HydrophobicContact CD-CE1 3.7Å; K333-F335 HydrophobicContact CD-CZ 4.11Å; K333-F335 HydrophobicContact CG-CE1 4.3Å; K333-F335 WeakPolarHBondContact O-CD1 3.35Å; K333-F335 PolarHBondContact O-N 3.42Å
334	G	87.7	Confident	90.1	Very high	13 Å²	13	60.7 Å²	60.7	13%	0.134	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	65.6	20.4	-173.6	0	0	0	0	0	113.7	K299 N300 L301 S332	K299-G334 CarbonylContact C-O 3.46Å; N300-G334 PolarHBondContact N-O 2.94Å; L301-G334 PolarHBondContact N-O 3.5Å; L301-G334 VanDerWaalsContact N-O 3.09Å; S332-G334 PolarHBondContact O-N 2.97Å; S332-G334 PolarHBondContact OG-N 3.46Å; S332-G334 VanDerWaalsContact OG-N 3.14Å
335	F	93.3	Very high	90.1	Very high	46 Å²	46	56.8 Å²	56.8	20%	0.202	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	156.4	176	79.5	-96.6	0	0	0	113.4	Y297 V298 K299 M326 K333 F337	Y297-F335 HydrophobicContact CD2-CD2 4.23Å; Y297-F335 HydrophobicContact CE2-CB 4.12Å; Y297-F335 AromaticContact CE2-CD2 3.44Å; Y297-F335 HydrophobicContact CE2-CD2 3.44Å; Y297-F335 VanDerWaalsContact CE2-CD2 3.44Å; Y297-F335 AromaticContact CE2-CE2 3.98Å; Y297-F335 HydrophobicContact CE2-CE2 3.98Å; Y297-F335 AromaticContact CE2-CG 3.93Å; Y297-F335 HydrophobicContact CE2-CG 3.93Å; V298-F335 CarbonylContact O-C 3.58Å; V298-F335 WeakPolarHBondContact O-CA 3.32Å; V298-F335 VanDerWaalsContact O-CB 3.3Å; V298-F335 WeakPolarHBondContact O-CB 3.37Å; K299-F335 HydrophobicContact CB-CB 4.21Å; K299-F335 HydrophobicContact CG-CB 3.91Å; M326-F335 HydrophobicContact CB-CD2 4.11Å; M326-F335 HydrophobicContact CB-CE1 4.46Å; M326-F335 HydrophobicContact CB-CE2 3.74Å; M326-F335 HydrophobicContact CB-CZ 3.92Å; M326-F335 HydrophobicContact CG-CD2 3.99Å; M326-F335 HydrophobicContact CG-CE2 3.5Å; M326-F335 HydrophobicContact CG-CZ 4.09Å; M326-F335 PolarHBondContact N-O 3.21Å; K333-F335 HydrophobicContact CB-CD1 3.62Å; K333-F335 HydrophobicContact CB-CE1 3.55Å; K333-F335 HydrophobicContact CD-CE1 3.7Å; K333-F335 HydrophobicContact CD-CZ 4.11Å; K333-F335 HydrophobicContact CG-CE1 4.3Å; K333-F335 WeakPolarHBondContact O-CD1 3.35Å; K333-F335 PolarHBondContact O-N 3.42Å; F335-F337 HydrophobicContact CD2-CE2 4.43Å; F335-F337 HydrophobicContact CE2-CE2 4.07Å; F335-F337 HydrophobicContact CE2-CZ 4.37Å
336	G	93.7	Very high	90.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	-173.3	178.6	0	0	0	0	0	112.2	V298 K324	V298-G336 PolarHBondContact N-O 3.5Å; V298-G336 PolarHBondContact O-N 2.95Å; K324-G336 CarbonylContact O-C 3.51Å; K324-G336 WeakPolarHBondContact O-CA 3.44Å
337	F	94.9	Very high	90.1	Very high	65 Å²	65	57 Å²	57	29%	0.285	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145	177.2	-61.9	-86.2	0	0	0	110.6	L296 Y297 A323 K324 M326 F335 A368	L296-F337 WeakPolarHBondContact O-CA 3.21Å; Y297-F337 HydrophobicContact CD2-CD1 4.34Å; Y297-F337 AromaticContact CD2-CE1 3.71Å; Y297-F337 HydrophobicContact CD2-CE1 3.71Å; Y297-F337 AromaticContact CD2-CZ 3.97Å; Y297-F337 HydrophobicContact CD2-CZ 3.97Å; Y297-F337 HydrophobicContact CG-CE1 4.48Å; A323-F337 WeakPolarHBondContact CA-O 3.2Å; K324-F337 PolarHBondContact N-O 3.22Å; K324-F337 PolarHBondContact O-N 3.15Å; M326-F337 HydrophobicContact CG-CD2 4.16Å; M326-F337 HydrophobicContact CG-CE2 3.89Å; M326-F337 HydrophobicContact SD-CD2 4.43Å; M326-F337 HydrophobicContact SD-CE2 4.28Å; F335-F337 HydrophobicContact CD2-CE2 4.43Å; F335-F337 HydrophobicContact CE2-CE2 4.07Å; F335-F337 HydrophobicContact CE2-CZ 4.37Å; F337-A368 HydrophobicContact CD1-CB 3.99Å; F337-A368 HydrophobicContact CE1-CB 4.08Å
338	V	95.1	Very high	90.3	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	117.6	174.1	-177.4	0	0	0	0	108.3	L296 V298 L310 F314 I320 S322 A323 F340	L296-V338 WeakPolarHBondContact CB-O 3.33Å; L296-V338 PolarHBondContact N-O 2.89Å; L296-V338 PolarHBondContact O-N 3.22Å; V298-V338 HydrophobicContact CG2-CG2 4.04Å; L310-V338 HydrophobicContact CD1-CG2 3.97Å; L310-V338 HydrophobicContact CD2-CG2 3.86Å; L310-V338 HydrophobicContact CG-CG2 3.73Å; F314-V338 HydrophobicContact CB-CG1 4.08Å; F314-V338 HydrophobicContact CD1-CG1 4.33Å; F314-V338 HydrophobicContact CD1-CG2 4.38Å; F314-V338 HydrophobicContact CD2-CG2 4.38Å; F314-V338 HydrophobicContact CG-CG1 4.32Å; F314-V338 HydrophobicContact CG-CG2 4.19Å; I320-V338 HydrophobicContact CD1-CG1 3.88Å; I320-V338 HydrophobicContact CG1-CG1 3.88Å; I320-V338 HydrophobicContact CG2-CG1 4.14Å; S322-V338 CarbonylContact O-C 3.55Å; S322-V338 WeakPolarHBondContact O-CA 3.36Å; A323-V338 HydrophobicContact CB-CG2 4.27Å; V338-F340 HydrophobicContact CG1-CD2 4.37Å; V338-F340 HydrophobicContact CG1-CE2 3.8Å; V338-F340 HydrophobicContact CG1-CZ 4.07Å
339	C	93.1	Very high	90.7	Very high	4 Å²	4	52 Å²	52	3%	0.027	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.6	176.9	-166.9	0	0	0	0	109.9	V294 N295 I320 T321 S322	V294-C339 WeakPolarHBondContact O-CA 3.38Å; N295-C339 HydrophobicContact CB-CB 4.4Å; I320-C339 CarbonylContact C-O 3.53Å; I320-C339 WeakPolarHBondContact CA-O 3.49Å; T321-C339 PolarHBondContact N-O 3.29Å; T321-C339 PolarHBondContact OG1-O 3.03Å; T321-C339 VanDerWaalsContact OG1-O 3.07Å; T321-C339 PolarHBondContact OG1-SG 3.18Å; S322-C339 PolarHBondContact N-O 3.31Å; S322-C339 PolarHBondContact O-N 3.33Å
340	F	94.9	Very high	91.4	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.009	28%	0.276	C	S	.	.			trans	-90.3	-179.6	174.2	-73.6	-83	0	0	0	111.6	V294 L296 F314 T319 I320 T321 V338 E345 A346 A349	V294-F340 PolarHBondContact O-N 2.85Å; L296-F340 HydrophobicContact CD1-CD2 4.25Å; L296-F340 HydrophobicContact CD1-CE2 3.77Å; L296-F340 HydrophobicContact CG-CD2 4.41Å; L296-F340 HydrophobicContact CG-CE2 4.34Å; F314-F340 HydrophobicContact CB-CZ 4.22Å; F314-F340 HydrophobicContact CD1-CE2 4.41Å; F314-F340 HydrophobicContact CD1-CZ 4.23Å; T319-F340 CarbonylContact O-C 3.42Å; I320-F340 HydrophobicContact CG1-CD1 4.18Å; I320-F340 HydrophobicContact CG1-CE1 3.76Å; I320-F340 HydrophobicContact CG1-CZ 4.18Å; T321-F340 PolarHBondContact OG1-O 3.12Å; V338-F340 HydrophobicContact CG1-CD2 4.37Å; V338-F340 HydrophobicContact CG1-CE2 3.8Å; V338-F340 HydrophobicContact CG1-CZ 4.07Å; F340-E345 HydrophobicContact CB-CB 3.99Å; F340-E345 HydrophobicContact CD1-CB 3.88Å; F340-E345 HydrophobicContact CG-CB 4Å; F340-A346 HydrophobicContact CB-CB 4.32Å; F340-A346 HydrophobicContact CD2-CB 3.94Å; F340-A346 HydrophobicContact CG-CB 4.44Å; F340-A349 HydrophobicContact CE2-CB 3.65Å; F340-A349 HydrophobicContact CZ-CB 3.73Å
341	S	92.6	Very high	92.1	Very high	64 Å²	64	51.1 Å²	51.1	45%	0.448	27%	0.272	S	S	.	.	S	Bend	trans	-79.7	-41.6	168.6	33	0	0	0	0	112.6	T319 E345	T319-S341 WeakPolarHBondContact CB-OG 3.47Å; T319-S341 PolarHBondContact O-N 3.48Å; T319-S341 PolarHBondContact O-OG 2.93Å; S341-E345 PolarHBondContact OG-OE1 3.44Å; S341-E345 PolarHBondContact OG-OE2 3.18Å
342	S	91.8	Very high	92.6	Very high	31 Å²	31	48.4 Å²	48.4	22%	0.217	26%	0.26	C	S	.	.	S	Bend	trans	-120.3	156.4	-178.9	75.1	0	0	0	0	112.9	E344 E345 A346	S342-E344 PolarHBondContact O-N 3.35Å; S342-E345 WeakPolarHBondContact CB-OE1 3.32Å; S342-E345 PolarHBondContact N-OE1 3.38Å; S342-E345 WeakPolarHBondContact OG-CG 3.37Å; S342-E345 PolarHBondContact OG-N 2.91Å; S342-E345 PolarHBondContact OG-OE1 3.18Å; S342-A346 PolarHBondContact O-N 2.99Å
343	P	92.3	Very high	92.8	Very high	64 Å²	64	47.1 Å²	47.1	42%	0.416	25%	0.251	S	S	.	.	H	α-helix	trans	-73.7	-17.7	177	30.3	-35.4	0	0	0	112.3	V294 T347	V294-P343 HydrophobicContact CG1-CB 4.32Å; P343-T347 WeakPolarHBondContact O-CB 3.46Å; P343-T347 PolarHBondContact O-N 3.34Å; P343-T347 PolarHBondContact O-OG1 3.14Å
344	E	92.1	Very high	93	Very high	158 Å²	158	46.6 Å²	46.6	74%	0.738	25%	0.252	S	S	*	.	H	α-helix	trans	-72.9	-49.6	178	-65.8	172.9	-160.2	0	0	110.7	S342 A346 T347 K348	S342-E344 PolarHBondContact O-N 3.35Å; E344-A346 VanDerWaalsContact C-N 3.29Å; E344-A346 PolarHBondContact O-N 3.11Å; E344-T347 PolarHBondContact O-N 2.91Å; E344-T347 VanDerWaalsContact O-N 3.15Å; E344-K348 PolarHBondContact O-N 3.09Å
345	E	94.4	Very high	93.1	Very high	36 Å²	36	48.3 Å²	48.3	17%	0.168	27%	0.269	C	S	.	.	H	α-helix	trans	-52.4	-47.3	168.7	-68.3	160.8	-113.5	0	0	111.5	Y317 G318 T319 F340 S341 S342 T347 K348 A349	Y317-E345 WeakPolarHBondContact O-CB 3.4Å; G318-E345 VanDerWaalsContact C-OE2 3.31Å; G318-E345 WeakPolarHBondContact CA-OE2 3.35Å; T319-E345 PolarHBondContact N-OE2 3.39Å; F340-E345 HydrophobicContact CB-CB 3.99Å; F340-E345 HydrophobicContact CD1-CB 3.88Å; F340-E345 HydrophobicContact CG-CB 4Å; S341-E345 PolarHBondContact OG-OE1 3.44Å; S341-E345 PolarHBondContact OG-OE2 3.18Å; S342-E345 WeakPolarHBondContact CB-OE1 3.32Å; S342-E345 PolarHBondContact N-OE1 3.38Å; S342-E345 WeakPolarHBondContact OG-CG 3.37Å; S342-E345 PolarHBondContact OG-N 2.91Å; S342-E345 PolarHBondContact OG-OE1 3.18Å; E345-T347 VanDerWaalsContact C-N 3.34Å; E345-T347 PolarHBondContact O-N 3.43Å; E345-K348 PolarHBondContact O-N 3.26Å; E345-A349 WeakPolarHBondContact O-CB 3.4Å; E345-A349 PolarHBondContact O-N 2.79Å
346	A	92.6	Very high	93	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.5	-40.1	179.1	0	0	0	0	0	112	G293 L296 F340 S342 E344 A349 V350	G293-A346 VanDerWaalsContact O-CB 3.3Å; G293-A346 WeakPolarHBondContact O-CB 3.44Å; L296-A346 HydrophobicContact CD2-CB 3.95Å; L296-A346 HydrophobicContact CG-CB 4.35Å; F340-A346 HydrophobicContact CB-CB 4.32Å; F340-A346 HydrophobicContact CD2-CB 3.94Å; F340-A346 HydrophobicContact CG-CB 4.44Å; S342-A346 PolarHBondContact O-N 2.99Å; E344-A346 VanDerWaalsContact C-N 3.29Å; E344-A346 PolarHBondContact O-N 3.11Å; A346-A349 PolarHBondContact O-N 2.81Å; A346-V350 WeakPolarHBondContact O-CG2 3.31Å; A346-V350 PolarHBondContact O-N 3.1Å
347	T	92.2	Very high	92.8	Very high	77 Å²	77	57 Å²	57	47%	0.472	31%	0.308	S	S	.	.	H	α-helix	trans	-69.8	-39.3	177.9	-57.7	0	0	0	0	111.6	P343 E344 E345 V350 T351	P343-T347 WeakPolarHBondContact O-CB 3.46Å; P343-T347 PolarHBondContact O-N 3.34Å; P343-T347 PolarHBondContact O-OG1 3.14Å; E344-T347 PolarHBondContact O-N 2.91Å; E344-T347 VanDerWaalsContact O-N 3.15Å; E345-T347 VanDerWaalsContact C-N 3.34Å; E345-T347 PolarHBondContact O-N 3.43Å; T347-V350 PolarHBondContact O-N 2.95Å; T347-T351 PolarHBondContact O-N 3.43Å; T347-T351 PolarHBondContact O-OG1 2.91Å
348	K	93.9	Very high	92.3	Very high	106 Å²	106	54.1 Å²	54.1	46%	0.461	30%	0.296	S	S	.	.	H	α-helix	trans	-59.3	-49.3	171	-174.8	-177.7	177.6	-176.3	0	111.3	Y317 E344 E345 V350 T351 E352	Y317-K348 HydrophobicContact CD1-CG 4.4Å; E344-K348 PolarHBondContact O-N 3.09Å; E345-K348 PolarHBondContact O-N 3.26Å; K348-V350 PolarHBondContact O-N 2.85Å; K348-T351 WeakPolarHBondContact O-CB 3.49Å; K348-T351 PolarHBondContact O-N 3.46Å; K348-E352 WeakPolarHBondContact CE-OE1 3.23Å; K348-E352 VanDerWaalsContact CG-OE1 3.24Å; K348-E352 WeakPolarHBondContact CG-OE1 3.22Å; K348-E352 PolarHBondContact O-N 3.12Å
349	A	94.1	Very high	91.8	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-39.1	176.7	0	0	0	0	0	113.1	L296 F314 Y317 F340 E345 A346 T351 M353	L296-A349 HydrophobicContact CD1-CB 3.78Å; F314-A349 HydrophobicContact CD1-CB 4.34Å; Y317-A349 HydrophobicContact CG-CB 4.15Å; F340-A349 HydrophobicContact CE2-CB 3.65Å; F340-A349 HydrophobicContact CZ-CB 3.73Å; E345-A349 WeakPolarHBondContact O-CB 3.4Å; E345-A349 PolarHBondContact O-N 2.79Å; A346-A349 PolarHBondContact O-N 2.81Å; A349-T351 VanDerWaalsContact C-N 3.27Å; A349-T351 PolarHBondContact O-N 3.29Å; A349-M353 VanDerWaalsContact O-CB 3.26Å; A349-M353 WeakPolarHBondContact O-CB 3.43Å; A349-M353 PolarHBondContact O-N 3.1Å
350	V	94.1	Very high	91.5	Very high	34 Å²	34	61.3 Å²	61.3	21%	0.206	35%	0.346	C	S	.	.	H	α-helix	trans	-60.2	-38.5	171.2	170	0	0	0	0	111.3	L296 A346 T347 K348 N354 V365	L296-V350 HydrophobicContact CD1-CG2 3.99Å; L296-V350 HydrophobicContact CD2-CG2 3.45Å; L296-V350 VanDerWaalsContact CD2-CG2 3.45Å; L296-V350 HydrophobicContact CG-CG2 4.34Å; A346-V350 WeakPolarHBondContact O-CG2 3.31Å; A346-V350 PolarHBondContact O-N 3.1Å; T347-V350 PolarHBondContact O-N 2.95Å; K348-V350 PolarHBondContact O-N 2.85Å; V350-N354 WeakPolarHBondContact O-CB 3.37Å; V350-N354 PolarHBondContact O-N 2.92Å; V350-V365 HydrophobicContact CG2-CG1 4.12Å
351	T	92.4	Very high	91.2	Very high	107 Å²	107	63.6 Å²	63.6	66%	0.656	36%	0.356	S	S	*	.	H	α-helix	trans	-74.4	-40.6	-174.5	-53.8	0	0	0	0	111.9	T347 K348 A349	T347-T351 PolarHBondContact O-N 3.43Å; T347-T351 PolarHBondContact O-OG1 2.91Å; K348-T351 WeakPolarHBondContact O-CB 3.49Å; K348-T351 PolarHBondContact O-N 3.46Å; A349-T351 VanDerWaalsContact C-N 3.27Å; A349-T351 PolarHBondContact O-N 3.29Å
352	E	92.6	Very high	91.2	Very high	96 Å²	96	63.6 Å²	63.6	45%	0.449	35%	0.354	S	S	.	.	H	α-helix	trans	-93.6	-26.7	-174.9	-66.9	-174.7	-114.1	0	0	114.7	Y317 K348	Y317-E352 HydrophobicContact CD1-CB 4.25Å; Y317-E352 HydrophobicContact CE1-CB 3.57Å; Y317-E352 HydrophobicContact CE1-CG 4.16Å; Y317-E352 WeakPolarHBondContact CE1-OE2 3.36Å; K348-E352 WeakPolarHBondContact CE-OE1 3.23Å; K348-E352 VanDerWaalsContact CG-OE1 3.24Å; K348-E352 WeakPolarHBondContact CG-OE1 3.22Å; K348-E352 PolarHBondContact O-N 3.12Å
353	M	92.5	Very high	91.3	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-97.4	-16.5	-178.4	-64.3	-69.2	-81.1	0	0	114.1	E313 F314 Y317 A349 G355 R356 V358 L363 V365	E313-M353 HydrophobicContact CB-CE 4.04Å; E313-M353 WeakPolarHBondContact O-CE 3.43Å; F314-M353 HydrophobicContact CD1-CG 4.34Å; F314-M353 HydrophobicContact CD2-CE 3.88Å; F314-M353 HydrophobicContact CE1-CB 3.9Å; F314-M353 HydrophobicContact CE1-CE 4.48Å; F314-M353 HydrophobicContact CE1-CG 3.97Å; F314-M353 HydrophobicContact CE2-CE 3.62Å; F314-M353 HydrophobicContact CG-CE 4.43Å; F314-M353 HydrophobicContact CZ-CB 3.91Å; F314-M353 HydrophobicContact CZ-CE 3.95Å; F314-M353 HydrophobicContact CZ-CG 4.16Å; Y317-M353 HydrophobicContact CD2-CG 3.97Å; Y317-M353 HydrophobicContact CD2-SD 4.38Å; Y317-M353 HydrophobicContact CE2-CE 4.37Å; Y317-M353 HydrophobicContact CE2-CG 3.5Å; Y317-M353 HydrophobicContact CE2-SD 3.42Å; Y317-M353 WeakPolarHBondContact CE2-SD 3.44Å; A349-M353 VanDerWaalsContact O-CB 3.26Å; A349-M353 WeakPolarHBondContact O-CB 3.43Å; A349-M353 PolarHBondContact O-N 3.1Å; M353-G355 PolarHBondContact O-N 3.3Å; M353-R356 WeakPolarHBondContact O-CB 3.27Å; M353-R356 PolarHBondContact O-N 3.36Å; M353-R356 WeakPolarHBondContact SD-CD 3.45Å; M353-R356 PolarHBondContact SD-NH1 2.81Å; M353-V358 HydrophobicContact CE-CG2 4.42Å; M353-L363 HydrophobicContact CE-CD1 4.26Å; M353-V365 HydrophobicContact CB-CG2 3.91Å
354	N	93.1	Very high	91.4	Very high	76 Å²	76	64.5 Å²	64.5	41%	0.406	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	118.6	177.6	-174.5	44.6	0	0	0	111	V350 Y364 V365	V350-N354 WeakPolarHBondContact O-CB 3.37Å; V350-N354 PolarHBondContact O-N 2.92Å; N354-Y364 WeakPolarHBondContact OD1-CA 3.34Å; N354-V365 HydrophobicContact CB-CB 4.03Å; N354-V365 PolarHBondContact OD1-N 2.87Å; N354-V365 PolarHBondContact OD1-O 2.86Å
355	G	89	Confident	91.5	Very high	48 Å²	48	57 Å²	57	50%	0.495	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-12	-173.3	0	0	0	0	0	114.4	M353 I357 L363	M353-G355 PolarHBondContact O-N 3.3Å; G355-I357 PolarHBondContact O-N 2.91Å; G355-L363 WeakPolarHBondContact CA-O 3.38Å; G355-L363 PolarHBondContact N-O 3.29Å
356	R	90.9	Very high	91.4	Very high	111 Å²	111	56.4 Å²	56.4	42%	0.419	31%	0.312	S	S	.	.			trans	-67.8	130.6	-179.8	-170.8	-178.4	-180	-179.6	-1.4	110.7	Y317 M353 V358 L363	Y317-R356 PolarHBondContact OH-NH1 2.99Å; M353-R356 WeakPolarHBondContact O-CB 3.27Å; M353-R356 PolarHBondContact O-N 3.36Å; M353-R356 WeakPolarHBondContact SD-CD 3.45Å; M353-R356 PolarHBondContact SD-NH1 2.81Å; R356-V358 PolarHBondContact O-N 3.11Å; R356-L363 PolarHBondContact O-N 2.81Å
357	I	89.7	Confident	91.3	Very high	117 Å²	117	60.8 Å²	60.8	60%	0.6	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	125	174.1	-59.5	172.2	0	0	0	109.1	G355 P362	G355-I357 PolarHBondContact O-N 2.91Å; I357-P362 HydrophobicContact CG1-CB 4.04Å
358	V	84.9	Confident	91.1	Very high	6 Å²	6	58.3 Å²	58.3	4%	0.036	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.3	173.2	177.6	0	0	0	0	107.7	I305 E313 M353 R356 T360 K361 L363	I305-V358 HydrophobicContact CD1-CB 4.5Å; I305-V358 HydrophobicContact CD1-CG1 3.84Å; E313-V358 HydrophobicContact CG-CG1 4.05Å; M353-V358 HydrophobicContact CE-CG2 4.42Å; R356-V358 PolarHBondContact O-N 3.11Å; V358-T360 PolarHBondContact O-N 3.48Å; V358-K361 PolarHBondContact N-O 3.44Å; V358-K361 PolarHBondContact O-N 3.47Å; V358-L363 HydrophobicContact CB-CD1 4.11Å; V358-L363 HydrophobicContact CB-CD2 4.27Å; V358-L363 HydrophobicContact CB-CG 4.08Å; V358-L363 HydrophobicContact CG2-CD1 3.64Å; V358-L363 HydrophobicContact CG2-CG 3.91Å
359	A	84.4	Confident	90.6	Very high	55 Å²	55	57.8 Å²	57.8	46%	0.455	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	-99.4	-160.9	0	0	0	0	0	111.8	D302	D302-A359 HydrophobicContact CB-CB 4.14Å
360	T	86.7	Confident	89.9	Confident	99 Å²	99	61.9 Å²	61.9	61%	0.607	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.5	-14.5	-172	54.2	0	0	0	0	114.1	D302 V358	D302-T360 PolarHBondContact OD2-OG1 3.29Å; D302-T360 VanDerWaalsContact OD2-OG1 3.11Å; V358-T360 PolarHBondContact O-N 3.48Å
361	K	89.7	Confident	89.3	Confident	50 Å²	50	71.3 Å²	71.3	22%	0.217	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.3	-167.2	-69.7	165	-172.1	152.2	0	111	N300 D302 D303 V358 L363	N300-K361 WeakPolarHBondContact O-CB 3.46Å; D302-K361 HydrophobicContact CB-CD 4.11Å; D302-K361 VanDerWaalsContact OD2-CE 3.24Å; D302-K361 WeakPolarHBondContact OD2-CE 3.33Å; D302-K361 IonicContact OD2-NZ 2.63Å; D302-K361 PolarHBondContact OD2-NZ 3.25Å; D303-K361 VanDerWaalsContact CG-NZ 3.32Å; D303-K361 IonicContact OD1-NZ 2.7Å; D303-K361 PolarHBondContact OD1-NZ 3.34Å; D303-K361 IonicContact OD2-NZ 2.72Å; D303-K361 PolarHBondContact OD2-NZ 3.25Å; V358-K361 PolarHBondContact N-O 3.44Å; V358-K361 PolarHBondContact O-N 3.47Å; K361-L363 PolarHBondContact O-N 3.48Å
362	P	92.2	Very high	88.8	Confident	64 Å²	64	72.4 Å²	72.4	42%	0.416	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	123.1	171.1	28.3	-32.4	0	0	0	110.1	N300 I357	N300-P362 WeakPolarHBondContact CB-O 3.34Å; N300-P362 PolarHBondContact ND2-O 3.11Å; I357-P362 HydrophobicContact CG1-CB 4.04Å
363	L	93.9	Very high	88.2	Confident	5 Å²	5	72.6 Å²	72.6	3%	0.026	37%	0.367	C	S	.	.			trans	-69.7	147.7	179	-59.7	-169.1	0	0	0	111.4	V298 L301 F314 M353 G355 R356 V358 K361 V365	V298-L363 HydrophobicContact CG1-CD1 4.16Å; L301-L363 HydrophobicContact CD2-CD2 3.92Å; F314-L363 HydrophobicContact CE2-CD1 4.02Å; F314-L363 HydrophobicContact CZ-CD1 4.25Å; M353-L363 HydrophobicContact CE-CD1 4.26Å; G355-L363 WeakPolarHBondContact CA-O 3.38Å; G355-L363 PolarHBondContact N-O 3.29Å; R356-L363 PolarHBondContact O-N 2.81Å; V358-L363 HydrophobicContact CB-CD1 4.11Å; V358-L363 HydrophobicContact CB-CD2 4.27Å; V358-L363 HydrophobicContact CB-CG 4.08Å; V358-L363 HydrophobicContact CG2-CD1 3.64Å; V358-L363 HydrophobicContact CG2-CG 3.91Å; K361-L363 PolarHBondContact O-N 3.48Å; L363-V365 HydrophobicContact CB-CG2 4.26Å
364	Y	93.1	Very high	87.5	Confident	109 Å²	109	78 Å²	78	43%	0.427	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	120.8	165.2	171.4	-95.5	0	0	0	108.7	Y297 V298 K299 N354 A366	Y297-Y364 HydrophobicContact CD1-CD1 4.41Å; Y297-Y364 HydrophobicContact CD1-CE1 4.24Å; Y297-Y364 HydrophobicContact CE1-CD1 4.37Å; Y297-Y364 HydrophobicContact CE1-CE1 4.35Å; V298-Y364 CarbonylContact C-O 3.57Å; V298-Y364 WeakPolarHBondContact CA-O 3.36Å; K299-Y364 HydrophobicContact CB-CD1 4.05Å; K299-Y364 PolarHBondContact N-O 3.21Å; K299-Y364 PolarHBondContact O-N 3.29Å; N354-Y364 WeakPolarHBondContact OD1-CA 3.34Å; Y364-A366 HydrophobicContact CE1-CB 3.99Å
365	V	94.6	Very high	86.9	Confident	2 Å²	2	81.5 Å²	81.5	1%	0.012	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128.2	-175.6	-171.6	0	0	0	0	109.5	L296 V298 F314 V350 M353 N354 L363	L296-V365 HydrophobicContact CB-CG1 4.39Å; L296-V365 HydrophobicContact CD1-CG1 3.79Å; V298-V365 HydrophobicContact CG1-CG2 4.28Å; V298-V365 HydrophobicContact CG2-CG1 4.39Å; V298-V365 HydrophobicContact CG2-CG2 4.43Å; F314-V365 HydrophobicContact CE1-CG1 4.12Å; F314-V365 HydrophobicContact CE1-CG2 4.25Å; F314-V365 HydrophobicContact CZ-CG1 4.48Å; F314-V365 HydrophobicContact CZ-CG2 3.86Å; V350-V365 HydrophobicContact CG2-CG1 4.12Å; M353-V365 HydrophobicContact CB-CG2 3.91Å; N354-V365 HydrophobicContact CB-CB 4.03Å; N354-V365 PolarHBondContact OD1-N 2.87Å; N354-V365 PolarHBondContact OD1-O 2.86Å; L363-V365 HydrophobicContact CB-CG2 4.26Å
366	A	92.6	Very high	86.6	Confident	22 Å²	22	82 Å²	82	18%	0.182	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	165.6	178	0	0	0	0	0	111.3	L296 Y297 Y364	L296-A366 CarbonylContact C-O 3.51Å; L296-A366 WeakPolarHBondContact CA-O 3.45Å; Y297-A366 PolarHBondContact N-O 2.92Å; Y297-A366 PolarHBondContact O-N 3.36Å; Y297-A366 VanDerWaalsContact O-N 3.12Å; Y364-A366 HydrophobicContact CE1-CB 3.99Å
367	L	91.4	Very high	86.2	Confident	92 Å²	92	80.6 Å²	80.6	48%	0.482	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	136.6	171.9	-63	178.1	0	0	0	111.5	G293 L296 Q369	G293-L367 VanDerWaalsContact O-CD2 3.3Å; G293-L367 WeakPolarHBondContact O-CD2 3.17Å; L296-L367 HydrophobicContact CD2-CD2 3.77Å; L367-Q369 PolarHBondContact O-N 3.02Å
368	A	87.1	Confident	85.7	Confident	25 Å²	25	80 Å²	80	21%	0.207	40%	0.396	C	S	.	.			trans	-78	87.2	-172.2	0	0	0	0	0	113.6	N295 F337	N295-A368 HydrophobicContact CB-CB 4.21Å; N295-A368 WeakPolarHBondContact ND2-CB 3.06Å; N295-A368 WeakPolarHBondContact O-CB 3.34Å; N295-A368 PolarHBondContact O-N 3.39Å; F337-A368 HydrophobicContact CD1-CB 3.99Å; F337-A368 HydrophobicContact CE1-CB 4.08Å
369	Q	84	Confident	85.7	Confident	95 Å²	95	82.9 Å²	82.9	44%	0.444	41%	0.414	S	S	.	.			trans	-64.7	139	171.1	-66.1	178.3	-9	0	0	112.2	L367 R374	L367-Q369 PolarHBondContact O-N 3.02Å; Q369-R374 HydrophobicContact CB-CB 4.26Å
370	R	79.8	Confident	85.7	Confident	86 Å²	86	85.2 Å²	85.2	33%	0.325	42%	0.419	S	S	.	.			trans	-72.5	152.3	177.1	-72.4	-172.1	173.3	-168.3	3.6	111.5	R287 E372 E373 R374	R287-R370 VanDerWaalsContact C-NH2 3.35Å; R287-R370 PolarHBondContact O-NH2 3.44Å; R370-E372 VanDerWaalsContact C-N 3.28Å; R370-E372 PolarHBondContact O-N 3.36Å; R370-E373 HydrophobicContact CB-CB 4.26Å; R370-E373 PolarHBondContact N-OE2 3.11Å; R370-E373 PolarHBondContact O-N 3.42Å; R370-R374 VanDerWaalsContact O-CB 3.28Å; R370-R374 WeakPolarHBondContact O-CB 3.38Å; R370-R374 PolarHBondContact O-N 3.3Å
371	R	80.4	Confident	85.5	Confident	233 Å²	233	87 Å²	87	88%	0.879	42%	0.418	S	S	*	.	H	α-helix	trans	-56.8	-38.7	-180	-172.5	-179.8	-177.9	-173	1.4	113	K375	R371-K375 VanDerWaalsContact O-CB 3.28Å; R371-K375 WeakPolarHBondContact O-CB 3.39Å; R371-K375 PolarHBondContact O-N 2.93Å
372	E	81.7	Confident	85	Confident	129 Å²	129	91.8 Å²	91.8	60%	0.603	44%	0.436	S	S	*	.	H	α-helix	trans	-66	-53.7	178	-62.1	176.7	158.7	0	0	111.2	K284 R370 K375 A376	K284-E372 IonicContact NZ-OE2 3.85Å; R370-E372 VanDerWaalsContact C-N 3.28Å; R370-E372 PolarHBondContact O-N 3.36Å; E372-K375 WeakPolarHBondContact O-CB 3.22Å; E372-K375 PolarHBondContact O-N 3.46Å; E372-A376 PolarHBondContact O-N 3.35Å
373	E	80.2	Confident	84.4	Confident	100 Å²	100	93.5 Å²	93.5	47%	0.467	44%	0.439	S	S	.	.	H	α-helix	trans	-58.9	-50.5	177.5	174.4	-172.6	-150.1	0	0	112.1	R370 K375 A376 I377	R370-E373 HydrophobicContact CB-CB 4.26Å; R370-E373 PolarHBondContact N-OE2 3.11Å; R370-E373 PolarHBondContact O-N 3.42Å; E373-K375 VanDerWaalsContact C-N 3.28Å; E373-K375 PolarHBondContact O-N 3.49Å; E373-A376 WeakPolarHBondContact O-CA 3.28Å; E373-A376 WeakPolarHBondContact O-CB 3.29Å; E373-A376 PolarHBondContact O-N 2.83Å; E373-I377 HydrophobicContact CG-CD1 3.94Å; E373-I377 WeakPolarHBondContact O-CG1 3.38Å; E373-I377 PolarHBondContact O-N 3.36Å
374	R	77.4	Confident	83.8	Confident	114 Å²	114	99.6 Å²	99.6	43%	0.43	47%	0.468	S	S	.	.	H	α-helix	trans	-60.3	-37	176.2	-174	172.7	179	149.5	2.8	111.9	Q369 R370 L378	Q369-R374 HydrophobicContact CB-CB 4.26Å; R370-R374 VanDerWaalsContact O-CB 3.28Å; R370-R374 WeakPolarHBondContact O-CB 3.38Å; R370-R374 PolarHBondContact O-N 3.3Å; R374-L378 HydrophobicContact CG-CD1 4.11Å; R374-L378 WeakPolarHBondContact O-CB 3.36Å; R374-L378 WeakPolarHBondContact O-CD1 3.43Å; R374-L378 WeakPolarHBondContact O-CG 3.42Å; R374-L378 PolarHBondContact O-N 2.99Å
375	K	81.7	Confident	83.1	Confident	149 Å²	149	102.6 Å²	102.6	65%	0.648	48%	0.478	S	S	*	.	H	α-helix	trans	-64.6	-45.5	172.4	-173.6	-179.7	178.8	-174.9	0	110.7	R371 E372 E373 L378 T379	R371-K375 VanDerWaalsContact O-CB 3.28Å; R371-K375 WeakPolarHBondContact O-CB 3.39Å; R371-K375 PolarHBondContact O-N 2.93Å; E372-K375 WeakPolarHBondContact O-CB 3.22Å; E372-K375 PolarHBondContact O-N 3.46Å; E373-K375 VanDerWaalsContact C-N 3.28Å; E373-K375 PolarHBondContact O-N 3.49Å; K375-L378 PolarHBondContact O-N 3.46Å; K375-T379 WeakPolarHBondContact O-CB 3.17Å; K375-T379 PolarHBondContact O-N 3.16Å; K375-T379 PolarHBondContact O-OG1 2.95Å; K375-T379 VanDerWaalsContact O-OG1 3.07Å
376	A	81.9	Confident	82.1	Confident	60 Å²	60	106.1 Å²	106.1	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-45.9	177.6	0	0	0	0	0	112.3	E372 E373 L378 T379 N380	E372-A376 PolarHBondContact O-N 3.35Å; E373-A376 WeakPolarHBondContact O-CA 3.28Å; E373-A376 WeakPolarHBondContact O-CB 3.29Å; E373-A376 PolarHBondContact O-N 2.83Å; A376-L378 PolarHBondContact O-N 2.98Å; A376-T379 PolarHBondContact O-N 3.06Å; A376-N380 WeakPolarHBondContact O-CB 2.99Å; A376-N380 PolarHBondContact O-N 3.3Å
377	I	81.8	Confident	81.1	Confident	80 Å²	80	107.7 Å²	107.7	41%	0.41	51%	0.509	S	S	.	.	H	α-helix	trans	-59.5	-45.7	175.6	-66.8	166.6	0	0	0	110.9	E373 N380 K381	E373-I377 HydrophobicContact CG-CD1 3.94Å; E373-I377 WeakPolarHBondContact O-CG1 3.38Å; E373-I377 PolarHBondContact O-N 3.36Å; I377-N380 PolarHBondContact O-N 3.38Å; I377-K381 VanDerWaalsContact O-CB 3.28Å; I377-K381 WeakPolarHBondContact O-CB 3.39Å; I377-K381 PolarHBondContact O-N 3.01Å
378	L	80.3	Confident	80.2	Confident	106 Å²	106	107.3 Å²	107.3	56%	0.555	51%	0.511	S	S	*	.	H	α-helix	trans	-64.8	-44.2	177.6	-74.4	168.7	0	0	0	112.3	R374 K375 A376 K381 Y382	R374-L378 HydrophobicContact CG-CD1 4.11Å; R374-L378 WeakPolarHBondContact O-CB 3.36Å; R374-L378 WeakPolarHBondContact O-CD1 3.43Å; R374-L378 WeakPolarHBondContact O-CG 3.42Å; R374-L378 PolarHBondContact O-N 2.99Å; K375-L378 PolarHBondContact O-N 3.46Å; A376-L378 PolarHBondContact O-N 2.98Å; L378-K381 PolarHBondContact O-N 3.27Å; L378-Y382 WeakPolarHBondContact O-CB 3.35Å; L378-Y382 PolarHBondContact O-N 3.21Å
379	T	84.1	Confident	79	Confident	66 Å²	66	111.4 Å²	111.4	41%	0.405	53%	0.529	S	S	.	.	H	α-helix	trans	-63.5	-41.6	176.3	-62.4	0	0	0	0	111.4	K375 A376 Y382 M383	K375-T379 WeakPolarHBondContact O-CB 3.17Å; K375-T379 PolarHBondContact O-N 3.16Å; K375-T379 PolarHBondContact O-OG1 2.95Å; K375-T379 VanDerWaalsContact O-OG1 3.07Å; A376-T379 PolarHBondContact O-N 3.06Å; T379-Y382 PolarHBondContact O-N 2.92Å; T379-M383 HydrophobicContact CG2-CE 4.38Å; T379-M383 WeakPolarHBondContact O-CG 3.41Å; T379-M383 PolarHBondContact O-N 3.46Å
380	N	84.4	Confident	77.9	Confident	103 Å²	103	117 Å²	117	55%	0.551	55%	0.546	S	S	*	.	H	α-helix	trans	-68	-42.5	178.2	-156.7	20.6	0	0	0	111.5	A376 I377 Y382 M383 Q384	A376-N380 WeakPolarHBondContact O-CB 2.99Å; A376-N380 PolarHBondContact O-N 3.3Å; I377-N380 PolarHBondContact O-N 3.38Å; N380-Y382 VanDerWaalsContact C-N 3.28Å; N380-Y382 PolarHBondContact O-N 2.82Å; N380-M383 PolarHBondContact O-N 3.06Å; N380-Q384 WeakPolarHBondContact O-CB 3.45Å; N380-Q384 PolarHBondContact O-N 2.88Å
381	K	84.1	Confident	76.7	Confident	138 Å²	138	117.9 Å²	117.9	60%	0.6	56%	0.561	S	S	*	*	H	α-helix	trans	-63.6	-31.8	174.3	-167.4	168.6	-173.4	168.1	0	112.7	I377 L378 R385	I377-K381 VanDerWaalsContact O-CB 3.28Å; I377-K381 WeakPolarHBondContact O-CB 3.39Å; I377-K381 PolarHBondContact O-N 3.01Å; L378-K381 PolarHBondContact O-N 3.27Å; K381-R385 PolarHBondContact O-N 2.9Å; K381-R385 VanDerWaalsContact O-N 3.15Å
382	Y	78.6	Confident	75.4	Confident	150 Å²	150	114.7 Å²	114.7	59%	0.588	56%	0.558	S	S	*	*	H	α-helix	trans	-70	-46.4	172.1	178.8	-103.2	0	0	0	112	L378 T379 N380 Q384 R385 L386	L378-Y382 WeakPolarHBondContact O-CB 3.35Å; L378-Y382 PolarHBondContact O-N 3.21Å; T379-Y382 PolarHBondContact O-N 2.92Å; N380-Y382 VanDerWaalsContact C-N 3.28Å; N380-Y382 PolarHBondContact O-N 2.82Å; Y382-Q384 VanDerWaalsContact C-N 3.33Å; Y382-Q384 PolarHBondContact O-N 2.94Å; Y382-R385 PolarHBondContact O-N 3.3Å; Y382-L386 HydrophobicContact CD1-CD1 3.98Å; Y382-L386 HydrophobicContact CE1-CD1 3.48Å; Y382-L386 VanDerWaalsContact CE1-CD1 3.48Å; Y382-L386 HydrophobicContact CE1-CG 4.38Å; Y382-L386 PolarHBondContact O-N 2.94Å
383	M	80.4	Confident	73.7	Confident	99 Å²	99	112.6 Å²	112.6	49%	0.488	56%	0.558	S	S	.	*	H	α-helix	trans	-61.4	-40.1	174.1	-70.8	-167.1	-63.8	0	0	112.3	T379 N380 R385 L386 A387	T379-M383 HydrophobicContact CG2-CE 4.38Å; T379-M383 WeakPolarHBondContact O-CG 3.41Å; T379-M383 PolarHBondContact O-N 3.46Å; N380-M383 PolarHBondContact O-N 3.06Å; M383-R385 VanDerWaalsContact C-N 3.32Å; M383-R385 PolarHBondContact O-N 2.92Å; M383-L386 PolarHBondContact O-N 2.82Å; M383-A387 PolarHBondContact O-N 2.96Å
384	Q	79.9	Confident	71.5	Confident	133 Å²	133	114.6 Å²	114.6	62%	0.621	57%	0.572	S	S	*	*	H	α-helix	trans	-64.7	-34.6	176.8	-164.1	177.9	25	0	0	112.4	N380 Y382 A387 T388	N380-Q384 WeakPolarHBondContact O-CB 3.45Å; N380-Q384 PolarHBondContact O-N 2.88Å; Y382-Q384 VanDerWaalsContact C-N 3.33Å; Y382-Q384 PolarHBondContact O-N 2.94Å; Q384-A387 PolarHBondContact O-N 3Å; Q384-T388 PolarHBondContact O-N 3.27Å; Q384-T388 VanDerWaalsContact O-N 3.1Å; Q384-T388 PolarHBondContact O-OG1 3.32Å; Q384-T388 VanDerWaalsContact O-OG1 3.05Å
385	R	78.9	Confident	69.8	Low	172 Å²	172	114.6 Å²	114.6	65%	0.649	59%	0.587	S	S	*	*	H	α-helix	trans	-69.8	-37	172	-178.1	178.7	-75.9	179.5	-7.1	112.6	K381 Y382 M383 A387 T388 L389	K381-R385 PolarHBondContact O-N 2.9Å; K381-R385 VanDerWaalsContact O-N 3.15Å; Y382-R385 PolarHBondContact O-N 3.3Å; M383-R385 VanDerWaalsContact C-N 3.32Å; M383-R385 PolarHBondContact O-N 2.92Å; R385-A387 VanDerWaalsContact C-N 3.33Å; R385-T388 PolarHBondContact O-OG1 3.22Å; R385-L389 HydrophobicContact CG-CD1 4.45Å; R385-L389 PolarHBondContact O-N 2.82Å; R385-L389 VanDerWaalsContact O-N 3.12Å
386	L	73.9	Confident	68	Low	77 Å²	77	114.9 Å²	114.9	40%	0.403	59%	0.593	S	S	.	*	H	α-helix	trans	-66.4	-35.3	172.6	-76.4	170.7	0	0	0	112.1	Y382 M383 R390	Y382-L386 HydrophobicContact CD1-CD1 3.98Å; Y382-L386 HydrophobicContact CE1-CD1 3.48Å; Y382-L386 VanDerWaalsContact CE1-CD1 3.48Å; Y382-L386 HydrophobicContact CE1-CG 4.38Å; Y382-L386 PolarHBondContact O-N 2.94Å; M383-L386 PolarHBondContact O-N 2.82Å; L386-R390 PolarHBondContact O-N 2.82Å
387	A	71.4	Confident	65.6	Low	54 Å²	54	119.8 Å²	119.8	45%	0.446	61%	0.61	S	S	.	*	H	α-helix	trans	-66	-44.9	174.7	0	0	0	0	0	112.2	M383 Q384 R385 L389 R390 T391	M383-A387 PolarHBondContact O-N 2.96Å; Q384-A387 PolarHBondContact O-N 3Å; R385-A387 VanDerWaalsContact C-N 3.33Å; A387-L389 PolarHBondContact O-N 2.76Å; A387-R390 PolarHBondContact O-N 3.39Å; A387-T391 PolarHBondContact O-N 2.72Å
388	T	72.5	Confident	63.2	Low	84 Å²	84	122.3 Å²	122.3	52%	0.515	62%	0.624	S	S	.	*	H	α-helix	trans	-71.6	-25.5	178.8	41.3	0	0	0	0	114.3	Q384 R385 T391	Q384-T388 PolarHBondContact O-N 3.27Å; Q384-T388 VanDerWaalsContact O-N 3.1Å; Q384-T388 PolarHBondContact O-OG1 3.32Å; Q384-T388 VanDerWaalsContact O-OG1 3.05Å; R385-T388 PolarHBondContact O-OG1 3.22Å; T388-T391 WeakPolarHBondContact CA-OG1 3.31Å; T388-T391 PolarHBondContact O-N 2.93Å; T388-T391 PolarHBondContact O-OG1 2.99Å
389	L	61.9	Low	60.9	Low	111 Å²	111	121.8 Å²	121.8	58%	0.581	63%	0.629	S	S	*	*	H	α-helix	trans	-67.2	-39.7	168.8	-80.3	164.7	0	0	0	111.9	R385 A387 T391 M392	R385-L389 HydrophobicContact CG-CD1 4.45Å; R385-L389 PolarHBondContact O-N 2.82Å; R385-L389 VanDerWaalsContact O-N 3.12Å; A387-L389 PolarHBondContact O-N 2.76Å; L389-T391 PolarHBondContact O-N 3.12Å; L389-M392 PolarHBondContact O-N 3.3Å
390	R	60.2	Low	58.3	Low	212 Å²	212	129.5 Å²	129.5	80%	0.8	65%	0.652	S	S	*	*	H	α-helix	trans	-66	-20.8	176.4	-75.2	178	172.3	173.8	-1.9	114.1	L386 A387	L386-R390 PolarHBondContact O-N 2.82Å; A387-R390 PolarHBondContact O-N 3.39Å
391	T	55.5	Low	56.3	Low	106 Å²	106	130 Å²	130	65%	0.65	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-5.2	175.5	50.8	0	0	0	0	114.2	A387 T388 L389	A387-T391 PolarHBondContact O-N 2.72Å; T388-T391 WeakPolarHBondContact CA-OG1 3.31Å; T388-T391 PolarHBondContact O-N 2.93Å; T388-T391 PolarHBondContact O-OG1 2.99Å; L389-T391 PolarHBondContact O-N 3.12Å
392	M	53	Low	53.7	Low	165 Å²	165	132.4 Å²	132.4	81%	0.813	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-9.8	-179.8	-74.5	-73.4	168.1	0	0	113.6	L389	L389-M392 PolarHBondContact O-N 3.3Å
393	S	45	Very low	51.5	Low	85 Å²	85	130.8 Å²	130.8	59%	0.594	69%	0.685	S	S	*	*			trans	-103.8	68.1	-176.4	62.8	0	0	0	0	112.3
394	N	34.8	Very low	49	Very low	143 Å²	143	129.3 Å²	129.3	77%	0.765	70%	0.696	S	S	*	*			trans	-145.5	76.7	175.9	-153.9	89.7	0	0	0	112.2
395	P	42.6	Very low	46.6	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	71%	0.707	S	S	*	*			trans	-65.4	141	175.6	29.4	-34.5	0	0	0	110.9
396	I	42.2	Very low	44.1	Very low	154 Å²	154	134.8 Å²	134.8	79%	0.79	71%	0.714	S	S	*	*			trans	-81.6	119.9	176.5	-61.7	166	0	0	0	108.4
397	I	31.9	Very low	42	Very low	164 Å²	164	138.6 Å²	138.6	84%	0.841	73%	0.731	S	S	*	*			trans	-130.6	132.5	159.2	-66.6	-176.5	0	0	0	106.3
398	D	31.7	Very low	40	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	75%	0.749	S	S	*	*			trans	-93	175.9	-167.7	-141.1	-50.6	0	0	0	113.2
399	S	32.2	Very low	38.2	Very low	95 Å²	95	144.4 Å²	144.4	66%	0.664	76%	0.761	S	S	*	*			trans	-65.3	160.4	-178.3	54.6	0	0	0	0	115.5
400	Y	29.9	Very low	37.6	Very low	228 Å²	228	144.2 Å²	144.2	89%	0.894	77%	0.767	S	S	*	*			trans	-126.5	123.1	166.9	-105.9	-92.1	0	0	0	109.4
401	P	41.5	Very low	36.1	Very low	115 Å²	115	142.4 Å²	142.4	75%	0.747	77%	0.767	S	S	*	*			trans	-89.3	166.7	169.7	36	-33.5	0	0	0	111.6
402	Q	30.6	Very low	35.7	Very low	187 Å²	187	142.4 Å²	142.4	87%	0.874	77%	0.769	S	S	*	*			trans	-93.9	130.6	170.8	-92.3	-153.2	-20.9	0	0	113.4
403	S	31.1	Very low	36.3	Very low	116 Å²	116	140.1 Å²	140.1	81%	0.811	77%	0.767	S	S	*	*			trans	43.9	114.7	139.5	-56.1	0	0	0	0	120.7
404	G	27.9	Very low	35.7	Very low	69 Å²	69	142.7 Å²	142.7	71%	0.711	78%	0.779	S	S	*	*			trans	-158.3	52.3	173.1	0	0	0	0	0	115.7
405	Y	29.5	Very low	35.6	Very low	215 Å²	215	146.4 Å²	146.4	84%	0.843	78%	0.782	S	S	*	*			trans	71.8	127.3	160.8	-67	-72.4	0	0	0	122.8
406	Y	27.4	Very low	35.1	Very low	204 Å²	204	145.8 Å²	145.8	80%	0.8	78%	0.781	S	S	*	*			trans	64	119.3	150.3	-73.1	-65.7	0	0	0	124.6
407	M	28.9	Very low	34.5	Very low	157 Å²	157	146.5 Å²	146.5	77%	0.773	78%	0.778	S	S	*	*			trans	44.7	138.6	137.2	-73.4	-68.4	-173	0	0	120.6
408	T	29.3	Very low	34.6	Very low	132 Å²	132	148 Å²	148	81%	0.81	78%	0.775	S	S	*	*			cis	-147.6	-159.3	49.7	47.1	0	0	0	0	114.3
409	V	34.8	Very low	34.6	Very low	128 Å²	128	147.7 Å²	147.7	78%	0.776	77%	0.773	S	S	*	*			trans	-112.6	-179.2	-163.8	-117.6	0	0	0	0	112.4
410	P	49.6	Very low	34.6	Very low	108 Å²	108	150.2 Å²	150.2	70%	0.701	77%	0.774	S	S	*	*			trans	-127.4	-172.1	-130.3	43.9	-26.6	0	0	0	117.7
411	Q	29.1	Very low	34.8	Very low	174 Å²	174	144.4 Å²	144.4	81%	0.813	77%	0.767	S	S	*	*			trans	78.7	157.2	157.3	-84.4	-150.1	32.5	0	0	119.6
412	P	47.3	Very low	34.6	Very low	106 Å²	106	142.9 Å²	142.9	69%	0.688	76%	0.764	S	S	*	*			cis	-137.9	-139.8	-29.2	47.5	-28.6	0	0	0	112.1
413	P	65.3	Low	34.9	Very low	117 Å²	117	140.4 Å²	140.4	76%	0.76	76%	0.761	S	S	*	*			trans	-135.3	161.9	-145.7	39.7	-15.8	0	0	0	119.7
414	T	32.3	Very low	35	Very low	138 Å²	138	139.4 Å²	139.4	85%	0.847	75%	0.754	S	S	*	*			trans	-148.1	132.3	165.3	50.2	0	0	0	0	116.6
415	R	32.6	Very low	35.3	Very low	222 Å²	222	143 Å²	143	84%	0.838	76%	0.757	S	S	*	*			trans	21.6	126.9	138.5	-68.4	-179.4	176.8	-169.3	-2	119.8
416	S	31.2	Very low	35.5	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	76%	0.756	S	S	*	*				100.6	143.1	58.3	-66.2	0	0	0	0	113.1
417	F	30.6	Very low	35.7	Very low	169 Å²	169	141.7 Å²	141.7	74%	0.741	76%	0.76	S	S	*	*			trans	150	119.7	133.5	-93.5	-96.2	0	0	0	115.9
418	Y	34	Very low	36.6	Very low	196 Å²	196	139.2 Å²	139.2	77%	0.769	76%	0.756	S	S	*	*			trans	54.7	126.5	141.3	-78.5	-119.1	0	0	0	124.9
419	N	30.9	Very low	36.7	Very low	125 Å²	125	139.7 Å²	139.7	67%	0.668	76%	0.758	S	S	*	*				32.4	156.3	118.4	-91.2	11.6	0	0	0	122.2
420	H	32.5	Very low	37.4	Very low	147 Å²	147	138.7 Å²	138.7	68%	0.681	75%	0.754	S	S	*	*			cis	-164.4	153	32.1	-135.7	-55.4	0	0	0	115
421	S	34	Very low	36.5	Very low	107 Å²	107	145 Å²	145	75%	0.748	76%	0.764	S	S	*	*			trans	62	155.1	152.5	51.8	0	0	0	0	119.9
422	A	37.7	Very low	36.8	Very low	83 Å²	83	147.7 Å²	147.7	69%	0.686	77%	0.767	S	S	*	*			cis	-145.1	146.7	16.1	0	0	0	0	0	111.8
423	V	36.4	Very low	36.1	Very low	134 Å²	134	151.1 Å²	151.1	81%	0.812	78%	0.776	S	S	*	*				60.8	129.1	98	178.3	0	0	0	0	113.7
424	S	34.3	Very low	34.5	Very low	95 Å²	95	148.8 Å²	148.8	66%	0.664	77%	0.773	S	S	*	*			cis	-173.3	172.6	-9.7	-95.2	0	0	0	0	107.6
425	N	34.3	Very low	34.6	Very low	144 Å²	144	151 Å²	151	77%	0.77	77%	0.774	S	S	*	*			cis	-143	-138.3	-0.2	-127.9	-35.7	0	0	0	107.8
426	L	31.9	Very low	35.7	Very low	157 Å²	157	145.3 Å²	145.3	82%	0.822	77%	0.765	S	S	*	*			cis	-143.3	-168	3.7	-101.1	-175.2	0	0	0	109.7
427	R	33.2	Very low	36.4	Very low	236 Å²	236	146.7 Å²	146.7	89%	0.891	77%	0.772	S	S	*	*			trans	-159.6	-166.1	-178.3	-111.4	-173.3	-172.2	-171	5.3	109.1
428	P	47.2	Very low	36.4	Very low	105 Å²	105	150.4 Å²	150.4	68%	0.682	78%	0.781	S	S	*	*			cis	-136.1	178.9	1.2	40.2	-21.8	0	0	0	116.7
429	V	31.6	Very low	36.4	Very low	141 Å²	141	145.4 Å²	145.4	86%	0.855	78%	0.78	S	S	*	*			trans	-133.5	131.8	142.5	-179.2	0	0	0	0	107.7
430	P	49.3	Very low	36.4	Very low	107 Å²	107	148.7 Å²	148.7	70%	0.695	79%	0.792	S	S	*	*			trans	-100	158.6	-170.1	36.7	-34.4	0	0	0	115.1
431	R	30.2	Very low	36.3	Very low	241 Å²	241	145.2 Å²	145.2	91%	0.909	80%	0.796	S	S	*	*			trans	-151.3	135.6	166.4	-166.8	-178.3	-168.2	-165.1	3.8	110.7
432	W	36.2	Very low	37.2	Very low	230 Å²	230	145.3 Å²	145.3	87%	0.871	79%	0.794	S	S	*	*			trans	-124.4	165.4	169.3	-68.5	91.2	0	0	0	108.5
433	M	31.5	Very low	37	Very low	178 Å²	178	151.1 Å²	151.1	88%	0.877	80%	0.799	S	S	*	*			cis	-131.7	172.1	11.6	-60.6	171.2	176.6	0	0	112.1
434	G	31.9	Very low	36.7	Very low	68 Å²	68	149.9 Å²	149.9	70%	0.701	80%	0.796	S	S	*	*			trans	-81.8	-164.9	155.5	0	0	0	0	0	111.3
435	Q	35.6	Very low	36.6	Very low	185 Å²	185	149.2 Å²	149.2	86%	0.864	80%	0.797	S	S	*	*			cis	-163.7	-153.2	7.9	-132.1	-168.5	45.2	0	0	106.5
436	P	54.3	Low	36.4	Very low	102 Å²	102	151 Å²	151	66%	0.662	80%	0.801	S	S	*	*				-110.7	-153.9	-62.4	39.7	-22.8	0	0	0	109.6
437	P	46.2	Very low	36.2	Very low	131 Å²	131	154.4 Å²	154.4	85%	0.851	80%	0.804	S	S	*	*			cis	-126.2	-157.6	-5	42.5	-23.5	0	0	0	115
438	R	31.6	Very low	36.1	Very low	247 Å²	247	151.4 Å²	151.4	93%	0.932	80%	0.804	S	S	*	*			trans	-157	129.1	-151.8	171.1	-161.4	-173.4	-168.2	4.4	113
439	A	33	Very low	35.2	Very low	90 Å²	90	149.6 Å²	149.6	74%	0.744	80%	0.804	S	S	*	*			trans	175.5	159	159.6	0	0	0	0	0	109.3
440	Q	31.9	Very low	35.3	Very low	195 Å²	195	148.4 Å²	148.4	91%	0.911	80%	0.803	S	S	*	*			cis	-165	154.5	-22.3	-112.4	-177.9	-17.3	0	0	108.5
441	G	29.6	Very low	34.8	Very low	74 Å²	74	149.5 Å²	149.5	76%	0.763	81%	0.809	S	S	*	*			trans	88.1	159.5	148.9	0	0	0	0	0	119.9
442	P	53.3	Low	35	Very low	109 Å²	109	145.3 Å²	145.3	71%	0.708	80%	0.804	S	S	*	*			trans	-134.8	-171.6	-164.5	24.8	2.9	0	0	0	116.2
443	Y	32.5	Very low	35.3	Very low	205 Å²	205	140.5 Å²	140.5	80%	0.804	80%	0.803	S	S	*	*			trans	102.9	102.1	158.5	-62.9	-68.4	0	0	0	121.4
444	S	31.2	Very low	35.3	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	80%	0.803	S	S	*	*				42.8	130.1	127.8	64.7	0	0	0	0	124.3
445	A	32.1	Very low	35.1	Very low	82 Å²	82	152 Å²	152	68%	0.678	82%	0.815	S	S	*	*				139.7	152.8	110.5	0	0	0	0	0	117.8
446	Q	30.5	Very low	34.8	Very low	181 Å²	181	146.7 Å²	146.7	85%	0.846	81%	0.811	S	S	*	*			trans	69.8	94.8	151.6	-74.8	160.4	-31	0	0	123.4
447	Y	28.4	Very low	33.7	Very low	228 Å²	228	147.5 Å²	147.5	89%	0.894	82%	0.819	S	S	*	*				44.6	155.1	114.2	-88.6	-80.5	0	0	0	125.4
448	I	30.8	Very low	33.7	Very low	173 Å²	173	147.1 Å²	147.1	89%	0.887	82%	0.816	S	S	*	*			trans	89.2	129	171.2	-52.1	178.7	0	0	0	113.8
449	G	27.5	Very low	33.7	Very low	67 Å²	67	141.4 Å²	141.4	69%	0.691	81%	0.809	S	S	*	*			cis	-161.6	-173.9	2.9	0	0	0	0	0	113.8
450	S	32.8	Very low	33.7	Very low	117 Å²	117	144 Å²	144	82%	0.818	81%	0.809	S	S	*	*			trans	-103.3	171.2	-177.5	-43.4	0	0	0	0	112
451	P	40.7	Very low	33.6	Very low	129 Å²	129	140.3 Å²	140.3	84%	0.838	80%	0.8	S	S	*	*				-145.6	-174.3	76.5	38	-18	0	0	0	116.6
452	L	32.7	Very low	33.7	Very low	153 Å²	153	142.6 Å²	142.6	80%	0.801	80%	0.799	S	S	*	*			trans	-78.2	-179.9	-178.7	-117.1	78.7	0	0	0	112.7
453	P	42.6	Very low	32.8	Very low	129 Å²	129	143.6 Å²	143.6	84%	0.838	80%	0.803	S	S	*	*			cis	-138.3	173.2	36.2	40.2	-20	0	0	0	118.8
454	R	31.4	Very low	32.6	Very low	235 Å²	235	144 Å²	144	89%	0.887	80%	0.803	S	S	*	*			trans	-136.2	133	-178.6	-173.2	-173.6	-170.1	-148.2	6	109.6
455	R	29.2	Very low	32.6	Very low	252 Å²	252	146.9 Å²	146.9	95%	0.951	80%	0.804	S	S	*	*			trans	-116.5	148.4	157.2	-87.1	-174.9	170.5	-165.5	-1.7	107.8
456	G	29.1	Very low	32.3	Very low	75 Å²	75	147.3 Å²	147.3	77%	0.773	81%	0.808	S	S	*	*			cis	134.4	107.3	-2.9	0	0	0	0	0	110.9
457	S	31	Very low	32.3	Very low	119 Å²	119	143.4 Å²	143.4	83%	0.832	80%	0.801	S	S	*	*			trans	-154.1	132.4	172.5	-165.9	0	0	0	0	110.3
458	P	46.5	Very low	32.4	Very low	122 Å²	122	138.4 Å²	138.4	79%	0.792	79%	0.794	S	S	*	*			trans	-101.4	-168.7	-176.5	40.9	-36.3	0	0	0	113.3
459	T	30.6	Very low	32.3	Very low	128 Å²	128	138.8 Å²	138.8	79%	0.785	79%	0.792	S	S	*	*			trans	-128.1	170.8	-174.5	-23.7	0	0	0	0	111.5
460	I	34.3	Very low	32.4	Very low	144 Å²	144	139.9 Å²	139.9	74%	0.738	80%	0.795	S	S	*	*			trans	97.6	110.1	149.7	-77.2	164.5	0	0	0	120.2
461	T	29	Very low	32.3	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	80%	0.796	S	S	*	*			trans	84.5	140.2	141.4	48.8	0	0	0	0	127.5
462	T	32.4	Very low	31.8	Very low	123 Å²	123	146.4 Å²	146.4	76%	0.755	80%	0.801	S	S	*	*			trans	94.2	106.2	134.9	41.5	0	0	0	0	124
463	V	32.6	Very low	31.5	Very low	129 Å²	129	146.6 Å²	146.6	78%	0.782	80%	0.802	S	S	*	*				102.7	134.4	122.8	169.2	0	0	0	0	122.1
464	R	30	Very low	30.8	Very low	215 Å²	215	147.5 Å²	147.5	81%	0.811	80%	0.798	S	S	*	*			trans	81	104.5	160.4	-92.4	-179.8	179.7	-164.4	-0.5	123.1
465	Q	29.9	Very low	30.5	Very low	166 Å²	166	142.7 Å²	142.7	78%	0.776	80%	0.795	S	S	*	*				48.8	126.7	122.1	-67.3	178.8	-58.3	0	0	121.9
466	A	26.8	Very low	30.5	Very low	91 Å²	91	135.3 Å²	135.3	75%	0.752	78%	0.782	S	S	*	*				145.8	124.6	115.7	0	0	0	0	0	115.9
467	S	29.1	Very low	30.5	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	78%	0.776	S	S	*	*			trans	56.6	111.6	141.6	64	0	0	0	0	124.1
468	T	30.5	Very low	30.5	Very low	123 Å²	123	138.3 Å²	138.3	76%	0.755	77%	0.773	S	S	*	*				82.2	142.2	122.3	57.6	0	0	0	0	124.5
469	Q	29.5	Very low	29.6	Very low	180 Å²	180	140.5 Å²	140.5	84%	0.841	77%	0.77	S	S	*	*			trans	82.3	94.4	152.1	-74.9	174.8	60.1	0	0	121.5
470	A	29.7	Very low	29.4	Very low	91 Å²	91	139.8 Å²	139.8	75%	0.752	77%	0.766	S	S	*	*				52.7	114.2	123.6	0	0	0	0	0	121.3
471	P	31.8	Very low	29.2	Very low	129 Å²	129	139.9 Å²	139.9	84%	0.838	77%	0.768	S	S	*	*			trans	-83.7	138.9	163.7	33.6	-31.7	0	0	0	112.5
472	R	29.6	Very low	29.1	Very low	253 Å²	253	140.8 Å²	140.8	96%	0.955	77%	0.768	S	S	*	*			trans	-86.1	155.9	163.8	-69.6	-173.9	178.3	-167	0.7	110.9
473	I	26	Very low	28.8	Very low	157 Å²	157	142.9 Å²	142.9	81%	0.805	77%	0.773	S	S	*	*			trans	-115.7	139.2	174.1	-61.9	169.1	0	0	0	108.3
474	I	27.4	Very low	28.5	Very low	148 Å²	148	140.5 Å²	140.5	76%	0.759	77%	0.774	S	S	*	*			trans	177.4	115.4	144.5	-97.4	155.1	0	0	0	113
475	T	25.8	Very low	28.4	Very low	134 Å²	134	136.6 Å²	136.6	82%	0.822	78%	0.775	S	S	*	*			trans	60.9	165.6	156.2	68.5	0	0	0	0	119.1
476	S	28.1	Very low	28.3	Very low	98 Å²	98	138.2 Å²	138.2	69%	0.685	78%	0.782	S	S	*	*			cis	-150.1	161.1	9.1	62.7	0	0	0	0	114.6
477	S	30.3	Very low	28.3	Very low	93 Å²	93	140.2 Å²	140.2	65%	0.65	79%	0.786	S	S	*	*			trans	47	123.4	144.9	63	0	0	0	0	125.3
478	Q	29.7	Very low	28.2	Very low	164 Å²	164	139.6 Å²	139.6	77%	0.766	80%	0.795	S	S	*	*			trans	65.6	149.7	136.9	-64.1	-171.2	22.8	0	0	119.1
479	K	28.9	Very low	28.1	Very low	168 Å²	168	137.3 Å²	137.3	73%	0.73	80%	0.795	S	S	*	*			cis	-161.5	162.4	23.1	-133.5	164	-171.2	171.4	0	112.7
480	T	26.8	Very low	28.1	Very low	112 Å²	112	135.1 Å²	135.1	69%	0.687	79%	0.794	S	S	*	*			trans	61.2	116.5	153.4	44.8	0	0	0	0	125.2
481	N	28.3	Very low	28.4	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	80%	0.795	S	S	*	*				90.5	144	124.2	-68.5	5.1	0	0	0	125.5
482	N	28	Very low	28.2	Very low	137 Å²	137	141.4 Å²	141.4	73%	0.733	80%	0.797	S	S	*	*			trans	78.8	102.5	156.7	-73.3	0.5	0	0	0	123.3
483	I	26.1	Very low	28.2	Very low	166 Å²	166	132.8 Å²	132.8	85%	0.851	79%	0.787	S	S	*	*				37.6	114.5	122.8	-52.6	170.2	0	0	0	118
484	G	25.7	Very low	28.4	Very low	79 Å²	79	132.7 Å²	132.7	81%	0.814	79%	0.788	S	S	*	*			trans	-171.6	105	162	0	0	0	0	0	114
485	T	28	Very low	28.2	Very low	134 Å²	134	133.7 Å²	133.7	82%	0.822	79%	0.79	S	S	*	*			trans	-86.3	130.4	171	50.2	0	0	0	0	111.4
486	Q	29.1	Very low	28.3	Very low	199 Å²	199	137.4 Å²	137.4	93%	0.93	79%	0.79	S	S	*	*			trans	-163.4	168.2	150	-115.9	158.9	115	0	0	113.1
487	T	26.9	Very low	28.2	Very low	134 Å²	134	142 Å²	142	82%	0.822	80%	0.798	S	S	*	*			trans	-136.3	142.3	-163.9	51.5	0	0	0	0	112.5
488	G	27	Very low	28	Very low	87 Å²	87	148.9 Å²	148.9	90%	0.897	81%	0.811	S	S	*	*			trans	105.4	137.2	151.8	0	0	0	0	0	116.6
489	G	27.3	Very low	28	Very low	74 Å²	74	146.7 Å²	146.7	76%	0.763	81%	0.814	S	S	*	*			trans	176.4	112.3	172.6	0	0	0	0	0	110.1
490	V	30.4	Very low	28	Very low	135 Å²	135	144.6 Å²	144.6	82%	0.818	82%	0.821	S	S	*	*			trans	-132.7	125.1	-177.6	179.7	0	0	0	0	109.5
491	P	35.3	Very low	28.1	Very low	118 Å²	118	142.7 Å²	142.7	77%	0.766	82%	0.823	S	S	*	*			trans	-82.9	112	159.4	9.8	7.6	0	0	0	108.2
492	R	28.2	Very low	28.2	Very low	233 Å²	233	142.2 Å²	142.2	88%	0.879	83%	0.825	S	S	*	*				68.3	95.3	75.5	-158	-178.3	-161.3	-168.9	5	112.1
493	G	28.2	Very low	28.2	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	83%	0.834	S	S	*	*			trans	-100.4	160.5	169.9	0	0	0	0	0	112.4
494	N	30.6	Very low	28.5	Very low	154 Å²	154	146.1 Å²	146.1	82%	0.824	83%	0.83	S	S	*	*			trans	-106.5	157.9	177.6	-86.5	7.1	0	0	0	112.3
495	Q	24.6	Very low	29.2	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	83%	0.825	S	S	*	*			trans	-105.2	151.5	176.9	-51.1	164.5	-52.8	0	0	110.8
496	Y	27.5	Very low	29.1	Very low	212 Å²	212	148.6 Å²	148.6	83%	0.831	83%	0.825	S	S	*	*			trans	-157	117.2	136.1	-73.5	-58	0	0	0	106.3
497	K	26.2	Very low	29.2	Very low	194 Å²	194	147.8 Å²	147.8	84%	0.843	82%	0.82	S	S	*	*				83.7	127.6	73.2	-82.5	-163.1	175.5	-174.2	0	113.8
498	Y	25.6	Very low	29.3	Very low	237 Å²	237	147.1 Å²	147.1	93%	0.929	82%	0.816	S	S	*	*			trans	-89.9	160.2	177.7	-107.9	-99.2	0	0	0	111.9
499	S	29.5	Very low	29.6	Very low	118 Å²	118	149 Å²	149	83%	0.825	81%	0.809	S	S	*	*			trans	-145.6	164.9	165.3	51.8	0	0	0	0	110.3
500	S	28	Very low	29.5	Very low	125 Å²	125	152 Å²	152	87%	0.874	81%	0.814	S	S	*	*			trans	-139.7	163.8	-170.4	60.5	0	0	0	0	113.9
501	G	29.8	Very low	29.8	Very low	71 Å²	71	151.2 Å²	151.2	73%	0.732	81%	0.809	S	S	*	*			trans	105.1	154.5	-171.5	0	0	0	0	0	112
502	V	30	Very low	29.8	Very low	137 Å²	137	151.8 Å²	151.8	83%	0.83	81%	0.812	S	S	*	*			cis	-146	127.9	6.2	171.2	0	0	0	0	111.3
503	R	27.5	Very low	30	Very low	242 Å²	242	145 Å²	145	91%	0.913	81%	0.806	S	S	*	*			trans	38.8	134.9	139.2	-144.6	176.4	-160.7	167.3	2.9	122
504	N	33.7	Very low	31	Very low	142 Å²	142	146.8 Å²	146.8	76%	0.759	80%	0.804	S	S	*	*			trans	-102.4	154.6	173.9	-160.2	54.2	0	0	0	112.3
505	P	40.1	Very low	31	Very low	111 Å²	111	147.8 Å²	147.8	72%	0.721	81%	0.806	S	S	*	*			trans	-99.5	164.8	164.6	36.5	-30.7	0	0	0	113.2
506	L	26.4	Very low	31.3	Very low	155 Å²	155	145.9 Å²	145.9	81%	0.812	81%	0.806	S	S	*	*			trans	-150.2	133.3	-175.4	-118.8	173.1	0	0	0	110.9
507	H	31.1	Very low	31.5	Very low	181 Å²	181	146.2 Å²	146.2	84%	0.838	81%	0.806	S	S	*	*			trans	-155.7	151.7	172.6	-93.1	21.5	0	0	0	109.1
508	V	28.5	Very low	31.9	Very low	120 Å²	120	142.9 Å²	142.9	73%	0.727	81%	0.805	S	S	*	*			cis	-150.5	157.6	-28.9	148.7	0	0	0	0	105.4
509	V	32.9	Very low	32.5	Very low	126 Å²	126	140 Å²	140	76%	0.764	80%	0.8	S	S	*	*			trans	-112.7	138.3	-176.8	175.7	0	0	0	0	112.4	V511	V509-V511 HydrophobicContact CG1-CG2 4.34Å
510	T	26.4	Very low	32.5	Very low	139 Å²	139	141.3 Å²	141.3	85%	0.853	80%	0.802	S	S	*	*			trans	-150.9	157.8	154.7	-12.2	0	0	0	0	111.7
511	V	35.3	Very low	32.9	Very low	118 Å²	118	139.2 Å²	139.2	72%	0.715	79%	0.792	S	S	*	*			trans	-143.7	153.4	-172.8	-155.6	0	0	0	0	110.2	V509	V509-V511 HydrophobicContact CG1-CG2 4.34Å
512	P	35.8	Very low	33	Very low	129 Å²	129	142.2 Å²	142.2	84%	0.838	80%	0.799	S	S	*	*			trans	-138.5	175	130.6	32.3	-15.7	0	0	0	114.3
513	A	32.9	Very low	33	Very low	92 Å²	92	142 Å²	142	76%	0.76	80%	0.797	S	S	*	*			trans	-140.5	-166.3	-174.2	0	0	0	0	0	109.3
514	P	49.6	Very low	33.2	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	79%	0.791	S	S	*	*			cis	-137.7	-166.2	-5.8	33.6	-9.7	0	0	0	115.1
515	M	30.4	Very low	33	Very low	175 Å²	175	135.1 Å²	135.1	86%	0.862	80%	0.797	S	S	*	*			trans	76.7	143.5	167.3	-43.4	-174.3	78.6	0	0	116.1
516	T	30.4	Very low	32.7	Very low	130 Å²	130	134.1 Å²	134.1	80%	0.798	80%	0.798	S	S	*	*			cis	-129.1	174.7	1.7	44.9	0	0	0	0	112.9
517	R	31.4	Very low	32.7	Very low	219 Å²	219	135.6 Å²	135.6	83%	0.826	80%	0.801	S	S	*	*			trans	-83.8	158.6	168.3	-102.5	-177.8	-175.5	-174	2.2	110.5
518	P	33.8	Very low	32.8	Very low	125 Å²	125	133.1 Å²	133.1	81%	0.812	80%	0.8	S	S	*	*				-137.6	-171.8	52.2	38.8	-19.4	0	0	0	116.6
519	Q	38.7	Very low	32.7	Very low	177 Å²	177	131.4 Å²	131.4	83%	0.827	80%	0.799	S	S	*	*			trans	-84.9	140.9	-174	-63.1	168.9	-57.1	0	0	113.2
520	V	30.8	Very low	32.4	Very low	145 Å²	145	132.2 Å²	132.2	88%	0.879	80%	0.804	S	S	*	*			trans	-142.1	142.8	157.4	-171.4	0	0	0	0	107.8
521	A	35.3	Very low	32.4	Very low	80 Å²	80	133.7 Å²	133.7	66%	0.661	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-89.7	145	177	0	0	0	0	0	111.3
522	P	33.1	Very low	32.1	Very low	134 Å²	134	135.2 Å²	135.2	87%	0.87	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-73.7	134	177.4	30.2	-33.9	0	0	0	111.5
523	V	29	Very low	31.9	Very low	132 Å²	132	135 Å²	135	80%	0.8	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-85.5	137.3	179.4	174	0	0	0	0	110.5
524	A	31.3	Very low	31.9	Very low	94 Å²	94	133.8 Å²	133.8	78%	0.777	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-84.5	131.1	165.5	0	0	0	0	0	109.9
525	V	30.7	Very low	31.7	Very low	146 Å²	146	133.9 Å²	133.9	89%	0.885	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-82.8	138.6	176	-173.1	0	0	0	0	109.6
526	A	32	Very low	32.5	Very low	90 Å²	90	133.5 Å²	133.5	74%	0.744	80%	0.795	S	S	*	*			trans	-117.2	149.8	-177.6	0	0	0	0	0	112
527	E	27.3	Very low	33.7	Very low	187 Å²	187	132.6 Å²	132.6	87%	0.874	79%	0.791	S	S	*	*			trans	-120.5	158.9	163.1	-82.4	-159.9	146.9	0	0	109.6
528	P	33.6	Very low	34.9	Very low	128 Å²	128	124 Å²	124	83%	0.831	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-87.2	136.1	-132.9	29.8	-36.2	0	0	0	115.5
529	A	25.6	Very low	36.3	Very low	85 Å²	85	122.1 Å²	122.1	70%	0.702	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-97.8	125.3	167	0	0	0	0	0	110.9	H531	A529-H531 PolarHBondContact O-N 2.86Å
530	V	26.5	Very low	37.3	Very low	142 Å²	142	116.6 Å²	116.6	86%	0.861	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.6	167.9	177.6	0	0	0	0	108.5
531	H	26.3	Very low	38.6	Very low	170 Å²	170	114.4 Å²	114.4	79%	0.787	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-86.2	126.7	-174.2	-117.9	71.9	0	0	0	112.3	A529	A529-H531 PolarHBondContact O-N 2.86Å
532	I	29.1	Very low	39.9	Very low	150 Å²	150	115.9 Å²	115.9	77%	0.769	72%	0.718	S	S	*	*			trans	-133.8	127.9	159.2	-58.1	-178.9	0	0	0	106.5
533	P	31.8	Very low	41.3	Very low	126 Å²	126	109.8 Å²	109.8	82%	0.818	68%	0.678	S	S	*	*			trans	-80.8	129.2	-167.9	30.4	-34.7	0	0	0	113.3
534	G	33	Very low	42.9	Very low	65 Å²	65	107.3 Å²	107.3	67%	0.67	67%	0.671	S	S	*	*			trans	-165.8	162.7	174.1	0	0	0	0	0	111
535	P	46	Very low	44.8	Very low	111 Å²	111	107 Å²	107	72%	0.721	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-69	158.1	-176	29.4	-35.6	0	0	0	112.8
536	E	46.9	Very low	46.6	Very low	168 Å²	168	101.2 Å²	101.2	79%	0.785	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-49.9	140.7	-171.5	-61.5	-178.8	132.4	0	0	114.2	L538	E536-L538 PolarHBondContact O-N 3.12Å
537	P	54.8	Low	48.6	Very low	110 Å²	110	100.7 Å²	100.7	71%	0.714	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-67.1	122.3	-179.9	27.7	-34.1	0	0	0	110.8	T539	P537-T539 VanDerWaalsContact C-N 3.3Å; P537-T539 PolarHBondContact O-N 3.15Å; P537-T539 PolarHBondContact O-OG1 3.16Å
538	L	57.3	Low	50.3	Low	38 Å²	38	98.3 Å²	98.3	20%	0.199	62%	0.618	C	S	.	*			trans	-63.2	88.1	175.7	-100.8	155.4	0	0	0	110.3	E536 M542 R558	E536-L538 PolarHBondContact O-N 3.12Å; L538-M542 HydrophobicContact CD2-CB 4.5Å; L538-R558 HydrophobicContact CD1-CG 3.59Å
539	T	63.6	Low	52	Low	86 Å²	86	100.1 Å²	100.1	53%	0.528	62%	0.617	S	S	.	*			trans	-66.5	143.8	-176.5	-7	0	0	0	0	109.6	P537 S541 M542 L543	P537-T539 VanDerWaalsContact C-N 3.3Å; P537-T539 PolarHBondContact O-N 3.15Å; P537-T539 PolarHBondContact O-OG1 3.16Å; T539-S541 PolarHBondContact O-N 2.72Å; T539-M542 WeakPolarHBondContact O-CB 3.19Å; T539-M542 PolarHBondContact O-N 2.97Å; T539-L543 PolarHBondContact O-N 3.42Å
540	A	59.2	Low	54.4	Low	61 Å²	61	99.7 Å²	99.7	50%	0.504	60%	0.603	S	S	.	*	H	α-helix	trans	-53.5	-26.8	179.6	0	0	0	0	0	113.6	A544 L587	A540-A544 VanDerWaalsContact O-CB 3.23Å; A540-A544 WeakPolarHBondContact O-CB 3.48Å; A540-A544 PolarHBondContact O-N 2.91Å; A540-L587 HydrophobicContact CB-CD1 4.38Å
541	S	57.6	Low	56.8	Low	100 Å²	100	94.1 Å²	94.1	70%	0.699	57%	0.568	S	S	*	*	H	α-helix	trans	-69.3	-27.4	174.5	-166.5	0	0	0	0	114.6	T539	T539-S541 PolarHBondContact O-N 2.72Å
542	M	63.9	Low	59.4	Low	111 Å²	111	89.1 Å²	89.1	55%	0.547	54%	0.544	S	S	.	.	H	α-helix	trans	-77.9	-46.1	174.7	-63.8	176.7	72.6	0	0	110.1	L538 T539 A544 A545	L538-M542 HydrophobicContact CD2-CB 4.5Å; T539-M542 WeakPolarHBondContact O-CB 3.19Å; T539-M542 PolarHBondContact O-N 2.97Å; M542-A544 VanDerWaalsContact C-N 3.32Å; M542-A544 PolarHBondContact O-N 3.16Å; M542-A545 PolarHBondContact O-N 2.72Å; M542-A545 VanDerWaalsContact O-N 3.15Å
543	L	61.8	Low	62	Low	6 Å²	6	87.8 Å²	87.8	3%	0.031	54%	0.535	C	S	.	.	H	α-helix	trans	-62.8	-39.5	179.4	-157.2	80.6	0	0	0	111.6	T539 A545 A546 Q551 L554 L555 N583 L587	T539-L543 PolarHBondContact O-N 3.42Å; L543-A545 PolarHBondContact O-N 2.93Å; L543-A546 PolarHBondContact O-N 2.98Å; L543-Q551 HydrophobicContact CD1-CB 4.35Å; L543-Q551 HydrophobicContact CD1-CG 4.45Å; L543-Q551 HydrophobicContact CG-CB 4.28Å; L543-Q551 HydrophobicContact CG-CG 4.08Å; L543-Q551 VanDerWaalsContact O-CD 3.31Å; L543-Q551 VanDerWaalsContact O-CG 3.32Å; L543-Q551 WeakPolarHBondContact O-CG 3.42Å; L543-Q551 PolarHBondContact O-NE2 3Å; L543-L554 HydrophobicContact CD1-CB 4.32Å; L543-L555 HydrophobicContact CD1-CD2 4.49Å; L543-L555 HydrophobicContact CD1-CG 4.2Å; L543-L555 HydrophobicContact CD2-CD1 3.98Å; L543-L555 HydrophobicContact CD2-CD2 4.19Å; L543-L555 HydrophobicContact CD2-CG 4.14Å; L543-N583 HydrophobicContact CD2-CB 4.48Å; L543-L587 HydrophobicContact CD2-CD1 3.91Å; L543-L587 HydrophobicContact CD2-CD2 4.22Å; L543-L587 HydrophobicContact CD2-CG 4.12Å
544	A	63.2	Low	64.2	Low	79 Å²	79	84.5 Å²	84.5	65%	0.653	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.3	177.8	0	0	0	0	0	114.8	A540 M542	A540-A544 VanDerWaalsContact O-CB 3.23Å; A540-A544 WeakPolarHBondContact O-CB 3.48Å; A540-A544 PolarHBondContact O-N 2.91Å; M542-A544 VanDerWaalsContact C-N 3.32Å; M542-A544 PolarHBondContact O-N 3.16Å
545	A	70	Confident	66.6	Low	88 Å²	88	81.5 Å²	81.5	73%	0.727	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-15.5	177.6	0	0	0	0	0	113.6	M542 L543	M542-A545 PolarHBondContact O-N 2.72Å; M542-A545 VanDerWaalsContact O-N 3.15Å; L543-A545 PolarHBondContact O-N 2.93Å
546	A	69.2	Low	68.4	Low	24 Å²	24	76.6 Å²	76.6	20%	0.198	45%	0.448	C	S	.	.	S	Bend	trans	-88.5	151.9	-176.8	0	0	0	0	0	113	L543 D550 Q551 L554	L543-A546 PolarHBondContact O-N 2.98Å; A546-D550 HydrophobicContact CB-CB 4.47Å; A546-Q551 HydrophobicContact CB-CG 4.01Å; A546-Q551 PolarHBondContact O-NE2 3.3Å; A546-L554 HydrophobicContact CB-CD1 4.43Å
547	P	73.5	Confident	70.2	Confident	80 Å²	80	73.1 Å²	73.1	52%	0.519	43%	0.432	S	S	.	.			trans	-55.7	149.6	168.8	-25.4	34.7	0	0	0	113.6	M549 D550 Q551	P547-M549 VanDerWaalsContact C-N 3.28Å; P547-M549 PolarHBondContact O-N 3.11Å; P547-M549 VanDerWaalsContact O-N 3.15Å; P547-D550 HydrophobicContact CB-CB 4.49Å; P547-D550 VanDerWaalsContact CD-OD2 3.28Å; P547-D550 WeakPolarHBondContact CD-OD2 3.49Å; P547-D550 VanDerWaalsContact CG-OD2 3.29Å; P547-D550 WeakPolarHBondContact CG-OD2 3.41Å; P547-D550 PolarHBondContact O-N 2.87Å; P547-D550 VanDerWaalsContact O-N 3.12Å; P547-Q551 WeakPolarHBondContact O-CG 3.42Å; P547-Q551 PolarHBondContact O-N 3.03Å
548	L	64	Low	71.5	Confident	137 Å²	137	72.4 Å²	72.4	72%	0.717	42%	0.415	S	S	*	.	H	α-helix	trans	-61.7	-26.6	-170.9	-70.5	173	0	0	0	115.3
549	M	68.9	Low	72.8	Confident	165 Å²	165	70.6 Å²	70.6	81%	0.813	41%	0.405	S	S	*	.	H	α-helix	trans	-73.2	-51.5	173.1	-77.3	176.9	157.1	0	0	110.5	P547 Q551 K552 Q553	P547-M549 VanDerWaalsContact C-N 3.28Å; P547-M549 PolarHBondContact O-N 3.11Å; P547-M549 VanDerWaalsContact O-N 3.15Å; M549-Q551 VanDerWaalsContact C-N 3.26Å; M549-Q551 PolarHBondContact O-N 3.45Å; M549-K552 PolarHBondContact O-N 3.4Å; M549-Q553 PolarHBondContact O-N 3.43Å; M549-Q553 VanDerWaalsContact O-N 3.16Å
550	D	75.9	Confident	73.9	Confident	77 Å²	77	71.4 Å²	71.4	41%	0.412	40%	0.399	S	S	.	.	H	α-helix	trans	-58.2	-36.9	-179.7	-47.3	0.1	0	0	0	111.6	A546 P547 K552 Q553 L554	A546-D550 HydrophobicContact CB-CB 4.47Å; P547-D550 HydrophobicContact CB-CB 4.49Å; P547-D550 VanDerWaalsContact CD-OD2 3.28Å; P547-D550 WeakPolarHBondContact CD-OD2 3.49Å; P547-D550 VanDerWaalsContact CG-OD2 3.29Å; P547-D550 WeakPolarHBondContact CG-OD2 3.41Å; P547-D550 PolarHBondContact O-N 2.87Å; P547-D550 VanDerWaalsContact O-N 3.12Å; D550-K552 VanDerWaalsContact C-N 3.31Å; D550-K552 PolarHBondContact O-N 3.45Å; D550-Q553 PolarHBondContact O-N 3.04Å; D550-L554 WeakPolarHBondContact O-CB 3.46Å; D550-L554 WeakPolarHBondContact O-CG 3.36Å; D550-L554 PolarHBondContact O-N 3.39Å
551	Q	77.1	Confident	75.1	Confident	24 Å²	24	72 Å²	72	11%	0.112	40%	0.399	C	S	.	.	H	α-helix	trans	-55	-43.7	172.8	-70.5	-176.4	25.2	0	0	112.7	L543 A546 P547 M549 L555 N583	L543-Q551 HydrophobicContact CD1-CB 4.35Å; L543-Q551 HydrophobicContact CD1-CG 4.45Å; L543-Q551 HydrophobicContact CG-CB 4.28Å; L543-Q551 HydrophobicContact CG-CG 4.08Å; L543-Q551 VanDerWaalsContact O-CD 3.31Å; L543-Q551 VanDerWaalsContact O-CG 3.32Å; L543-Q551 WeakPolarHBondContact O-CG 3.42Å; L543-Q551 PolarHBondContact O-NE2 3Å; A546-Q551 HydrophobicContact CB-CG 4.01Å; A546-Q551 PolarHBondContact O-NE2 3.3Å; P547-Q551 WeakPolarHBondContact O-CG 3.42Å; P547-Q551 PolarHBondContact O-N 3.03Å; M549-Q551 VanDerWaalsContact C-N 3.26Å; M549-Q551 PolarHBondContact O-N 3.45Å; Q551-L555 WeakPolarHBondContact O-CG 3.35Å; Q551-L555 PolarHBondContact O-N 2.88Å; Q551-L555 VanDerWaalsContact O-N 3.11Å; Q551-N583 PolarHBondContact OE1-ND2 2.99Å
552	K	80.9	Confident	76.4	Confident	65 Å²	65	71.1 Å²	71.1	28%	0.283	39%	0.386	S	S	.	.	H	α-helix	trans	-75.6	-31.1	179.9	-70.2	-158.3	160.8	-157	0	112	M549 D550 G556 L579 E580 I581 N583	M549-K552 PolarHBondContact O-N 3.4Å; D550-K552 VanDerWaalsContact C-N 3.31Å; D550-K552 PolarHBondContact O-N 3.45Å; K552-G556 PolarHBondContact O-N 3.43Å; K552-L579 WeakPolarHBondContact CD-O 3.5Å; K552-L579 WeakPolarHBondContact CE-O 3.47Å; K552-L579 PolarHBondContact NZ-O 3.32Å; K552-L579 VanDerWaalsContact O-CD2 3.29Å; K552-L579 WeakPolarHBondContact O-CD2 3.24Å; K552-E580 PolarHBondContact NZ-O 2.93Å; K552-I581 PolarHBondContact NZ-O 3.39Å; K552-N583 WeakPolarHBondContact CE-OD1 3.27Å
553	Q	82.6	Confident	77.5	Confident	123 Å²	123	65.9 Å²	65.9	58%	0.575	36%	0.36	S	S	*	.	H	α-helix	trans	-65.1	-48.5	170.8	-176.6	174.7	-28.5	0	0	111.8	M549 D550 L555 G556 E557	M549-Q553 PolarHBondContact O-N 3.43Å; M549-Q553 VanDerWaalsContact O-N 3.16Å; D550-Q553 PolarHBondContact O-N 3.04Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-L555 PolarHBondContact O-N 2.98Å; Q553-G556 WeakPolarHBondContact O-CA 3.47Å; Q553-G556 PolarHBondContact O-N 2.96Å; Q553-E557 PolarHBondContact NE2-OE1 3.1Å; Q553-E557 PolarHBondContact O-N 3.44Å
554	L	79.8	Confident	78.6	Confident	57 Å²	57	69.4 Å²	69.4	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-39.3	179.3	-72.1	168.3	0	0	0	112.7	L543 A546 D550	L543-L554 HydrophobicContact CD1-CB 4.32Å; A546-L554 HydrophobicContact CB-CD1 4.43Å; D550-L554 WeakPolarHBondContact O-CB 3.46Å; D550-L554 WeakPolarHBondContact O-CG 3.36Å; D550-L554 PolarHBondContact O-N 3.39Å
555	L	82.6	Confident	79.6	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-65.3	-40.8	171.5	-72.3	170.3	0	0	0	111.5	L543 Q551 Q553 E557 R558 L559 L579 N583 L586 L587 L590	L543-L555 HydrophobicContact CD1-CD2 4.49Å; L543-L555 HydrophobicContact CD1-CG 4.2Å; L543-L555 HydrophobicContact CD2-CD1 3.98Å; L543-L555 HydrophobicContact CD2-CD2 4.19Å; L543-L555 HydrophobicContact CD2-CG 4.14Å; Q551-L555 WeakPolarHBondContact O-CG 3.35Å; Q551-L555 PolarHBondContact O-N 2.88Å; Q551-L555 VanDerWaalsContact O-N 3.11Å; Q553-L555 VanDerWaalsContact C-N 3.34Å; Q553-L555 PolarHBondContact O-N 2.98Å; L555-E557 PolarHBondContact O-N 3.23Å; L555-R558 PolarHBondContact O-N 3.39Å; L555-L559 HydrophobicContact CB-CD1 4.45Å; L555-L559 WeakPolarHBondContact O-CB 3.42Å; L555-L559 WeakPolarHBondContact O-CG 3.4Å; L555-L559 PolarHBondContact O-N 3.45Å; L555-L579 HydrophobicContact CB-CD2 4.07Å; L555-N583 HydrophobicContact CD1-CB 4.04Å; L555-L586 HydrophobicContact CD1-CB 3.91Å; L555-L586 HydrophobicContact CD1-CD1 3.9Å; L555-L586 HydrophobicContact CD2-CB 4.34Å; L555-L587 HydrophobicContact CD2-CD2 4.06Å; L555-L587 HydrophobicContact CD2-CG 4.3Å; L555-L590 HydrophobicContact CD2-CD1 3.66Å
556	G	83.3	Confident	80.2	Confident	9 Å²	9	69 Å²	69	9%	0.093	36%	0.362	C	S	.	.	H	α-helix	trans	-60.1	-44.3	177.6	0	0	0	0	0	113.3	K552 Q553 R558 L559 Y560	K552-G556 PolarHBondContact O-N 3.43Å; Q553-G556 WeakPolarHBondContact O-CA 3.47Å; Q553-G556 PolarHBondContact O-N 2.96Å; G556-R558 PolarHBondContact O-N 2.9Å; G556-L559 PolarHBondContact O-N 3.17Å; G556-Y560 VanDerWaalsContact O-CB 3.25Å; G556-Y560 WeakPolarHBondContact O-CB 3.45Å; G556-Y560 PolarHBondContact O-N 3.11Å
557	E	86.1	Confident	80.9	Confident	94 Å²	94	71.5 Å²	71.5	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-63.6	-21.1	177.2	-72	175	-164.6	0	0	113.6	Q553 L555 P561	Q553-E557 PolarHBondContact NE2-OE1 3.1Å; Q553-E557 PolarHBondContact O-N 3.44Å; L555-E557 PolarHBondContact O-N 3.23Å; E557-P561 VanDerWaalsContact O-CD 3.31Å; E557-P561 WeakPolarHBondContact O-CD 3.35Å
558	R	81.7	Confident	81.5	Confident	95 Å²	95	71 Å²	71	36%	0.358	37%	0.366	S	S	.	.	H	α-helix	trans	-96.3	-35.3	175.2	-59.4	-62.2	132.3	112	6.9	113.6	L538 L555 G556 L590	L538-R558 HydrophobicContact CD1-CG 3.59Å; L555-R558 PolarHBondContact O-N 3.39Å; G556-R558 PolarHBondContact O-N 2.9Å; R558-L590 HydrophobicContact CB-CD1 4.1Å; R558-L590 HydrophobicContact CB-CD2 3.76Å
559	L	84	Confident	82.5	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-73.1	-39	177.7	-71.3	166.1	0	0	0	111.5	L555 G556 L562 I563 T575 L579 L586 M589 L590 L596	L555-L559 HydrophobicContact CB-CD1 4.45Å; L555-L559 WeakPolarHBondContact O-CB 3.42Å; L555-L559 WeakPolarHBondContact O-CG 3.4Å; L555-L559 PolarHBondContact O-N 3.45Å; G556-L559 PolarHBondContact O-N 3.17Å; L559-L562 PolarHBondContact O-N 3.3Å; L559-I563 HydrophobicContact CB-CD1 3.93Å; L559-I563 WeakPolarHBondContact O-CD1 3.23Å; L559-I563 VanDerWaalsContact O-CG1 3.24Å; L559-I563 WeakPolarHBondContact O-CG1 3.44Å; L559-I563 PolarHBondContact O-N 3.45Å; L559-T575 HydrophobicContact CB-CG2 4.26Å; L559-L579 HydrophobicContact CD1-CD2 4.35Å; L559-L586 HydrophobicContact CD1-CB 4.47Å; L559-L586 HydrophobicContact CD1-CD2 3.93Å; L559-M589 HydrophobicContact CD2-CB 4.48Å; L559-M589 HydrophobicContact CD2-CE 4.11Å; L559-L590 HydrophobicContact CD2-CD2 3.69Å; L559-L590 HydrophobicContact CD2-CG 3.98Å; L559-L590 HydrophobicContact CG-CD2 3.99Å; L559-L590 HydrophobicContact CG-CG 4.32Å; L559-L596 HydrophobicContact CD2-CD1 3.9Å
560	Y	86.3	Confident	83.3	Confident	103 Å²	103	66.8 Å²	66.8	40%	0.404	35%	0.348	S	S	.	.	H	α-helix	trans	-57.2	-47.8	-175.3	-178.1	-87.8	0	0	0	113.7	G556 L562 I563 H564 A571	G556-Y560 VanDerWaalsContact O-CB 3.25Å; G556-Y560 WeakPolarHBondContact O-CB 3.45Å; G556-Y560 PolarHBondContact O-N 3.11Å; Y560-L562 PolarHBondContact O-N 2.87Å; Y560-I563 PolarHBondContact O-N 2.86Å; Y560-H564 HydrophobicContact CE1-CB 4.25Å; Y560-H564 WeakPolarHBondContact O-CB 3.32Å; Y560-H564 PolarHBondContact O-N 2.8Å; Y560-A571 HydrophobicContact CD2-CB 4.37Å; Y560-A571 HydrophobicContact CE2-CB 3.94Å
561	P	85.7	Confident	83.7	Confident	75 Å²	75	63.1 Å²	63.1	49%	0.487	33%	0.328	S	S	.	.	H	α-helix	trans	-62.7	-39.3	178.7	-23.5	35.3	0	0	0	113.4	E557 H564 A565	E557-P561 VanDerWaalsContact O-CD 3.31Å; E557-P561 WeakPolarHBondContact O-CD 3.35Å; P561-H564 PolarHBondContact O-N 3.47Å; P561-A565 PolarHBondContact O-N 3.12Å
562	L	84.6	Confident	84	Confident	81 Å²	81	64.1 Å²	64.1	42%	0.424	35%	0.345	S	S	.	.	H	α-helix	trans	-66.1	-45.3	178.7	-59.9	174.1	0	0	0	111.1	L559 Y560 H564 A565 L566 L590 L596	L559-L562 PolarHBondContact O-N 3.3Å; Y560-L562 PolarHBondContact O-N 2.87Å; L562-H564 VanDerWaalsContact C-N 3.32Å; L562-H564 PolarHBondContact O-N 2.94Å; L562-A565 PolarHBondContact O-N 3.43Å; L562-L566 PolarHBondContact O-N 3.27Å; L562-L590 HydrophobicContact CD1-CD2 3.91Å; L562-L596 HydrophobicContact CB-CD2 3.7Å; L562-L596 HydrophobicContact CD1-CD2 3.97Å; L562-L596 HydrophobicContact CG-CD2 4.48Å
563	I	85.9	Confident	84.1	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-68.7	-33.6	177.1	-60	161.4	0	0	0	110.8	L559 Y560 L566 H567 A571 I574 T575 L578 L596 V600	L559-I563 HydrophobicContact CB-CD1 3.93Å; L559-I563 WeakPolarHBondContact O-CD1 3.23Å; L559-I563 VanDerWaalsContact O-CG1 3.24Å; L559-I563 WeakPolarHBondContact O-CG1 3.44Å; L559-I563 PolarHBondContact O-N 3.45Å; Y560-I563 PolarHBondContact O-N 2.86Å; I563-L566 PolarHBondContact O-N 2.89Å; I563-H567 PolarHBondContact O-N 3.43Å; I563-A571 HydrophobicContact CG2-CB 4.2Å; I563-I574 HydrophobicContact CD1-CG2 4.4Å; I563-I574 HydrophobicContact CG2-CB 3.9Å; I563-I574 HydrophobicContact CG2-CD1 4.38Å; I563-I574 HydrophobicContact CG2-CG2 3.67Å; I563-T575 HydrophobicContact CD1-CG2 4.4Å; I563-T575 WeakPolarHBondContact CD1-OG1 3.5Å; I563-L578 HydrophobicContact CD1-CD1 3.69Å; I563-L596 HydrophobicContact CD1-CD1 4.48Å; I563-L596 HydrophobicContact CG1-CD1 4.16Å; I563-V600 HydrophobicContact CG1-CG2 4Å; I563-V600 HydrophobicContact CG2-CG2 4.4Å
564	H	86.1	Confident	84.3	Confident	80 Å²	80	62.1 Å²	62.1	37%	0.37	33%	0.334	S	S	.	.	H	α-helix	trans	-69.2	-33.8	177	-169.2	81.9	0	0	0	112.7	Y560 P561 L562 L566 P568 A571	Y560-H564 HydrophobicContact CE1-CB 4.25Å; Y560-H564 WeakPolarHBondContact O-CB 3.32Å; Y560-H564 PolarHBondContact O-N 2.8Å; P561-H564 PolarHBondContact O-N 3.47Å; L562-H564 VanDerWaalsContact C-N 3.32Å; L562-H564 PolarHBondContact O-N 2.94Å; H564-L566 VanDerWaalsContact C-N 3.26Å; H564-L566 PolarHBondContact O-N 2.91Å; H564-P568 PolarHBondContact ND1-O 2.91Å; H564-P568 WeakPolarHBondContact O-CA 3.49Å; H564-P568 VanDerWaalsContact O-CD 3.26Å; H564-P568 WeakPolarHBondContact O-CD 3.46Å; H564-P568 VanDerWaalsContact O-CG 3.28Å; H564-P568 WeakPolarHBondContact O-CG 3.4Å; H564-A571 HydrophobicContact CB-CB 3.81Å
565	A	84.4	Confident	84.6	Confident	87 Å²	87	59.7 Å²	59.7	72%	0.719	32%	0.322	S	S	*	.	H	α-helix	trans	-63.8	-30.5	171.9	0	0	0	0	0	112.9	P561 L562	P561-A565 PolarHBondContact O-N 3.12Å; L562-A565 PolarHBondContact O-N 3.43Å
566	L	82	Confident	84.7	Confident	73 Å²	73	61.5 Å²	61.5	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-85.5	-47.5	178.7	-62.6	165.6	0	0	0	112.5	L562 I563 H564 N597	L562-L566 PolarHBondContact O-N 3.27Å; I563-L566 PolarHBondContact O-N 2.89Å; H564-L566 VanDerWaalsContact C-N 3.26Å; H564-L566 PolarHBondContact O-N 2.91Å; L566-N597 VanDerWaalsContact CD1-OD1 3.22Å; L566-N597 WeakPolarHBondContact CD1-OD1 3.48Å
567	H	84.4	Confident	84.7	Confident	76 Å²	76	63.9 Å²	63.9	35%	0.352	35%	0.35	S	S	.	.			trans	-140.6	76.5	-174.3	-62	-67.1	0	0	0	112.6	I563 N569 L570 A571 I574 V600 I604	I563-H567 PolarHBondContact O-N 3.43Å; H567-N569 VanDerWaalsContact C-N 3.27Å; H567-N569 PolarHBondContact O-N 2.63Å; H567-N569 VanDerWaalsContact O-N 3.1Å; H567-L570 PolarHBondContact O-N 2.92Å; H567-L570 VanDerWaalsContact O-N 3.08Å; H567-A571 PolarHBondContact O-N 3.2Å; H567-I574 HydrophobicContact CB-CD1 4.26Å; H567-V600 VanDerWaalsContact CD2-CG1 3.49Å; H567-V600 WeakPolarHBondContact CD2-CG1 3.44Å; H567-I604 VanDerWaalsContact CD2-CD1 3.44Å; H567-I604 WeakPolarHBondContact CD2-CD1 3.25Å; H567-I604 WeakPolarHBondContact NE2-CD1 3.31Å
568	P	85.3	Confident	84.6	Confident	69 Å²	69	59.6 Å²	59.6	45%	0.448	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-44	-174.2	-27.6	31.2	0	0	0	114.1	H564 L570	H564-P568 PolarHBondContact ND1-O 2.91Å; H564-P568 WeakPolarHBondContact O-CA 3.49Å; H564-P568 VanDerWaalsContact O-CD 3.26Å; H564-P568 WeakPolarHBondContact O-CD 3.46Å; H564-P568 VanDerWaalsContact O-CG 3.28Å; H564-P568 WeakPolarHBondContact O-CG 3.4Å; P568-L570 VanDerWaalsContact C-N 3.32Å; P568-L570 PolarHBondContact O-N 2.77Å
569	N	84.4	Confident	84.9	Confident	163 Å²	163	56.9 Å²	56.9	87%	0.872	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-13	-173.6	-64.4	-21.9	0	0	0	114.9	H567	H567-N569 VanDerWaalsContact C-N 3.27Å; H567-N569 PolarHBondContact O-N 2.63Å; H567-N569 VanDerWaalsContact O-N 3.1Å
570	L	86.1	Confident	84.9	Confident	51 Å²	51	64.8 Å²	64.8	27%	0.267	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-7.1	-177.7	-65.5	177.9	0	0	0	113.4	H567 P568 G572 K573 I574	H567-L570 PolarHBondContact O-N 2.92Å; H567-L570 VanDerWaalsContact O-N 3.08Å; P568-L570 VanDerWaalsContact C-N 3.32Å; P568-L570 PolarHBondContact O-N 2.77Å; L570-G572 VanDerWaalsContact C-N 3.32Å; L570-G572 PolarHBondContact O-N 2.95Å; L570-G572 VanDerWaalsContact O-N 3.14Å; L570-K573 PolarHBondContact O-N 3.02Å; L570-I574 HydrophobicContact CB-CD1 3.54Å; L570-I574 HydrophobicContact CB-CG1 4.07Å; L570-I574 PolarHBondContact O-N 3.37Å
571	A	84.1	Confident	84.7	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-49.1	-44.7	-171.1	0	0	0	0	0	114.6	Y560 I563 H564 H567 K573 I574 T575	Y560-A571 HydrophobicContact CD2-CB 4.37Å; Y560-A571 HydrophobicContact CE2-CB 3.94Å; I563-A571 HydrophobicContact CG2-CB 4.2Å; H564-A571 HydrophobicContact CB-CB 3.81Å; H567-A571 PolarHBondContact O-N 3.2Å; A571-K573 PolarHBondContact O-N 3.15Å; A571-I574 PolarHBondContact O-N 3.4Å; A571-T575 VanDerWaalsContact O-CB 3.27Å; A571-T575 WeakPolarHBondContact O-CB 3.32Å; A571-T575 PolarHBondContact O-N 3.31Å; A571-T575 PolarHBondContact O-OG1 3.11Å
572	G	83.3	Confident	84.6	Confident	45 Å²	45	63.7 Å²	63.7	46%	0.464	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-38.6	178.8	0	0	0	0	0	113.9	L570 G576	L570-G572 VanDerWaalsContact C-N 3.32Å; L570-G572 PolarHBondContact O-N 2.95Å; L570-G572 VanDerWaalsContact O-N 3.14Å; G572-G576 PolarHBondContact O-N 3.27Å
573	K	84.1	Confident	84.4	Confident	146 Å²	146	61.3 Å²	61.3	64%	0.635	34%	0.344	S	S	*	.	H	α-helix	trans	-75.5	-40.9	177.9	-69.6	-169.5	174.3	-170.3	0	111.9	L570 A571 G576 M577 L607	L570-K573 PolarHBondContact O-N 3.02Å; A571-K573 PolarHBondContact O-N 3.15Å; K573-G576 PolarHBondContact O-N 3.25Å; K573-M577 WeakPolarHBondContact O-CG 3.42Å; K573-M577 PolarHBondContact O-N 2.88Å; K573-L607 HydrophobicContact CB-CD1 4.32Å
574	I	85.4	Confident	84	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-46.8	176.5	-64.4	166.7	0	0	0	110.1	I563 H567 L570 A571 G576 M577 L578 V600 A603 I604 L607	I563-I574 HydrophobicContact CD1-CG2 4.4Å; I563-I574 HydrophobicContact CG2-CB 3.9Å; I563-I574 HydrophobicContact CG2-CD1 4.38Å; I563-I574 HydrophobicContact CG2-CG2 3.67Å; H567-I574 HydrophobicContact CB-CD1 4.26Å; L570-I574 HydrophobicContact CB-CD1 3.54Å; L570-I574 HydrophobicContact CB-CG1 4.07Å; L570-I574 PolarHBondContact O-N 3.37Å; A571-I574 PolarHBondContact O-N 3.4Å; I574-G576 PolarHBondContact O-N 2.72Å; I574-M577 PolarHBondContact O-N 3.22Å; I574-L578 HydrophobicContact CG2-CD1 3.79Å; I574-L578 HydrophobicContact CG2-CG 4.3Å; I574-L578 WeakPolarHBondContact O-CB 3.39Å; I574-L578 VanDerWaalsContact O-CG 3.3Å; I574-L578 WeakPolarHBondContact O-CG 3.41Å; I574-L578 PolarHBondContact O-N 3.36Å; I574-V600 HydrophobicContact CD1-CG1 4.44Å; I574-V600 HydrophobicContact CG2-CG1 4.37Å; I574-V600 HydrophobicContact CG2-CG2 4.08Å; I574-A603 HydrophobicContact CG2-CB 4.11Å; I574-I604 HydrophobicContact CD1-CD1 3.95Å; I574-I604 HydrophobicContact CD1-CG1 3.64Å; I574-I604 HydrophobicContact CG1-CG1 4.33Å; I574-L607 HydrophobicContact CG1-CD1 3.87Å
575	T	86.8	Confident	83.7	Confident	6 Å²	6	65.5 Å²	65.5	4%	0.037	37%	0.374	C	S	.	.	H	α-helix	trans	-60.6	-44.8	175.9	-49.6	0	0	0	0	110.9	L559 I563 A571 M577 L578 L579	L559-T575 HydrophobicContact CB-CG2 4.26Å; I563-T575 HydrophobicContact CD1-CG2 4.4Å; I563-T575 WeakPolarHBondContact CD1-OG1 3.5Å; A571-T575 VanDerWaalsContact O-CB 3.27Å; A571-T575 WeakPolarHBondContact O-CB 3.32Å; A571-T575 PolarHBondContact O-N 3.31Å; A571-T575 PolarHBondContact O-OG1 3.11Å; T575-M577 PolarHBondContact O-N 3.24Å; T575-L578 PolarHBondContact O-N 3.06Å; T575-L579 HydrophobicContact CG2-CD1 4.17Å; T575-L579 HydrophobicContact CG2-CG 4.31Å; T575-L579 WeakPolarHBondContact O-CB 3.41Å; T575-L579 VanDerWaalsContact O-CG 3.27Å; T575-L579 WeakPolarHBondContact O-CG 3.32Å; T575-L579 PolarHBondContact O-N 3.18Å
576	G	85.6	Confident	83.6	Confident	39 Å²	39	61.3 Å²	61.3	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-57.1	-45.5	176.3	0	0	0	0	0	113.4	G572 K573 I574 L579	G572-G576 PolarHBondContact O-N 3.27Å; K573-G576 PolarHBondContact O-N 3.25Å; I574-G576 PolarHBondContact O-N 2.72Å; G576-L579 PolarHBondContact O-N 3.45Å
577	M	83	Confident	83.6	Confident	59 Å²	59	59.2 Å²	59.2	29%	0.291	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-42.1	176.5	-71.8	172.6	61.3	0	0	112.8	K573 I574 T575 L579 E580 A603 V606 L607	K573-M577 WeakPolarHBondContact O-CG 3.42Å; K573-M577 PolarHBondContact O-N 2.88Å; I574-M577 PolarHBondContact O-N 3.22Å; T575-M577 PolarHBondContact O-N 3.24Å; M577-L579 VanDerWaalsContact C-N 3.29Å; M577-L579 PolarHBondContact O-N 2.95Å; M577-E580 WeakPolarHBondContact O-CB 3.29Å; M577-E580 PolarHBondContact O-N 3.22Å; M577-E580 VanDerWaalsContact O-N 3.11Å; M577-A603 HydrophobicContact CE-CB 4.38Å; M577-V606 HydrophobicContact CE-CB 4.01Å; M577-V606 HydrophobicContact CE-CG1 3.71Å; M577-L607 HydrophobicContact CE-CG 4.38Å; M577-L607 HydrophobicContact SD-CD1 4Å; M577-L607 HydrophobicContact SD-CD2 3.64Å; M577-L607 HydrophobicContact SD-CG 3.64Å
578	L	84.4	Confident	83.3	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-64.2	-36.7	177	-68.9	174.3	0	0	0	110.8	I563 I574 T575 E580 I581 L586 M589 L596 K599 V600	I563-L578 HydrophobicContact CD1-CD1 3.69Å; I574-L578 HydrophobicContact CG2-CD1 3.79Å; I574-L578 HydrophobicContact CG2-CG 4.3Å; I574-L578 WeakPolarHBondContact O-CB 3.39Å; I574-L578 VanDerWaalsContact O-CG 3.3Å; I574-L578 WeakPolarHBondContact O-CG 3.41Å; I574-L578 PolarHBondContact O-N 3.36Å; T575-L578 PolarHBondContact O-N 3.06Å; L578-E580 PolarHBondContact O-N 3.01Å; L578-I581 HydrophobicContact CD2-CD1 3.67Å; L578-I581 WeakPolarHBondContact O-CB 3.45Å; L578-I581 VanDerWaalsContact O-CG1 3.31Å; L578-I581 WeakPolarHBondContact O-CG1 3.46Å; L578-I581 PolarHBondContact O-N 3Å; L578-L586 HydrophobicContact CB-CD2 4.45Å; L578-L586 WeakPolarHBondContact O-CD2 3.4Å; L578-M589 HydrophobicContact CB-CE 4.31Å; L578-M589 HydrophobicContact CD1-CE 3.95Å; L578-M589 HydrophobicContact CD2-CE 4.09Å; L578-M589 HydrophobicContact CG-CE 4.34Å; L578-L596 HydrophobicContact CD1-CD1 4.43Å; L578-K599 HydrophobicContact CD2-CB 3.95Å; L578-V600 HydrophobicContact CD1-CG2 4.07Å
579	L	86.3	Confident	83.1	Confident	38 Å²	38	57.1 Å²	57.1	20%	0.199	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-6.1	174.2	-72.8	177.6	0	0	0	114.7	K552 L555 L559 T575 G576 M577 I581 L586	K552-L579 WeakPolarHBondContact CD-O 3.5Å; K552-L579 WeakPolarHBondContact CE-O 3.47Å; K552-L579 PolarHBondContact NZ-O 3.32Å; K552-L579 VanDerWaalsContact O-CD2 3.29Å; K552-L579 WeakPolarHBondContact O-CD2 3.24Å; L555-L579 HydrophobicContact CB-CD2 4.07Å; L559-L579 HydrophobicContact CD1-CD2 4.35Å; T575-L579 HydrophobicContact CG2-CD1 4.17Å; T575-L579 HydrophobicContact CG2-CG 4.31Å; T575-L579 WeakPolarHBondContact O-CB 3.41Å; T575-L579 VanDerWaalsContact O-CG 3.27Å; T575-L579 WeakPolarHBondContact O-CG 3.32Å; T575-L579 PolarHBondContact O-N 3.18Å; G576-L579 PolarHBondContact O-N 3.45Å; M577-L579 VanDerWaalsContact C-N 3.29Å; M577-L579 PolarHBondContact O-N 2.95Å; L579-I581 VanDerWaalsContact C-N 3.35Å; L579-L586 HydrophobicContact CD2-CD1 4.12Å
580	E	84.1	Confident	82.8	Confident	165 Å²	165	51.8 Å²	51.8	77%	0.771	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-20.7	168.1	-59.4	-168.3	164.3	0	0	112.6	K552 M577 L578	K552-E580 PolarHBondContact NZ-O 2.93Å; M577-E580 WeakPolarHBondContact O-CB 3.29Å; M577-E580 PolarHBondContact O-N 3.22Å; M577-E580 VanDerWaalsContact O-N 3.11Å; L578-E580 PolarHBondContact O-N 3.01Å
581	I	83.7	Confident	82.5	Confident	38 Å²	38	56.9 Å²	56.9	20%	0.195	31%	0.306	C	S	.	.	S	Bend	trans	-68.4	162.4	-179.7	-57.3	174.4	0	0	0	111.6	K552 L578 L579 E585 L586 K599	K552-I581 PolarHBondContact NZ-O 3.39Å; L578-I581 HydrophobicContact CD2-CD1 3.67Å; L578-I581 WeakPolarHBondContact O-CB 3.45Å; L578-I581 VanDerWaalsContact O-CG1 3.31Å; L578-I581 WeakPolarHBondContact O-CG1 3.46Å; L578-I581 PolarHBondContact O-N 3Å; L579-I581 VanDerWaalsContact C-N 3.35Å; I581-E585 HydrophobicContact CG2-CB 3.82Å; I581-E585 HydrophobicContact CG2-CG 3.96Å; I581-L586 HydrophobicContact CB-CD2 4.16Å; I581-L586 HydrophobicContact CB-CG 4.33Å; I581-K599 HydrophobicContact CD1-CD 4.35Å
582	D	82.3	Confident	82.5	Confident	118 Å²	118	58.3 Å²	58.3	63%	0.631	32%	0.316	S	S	*	.			trans	-63.3	134.7	175.1	-80.5	-39.1	0	0	0	112.6	S584 E585 L586	D582-S584 PolarHBondContact O-N 3.48Å; D582-E585 PolarHBondContact O-N 3.31Å; D582-L586 PolarHBondContact O-N 2.93Å; D582-L586 VanDerWaalsContact O-N 3.16Å
583	N	79.9	Confident	82.3	Confident	30 Å²	30	60.6 Å²	60.6	16%	0.16	32%	0.323	C	S	.	.	H	α-helix	trans	-56.5	-25.6	-175.4	-63.8	6.7	0	0	0	113.9	L543 Q551 K552 L555 L587	L543-N583 HydrophobicContact CD2-CB 4.48Å; Q551-N583 PolarHBondContact OE1-ND2 2.99Å; K552-N583 WeakPolarHBondContact CE-OD1 3.27Å; L555-N583 HydrophobicContact CD1-CB 4.04Å; N583-L587 WeakPolarHBondContact O-CG 3.49Å; N583-L587 PolarHBondContact O-N 3.11Å
584	S	79	Confident	82.1	Confident	92 Å²	92	61.1 Å²	61.1	64%	0.643	33%	0.327	S	S	*	.	H	α-helix	trans	-75.3	-30.8	176	50.8	0	0	0	0	114.2	D582 H588	D582-S584 PolarHBondContact O-N 3.48Å; S584-H588 PolarHBondContact O-N 2.67Å
585	E	79.9	Confident	82.1	Confident	76 Å²	76	62.5 Å²	62.5	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-78.2	-34.3	174.3	-174.3	170.3	165.1	0	0	109.8	I581 D582 H588 M589 K599	I581-E585 HydrophobicContact CG2-CB 3.82Å; I581-E585 HydrophobicContact CG2-CG 3.96Å; D582-E585 PolarHBondContact O-N 3.31Å; E585-H588 WeakPolarHBondContact O-CB 3.4Å; E585-H588 PolarHBondContact O-N 2.82Å; E585-M589 WeakPolarHBondContact O-CG 3.44Å; E585-M589 PolarHBondContact O-N 3.45Å; E585-K599 WeakPolarHBondContact OE1-CE 3.3Å; E585-K599 IonicContact OE1-NZ 2.72Å
586	L	81.5	Confident	82	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.5	-36.8	171.7	-64	-179.6	0	0	0	113.7	L555 L559 L578 L579 I581 D582 M589 L590	L555-L586 HydrophobicContact CD1-CB 3.91Å; L555-L586 HydrophobicContact CD1-CD1 3.9Å; L555-L586 HydrophobicContact CD2-CB 4.34Å; L559-L586 HydrophobicContact CD1-CB 4.47Å; L559-L586 HydrophobicContact CD1-CD2 3.93Å; L578-L586 HydrophobicContact CB-CD2 4.45Å; L578-L586 WeakPolarHBondContact O-CD2 3.4Å; L579-L586 HydrophobicContact CD2-CD1 4.12Å; I581-L586 HydrophobicContact CB-CD2 4.16Å; I581-L586 HydrophobicContact CB-CG 4.33Å; D582-L586 PolarHBondContact O-N 2.93Å; D582-L586 VanDerWaalsContact O-N 3.16Å; L586-M589 HydrophobicContact CD2-CE 3.59Å; L586-M589 HydrophobicContact CD2-SD 3.93Å; L586-M589 PolarHBondContact O-N 3.47Å; L586-L590 PolarHBondContact O-N 3.43Å
587	L	80.9	Confident	82	Confident	28 Å²	28	64 Å²	64	15%	0.147	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-43.8	170.7	-77.5	169.6	0	0	0	111.6	A540 L543 L555 N583 M589 L590 E591	A540-L587 HydrophobicContact CB-CD1 4.38Å; L543-L587 HydrophobicContact CD2-CD1 3.91Å; L543-L587 HydrophobicContact CD2-CD2 4.22Å; L543-L587 HydrophobicContact CD2-CG 4.12Å; L555-L587 HydrophobicContact CD2-CD2 4.06Å; L555-L587 HydrophobicContact CD2-CG 4.3Å; N583-L587 WeakPolarHBondContact O-CG 3.49Å; N583-L587 PolarHBondContact O-N 3.11Å; L587-M589 VanDerWaalsContact C-N 3.28Å; L587-M589 PolarHBondContact O-N 2.95Å; L587-L590 WeakPolarHBondContact O-CB 3.27Å; L587-L590 PolarHBondContact O-N 3.29Å; L587-E591 PolarHBondContact O-N 3.15Å
588	H	80	Confident	82.2	Confident	99 Å²	99	64.6 Å²	64.6	46%	0.458	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-35.1	175.7	-174.4	-90.3	0	0	0	112.7	S584 E585 L590 E591 S592 S595	S584-H588 PolarHBondContact O-N 2.67Å; E585-H588 WeakPolarHBondContact O-CB 3.4Å; E585-H588 PolarHBondContact O-N 2.82Å; H588-L590 VanDerWaalsContact C-N 3.3Å; H588-L590 PolarHBondContact O-N 3.45Å; H588-E591 PolarHBondContact O-N 3.04Å; H588-S592 WeakPolarHBondContact O-CB 3.26Å; H588-S592 PolarHBondContact O-N 3.19Å; H588-S595 PolarHBondContact ND1-OG 2.89Å
589	M	79.4	Confident	82.2	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-68.4	-24.4	172.7	-74	161.3	40.4	0	0	113.8	L559 L578 E585 L586 L587 L596 K599	L559-M589 HydrophobicContact CD2-CB 4.48Å; L559-M589 HydrophobicContact CD2-CE 4.11Å; L578-M589 HydrophobicContact CB-CE 4.31Å; L578-M589 HydrophobicContact CD1-CE 3.95Å; L578-M589 HydrophobicContact CD2-CE 4.09Å; L578-M589 HydrophobicContact CG-CE 4.34Å; E585-M589 WeakPolarHBondContact O-CG 3.44Å; E585-M589 PolarHBondContact O-N 3.45Å; L586-M589 HydrophobicContact CD2-CE 3.59Å; L586-M589 HydrophobicContact CD2-SD 3.93Å; L586-M589 PolarHBondContact O-N 3.47Å; L587-M589 VanDerWaalsContact C-N 3.28Å; L587-M589 PolarHBondContact O-N 2.95Å; M589-L596 HydrophobicContact CB-CB 4.42Å; M589-L596 HydrophobicContact CB-CD1 4.35Å; M589-L596 HydrophobicContact CE-CD1 3.8Å; M589-K599 HydrophobicContact CE-CB 4.49Å; M589-K599 HydrophobicContact SD-CB 4.17Å; M589-K599 HydrophobicContact SD-CG 4.01Å
590	L	78.6	Confident	82.2	Confident	51 Å²	51	65 Å²	65	27%	0.267	35%	0.346	S	S	.	.	H	α-helix	trans	-81.8	-26.6	171.7	-70.4	170.3	0	0	0	112.2	L555 R558 L559 L562 L586 L587 H588	L555-L590 HydrophobicContact CD2-CD1 3.66Å; R558-L590 HydrophobicContact CB-CD1 4.1Å; R558-L590 HydrophobicContact CB-CD2 3.76Å; L559-L590 HydrophobicContact CD2-CD2 3.69Å; L559-L590 HydrophobicContact CD2-CG 3.98Å; L559-L590 HydrophobicContact CG-CD2 3.99Å; L559-L590 HydrophobicContact CG-CG 4.32Å; L562-L590 HydrophobicContact CD1-CD2 3.91Å; L586-L590 PolarHBondContact O-N 3.43Å; L587-L590 WeakPolarHBondContact O-CB 3.27Å; L587-L590 PolarHBondContact O-N 3.29Å; H588-L590 VanDerWaalsContact C-N 3.3Å; H588-L590 PolarHBondContact O-N 3.45Å
591	E	79.9	Confident	82.3	Confident	159 Å²	159	63.4 Å²	63.4	74%	0.743	34%	0.338	S	S	*	.	H	α-helix	trans	-83.7	-25.3	175.1	-67.8	175.3	176.7	0	0	113.1	L587 H588	L587-E591 PolarHBondContact O-N 3.15Å; H588-E591 PolarHBondContact O-N 3.04Å
592	S	83.6	Confident	82.5	Confident	30 Å²	30	66.6 Å²	66.6	21%	0.21	35%	0.353	C	S	.	.			trans	-128.3	110.2	-177.1	176.3	0	0	0	0	112.6	H588 E594 S595 L596	H588-S592 WeakPolarHBondContact O-CB 3.26Å; H588-S592 PolarHBondContact O-N 3.19Å; S592-E594 VanDerWaalsContact C-N 3.3Å; S592-E594 PolarHBondContact O-N 2.97Å; S592-S595 WeakPolarHBondContact O-CB 3.39Å; S592-S595 PolarHBondContact O-N 2.99Å; S592-S595 WeakPolarHBondContact OG-CB 3.42Å; S592-S595 PolarHBondContact OG-N 2.96Å; S592-L596 PolarHBondContact O-N 3.14Å; S592-L596 VanDerWaalsContact O-N 3.11Å
593	P	78.9	Confident	82.7	Confident	93 Å²	93	61.3 Å²	61.3	60%	0.604	33%	0.325	S	S	*	.	H	α-helix	trans	-67.8	-28.8	179.1	27.4	-34.3	0	0	0	112.8	L596 N597	P593-L596 PolarHBondContact O-N 3.35Å; P593-N597 VanDerWaalsContact O-CG 3.22Å; P593-N597 PolarHBondContact O-N 3Å; P593-N597 PolarHBondContact O-OD1 3.14Å
594	E	80.8	Confident	83	Confident	157 Å²	157	61 Å²	61	73%	0.734	32%	0.323	S	S	*	.	H	α-helix	trans	-65.6	-42.1	173.5	-61.9	179.1	169.5	0	0	111.2	S592 L596 N597 S598	S592-E594 VanDerWaalsContact C-N 3.3Å; S592-E594 PolarHBondContact O-N 2.97Å; E594-L596 VanDerWaalsContact C-N 3.3Å; E594-L596 PolarHBondContact O-N 2.83Å; E594-N597 PolarHBondContact O-N 3.34Å; E594-S598 PolarHBondContact O-N 3.37Å; E594-S598 VanDerWaalsContact O-N 3.1Å
595	S	84.7	Confident	83.4	Confident	29 Å²	29	59.2 Å²	59.2	20%	0.203	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-34.9	174.5	-169.9	0	0	0	0	112.1	H588 S592 K599	H588-S595 PolarHBondContact ND1-OG 2.89Å; S592-S595 WeakPolarHBondContact O-CB 3.39Å; S592-S595 PolarHBondContact O-N 2.99Å; S592-S595 WeakPolarHBondContact OG-CB 3.42Å; S592-S595 PolarHBondContact OG-N 2.96Å; S595-K599 WeakPolarHBondContact O-CG 3.47Å; S595-K599 PolarHBondContact O-N 2.94Å
596	L	85.3	Confident	83.7	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-68.8	-50.2	174.2	-178.9	59.6	0	0	0	111.3	L559 L562 I563 L578 M589 S592 P593 E594 S598 K599 V600	L559-L596 HydrophobicContact CD2-CD1 3.9Å; L562-L596 HydrophobicContact CB-CD2 3.7Å; L562-L596 HydrophobicContact CD1-CD2 3.97Å; L562-L596 HydrophobicContact CG-CD2 4.48Å; I563-L596 HydrophobicContact CD1-CD1 4.48Å; I563-L596 HydrophobicContact CG1-CD1 4.16Å; L578-L596 HydrophobicContact CD1-CD1 4.43Å; M589-L596 HydrophobicContact CB-CB 4.42Å; M589-L596 HydrophobicContact CB-CD1 4.35Å; M589-L596 HydrophobicContact CE-CD1 3.8Å; S592-L596 PolarHBondContact O-N 3.14Å; S592-L596 VanDerWaalsContact O-N 3.11Å; P593-L596 PolarHBondContact O-N 3.35Å; E594-L596 VanDerWaalsContact C-N 3.3Å; E594-L596 PolarHBondContact O-N 2.83Å; L596-S598 PolarHBondContact O-N 2.79Å; L596-K599 PolarHBondContact O-N 3.18Å; L596-K599 VanDerWaalsContact O-N 3.16Å; L596-V600 HydrophobicContact CD1-CG2 4.02Å; L596-V600 HydrophobicContact CG-CG2 4.25Å; L596-V600 WeakPolarHBondContact O-CB 3.42Å; L596-V600 VanDerWaalsContact O-CG2 3.31Å; L596-V600 WeakPolarHBondContact O-CG2 3.05Å; L596-V600 PolarHBondContact O-N 3.05Å
597	N	85.5	Confident	83.8	Confident	69 Å²	69	60.8 Å²	60.8	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-57	-49	-178.3	-71.8	-9.8	0	0	0	111.9	L566 P593 E594 K599 V600 E601	L566-N597 VanDerWaalsContact CD1-OD1 3.22Å; L566-N597 WeakPolarHBondContact CD1-OD1 3.48Å; P593-N597 VanDerWaalsContact O-CG 3.22Å; P593-N597 PolarHBondContact O-N 3Å; P593-N597 PolarHBondContact O-OD1 3.14Å; E594-N597 PolarHBondContact O-N 3.34Å; N597-K599 VanDerWaalsContact C-N 3.28Å; N597-K599 PolarHBondContact O-N 3.28Å; N597-V600 WeakPolarHBondContact O-CB 3.4Å; N597-V600 PolarHBondContact O-N 3.22Å; N597-V600 VanDerWaalsContact O-N 3.15Å; N597-E601 PolarHBondContact O-N 3.39Å
598	S	87.5	Confident	83.9	Confident	73 Å²	73	65.5 Å²	65.5	51%	0.51	35%	0.349	S	S	.	.	H	α-helix	trans	-59.8	-37.1	178.8	-178.3	0	0	0	0	112.7	E594 L596 E602	E594-S598 PolarHBondContact O-N 3.37Å; E594-S598 VanDerWaalsContact O-N 3.1Å; L596-S598 PolarHBondContact O-N 2.79Å; S598-E602 PolarHBondContact O-N 3.28Å; S598-E602 VanDerWaalsContact O-N 3.11Å
599	K	84.6	Confident	84.1	Confident	48 Å²	48	63.5 Å²	63.5	21%	0.209	35%	0.349	C	S	.	.	H	α-helix	trans	-75.1	-31.9	176.8	-77.7	-75.8	165.9	-170.7	0	113.5	L578 I581 E585 M589 S595 L596 N597 E602 A603	L578-K599 HydrophobicContact CD2-CB 3.95Å; I581-K599 HydrophobicContact CD1-CD 4.35Å; E585-K599 WeakPolarHBondContact OE1-CE 3.3Å; E585-K599 IonicContact OE1-NZ 2.72Å; M589-K599 HydrophobicContact CE-CB 4.49Å; M589-K599 HydrophobicContact SD-CB 4.17Å; M589-K599 HydrophobicContact SD-CG 4.01Å; S595-K599 WeakPolarHBondContact O-CG 3.47Å; S595-K599 PolarHBondContact O-N 2.94Å; L596-K599 PolarHBondContact O-N 3.18Å; L596-K599 VanDerWaalsContact O-N 3.16Å; N597-K599 VanDerWaalsContact C-N 3.28Å; N597-K599 PolarHBondContact O-N 3.28Å; K599-E602 WeakPolarHBondContact CD-OE2 3.44Å; K599-E602 WeakPolarHBondContact CE-OE2 3.34Å; K599-E602 IonicContact NZ-OE2 2.64Å; K599-E602 PolarHBondContact NZ-OE2 3.11Å; K599-A603 WeakPolarHBondContact O-CB 3.31Å; K599-A603 PolarHBondContact O-N 3.24Å
600	V	86.4	Confident	84.1	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-66.6	-41.7	172.5	166.4	0	0	0	0	110.7	I563 H567 I574 L578 L596 N597 A603 I604	I563-V600 HydrophobicContact CG1-CG2 4Å; I563-V600 HydrophobicContact CG2-CG2 4.4Å; H567-V600 VanDerWaalsContact CD2-CG1 3.49Å; H567-V600 WeakPolarHBondContact CD2-CG1 3.44Å; I574-V600 HydrophobicContact CD1-CG1 4.44Å; I574-V600 HydrophobicContact CG2-CG1 4.37Å; I574-V600 HydrophobicContact CG2-CG2 4.08Å; L578-V600 HydrophobicContact CD1-CG2 4.07Å; L596-V600 HydrophobicContact CD1-CG2 4.02Å; L596-V600 HydrophobicContact CG-CG2 4.25Å; L596-V600 WeakPolarHBondContact O-CB 3.42Å; L596-V600 VanDerWaalsContact O-CG2 3.31Å; L596-V600 WeakPolarHBondContact O-CG2 3.05Å; L596-V600 PolarHBondContact O-N 3.05Å; N597-V600 WeakPolarHBondContact O-CB 3.4Å; N597-V600 PolarHBondContact O-N 3.22Å; N597-V600 VanDerWaalsContact O-N 3.15Å; V600-A603 PolarHBondContact O-N 3.49Å; V600-I604 HydrophobicContact CG1-CD1 3.9Å; V600-I604 WeakPolarHBondContact O-CD1 3.22Å; V600-I604 VanDerWaalsContact O-CG1 3.26Å; V600-I604 WeakPolarHBondContact O-CG1 3.24Å; V600-I604 PolarHBondContact O-N 3.38Å
601	E	86.1	Confident	84.1	Confident	133 Å²	133	71.8 Å²	71.8	62%	0.621	38%	0.384	S	S	*	.	H	α-helix	trans	-62.8	-44.4	173.2	-71.5	179.5	176	0	0	112.4	N597 A603 I604 A605	N597-E601 PolarHBondContact O-N 3.39Å; E601-A603 PolarHBondContact O-N 2.92Å; E601-I604 PolarHBondContact O-N 2.88Å; E601-A605 PolarHBondContact O-N 2.93Å
602	E	87.8	Confident	83.9	Confident	105 Å²	105	67.4 Å²	67.4	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-57.5	-46.7	174.7	-172.1	-179.5	-176	0	0	111.3	S598 K599 I604 A605 V606	S598-E602 PolarHBondContact O-N 3.28Å; S598-E602 VanDerWaalsContact O-N 3.11Å; K599-E602 WeakPolarHBondContact CD-OE2 3.44Å; K599-E602 WeakPolarHBondContact CE-OE2 3.34Å; K599-E602 IonicContact NZ-OE2 2.64Å; K599-E602 PolarHBondContact NZ-OE2 3.11Å; E602-I604 VanDerWaalsContact C-N 3.34Å; E602-I604 PolarHBondContact O-N 3.48Å; E602-A605 PolarHBondContact O-N 3.41Å; E602-V606 WeakPolarHBondContact O-CG2 3.5Å; E602-V606 PolarHBondContact O-N 3.19Å; E602-V606 VanDerWaalsContact O-N 3.1Å
603	A	86.9	Confident	83.3	Confident	7 Å²	7	73.8 Å²	73.8	6%	0.058	40%	0.399	C	S	.	.	H	α-helix	trans	-63.4	-37.3	176.7	0	0	0	0	0	112.8	I574 M577 K599 V600 E601 V606 L607	I574-A603 HydrophobicContact CG2-CB 4.11Å; M577-A603 HydrophobicContact CE-CB 4.38Å; K599-A603 WeakPolarHBondContact O-CB 3.31Å; K599-A603 PolarHBondContact O-N 3.24Å; V600-A603 PolarHBondContact O-N 3.49Å; E601-A603 PolarHBondContact O-N 2.92Å; A603-V606 PolarHBondContact O-N 3.16Å; A603-L607 WeakPolarHBondContact O-CB 3.49Å; A603-L607 WeakPolarHBondContact O-CG 3.41Å; A603-L607 PolarHBondContact O-N 3.1Å
604	I	86.4	Confident	82.8	Confident	22 Å²	22	75.7 Å²	75.7	11%	0.113	40%	0.4	C	S	.	.	H	α-helix	trans	-66.2	-43.3	175.7	-72.7	164.9	0	0	0	111.2	H567 I574 V600 E601 E602 V606 L607 Q608	H567-I604 VanDerWaalsContact CD2-CD1 3.44Å; H567-I604 WeakPolarHBondContact CD2-CD1 3.25Å; H567-I604 WeakPolarHBondContact NE2-CD1 3.31Å; I574-I604 HydrophobicContact CD1-CD1 3.95Å; I574-I604 HydrophobicContact CD1-CG1 3.64Å; I574-I604 HydrophobicContact CG1-CG1 4.33Å; V600-I604 HydrophobicContact CG1-CD1 3.9Å; V600-I604 WeakPolarHBondContact O-CD1 3.22Å; V600-I604 VanDerWaalsContact O-CG1 3.26Å; V600-I604 WeakPolarHBondContact O-CG1 3.24Å; V600-I604 PolarHBondContact O-N 3.38Å; E601-I604 PolarHBondContact O-N 2.88Å; E602-I604 VanDerWaalsContact C-N 3.34Å; E602-I604 PolarHBondContact O-N 3.48Å; I604-V606 VanDerWaalsContact C-N 3.32Å; I604-V606 PolarHBondContact O-N 2.88Å; I604-L607 PolarHBondContact O-N 3.45Å; I604-Q608 HydrophobicContact CG2-CG 4.43Å; I604-Q608 WeakPolarHBondContact O-CG 3.18Å; I604-Q608 PolarHBondContact O-N 2.97Å
605	A	86.7	Confident	81.6	Confident	56 Å²	56	73.4 Å²	73.4	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-60.4	-41.9	176.4	0	0	0	0	0	111.8	E601 E602 Q608 A609	E601-A605 PolarHBondContact O-N 2.93Å; E602-A605 PolarHBondContact O-N 3.41Å; A605-Q608 PolarHBondContact O-N 3.39Å; A605-A609 WeakPolarHBondContact O-CB 3.26Å; A605-A609 PolarHBondContact O-N 2.9Å
606	V	86.5	Confident	79.9	Confident	79 Å²	79	75.3 Å²	75.3	48%	0.479	41%	0.414	S	S	.	.	H	α-helix	trans	-64.1	-43.4	174.5	174.2	0	0	0	0	111.7	M577 E602 A603 I604 Q608 A609 H610	M577-V606 HydrophobicContact CE-CB 4.01Å; M577-V606 HydrophobicContact CE-CG1 3.71Å; E602-V606 WeakPolarHBondContact O-CG2 3.5Å; E602-V606 PolarHBondContact O-N 3.19Å; E602-V606 VanDerWaalsContact O-N 3.1Å; A603-V606 PolarHBondContact O-N 3.16Å; I604-V606 VanDerWaalsContact C-N 3.32Å; I604-V606 PolarHBondContact O-N 2.88Å; V606-Q608 VanDerWaalsContact C-N 3.34Å; V606-Q608 PolarHBondContact O-N 3.44Å; V606-A609 PolarHBondContact O-N 3.32Å; V606-H610 PolarHBondContact O-N 2.85Å
607	L	83.4	Confident	78.1	Confident	30 Å²	30	80.7 Å²	80.7	16%	0.157	45%	0.449	C	S	.	.	H	α-helix	trans	-64.2	-35.7	176.5	-76.6	168.4	0	0	0	113	K573 I574 M577 A603 I604 K611	K573-L607 HydrophobicContact CB-CD1 4.32Å; I574-L607 HydrophobicContact CG1-CD1 3.87Å; M577-L607 HydrophobicContact CE-CG 4.38Å; M577-L607 HydrophobicContact SD-CD1 4Å; M577-L607 HydrophobicContact SD-CD2 3.64Å; M577-L607 HydrophobicContact SD-CG 3.64Å; A603-L607 WeakPolarHBondContact O-CB 3.49Å; A603-L607 WeakPolarHBondContact O-CG 3.41Å; A603-L607 PolarHBondContact O-N 3.1Å; I604-L607 PolarHBondContact O-N 3.45Å; L607-K611 WeakPolarHBondContact O-CG 3.49Å; L607-K611 PolarHBondContact O-N 3.24Å
608	Q	83.8	Confident	76.4	Confident	127 Å²	127	87.5 Å²	87.5	59%	0.593	48%	0.476	S	S	*	.	H	α-helix	trans	-67.8	-45	173.4	-70.6	178	17.1	0	0	111.3	I604 A605 V606 H610 K611 A612	I604-Q608 HydrophobicContact CG2-CG 4.43Å; I604-Q608 WeakPolarHBondContact O-CG 3.18Å; I604-Q608 PolarHBondContact O-N 2.97Å; A605-Q608 PolarHBondContact O-N 3.39Å; V606-Q608 VanDerWaalsContact C-N 3.34Å; V606-Q608 PolarHBondContact O-N 3.44Å; Q608-H610 VanDerWaalsContact C-N 3.28Å; Q608-H610 PolarHBondContact O-N 3.41Å; Q608-K611 PolarHBondContact O-N 3.34Å; Q608-A612 PolarHBondContact O-N 3.46Å
609	A	83.1	Confident	74.2	Confident	56 Å²	56	97.2 Å²	97.2	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-63.2	-31.4	176.5	0	0	0	0	0	113.2	A605 V606 K613	A605-A609 WeakPolarHBondContact O-CB 3.26Å; A605-A609 PolarHBondContact O-N 2.9Å; V606-A609 PolarHBondContact O-N 3.32Å; A609-K613 PolarHBondContact O-N 3.27Å
610	H	79.9	Confident	73.7	Confident	109 Å²	109	99.7 Å²	99.7	51%	0.505	52%	0.524	S	S	.	.	H	α-helix	trans	-68.4	-51.1	173	-160.4	-80.7	0	0	0	111.5	V606 Q608 A612 K613 E614	V606-H610 PolarHBondContact O-N 2.85Å; Q608-H610 VanDerWaalsContact C-N 3.28Å; Q608-H610 PolarHBondContact O-N 3.41Å; H610-A612 VanDerWaalsContact C-N 3.26Å; H610-A612 PolarHBondContact O-N 3.27Å; H610-K613 WeakPolarHBondContact O-CB 3.28Å; H610-K613 PolarHBondContact O-N 3.41Å; H610-E614 IonicContact CE1-OE1 2.73Å; H610-E614 PolarHBondContact CE1-OE1 3.06Å; H610-E614 IonicContact CE1-OE2 3.34Å; H610-E614 PolarHBondContact CE1-OE2 3.08Å; H610-E614 IonicContact ND1-OE1 2.68Å; H610-E614 IonicContact ND1-OE2 3.12Å; H610-E614 PolarHBondContact ND1-OE2 2.82Å; H610-E614 PolarHBondContact O-N 3.01Å
611	K	77.9	Confident	73.1	Confident	118 Å²	118	104.9 Å²	104.9	51%	0.513	55%	0.551	S	S	.	*	H	α-helix	trans	-56.2	-39.7	176.5	-73.7	175.7	176.1	-177.3	0	112.4	L607 Q608 K613 E614 C615	L607-K611 WeakPolarHBondContact O-CG 3.49Å; L607-K611 PolarHBondContact O-N 3.24Å; Q608-K611 PolarHBondContact O-N 3.34Å; K611-K613 VanDerWaalsContact C-N 3.28Å; K611-K613 PolarHBondContact O-N 3.47Å; K611-E614 PolarHBondContact O-N 3.49Å; K611-E614 VanDerWaalsContact O-N 3.16Å; K611-C615 PolarHBondContact O-N 3.1Å
612	A	75.4	Confident	72.3	Confident	67 Å²	67	103.3 Å²	103.3	55%	0.554	55%	0.547	S	S	*	.	H	α-helix	trans	-61.3	-34	176.5	0	0	0	0	0	113.1	Q608 H610 S616	Q608-A612 PolarHBondContact O-N 3.46Å; H610-A612 VanDerWaalsContact C-N 3.26Å; H610-A612 PolarHBondContact O-N 3.27Å; A612-S616 PolarHBondContact O-N 3.43Å
613	K	72	Confident	71.4	Confident	164 Å²	164	103.2 Å²	103.2	71%	0.713	55%	0.55	S	S	*	*	H	α-helix	trans	-77.9	-27.1	174	-73.1	179.3	175.7	177.4	0	113.7	A609 H610 K611 S616	A609-K613 PolarHBondContact O-N 3.27Å; H610-K613 WeakPolarHBondContact O-CB 3.28Å; H610-K613 PolarHBondContact O-N 3.41Å; K611-K613 VanDerWaalsContact C-N 3.28Å; K611-K613 PolarHBondContact O-N 3.47Å; K613-S616 PolarHBondContact O-OG 3.39Å
614	E	67.4	Low	70.5	Confident	133 Å²	133	109.3 Å²	109.3	62%	0.621	58%	0.581	S	S	*	*	H	α-helix	trans	-78.5	-30.3	175.6	-69.3	175	124.6	0	0	112	H610 K611	H610-E614 IonicContact CE1-OE1 2.73Å; H610-E614 PolarHBondContact CE1-OE1 3.06Å; H610-E614 IonicContact CE1-OE2 3.34Å; H610-E614 PolarHBondContact CE1-OE2 3.08Å; H610-E614 IonicContact ND1-OE1 2.68Å; H610-E614 IonicContact ND1-OE2 3.12Å; H610-E614 PolarHBondContact ND1-OE2 2.82Å; H610-E614 PolarHBondContact O-N 3.01Å; K611-E614 PolarHBondContact O-N 3.49Å; K611-E614 VanDerWaalsContact O-N 3.16Å
615	C	56.9	Low	69.4	Low	110 Å²	110	115.1 Å²	115.1	74%	0.743	61%	0.612	S	S	*	*	S	Bend	trans	-81.5	-11.7	175	-74.2	0	0	0	0	114.9	K611 P617	K611-C615 PolarHBondContact O-N 3.1Å; C615-P617 WeakPolarHBondContact O-CD 3.48Å
616	S	47.9	Very low	68.2	Low	68 Å²	68	119.3 Å²	119.3	48%	0.476	62%	0.623	S	S	.	*	S	Bend	trans	-75.5	116.3	172.1	56.3	0	0	0	0	110.3	A612 K613 K618	A612-S616 PolarHBondContact O-N 3.43Å; K613-S616 PolarHBondContact O-OG 3.39Å; S616-K618 PolarHBondContact O-N 3.43Å
617	P	48.1	Very low	66.7	Low	119 Å²	119	122.4 Å²	122.4	77%	0.773	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-65.4	134.5	-178	26.8	-34.2	0	0	0	110.7	C615 K619	C615-P617 WeakPolarHBondContact O-CD 3.48Å; P617-K619 PolarHBondContact O-N 3.37Å
618	K	50.5	Low	65.4	Low	213 Å²	213	130.1 Å²	130.1	93%	0.926	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-62.7	116.7	172.6	-66.5	177.9	-179.2	175.2	0	109.1	S616	S616-K618 PolarHBondContact O-N 3.43Å
619	K	41.3	Very low	63.7	Low	277 Å²	277	130.4 Å²	130.4	100%	1.204	68%	0.681	S	S	*	*			trans	-86.2	0	159.5	-80	-171.9	170.9	-174.5	0	109.9	P617	P617-K619 PolarHBondContact O-N 3.37Å

Retrieved 619 of 619 residues in 372.6 ms (Link to these results)

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