A0A096MFQ5_POEFO Loading...

Ubiquitin-fold modifier-conjugating enzyme 1

E2-like enzyme which specifically catalyzes the second step in ufmylation. Accepts the ubiquitin-like modifier UFM1 from the E1 enzyme UBA5 and forms an intermediate with UFM1 via a thioester linkage. Ufmylation is involved in various processes, such as ribosome recycling, response to DNA damage, interferon response or reticulophagy (also called ER-phagy).

AlphaFold DB , UniProt , Accession A0A096MFQ5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 170 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	53.7	Low	78.6	Confident	218 Å²	218	91.6 Å²	91.6	100%	1.074	50%	0.499	S	S	*	.				0	129.3	0	-90.6	-168.8	-81.3	0	0	107.6
2	A	64.6	Low	79.6	Confident	53 Å²	53	93.4 Å²	93.4	44%	0.438	50%	0.501	S	S	.	.			trans	-61.4	142.4	172.4	0	0	0	0	0	109.9	T6 R7	A2-T6 HydrophobicContact CB-CG2 4.44Å; A2-R7 HydrophobicContact CB-CG 4.44Å; A2-R7 PolarHBondContact O-NE 2.66Å; A2-R7 PolarHBondContact O-NH2 3.01Å
3	D	76.4	Confident	80.9	Confident	96 Å²	96	86.5 Å²	86.5	51%	0.513	46%	0.464	S	S	.	.			trans	-66.4	164	178.1	63.5	46.3	0	0	0	112.1	A5 T6 R7	D3-A5 VanDerWaalsContact C-N 3.3Å; D3-A5 PolarHBondContact O-N 2.92Å; D3-A5 PolarHBondContact OD1-N 2.53Å; D3-T6 PolarHBondContact O-N 3.01Å; D3-T6 VanDerWaalsContact OD1-CB 3.22Å; D3-T6 WeakPolarHBondContact OD1-CB 3.32Å; D3-T6 PolarHBondContact OD1-N 3.05Å; D3-T6 PolarHBondContact OD1-OG1 3.3Å; D3-R7 WeakPolarHBondContact O-CG 3.08Å; D3-R7 PolarHBondContact O-N 3.01Å; D3-R7 VanDerWaalsContact O-N 3.1Å
4	E	79.2	Confident	82.1	Confident	102 Å²	102	83.9 Å²	83.9	48%	0.477	45%	0.454	S	S	.	.	H	α-helix	trans	-65	-33.9	-174.6	-179.5	60.8	-165.8	0	0	112.4	R7 R8	E4-R7 PolarHBondContact O-N 3.49Å; E4-R8 WeakPolarHBondContact O-CG 3.1Å; E4-R8 PolarHBondContact O-N 3.21Å; E4-R8 IonicContact OE1-CZ 3.5Å; E4-R8 IonicContact OE1-NE 2.89Å; E4-R8 PolarHBondContact OE1-NE 2.91Å; E4-R8 IonicContact OE1-NH2 3.23Å; E4-R8 PolarHBondContact OE1-NH2 3.37Å
5	A	79.7	Confident	83.2	Confident	73 Å²	73	83.4 Å²	83.4	60%	0.603	45%	0.451	S	S	*	.	H	α-helix	trans	-65.6	-46.8	178.5	0	0	0	0	0	111.1	D3 R7 R8 A9	D3-A5 VanDerWaalsContact C-N 3.3Å; D3-A5 PolarHBondContact O-N 2.92Å; D3-A5 PolarHBondContact OD1-N 2.53Å; A5-R7 VanDerWaalsContact C-N 3.34Å; A5-R7 PolarHBondContact O-N 3.24Å; A5-R8 PolarHBondContact O-N 3.35Å; A5-A9 PolarHBondContact O-N 3.24Å
6	T	80.6	Confident	84.1	Confident	38 Å²	38	78.5 Å²	78.5	23%	0.233	42%	0.424	C	S	.	.	H	α-helix	trans	-60.6	-43.8	176.1	-56.6	0	0	0	0	110.9	A2 D3 R8 A9 V10 L140	A2-T6 HydrophobicContact CB-CG2 4.44Å; D3-T6 PolarHBondContact O-N 3.01Å; D3-T6 VanDerWaalsContact OD1-CB 3.22Å; D3-T6 WeakPolarHBondContact OD1-CB 3.32Å; D3-T6 PolarHBondContact OD1-N 3.05Å; D3-T6 PolarHBondContact OD1-OG1 3.3Å; T6-R8 PolarHBondContact O-N 3.27Å; T6-A9 PolarHBondContact O-N 3.22Å; T6-V10 HydrophobicContact CG2-CG2 4.35Å; T6-V10 WeakPolarHBondContact O-CB 3.47Å; T6-V10 WeakPolarHBondContact O-CG2 3.39Å; T6-V10 PolarHBondContact O-N 2.92Å; T6-L140 HydrophobicContact CG2-CD2 4.08Å
7	R	84.4	Confident	84.9	Confident	120 Å²	120	84.4 Å²	84.4	45%	0.453	45%	0.445	S	S	.	.	H	α-helix	trans	-61	-43.6	176.9	-71.3	179	-161.6	-168.5	4.6	112.1	A2 D3 E4 A5 S11	A2-R7 HydrophobicContact CB-CG 4.44Å; A2-R7 PolarHBondContact O-NE 2.66Å; A2-R7 PolarHBondContact O-NH2 3.01Å; D3-R7 WeakPolarHBondContact O-CG 3.08Å; D3-R7 PolarHBondContact O-N 3.01Å; D3-R7 VanDerWaalsContact O-N 3.1Å; E4-R7 PolarHBondContact O-N 3.49Å; A5-R7 VanDerWaalsContact C-N 3.34Å; A5-R7 PolarHBondContact O-N 3.24Å; R7-S11 VanDerWaalsContact O-CB 3.27Å; R7-S11 WeakPolarHBondContact O-CB 3.17Å; R7-S11 PolarHBondContact O-N 3.45Å; R7-S11 PolarHBondContact O-OG 2.72Å
8	R	84.4	Confident	85.7	Confident	154 Å²	154	80.3 Å²	80.3	58%	0.581	42%	0.424	S	S	*	.	H	α-helix	trans	-63.2	-49.6	178.2	-75	176.4	-172.9	-166.8	1.8	111.6	E4 A5 T6 V10 S11	E4-R8 WeakPolarHBondContact O-CG 3.1Å; E4-R8 PolarHBondContact O-N 3.21Å; E4-R8 IonicContact OE1-CZ 3.5Å; E4-R8 IonicContact OE1-NE 2.89Å; E4-R8 PolarHBondContact OE1-NE 2.91Å; E4-R8 IonicContact OE1-NH2 3.23Å; E4-R8 PolarHBondContact OE1-NH2 3.37Å; A5-R8 PolarHBondContact O-N 3.35Å; T6-R8 PolarHBondContact O-N 3.27Å; R8-V10 VanDerWaalsContact C-N 3.32Å; R8-V10 PolarHBondContact O-N 2.89Å; R8-S11 PolarHBondContact O-N 3.23Å; R8-S11 PolarHBondContact O-OG 3.41Å
9	A	82.4	Confident	86.3	Confident	44 Å²	44	81.1 Å²	81.1	36%	0.364	43%	0.425	S	S	.	.	H	α-helix	trans	-57.2	-46.4	178.5	0	0	0	0	0	111.5	A5 T6 S11 Q12	A5-A9 PolarHBondContact O-N 3.24Å; T6-A9 PolarHBondContact O-N 3.22Å; A9-S11 PolarHBondContact O-N 3.33Å; A9-Q12 PolarHBondContact O-N 2.91Å
10	V	88.5	Confident	86.9	Confident	18 Å²	18	77.1 Å²	77.1	11%	0.109	40%	0.404	C	S	.	.	H	α-helix	trans	-70	-33.4	-179.2	173.7	0	0	0	0	112.1	T6 R8 Q12 I13 A139 L140	T6-V10 HydrophobicContact CG2-CG2 4.35Å; T6-V10 WeakPolarHBondContact O-CB 3.47Å; T6-V10 WeakPolarHBondContact O-CG2 3.39Å; T6-V10 PolarHBondContact O-N 2.92Å; R8-V10 VanDerWaalsContact C-N 3.32Å; R8-V10 PolarHBondContact O-N 2.89Å; V10-Q12 PolarHBondContact O-N 3.23Å; V10-Q12 VanDerWaalsContact O-N 3.15Å; V10-I13 WeakPolarHBondContact O-CB 3.3Å; V10-I13 PolarHBondContact O-N 2.93Å; V10-I13 VanDerWaalsContact O-N 3.09Å; V10-A139 HydrophobicContact CG2-CB 4Å; V10-L140 HydrophobicContact CG1-CD1 4.05Å; V10-L140 HydrophobicContact CG1-CD2 4.4Å; V10-L140 HydrophobicContact CG1-CG 4.31Å; V10-L140 HydrophobicContact CG2-CD1 4.46Å; V10-L140 HydrophobicContact CG2-CD2 3.61Å; V10-L140 HydrophobicContact CG2-CG 3.82Å
11	S	90.4	Very high	87.4	Confident	92 Å²	92	73.5 Å²	73.5	64%	0.643	39%	0.385	S	S	*	.	H	α-helix	trans	-62.8	-20.8	178.8	73.7	0	0	0	0	114	R7 R8 A9	R7-S11 VanDerWaalsContact O-CB 3.27Å; R7-S11 WeakPolarHBondContact O-CB 3.17Å; R7-S11 PolarHBondContact O-N 3.45Å; R7-S11 PolarHBondContact O-OG 2.72Å; R8-S11 PolarHBondContact O-N 3.23Å; R8-S11 PolarHBondContact O-OG 3.41Å; A9-S11 PolarHBondContact O-N 3.33Å
12	Q	90.8	Very high	89.4	Confident	113 Å²	113	64.6 Å²	64.6	53%	0.528	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.7	179.5	-63.3	-176.7	-5.1	0	0	113	A9 V10 P14 Q45	A9-Q12 PolarHBondContact O-N 2.91Å; V10-Q12 PolarHBondContact O-N 3.23Å; V10-Q12 VanDerWaalsContact O-N 3.15Å; Q12-P14 WeakPolarHBondContact O-CD 3.37Å; Q12-Q45 PolarHBondContact O-NE2 2.88Å
13	I	96.3	Very high	90.8	Very high	4 Å²	4	70.7 Å²	70.7	2%	0.021	36%	0.356	C	S	.	.	S	Bend	trans	-73.4	126.4	175.9	-56.8	177.4	0	0	0	108.4	V10 L15 A38 F42 A135 H136 A139	V10-I13 WeakPolarHBondContact O-CB 3.3Å; V10-I13 PolarHBondContact O-N 2.93Å; V10-I13 VanDerWaalsContact O-N 3.09Å; I13-L15 PolarHBondContact O-N 3.36Å; I13-A38 HydrophobicContact CG2-CB 4.31Å; I13-F42 HydrophobicContact CD1-CD1 4.43Å; I13-F42 HydrophobicContact CD1-CD2 4.04Å; I13-F42 HydrophobicContact CD1-CE2 4.22Å; I13-F42 HydrophobicContact CD1-CG 4.17Å; I13-F42 HydrophobicContact CG1-CB 4.41Å; I13-F42 HydrophobicContact CG1-CD2 3.92Å; I13-F42 HydrophobicContact CG1-CE2 4.47Å; I13-F42 HydrophobicContact CG1-CG 4.19Å; I13-A135 HydrophobicContact CG2-CB 3.62Å; I13-H136 VanDerWaalsContact CG2-CE1 3.42Å; I13-H136 WeakPolarHBondContact CG2-CE1 3.09Å; I13-A139 HydrophobicContact CD1-CB 3.74Å
14	P	97.9	Very high	91.7	Very high	49 Å²	49	70.3 Å²	70.3	32%	0.318	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-56.7	128.6	175.1	-24.4	33.2	0	0	0	111.5	Q12 A38 R41	Q12-P14 WeakPolarHBondContact O-CD 3.37Å; P14-A38 HydrophobicContact CB-CB 4.39Å; P14-R41 HydrophobicContact CG-CB 3.73Å; P14-R41 HydrophobicContact CG-CG 3.8Å
15	L	98.1	Very high	92.3	Very high	77 Å²	77	76.2 Å²	76.2	40%	0.403	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-80.2	140.1	176.7	-59.9	178	0	0	0	110.9	I13 R131 H136	I13-L15 PolarHBondContact O-N 3.36Å; L15-R131 HydrophobicContact CB-CB 4.45Å; L15-R131 HydrophobicContact CD2-CB 4.44Å; L15-H136 WeakPolarHBondContact CD2-NE2 3.41Å
16	L	98.6	Very high	93	Very high	5 Å²	5	77.2 Å²	77.2	3%	0.026	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-84.9	157	179.5	-66.2	85.3	0	0	0	110.4	R31 E34 E35 A38 R131	L16-R31 VanDerWaalsContact CD2-NE 3.34Å; L16-E34 HydrophobicContact CB-CB 4.43Å; L16-E34 WeakPolarHBondContact CB-OE2 3.39Å; L16-E34 HydrophobicContact CD2-CB 3.77Å; L16-E34 HydrophobicContact CG-CB 3.89Å; L16-E35 HydrophobicContact CD2-CG 3.85Å; L16-E35 WeakPolarHBondContact CD2-OE1 3.3Å; L16-A38 HydrophobicContact CD1-CB 4.16Å; L16-R131 PolarHBondContact N-O 2.89Å; L16-R131 WeakPolarHBondContact O-CA 3.38Å
17	K	98.2	Very high	93.8	Very high	178 Å²	178	79.2 Å²	79.2	77%	0.774	39%	0.385	S	S	*	.			trans	-124.8	-35.3	-175.2	-63.7	-179.3	-177.1	177.4	0	111.6	H19 E34	K17-H19 PolarHBondContact O-N 3.43Å; K17-E34 PolarHBondContact N-OE2 2.93Å
18	T	98.3	Very high	94.5	Very high	12 Å²	12	74.4 Å²	74.4	7%	0.074	37%	0.367	C	S	.	.			trans	-74.4	117.4	-176.1	-59	0	0	0	0	109.7	A20 L27 Q30 R31 E34	T18-A20 HydrophobicContact CG2-CB 3.82Å; T18-A20 PolarHBondContact O-N 3.1Å; T18-L27 HydrophobicContact CG2-CB 4.18Å; T18-Q30 HydrophobicContact CG2-CB 4.42Å; T18-Q30 HydrophobicContact CG2-CG 4.43Å; T18-Q30 WeakPolarHBondContact OG1-CG 3.22Å; T18-Q30 PolarHBondContact OG1-NE2 3.31Å; T18-Q30 VanDerWaalsContact OG1-NE2 3.16Å; T18-R31 HydrophobicContact CG2-CB 4.02Å; T18-R31 WeakPolarHBondContact O-CD 3.25Å; T18-R31 PolarHBondContact O-NH1 3Å; T18-E34 WeakPolarHBondContact CB-OE1 3.48Å; T18-E34 PolarHBondContact N-OE1 2.91Å; T18-E34 PolarHBondContact N-OE2 2.72Å; T18-E34 PolarHBondContact OG1-OE1 2.87Å
19	H	98	Very high	95.1	Very high	95 Å²	95	70.8 Å²	70.8	44%	0.44	36%	0.364	S	S	.	.			trans	-88.6	89.5	171.1	-167.4	-65.4	0	0	0	108.4	K17 E92 P130	K17-H19 PolarHBondContact O-N 3.43Å; H19-E92 IonicContact CD2-OE1 3.25Å; H19-E92 IonicContact CE1-OE1 2.95Å; H19-E92 PolarHBondContact CE1-OE1 3.46Å; H19-E92 VanDerWaalsContact CE1-OE1 3.25Å; H19-E92 IonicContact NE2-OE1 2.73Å; H19-E92 PolarHBondContact NE2-OE1 3.16Å; H19-P130 HydrophobicContact CB-CB 3.92Å; H19-P130 HydrophobicContact CB-CG 3.95Å
20	A	97.9	Very high	95.9	Very high	1 Å²	1	73.5 Å²	73.5	1%	0.008	37%	0.369	C	S	.	.			trans	-154.4	140.2	-179.5	0	0	0	0	0	110.3	T18 E24 L27 R31	T18-A20 HydrophobicContact CG2-CB 3.82Å; T18-A20 PolarHBondContact O-N 3.1Å; A20-E24 HydrophobicContact CB-CB 4.04Å; A20-E24 HydrophobicContact CB-CG 4.49Å; A20-L27 HydrophobicContact CB-CB 3.54Å; A20-R31 HydrophobicContact CB-CB 4.33Å
21	G	96.3	Very high	96.3	Very high	1 Å²	1	72.7 Å²	72.7	1%	0.01	36%	0.364	C	S	.	.			trans	-106.6	-171.6	171.8	0	0	0	0	0	112.2	R23 E24 W28 Y90	G21-R23 PolarHBondContact O-N 3.42Å; G21-E24 WeakPolarHBondContact CA-OE2 3.26Å; G21-E24 PolarHBondContact N-OE2 3.12Å; G21-E24 PolarHBondContact O-N 2.78Å; G21-W28 WeakPolarHBondContact O-CB 3.4Å; G21-Y90 WeakPolarHBondContact CA-O 3.28Å; G21-Y90 PolarHBondContact N-O 3.26Å
22	P	96.1	Very high	96.7	Very high	32 Å²	32	69.3 Å²	69.3	21%	0.208	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.7	-175.5	28.1	-35.7	0	0	0	114	T63 I86	P22-T63 HydrophobicContact CB-CG2 3.92Å; P22-I86 HydrophobicContact CG-CG2 4.17Å
23	R	94.9	Very high	97.1	Very high	180 Å²	180	70.3 Å²	70.3	68%	0.679	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-25.2	177.3	-72.6	-167.8	173.8	173.7	2.7	112.7	G21 R25 V88	G21-R23 PolarHBondContact O-N 3.42Å; R23-R25 VanDerWaalsContact C-N 3.28Å; R23-R25 PolarHBondContact O-N 3.42Å; R23-V88 HydrophobicContact CG-CG1 4.11Å
24	E	95.1	Very high	97.2	Very high	88 Å²	88	71.6 Å²	71.6	41%	0.411	35%	0.347	S	S	.	.			trans	-79.9	70.3	-178.6	-66.2	69.8	-148.1	0	0	110.9	A20 G21 A26 L27 W28	A20-E24 HydrophobicContact CB-CB 4.04Å; A20-E24 HydrophobicContact CB-CG 4.49Å; G21-E24 WeakPolarHBondContact CA-OE2 3.26Å; G21-E24 PolarHBondContact N-OE2 3.12Å; G21-E24 PolarHBondContact O-N 2.78Å; E24-A26 PolarHBondContact O-N 2.93Å; E24-L27 HydrophobicContact CB-CB 4.45Å; E24-L27 PolarHBondContact O-N 3.31Å; E24-W28 WeakPolarHBondContact O-CB 3.32Å; E24-W28 PolarHBondContact O-N 3.11Å
25	R	90.7	Very high	97.2	Very high	227 Å²	227	69.3 Å²	69.3	86%	0.857	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.5	-33.9	-171.5	-65	-173.4	179.7	-154	-1.3	115.8	R23 P29	R23-R25 VanDerWaalsContact C-N 3.28Å; R23-R25 PolarHBondContact O-N 3.42Å; R25-P29 VanDerWaalsContact O-CD 3.27Å; R25-P29 WeakPolarHBondContact O-CD 3.37Å
26	A	95.3	Very high	97.2	Very high	93 Å²	93	69.7 Å²	69.7	77%	0.769	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-31.8	-179.6	0	0	0	0	0	113.3	E24	E24-A26 PolarHBondContact O-N 2.93Å
27	L	97.5	Very high	97.2	Very high	80 Å²	80	74.5 Å²	74.5	42%	0.419	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-20.7	-173.4	-63.2	176.8	0	0	0	112.7	T18 A20 E24 Q30 R31	T18-L27 HydrophobicContact CG2-CB 4.18Å; A20-L27 HydrophobicContact CB-CB 3.54Å; E24-L27 HydrophobicContact CB-CB 4.45Å; E24-L27 PolarHBondContact O-N 3.31Å; L27-Q30 WeakPolarHBondContact O-CB 3.38Å; L27-Q30 PolarHBondContact O-N 2.95Å; L27-Q30 VanDerWaalsContact O-N 3.08Å; L27-R31 PolarHBondContact O-N 2.88Å
28	W	97.9	Very high	97.2	Very high	19 Å²	19	66 Å²	66	7%	0.072	32%	0.315	C	S	.	.	H	α-helix	trans	-56.7	-45.1	178.1	179.9	-120.9	0	0	0	113.4	G21 E24 Q30 R31 L32 D61 G62 I86 Y90	G21-W28 WeakPolarHBondContact O-CB 3.4Å; E24-W28 WeakPolarHBondContact O-CB 3.32Å; E24-W28 PolarHBondContact O-N 3.11Å; W28-Q30 PolarHBondContact O-N 3.23Å; W28-R31 HydrophobicContact CE3-CB 3.97Å; W28-R31 HydrophobicContact CE3-CG 3.91Å; W28-R31 HydrophobicContact CZ3-CB 4.19Å; W28-R31 HydrophobicContact CZ3-CG 3.61Å; W28-R31 WeakPolarHBondContact O-CB 3.26Å; W28-R31 PolarHBondContact O-N 3.5Å; W28-R31 VanDerWaalsContact O-N 3.14Å; W28-L32 HydrophobicContact CZ2-CD1 4.15Å; W28-L32 WeakPolarHBondContact O-CB 3.41Å; W28-L32 PolarHBondContact O-N 3.3Å; W28-D61 PolarHBondContact NE1-O 3.2Å; W28-G62 WeakPolarHBondContact CZ2-O 3.1Å; W28-I86 HydrophobicContact CH2-CG2 4.03Å; W28-Y90 HydrophobicContact CH2-CD1 4.06Å; W28-Y90 HydrophobicContact CH2-CE1 4.22Å; W28-Y90 AromaticContact CZ3-CD1 3.8Å; W28-Y90 HydrophobicContact CZ3-CD1 3.8Å; W28-Y90 HydrophobicContact CZ3-CE1 4.08Å
29	P	98.1	Very high	97.2	Very high	78 Å²	78	66 Å²	66	51%	0.506	31%	0.314	S	S	.	.	H	α-helix	trans	-61.1	-33	176.5	-24.2	35.8	0	0	0	113	R25 K33	R25-P29 VanDerWaalsContact O-CD 3.27Å; R25-P29 WeakPolarHBondContact O-CD 3.37Å; P29-K33 WeakPolarHBondContact O-CB 3.46Å; P29-K33 PolarHBondContact O-N 2.98Å
30	Q	98.3	Very high	97.2	Very high	102 Å²	102	65.8 Å²	65.8	48%	0.477	32%	0.315	S	S	.	.	H	α-helix	trans	-68.7	-45.5	175.5	-176.2	-179.7	-17.7	0	0	111	T18 L27 W28 L32 K33 E34	T18-Q30 HydrophobicContact CG2-CB 4.42Å; T18-Q30 HydrophobicContact CG2-CG 4.43Å; T18-Q30 WeakPolarHBondContact OG1-CG 3.22Å; T18-Q30 PolarHBondContact OG1-NE2 3.31Å; T18-Q30 VanDerWaalsContact OG1-NE2 3.16Å; L27-Q30 WeakPolarHBondContact O-CB 3.38Å; L27-Q30 PolarHBondContact O-N 2.95Å; L27-Q30 VanDerWaalsContact O-N 3.08Å; W28-Q30 PolarHBondContact O-N 3.23Å; Q30-L32 PolarHBondContact O-N 3.24Å; Q30-K33 WeakPolarHBondContact O-CB 3.39Å; Q30-K33 PolarHBondContact O-N 2.89Å; Q30-E34 PolarHBondContact O-N 2.86Å
31	R	98.4	Very high	97.2	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-58.3	-47.3	172.9	174.6	59.4	178	-136.1	7.3	111.4	L16 T18 A20 L27 W28 K33 E34 E35 Y90 P130 F132	L16-R31 VanDerWaalsContact CD2-NE 3.34Å; T18-R31 HydrophobicContact CG2-CB 4.02Å; T18-R31 WeakPolarHBondContact O-CD 3.25Å; T18-R31 PolarHBondContact O-NH1 3Å; A20-R31 HydrophobicContact CB-CB 4.33Å; L27-R31 PolarHBondContact O-N 2.88Å; W28-R31 HydrophobicContact CE3-CB 3.97Å; W28-R31 HydrophobicContact CE3-CG 3.91Å; W28-R31 HydrophobicContact CZ3-CB 4.19Å; W28-R31 HydrophobicContact CZ3-CG 3.61Å; W28-R31 WeakPolarHBondContact O-CB 3.26Å; W28-R31 PolarHBondContact O-N 3.5Å; W28-R31 VanDerWaalsContact O-N 3.14Å; R31-K33 VanDerWaalsContact C-N 3.29Å; R31-K33 PolarHBondContact O-N 2.95Å; R31-E34 WeakPolarHBondContact O-CA 3.47Å; R31-E34 WeakPolarHBondContact O-CB 3.42Å; R31-E34 PolarHBondContact O-N 2.97Å; R31-E35 HydrophobicContact CG-CG 4.49Å; R31-E35 IonicContact CZ-OE1 2.68Å; R31-E35 VanDerWaalsContact CZ-OE1 3.25Å; R31-E35 IonicContact NE-OE1 3.25Å; R31-E35 PolarHBondContact NE-OE1 3.01Å; R31-E35 IonicContact NH2-OE1 2.68Å; R31-E35 PolarHBondContact NH2-OE1 3.42Å; R31-E35 WeakPolarHBondContact O-CG 3.35Å; R31-E35 PolarHBondContact O-N 3.29Å; R31-Y90 PolarHBondContact NH2-OH 3.17Å; R31-P130 PolarHBondContact NH1-O 2.85Å; R31-F132 PolarHBondContact NH2-O 2.87Å
32	L	98.1	Very high	97.2	Very high	21 Å²	21	72.5 Å²	72.5	11%	0.11	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-38.2	-179.1	-171.1	62.8	0	0	0	111.8	W28 Q30 E34 E35 Y36 W65	W28-L32 HydrophobicContact CZ2-CD1 4.15Å; W28-L32 WeakPolarHBondContact O-CB 3.41Å; W28-L32 PolarHBondContact O-N 3.3Å; Q30-L32 PolarHBondContact O-N 3.24Å; L32-E34 VanDerWaalsContact C-N 3.33Å; L32-E34 PolarHBondContact O-N 3.41Å; L32-E35 WeakPolarHBondContact O-CB 3.39Å; L32-E35 PolarHBondContact O-N 3.29Å; L32-Y36 HydrophobicContact CD1-CD2 4.3Å; L32-Y36 HydrophobicContact CD1-CE2 3.97Å; L32-Y36 HydrophobicContact CD2-CE2 4.24Å; L32-Y36 HydrophobicContact CG-CD2 4.01Å; L32-Y36 HydrophobicContact CG-CE2 3.79Å; L32-Y36 VanDerWaalsContact O-CD2 3.25Å; L32-Y36 WeakPolarHBondContact O-CD2 3.39Å; L32-Y36 PolarHBondContact O-N 3.02Å; L32-W65 HydrophobicContact CD1-CH2 4.49Å; L32-W65 HydrophobicContact CD1-CZ2 3.71Å
33	K	98.4	Very high	97.2	Very high	135 Å²	135	72.3 Å²	72.3	59%	0.587	34%	0.338	S	S	*	.	H	α-helix	trans	-59.9	-42.9	171.8	-175.6	-179.3	179.6	179.9	0	112	P29 Q30 R31 Q37	P29-K33 WeakPolarHBondContact O-CB 3.46Å; P29-K33 PolarHBondContact O-N 2.98Å; Q30-K33 WeakPolarHBondContact O-CB 3.39Å; Q30-K33 PolarHBondContact O-N 2.89Å; R31-K33 VanDerWaalsContact C-N 3.29Å; R31-K33 PolarHBondContact O-N 2.95Å; K33-Q37 WeakPolarHBondContact O-CB 3.35Å; K33-Q37 VanDerWaalsContact O-CG 3.28Å; K33-Q37 WeakPolarHBondContact O-CG 3.31Å; K33-Q37 PolarHBondContact O-N 3.37Å
34	E	98.7	Very high	97.3	Very high	31 Å²	31	68.1 Å²	68.1	15%	0.145	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-40.1	175.3	-64.8	172.9	-170	0	0	111.5	L16 K17 T18 Q30 R31 L32 Q37 A38	L16-E34 HydrophobicContact CB-CB 4.43Å; L16-E34 WeakPolarHBondContact CB-OE2 3.39Å; L16-E34 HydrophobicContact CD2-CB 3.77Å; L16-E34 HydrophobicContact CG-CB 3.89Å; K17-E34 PolarHBondContact N-OE2 2.93Å; T18-E34 WeakPolarHBondContact CB-OE1 3.48Å; T18-E34 PolarHBondContact N-OE1 2.91Å; T18-E34 PolarHBondContact N-OE2 2.72Å; T18-E34 PolarHBondContact OG1-OE1 2.87Å; Q30-E34 PolarHBondContact O-N 2.86Å; R31-E34 WeakPolarHBondContact O-CA 3.47Å; R31-E34 WeakPolarHBondContact O-CB 3.42Å; R31-E34 PolarHBondContact O-N 2.97Å; L32-E34 VanDerWaalsContact C-N 3.33Å; L32-E34 PolarHBondContact O-N 3.41Å; E34-Q37 PolarHBondContact O-N 2.86Å; E34-A38 WeakPolarHBondContact O-CB 3.33Å; E34-A38 PolarHBondContact O-N 3.32Å
35	E	98.6	Very high	97.2	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-60	-49.9	176	-64.8	-64.8	173	0	0	112	L16 R31 L32 Q37 A38 L39 Y90 G133 L134	L16-E35 HydrophobicContact CD2-CG 3.85Å; L16-E35 WeakPolarHBondContact CD2-OE1 3.3Å; R31-E35 HydrophobicContact CG-CG 4.49Å; R31-E35 IonicContact CZ-OE1 2.68Å; R31-E35 VanDerWaalsContact CZ-OE1 3.25Å; R31-E35 IonicContact NE-OE1 3.25Å; R31-E35 PolarHBondContact NE-OE1 3.01Å; R31-E35 IonicContact NH2-OE1 2.68Å; R31-E35 PolarHBondContact NH2-OE1 3.42Å; R31-E35 WeakPolarHBondContact O-CG 3.35Å; R31-E35 PolarHBondContact O-N 3.29Å; L32-E35 WeakPolarHBondContact O-CB 3.39Å; L32-E35 PolarHBondContact O-N 3.29Å; E35-Q37 VanDerWaalsContact C-N 3.34Å; E35-Q37 PolarHBondContact O-N 3.19Å; E35-A38 PolarHBondContact O-N 3.39Å; E35-L39 WeakPolarHBondContact O-CB 3.27Å; E35-L39 WeakPolarHBondContact O-CG 3.34Å; E35-L39 PolarHBondContact O-N 3.44Å; E35-Y90 VanDerWaalsContact CD-OH 3.28Å; E35-Y90 WeakPolarHBondContact OE1-CE1 3.28Å; E35-Y90 PolarHBondContact OE1-OH 3.38Å; E35-G133 WeakPolarHBondContact OE2-CA 3.37Å; E35-L134 HydrophobicContact CG-CG 4.48Å; E35-L134 PolarHBondContact OE2-N 2.49Å
36	Y	98.5	Very high	97.4	Very high	85 Å²	85	56.3 Å²	56.3	33%	0.333	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-42.7	177.2	-83.4	-67.4	0	0	0	112.1	L32 A38 L39 I40 S58 W65	L32-Y36 HydrophobicContact CD1-CD2 4.3Å; L32-Y36 HydrophobicContact CD1-CE2 3.97Å; L32-Y36 HydrophobicContact CD2-CE2 4.24Å; L32-Y36 HydrophobicContact CG-CD2 4.01Å; L32-Y36 HydrophobicContact CG-CE2 3.79Å; L32-Y36 VanDerWaalsContact O-CD2 3.25Å; L32-Y36 WeakPolarHBondContact O-CD2 3.39Å; L32-Y36 PolarHBondContact O-N 3.02Å; Y36-A38 VanDerWaalsContact C-N 3.33Å; Y36-A38 PolarHBondContact O-N 3.02Å; Y36-L39 PolarHBondContact O-N 3.12Å; Y36-I40 WeakPolarHBondContact O-CB 3.45Å; Y36-I40 WeakPolarHBondContact O-CD1 3.49Å; Y36-I40 WeakPolarHBondContact O-CG1 3.2Å; Y36-I40 PolarHBondContact O-N 3.44Å; Y36-S58 PolarHBondContact OH-OG 2.85Å; Y36-W65 HydrophobicContact CD1-CH2 4.17Å; Y36-W65 AromaticContact CE1-CH2 3.74Å; Y36-W65 HydrophobicContact CE1-CH2 3.74Å; Y36-W65 HydrophobicContact CE1-CZ3 4.07Å; Y36-W65 HydrophobicContact CE2-CH2 4.23Å; Y36-W65 AromaticContact CZ-CH2 3.8Å
37	Q	98.4	Very high	97.4	Very high	105 Å²	105	57.2 Å²	57.2	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-61.6	-42.6	176.8	-75.1	178.3	-18.4	0	0	111.7	K33 E34 E35 R41	K33-Q37 WeakPolarHBondContact O-CB 3.35Å; K33-Q37 VanDerWaalsContact O-CG 3.28Å; K33-Q37 WeakPolarHBondContact O-CG 3.31Å; K33-Q37 PolarHBondContact O-N 3.37Å; E34-Q37 PolarHBondContact O-N 2.86Å; E35-Q37 VanDerWaalsContact C-N 3.34Å; E35-Q37 PolarHBondContact O-N 3.19Å; Q37-R41 WeakPolarHBondContact O-CB 3.27Å; Q37-R41 WeakPolarHBondContact O-CG 3.39Å; Q37-R41 PolarHBondContact O-N 3.4Å
38	A	98.4	Very high	97.3	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-65.2	-44.1	176.9	0	0	0	0	0	112	I13 P14 L16 E34 E35 Y36 F42 A135	I13-A38 HydrophobicContact CG2-CB 4.31Å; P14-A38 HydrophobicContact CB-CB 4.39Å; L16-A38 HydrophobicContact CD1-CB 4.16Å; E34-A38 WeakPolarHBondContact O-CB 3.33Å; E34-A38 PolarHBondContact O-N 3.32Å; E35-A38 PolarHBondContact O-N 3.39Å; Y36-A38 VanDerWaalsContact C-N 3.33Å; Y36-A38 PolarHBondContact O-N 3.02Å; A38-F42 WeakPolarHBondContact O-CB 3.44Å; A38-F42 PolarHBondContact O-N 3.45Å; A38-A135 HydrophobicContact CB-CB 4.06Å
39	L	98.4	Very high	97	Very high	12 Å²	12	60.5 Å²	60.5	6%	0.063	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-48.5	177.2	-76	167.8	0	0	0	112.1	E35 Y36 R41 F42 V43 F54 L56 W65 L134 A135	E35-L39 WeakPolarHBondContact O-CB 3.27Å; E35-L39 WeakPolarHBondContact O-CG 3.34Å; E35-L39 PolarHBondContact O-N 3.44Å; Y36-L39 PolarHBondContact O-N 3.12Å; L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 2.98Å; L39-F42 PolarHBondContact O-N 3.25Å; L39-V43 WeakPolarHBondContact O-CG2 3.44Å; L39-V43 PolarHBondContact O-N 2.94Å; L39-F54 HydrophobicContact CD2-CE2 4.02Å; L39-F54 HydrophobicContact CD2-CZ 4.28Å; L39-L56 HydrophobicContact CD2-CD1 4.29Å; L39-W65 HydrophobicContact CD1-CE3 4.46Å; L39-W65 HydrophobicContact CD1-CH2 3.73Å; L39-W65 HydrophobicContact CD1-CZ3 3.55Å; L39-L134 HydrophobicContact CD1-CB 4.19Å; L39-L134 HydrophobicContact CD1-CD1 4.37Å; L39-L134 HydrophobicContact CD2-CB 4.27Å; L39-L134 HydrophobicContact CG-CB 4.38Å; L39-A135 HydrophobicContact CD2-CB 4.06Å; L39-A135 HydrophobicContact CG-CB 4.37Å
40	I	97.4	Very high	96.7	Very high	90 Å²	90	64.3 Å²	64.3	46%	0.462	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-48.6	178.7	-71	162.9	0	0	0	110	Y36 F42 V43 E44	Y36-I40 WeakPolarHBondContact O-CB 3.45Å; Y36-I40 WeakPolarHBondContact O-CD1 3.49Å; Y36-I40 WeakPolarHBondContact O-CG1 3.2Å; Y36-I40 PolarHBondContact O-N 3.44Å; I40-F42 VanDerWaalsContact C-N 3.32Å; I40-F42 PolarHBondContact O-N 2.9Å; I40-V43 PolarHBondContact O-N 2.97Å; I40-E44 HydrophobicContact CG2-CG 4.29Å; I40-E44 WeakPolarHBondContact O-CB 3.34Å; I40-E44 WeakPolarHBondContact O-CG 3.5Å; I40-E44 PolarHBondContact O-N 3.3Å
41	R	97.4	Very high	96.3	Very high	135 Å²	135	64.2 Å²	64.2	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-41.1	178.6	-72.7	-63.2	-170.1	-165.9	6.5	112.6	P14 Q37 L39 E44 Q45	P14-R41 HydrophobicContact CG-CB 3.73Å; P14-R41 HydrophobicContact CG-CG 3.8Å; Q37-R41 WeakPolarHBondContact O-CB 3.27Å; Q37-R41 WeakPolarHBondContact O-CG 3.39Å; Q37-R41 PolarHBondContact O-N 3.4Å; L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 2.98Å; R41-E44 WeakPolarHBondContact CD-OE2 3.31Å; R41-E44 IonicContact CZ-OE2 3.92Å; R41-E44 IonicContact NE-OE2 3.44Å; R41-E44 IonicContact NH1-OE2 2.82Å; R41-E44 PolarHBondContact NH1-OE2 3.32Å; R41-E44 PolarHBondContact O-N 2.67Å; R41-Q45 WeakPolarHBondContact O-CB 3.21Å; R41-Q45 VanDerWaalsContact O-CG 3.24Å; R41-Q45 WeakPolarHBondContact O-CG 3.42Å; R41-Q45 PolarHBondContact O-N 3.36Å
42	F	96.9	Very high	96.2	Very high	8 Å²	8	66.1 Å²	66.1	4%	0.035	34%	0.34	C	S	.	.	H	α-helix	trans	-66	-42	177.9	-176.3	-139.1	0	0	0	111.7	I13 A38 L39 I40 Q45 N46 W53 F54 A135 M138 A139	I13-F42 HydrophobicContact CD1-CD1 4.43Å; I13-F42 HydrophobicContact CD1-CD2 4.04Å; I13-F42 HydrophobicContact CD1-CE2 4.22Å; I13-F42 HydrophobicContact CD1-CG 4.17Å; I13-F42 HydrophobicContact CG1-CB 4.41Å; I13-F42 HydrophobicContact CG1-CD2 3.92Å; I13-F42 HydrophobicContact CG1-CE2 4.47Å; I13-F42 HydrophobicContact CG1-CG 4.19Å; A38-F42 WeakPolarHBondContact O-CB 3.44Å; A38-F42 PolarHBondContact O-N 3.45Å; L39-F42 PolarHBondContact O-N 3.25Å; I40-F42 VanDerWaalsContact C-N 3.32Å; I40-F42 PolarHBondContact O-N 2.9Å; F42-Q45 PolarHBondContact O-N 3.5Å; F42-N46 WeakPolarHBondContact CE2-ND2 3.5Å; F42-N46 VanDerWaalsContact CE2-OD1 3.27Å; F42-N46 WeakPolarHBondContact CE2-OD1 3.41Å; F42-N46 WeakPolarHBondContact CZ-ND2 3.44Å; F42-N46 WeakPolarHBondContact O-CB 3.26Å; F42-N46 PolarHBondContact O-N 3.45Å; F42-N46 PolarHBondContact O-ND2 3Å; F42-W53 HydrophobicContact CE1-CZ2 4.05Å; F42-W53 HydrophobicContact CZ-CZ2 4.41Å; F42-W53 AromaticContact CZ-NE1 3.92Å; F42-F54 AromaticContact CD1-CE1 3.68Å; F42-F54 HydrophobicContact CD1-CE1 3.68Å; F42-F54 AromaticContact CD1-CZ 3.69Å; F42-F54 HydrophobicContact CD1-CZ 3.69Å; F42-F54 AromaticContact CE1-CE1 3.61Å; F42-F54 HydrophobicContact CE1-CE1 3.61Å; F42-F54 HydrophobicContact CE1-CZ 4.04Å; F42-A135 HydrophobicContact CB-CB 4.25Å; F42-A135 HydrophobicContact CD1-CB 4.31Å; F42-M138 HydrophobicContact CE1-CB 4.49Å; F42-A139 HydrophobicContact CE1-CB 3.87Å; F42-A139 HydrophobicContact CE2-CB 4.4Å; F42-A139 HydrophobicContact CZ-CB 3.65Å
43	V	96.4	Very high	96.1	Very high	28 Å²	28	66.1 Å²	66.1	17%	0.17	34%	0.338	C	S	.	.	H	α-helix	trans	-65.2	-41.3	174.9	172.3	0	0	0	0	111.7	L39 I40 Q45 N46 K47 F54	L39-V43 WeakPolarHBondContact O-CG2 3.44Å; L39-V43 PolarHBondContact O-N 2.94Å; I40-V43 PolarHBondContact O-N 2.97Å; V43-Q45 VanDerWaalsContact C-N 3.34Å; V43-Q45 PolarHBondContact O-N 3.41Å; V43-N46 PolarHBondContact O-N 3.38Å; V43-K47 HydrophobicContact CG1-CD 4.13Å; V43-K47 WeakPolarHBondContact O-CB 3.46Å; V43-K47 WeakPolarHBondContact O-CG 3.31Å; V43-K47 PolarHBondContact O-N 3.29Å; V43-F54 HydrophobicContact CG2-CE1 4.14Å; V43-F54 HydrophobicContact CG2-CE2 4.01Å; V43-F54 HydrophobicContact CG2-CZ 3.67Å
44	E	96.1	Very high	96.1	Very high	92 Å²	92	59.8 Å²	59.8	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-58.4	-45	174.5	-76.1	175.8	174	0	0	111.6	I40 R41 K47 A48	I40-E44 HydrophobicContact CG2-CG 4.29Å; I40-E44 WeakPolarHBondContact O-CB 3.34Å; I40-E44 WeakPolarHBondContact O-CG 3.5Å; I40-E44 PolarHBondContact O-N 3.3Å; R41-E44 WeakPolarHBondContact CD-OE2 3.31Å; R41-E44 IonicContact CZ-OE2 3.92Å; R41-E44 IonicContact NE-OE2 3.44Å; R41-E44 IonicContact NH1-OE2 2.82Å; R41-E44 PolarHBondContact NH1-OE2 3.32Å; R41-E44 PolarHBondContact O-N 2.67Å; E44-K47 PolarHBondContact O-N 2.76Å; E44-A48 WeakPolarHBondContact O-CB 3.48Å; E44-A48 PolarHBondContact O-N 3.39Å
45	Q	93.8	Very high	96.1	Very high	53 Å²	53	65.7 Å²	65.7	25%	0.248	33%	0.332	C	S	.	.	H	α-helix	trans	-64.5	-45.5	177.1	-72.5	164.4	3.9	0	0	111.8	Q12 R41 F42 V43 K47 A48 A49	Q12-Q45 PolarHBondContact O-NE2 2.88Å; R41-Q45 WeakPolarHBondContact O-CB 3.21Å; R41-Q45 VanDerWaalsContact O-CG 3.24Å; R41-Q45 WeakPolarHBondContact O-CG 3.42Å; R41-Q45 PolarHBondContact O-N 3.36Å; F42-Q45 PolarHBondContact O-N 3.5Å; V43-Q45 VanDerWaalsContact C-N 3.34Å; V43-Q45 PolarHBondContact O-N 3.41Å; Q45-K47 VanDerWaalsContact C-N 3.32Å; Q45-K47 PolarHBondContact O-N 3.25Å; Q45-A48 PolarHBondContact O-N 3.34Å; Q45-A49 WeakPolarHBondContact O-CB 3.37Å; Q45-A49 PolarHBondContact O-N 3.22Å
46	N	94.4	Very high	96	Very high	13 Å²	13	66.9 Å²	66.9	7%	0.07	34%	0.338	C	S	.	.	H	α-helix	trans	-58.7	-44.4	177	-71.9	-18	0	0	0	111.1	F42 V43 A49 D50 N51 D52 W53	F42-N46 WeakPolarHBondContact CE2-ND2 3.5Å; F42-N46 VanDerWaalsContact CE2-OD1 3.27Å; F42-N46 WeakPolarHBondContact CE2-OD1 3.41Å; F42-N46 WeakPolarHBondContact CZ-ND2 3.44Å; F42-N46 WeakPolarHBondContact O-CB 3.26Å; F42-N46 PolarHBondContact O-N 3.45Å; F42-N46 PolarHBondContact O-ND2 3Å; V43-N46 PolarHBondContact O-N 3.38Å; N46-A49 CarbonylContact O-C 3.5Å; N46-A49 PolarHBondContact O-N 3.43Å; N46-D50 PolarHBondContact O-N 2.81Å; N46-N51 WeakPolarHBondContact CB-O 3.22Å; N46-N51 CarbonylContact O-C 3.52Å; N46-N51 PolarHBondContact O-N 3.19Å; N46-D52 PolarHBondContact O-N 3.21Å; N46-W53 PolarHBondContact ND2-NE1 3.46Å
47	K	94.8	Very high	96	Very high	113 Å²	113	69.6 Å²	69.6	49%	0.491	35%	0.354	S	S	.	.	H	α-helix	trans	-63.6	-43.4	175.1	-75.1	174.7	178.3	179.1	0	112.8	V43 E44 Q45 A49 D50 D52	V43-K47 HydrophobicContact CG1-CD 4.13Å; V43-K47 WeakPolarHBondContact O-CB 3.46Å; V43-K47 WeakPolarHBondContact O-CG 3.31Å; V43-K47 PolarHBondContact O-N 3.29Å; E44-K47 PolarHBondContact O-N 2.76Å; Q45-K47 VanDerWaalsContact C-N 3.32Å; Q45-K47 PolarHBondContact O-N 3.25Å; K47-A49 PolarHBondContact O-N 3.15Å; K47-D50 PolarHBondContact O-N 3.08Å; K47-D50 VanDerWaalsContact O-N 3.1Å; K47-D52 WeakPolarHBondContact CE-OD2 3.43Å; K47-D52 HydrophobicContact CG-CB 3.82Å
48	A	94.8	Very high	96	Very high	94 Å²	94	65.9 Å²	65.9	78%	0.777	34%	0.339	S	S	*	.	H	α-helix	trans	-63.4	-26.1	177.2	0	0	0	0	0	112.6	E44 Q45	E44-A48 WeakPolarHBondContact O-CB 3.48Å; E44-A48 PolarHBondContact O-N 3.39Å; Q45-A48 PolarHBondContact O-N 3.34Å
49	A	92.1	Very high	96	Very high	74 Å²	74	68 Å²	68	61%	0.612	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	8.6	176.4	0	0	0	0	0	114	Q45 N46 K47 N51	Q45-A49 WeakPolarHBondContact O-CB 3.37Å; Q45-A49 PolarHBondContact O-N 3.22Å; N46-A49 CarbonylContact O-C 3.5Å; N46-A49 PolarHBondContact O-N 3.43Å; K47-A49 PolarHBondContact O-N 3.15Å; A49-N51 PolarHBondContact O-N 2.9Å
50	D	91.8	Very high	95.9	Very high	158 Å²	158	73.7 Å²	73.7	85%	0.845	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	36.7	-174.9	-160.9	35	0	0	0	113.9	N46 K47	N46-D50 PolarHBondContact O-N 2.81Å; K47-D50 PolarHBondContact O-N 3.08Å; K47-D50 VanDerWaalsContact O-N 3.1Å
51	N	90.6	Very high	95.8	Very high	100 Å²	100	74.6 Å²	74.6	54%	0.535	39%	0.394	S	S	.	.			trans	-131.7	38.4	-178	-169.3	32	0	0	0	111.2	N46 A49 W53	N46-N51 WeakPolarHBondContact CB-O 3.22Å; N46-N51 CarbonylContact O-C 3.52Å; N46-N51 PolarHBondContact O-N 3.19Å; A49-N51 PolarHBondContact O-N 2.9Å; N51-W53 PolarHBondContact O-N 3.02Å
52	D	95.3	Very high	95.8	Very high	39 Å²	39	68.2 Å²	68.2	21%	0.209	37%	0.37	C	S	.	.			trans	-65	128.3	172.5	-166.3	19.8	0	0	0	109.1	N46 K47 W70	N46-D52 PolarHBondContact O-N 3.21Å; K47-D52 WeakPolarHBondContact CE-OD2 3.43Å; K47-D52 HydrophobicContact CG-CB 3.82Å; D52-W70 VanDerWaalsContact C-CZ2 3.44Å; D52-W70 HydrophobicContact CB-CZ2 4.09Å; D52-W70 VanDerWaalsContact O-CE2 3.24Å; D52-W70 WeakPolarHBondContact O-CZ2 3.03Å; D52-W70 PolarHBondContact O-NE1 2.9Å
53	W	97	Very high	95.8	Very high	22 Å²	22	70.1 Å²	70.1	8%	0.083	38%	0.382	C	S	.	.			trans	-141	-3.6	-169.9	71.5	-90.7	0	0	0	115.3	F42 N46 N51 C69 W70 M138 L142 A143 L146	F42-W53 HydrophobicContact CE1-CZ2 4.05Å; F42-W53 HydrophobicContact CZ-CZ2 4.41Å; F42-W53 AromaticContact CZ-NE1 3.92Å; N46-W53 PolarHBondContact ND2-NE1 3.46Å; N51-W53 PolarHBondContact O-N 3.02Å; W53-C69 HydrophobicContact CE3-CB 4.17Å; W53-C69 HydrophobicContact CZ3-CB 4.18Å; W53-C69 CarbonylContact O-C 3.55Å; W53-C69 VanDerWaalsContact O-CA 3.28Å; W53-C69 WeakPolarHBondContact O-CA 3.19Å; W53-W70 PolarHBondContact O-N 3.15Å; W53-M138 HydrophobicContact CH2-CB 3.78Å; W53-M138 HydrophobicContact CH2-CE 3.9Å; W53-M138 VanDerWaalsContact CH2-O 3.31Å; W53-M138 WeakPolarHBondContact CH2-O 3.32Å; W53-M138 HydrophobicContact CZ2-CB 3.94Å; W53-M138 HydrophobicContact CZ3-CE 4.09Å; W53-L142 HydrophobicContact CH2-CB 4.4Å; W53-L142 HydrophobicContact CH2-CD2 4.43Å; W53-L142 HydrophobicContact CH2-CG 4.45Å; W53-L142 HydrophobicContact CZ3-CD2 4.06Å; W53-L142 HydrophobicContact CZ3-CG 4.17Å; W53-A143 HydrophobicContact CH2-CB 3.84Å; W53-A143 HydrophobicContact CZ2-CB 3.8Å; W53-A143 HydrophobicContact CZ3-CB 4.38Å; W53-L146 HydrophobicContact CE3-CD1 4.16Å; W53-L146 HydrophobicContact CZ3-CD1 3.94Å
54	F	98.2	Very high	95.9	Very high	2 Å²	2	74.2 Å²	74.2	1%	0.009	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	161.5	177.5	74.1	-80	0	0	0	114.2	L39 F42 V43 L56 T68 C69 M138	L39-F54 HydrophobicContact CD2-CE2 4.02Å; L39-F54 HydrophobicContact CD2-CZ 4.28Å; F42-F54 AromaticContact CD1-CE1 3.68Å; F42-F54 HydrophobicContact CD1-CE1 3.68Å; F42-F54 AromaticContact CD1-CZ 3.69Å; F42-F54 HydrophobicContact CD1-CZ 3.69Å; F42-F54 AromaticContact CE1-CE1 3.61Å; F42-F54 HydrophobicContact CE1-CE1 3.61Å; F42-F54 HydrophobicContact CE1-CZ 4.04Å; V43-F54 HydrophobicContact CG2-CE1 4.14Å; V43-F54 HydrophobicContact CG2-CE2 4.01Å; V43-F54 HydrophobicContact CG2-CZ 3.67Å; F54-L56 HydrophobicContact CD2-CD1 4.13Å; F54-L56 HydrophobicContact CD2-CG 3.99Å; F54-L56 HydrophobicContact CE2-CD1 4.12Å; F54-L56 HydrophobicContact CE2-CG 4.34Å; F54-T68 CarbonylContact C-O 3.44Å; F54-T68 VanDerWaalsContact CA-O 3.28Å; F54-T68 WeakPolarHBondContact CA-O 3.44Å; F54-C69 HydrophobicContact CB-CB 4.01Å; F54-M138 HydrophobicContact CB-CE 4.16Å; F54-M138 HydrophobicContact CD2-CE 3.86Å; F54-M138 HydrophobicContact CE2-CE 4.44Å; F54-M138 HydrophobicContact CE2-CG 4.29Å; F54-M138 HydrophobicContact CG-CE 3.97Å; F54-M138 HydrophobicContact CZ-CB 4.44Å; F54-M138 HydrophobicContact CZ-CG 4.49Å
55	R	97.8	Very high	96	Very high	155 Å²	155	69.9 Å²	69.9	59%	0.585	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	141.5	165.7	-67.2	-174.7	-178.4	-162.1	2.9	109.4	G67 T68 W70	R55-G67 VanDerWaalsContact O-CA 3.29Å; R55-G67 WeakPolarHBondContact O-CA 3.4Å; R55-T68 PolarHBondContact N-O 3.09Å; R55-T68 PolarHBondContact O-N 3.31Å; R55-T68 VanDerWaalsContact O-O 3.14Å; R55-W70 HydrophobicContact CG-CH2 4.07Å; R55-W70 HydrophobicContact CG-CZ3 4.11Å
56	L	97.9	Very high	96.3	Very high	25 Å²	25	70.1 Å²	70.1	13%	0.131	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	140.6	178.9	-78.2	176.6	0	0	0	110.2	L39 F54 W65 V82 F84 M138	L39-L56 HydrophobicContact CD2-CD1 4.29Å; F54-L56 HydrophobicContact CD2-CD1 4.13Å; F54-L56 HydrophobicContact CD2-CG 3.99Å; F54-L56 HydrophobicContact CE2-CD1 4.12Å; F54-L56 HydrophobicContact CE2-CG 4.34Å; L56-W65 HydrophobicContact CB-CE3 4.14Å; L56-W65 HydrophobicContact CB-CZ3 4.46Å; L56-V82 HydrophobicContact CD2-CG2 3.64Å; L56-F84 HydrophobicContact CD1-CE1 4.19Å; L56-F84 HydrophobicContact CD1-CZ 4.2Å; L56-F84 HydrophobicContact CD2-CE1 4.06Å; L56-M138 HydrophobicContact CD1-CE 3.9Å; L56-M138 HydrophobicContact CD1-CG 3.91Å; L56-M138 HydrophobicContact CD1-SD 3.81Å; L56-M138 HydrophobicContact CG-CE 4.36Å
57	E	97.8	Very high	96.4	Very high	143 Å²	143	70.4 Å²	70.4	67%	0.668	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.1	155.1	173.6	-64.6	177.9	-172.8	0	0	108.5	W65 T66	E57-W65 CarbonylContact O-C 3.53Å; E57-W65 VanDerWaalsContact O-CA 3.32Å; E57-W65 WeakPolarHBondContact O-CA 3.49Å; E57-T66 PolarHBondContact N-O 3.22Å; E57-T66 PolarHBondContact O-N 2.82Å; E57-T66 VanDerWaalsContact O-O 3.05Å
58	S	98.3	Very high	96.6	Very high	26 Å²	26	66.7 Å²	66.7	18%	0.182	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	162.8	176.4	79.3	0	0	0	0	111.6	Y36 R64 W65	Y36-S58 PolarHBondContact OH-OG 2.85Å; S58-R64 CarbonylContact C-O 3.55Å; S58-R64 WeakPolarHBondContact CA-O 3.27Å; S58-R64 WeakPolarHBondContact CB-O 3.45Å; S58-W65 VanDerWaalsContact CB-CE2 3.46Å
59	N	98.1	Very high	96.8	Very high	46 Å²	46	62.2 Å²	62.2	25%	0.246	34%	0.335	C	S	.	.			trans	-62.1	165.2	160	72.3	-37	0	0	0	110.8	D61 G62 T63 R64	N59-D61 PolarHBondContact O-N 3.37Å; N59-D61 VanDerWaalsContact O-N 3.09Å; N59-G62 PolarHBondContact O-N 3.42Å; N59-G62 PolarHBondContact OD1-N 2.89Å; N59-T63 PolarHBondContact ND2-OG1 2.84Å; N59-T63 PolarHBondContact OD1-N 3.22Å; N59-R64 PolarHBondContact N-O 3.16Å; N59-R64 PolarHBondContact OD1-N 2.88Å; N59-R64 PolarHBondContact OD1-O 3.36Å
60	P	96.6	Very high	97	Very high	132 Å²	132	60 Å²	60	86%	0.857	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.8	-178	-29.5	37.2	0	0	0	115	G62	P60-G62 VanDerWaalsContact C-N 3.34Å
61	D	95.2	Very high	97.3	Very high	109 Å²	109	54.6 Å²	54.6	58%	0.583	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.4	179.8	-55.9	-52.6	0	0	0	113.5	W28 N59 T63	W28-D61 PolarHBondContact NE1-O 3.2Å; N59-D61 PolarHBondContact O-N 3.37Å; N59-D61 VanDerWaalsContact O-N 3.09Å; D61-T63 HydrophobicContact CB-CG2 4.09Å; D61-T63 PolarHBondContact O-N 3.01Å
62	G	97.4	Very high	97.5	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	70.9	12.8	-178.3	0	0	0	0	0	114.8	W28 N59 P60 W65 I86	W28-G62 WeakPolarHBondContact CZ2-O 3.1Å; N59-G62 PolarHBondContact O-N 3.42Å; N59-G62 PolarHBondContact OD1-N 2.89Å; P60-G62 VanDerWaalsContact C-N 3.34Å; G62-W65 PolarHBondContact O-NE1 2.93Å; G62-I86 VanDerWaalsContact O-CG1 3.29Å; G62-I86 WeakPolarHBondContact O-CG1 3.47Å
63	T	97.9	Very high	97.5	Very high	48 Å²	48	54.5 Å²	54.5	29%	0.294	28%	0.281	S	S	.	.	S	Bend	trans	-93.9	-18.6	-174	59	0	0	0	0	114.1	P22 N59 D61 D85 I86	P22-T63 HydrophobicContact CB-CG2 3.92Å; N59-T63 PolarHBondContact ND2-OG1 2.84Å; N59-T63 PolarHBondContact OD1-N 3.22Å; D61-T63 HydrophobicContact CB-CG2 4.09Å; D61-T63 PolarHBondContact O-N 3.01Å; T63-D85 WeakPolarHBondContact O-CA 3.36Å; T63-I86 PolarHBondContact O-N 3.1Å
64	R	98.4	Very high	97.3	Very high	115 Å²	115	60.7 Å²	60.7	43%	0.434	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.6	174.5	179.1	165.6	-177.1	162.6	4.6	109.3	S58 N59 E83 D85	S58-R64 CarbonylContact C-O 3.55Å; S58-R64 WeakPolarHBondContact CA-O 3.27Å; S58-R64 WeakPolarHBondContact CB-O 3.45Å; N59-R64 PolarHBondContact N-O 3.16Å; N59-R64 PolarHBondContact OD1-N 2.88Å; N59-R64 PolarHBondContact OD1-O 3.36Å; R64-E83 IonicContact NH2-OE2 3.95Å; R64-E83 PolarHBondContact NH2-OE2 3.23Å; R64-D85 WeakPolarHBondContact CB-OD1 3.32Å; R64-D85 WeakPolarHBondContact CD-OD1 3.41Å; R64-D85 VanDerWaalsContact CG-OD1 3.23Å; R64-D85 WeakPolarHBondContact CG-OD1 3.38Å
65	W	98.7	Very high	97	Very high	1 Å²	1	68.8 Å²	68.8	0%	0.004	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138	-178.3	-68.4	73.5	0	0	0	110.4	L32 Y36 L39 L56 E57 S58 G62 E83 F84 L134	L32-W65 HydrophobicContact CD1-CH2 4.49Å; L32-W65 HydrophobicContact CD1-CZ2 3.71Å; Y36-W65 HydrophobicContact CD1-CH2 4.17Å; Y36-W65 AromaticContact CE1-CH2 3.74Å; Y36-W65 HydrophobicContact CE1-CH2 3.74Å; Y36-W65 HydrophobicContact CE1-CZ3 4.07Å; Y36-W65 HydrophobicContact CE2-CH2 4.23Å; Y36-W65 AromaticContact CZ-CH2 3.8Å; L39-W65 HydrophobicContact CD1-CE3 4.46Å; L39-W65 HydrophobicContact CD1-CH2 3.73Å; L39-W65 HydrophobicContact CD1-CZ3 3.55Å; L56-W65 HydrophobicContact CB-CE3 4.14Å; L56-W65 HydrophobicContact CB-CZ3 4.46Å; E57-W65 CarbonylContact O-C 3.53Å; E57-W65 VanDerWaalsContact O-CA 3.32Å; E57-W65 WeakPolarHBondContact O-CA 3.49Å; S58-W65 VanDerWaalsContact CB-CE2 3.46Å; G62-W65 PolarHBondContact O-NE1 2.93Å; W65-E83 VanDerWaalsContact O-CA 3.28Å; W65-E83 WeakPolarHBondContact O-CA 3.32Å; W65-F84 HydrophobicContact CB-CD1 4.36Å; W65-F84 HydrophobicContact CB-CD2 3.93Å; W65-F84 HydrophobicContact CB-CE1 3.95Å; W65-F84 HydrophobicContact CB-CE2 3.47Å; W65-F84 VanDerWaalsContact CB-CE2 3.47Å; W65-F84 HydrophobicContact CB-CG 4.35Å; W65-F84 HydrophobicContact CB-CZ 3.48Å; W65-F84 VanDerWaalsContact CB-CZ 3.48Å; W65-F84 AromaticContact CD1-CE2 3.8Å; W65-F84 HydrophobicContact CD2-CE2 4.41Å; W65-F84 HydrophobicContact CD2-CZ 4.4Å; W65-F84 HydrophobicContact CG-CD2 4.33Å; W65-F84 AromaticContact CG-CE2 3.6Å; W65-F84 HydrophobicContact CG-CE2 3.6Å; W65-F84 AromaticContact CG-CZ 3.84Å; W65-F84 HydrophobicContact CG-CZ 3.84Å; W65-F84 PolarHBondContact N-O 2.8Å; W65-F84 PolarHBondContact O-N 3.5Å; W65-L134 HydrophobicContact CD2-CD1 3.7Å; W65-L134 HydrophobicContact CE3-CD1 4.14Å; W65-L134 HydrophobicContact CG-CD1 4.3Å; W65-L134 HydrophobicContact CH2-CD1 3.84Å; W65-L134 HydrophobicContact CZ2-CD1 3.37Å; W65-L134 HydrophobicContact CZ3-CD1 4.2Å
66	T	98.6	Very high	96.8	Very high	57 Å²	57	63.7 Å²	63.7	35%	0.35	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	152.5	179.3	56.7	0	0	0	0	109.7	E57 V82 E83	E57-T66 PolarHBondContact N-O 3.22Å; E57-T66 PolarHBondContact O-N 2.82Å; E57-T66 VanDerWaalsContact O-O 3.05Å; T66-V82 CarbonylContact C-O 3.49Å; T66-V82 WeakPolarHBondContact CA-O 3.33Å; T66-E83 HydrophobicContact CG2-CB 3.99Å
67	G	98.1	Very high	96.7	Very high	20 Å²	20	68.2 Å²	68.2	21%	0.206	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-154.7	174.7	0	0	0	0	0	112.7	R55 R81 V82	R55-G67 VanDerWaalsContact O-CA 3.29Å; R55-G67 WeakPolarHBondContact O-CA 3.4Å; G67-R81 WeakPolarHBondContact O-CA 3.32Å; G67-V82 PolarHBondContact N-O 3.19Å; G67-V82 PolarHBondContact O-N 3.27Å
68	T	98.3	Very high	96.7	Very high	34 Å²	34	62.1 Å²	62.1	21%	0.209	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.7	174.8	60.1	0	0	0	0	110.8	F54 R55 E79 F80 R81	F54-T68 CarbonylContact C-O 3.44Å; F54-T68 VanDerWaalsContact CA-O 3.28Å; F54-T68 WeakPolarHBondContact CA-O 3.44Å; R55-T68 PolarHBondContact N-O 3.09Å; R55-T68 PolarHBondContact O-N 3.31Å; R55-T68 VanDerWaalsContact O-O 3.14Å; T68-E79 WeakPolarHBondContact CB-OE1 3.38Å; T68-E79 PolarHBondContact OG1-OE1 3.48Å; T68-F80 CarbonylContact C-O 3.43Å; T68-F80 VanDerWaalsContact CA-O 3.23Å; T68-F80 WeakPolarHBondContact CA-O 3.28Å; T68-R81 HydrophobicContact CG2-CG 4.43Å
69	C	98.1	Very high	96.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157.6	164.6	68.4	0	0	0	0	109.1	W53 F54 E79 F80 V82 L142 L146	W53-C69 HydrophobicContact CE3-CB 4.17Å; W53-C69 HydrophobicContact CZ3-CB 4.18Å; W53-C69 CarbonylContact O-C 3.55Å; W53-C69 VanDerWaalsContact O-CA 3.28Å; W53-C69 WeakPolarHBondContact O-CA 3.19Å; F54-C69 HydrophobicContact CB-CB 4.01Å; C69-E79 WeakPolarHBondContact O-CA 3.3Å; C69-F80 PolarHBondContact N-O 3.23Å; C69-F80 PolarHBondContact O-N 2.99Å; C69-V82 HydrophobicContact CB-CG1 4Å; C69-V82 WeakPolarHBondContact SG-CG1 3.48Å; C69-L142 HydrophobicContact CB-CD2 4.37Å; C69-L146 HydrophobicContact CB-CD1 4.34Å
70	W	97.4	Very high	96.6	Very high	27 Å²	27	62 Å²	62	10%	0.102	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	154.3	174.4	56.7	88	0	0	0	111.9	D52 W53 R55 R77 Y78 E79	D52-W70 VanDerWaalsContact C-CZ2 3.44Å; D52-W70 HydrophobicContact CB-CZ2 4.09Å; D52-W70 VanDerWaalsContact O-CE2 3.24Å; D52-W70 WeakPolarHBondContact O-CZ2 3.03Å; D52-W70 PolarHBondContact O-NE1 2.9Å; W53-W70 PolarHBondContact O-N 3.15Å; R55-W70 HydrophobicContact CG-CH2 4.07Å; R55-W70 HydrophobicContact CG-CZ3 4.11Å; W70-R77 HydrophobicContact CB-CG 3.93Å; W70-R77 HydrophobicContact CG-CG 4.09Å; W70-Y78 CarbonylContact C-O 3.52Å; W70-Y78 WeakPolarHBondContact CA-O 3.34Å; W70-Y78 WeakPolarHBondContact CB-O 3.46Å; W70-E79 HydrophobicContact CB-CB 4.22Å; W70-E79 HydrophobicContact CB-CG 4.47Å
71	F	96.8	Very high	96.7	Very high	45 Å²	45	63.3 Å²	63.3	20%	0.197	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.1	-179.6	-170.7	-96.8	0	0	0	109.1	H73 Y78 L146 A147 I150 P151	F71-H73 HydrophobicContact CD1-CB 4.07Å; F71-H73 HydrophobicContact CE1-CB 3.98Å; F71-Y78 PolarHBondContact N-O 3.42Å; F71-Y78 PolarHBondContact O-N 2.68Å; F71-L146 HydrophobicContact CD2-CB 4.09Å; F71-A147 HydrophobicContact CE2-CB 4.23Å; F71-I150 HydrophobicContact CB-CG1 4.37Å; F71-I150 HydrophobicContact CB-CG2 4.21Å; F71-I150 HydrophobicContact CD1-CB 3.92Å; F71-I150 HydrophobicContact CD1-CG2 3.64Å; F71-I150 HydrophobicContact CE1-CB 4.38Å; F71-I150 HydrophobicContact CE1-CG2 4.37Å; F71-I150 HydrophobicContact CG-CB 4.22Å; F71-I150 HydrophobicContact CG-CG1 4.42Å; F71-I150 HydrophobicContact CG-CG2 4.16Å; F71-P151 HydrophobicContact CE1-CG 3.96Å; F71-P151 HydrophobicContact CZ-CG 4.24Å
72	V	95.2	Very high	96.8	Very high	89 Å²	89	58.3 Å²	58.3	54%	0.539	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	121	177.2	-177.5	0	0	0	0	108.8	L76	V72-L76 WeakPolarHBondContact CA-O 3.27Å
73	H	94.8	Very high	96.9	Very high	49 Å²	49	61 Å²	61	23%	0.227	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	127	175.7	-170.5	70	0	0	0	108.9	F71 L75 L76 Y78 I154	F71-H73 HydrophobicContact CD1-CB 4.07Å; F71-H73 HydrophobicContact CE1-CB 3.98Å; H73-L75 VanDerWaalsContact C-N 3.3Å; H73-L75 PolarHBondContact O-N 3.34Å; H73-L76 PolarHBondContact N-O 3.38Å; H73-L76 WeakPolarHBondContact O-CB 3.46Å; H73-L76 PolarHBondContact O-N 3.43Å; H73-Y78 HydrophobicContact CB-CD2 4.28Å; H73-Y78 HydrophobicContact CB-CE2 3.92Å; H73-I154 HydrophobicContact CB-CD1 3.8Å
74	E	93.3	Very high	96.9	Very high	151 Å²	151	59.1 Å²	59.1	71%	0.706	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	46.3	-177.7	-60.1	-176.7	162.5	0	0	113.3	L76	E74-L76 PolarHBondContact O-N 3.36Å; E74-L76 VanDerWaalsContact O-N 3.11Å
75	L	92.7	Very high	96.9	Very high	173 Å²	173	58.2 Å²	58.2	91%	0.906	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	9.2	-177.6	-51.9	175.1	0	0	0	115.2	H73	H73-L75 VanDerWaalsContact C-N 3.3Å; H73-L75 PolarHBondContact O-N 3.34Å
76	L	94.3	Very high	96.9	Very high	48 Å²	48	58.8 Å²	58.8	25%	0.251	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.3	176.3	-64.5	176	0	0	0	110.7	V72 H73 E74 Y78 H161	V72-L76 WeakPolarHBondContact CA-O 3.27Å; H73-L76 PolarHBondContact N-O 3.38Å; H73-L76 WeakPolarHBondContact O-CB 3.46Å; H73-L76 PolarHBondContact O-N 3.43Å; E74-L76 PolarHBondContact O-N 3.36Å; E74-L76 VanDerWaalsContact O-N 3.11Å; L76-Y78 HydrophobicContact CB-CD2 4.49Å; L76-Y78 HydrophobicContact CB-CE2 3.68Å; L76-Y78 WeakPolarHBondContact O-CD2 3.37Å; L76-Y78 WeakPolarHBondContact O-CE2 3.33Å; L76-H161 HydrophobicContact CD1-CB 4.13Å
77	R	95.4	Very high	96.8	Very high	119 Å²	119	57.7 Å²	57.7	45%	0.449	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	109.9	-178.9	-171.3	-180	80.5	110.2	8.7	110.4	W70 E79 H161	W70-R77 HydrophobicContact CB-CG 3.93Å; W70-R77 HydrophobicContact CG-CG 4.09Å; R77-E79 IonicContact CZ-OE2 2.84Å; R77-E79 IonicContact NH1-OE2 2.77Å; R77-E79 IonicContact NH2-OE2 3.74Å; R77-E79 PolarHBondContact NH2-OE2 3.21Å; R77-H161 PolarHBondContact O-CD2 2.89Å; R77-H161 PolarHBondContact O-NE2 2.81Å; R77-H161 VanDerWaalsContact O-NE2 3.16Å
78	Y	96.7	Very high	96.8	Very high	16 Å²	16	60.1 Å²	60.1	6%	0.063	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	123.8	176	-59.9	-95.5	0	0	0	109.3	W70 F71 H73 L76 I154 V159 H161	W70-Y78 CarbonylContact C-O 3.52Å; W70-Y78 WeakPolarHBondContact CA-O 3.34Å; W70-Y78 WeakPolarHBondContact CB-O 3.46Å; F71-Y78 PolarHBondContact N-O 3.42Å; F71-Y78 PolarHBondContact O-N 2.68Å; H73-Y78 HydrophobicContact CB-CD2 4.28Å; H73-Y78 HydrophobicContact CB-CE2 3.92Å; L76-Y78 HydrophobicContact CB-CD2 4.49Å; L76-Y78 HydrophobicContact CB-CE2 3.68Å; L76-Y78 WeakPolarHBondContact O-CD2 3.37Å; L76-Y78 WeakPolarHBondContact O-CE2 3.33Å; Y78-I154 HydrophobicContact CD1-CD1 4.21Å; Y78-I154 HydrophobicContact CD1-CG1 4.39Å; Y78-I154 HydrophobicContact CD2-CD1 3.82Å; Y78-I154 HydrophobicContact CE1-CD1 3.85Å; Y78-I154 HydrophobicContact CE1-CG1 3.91Å; Y78-I154 HydrophobicContact CE2-CD1 3.47Å; Y78-I154 VanDerWaalsContact CE2-CD1 3.47Å; Y78-I154 HydrophobicContact CE2-CG1 4.4Å; Y78-I154 HydrophobicContact CG-CD1 4.18Å; Y78-I154 VanDerWaalsContact CZ-CD1 3.47Å; Y78-V159 HydrophobicContact CD1-CG1 3.47Å; Y78-V159 VanDerWaalsContact CD1-CG1 3.47Å; Y78-V159 HydrophobicContact CE1-CG1 3.92Å; Y78-V159 HydrophobicContact CG-CG1 4.36Å; Y78-H161 HydrophobicContact CD1-CB 4.43Å; Y78-H161 HydrophobicContact CE1-CB 3.74Å
79	E	97.3	Very high	96.7	Very high	60 Å²	60	62.2 Å²	62.2	28%	0.28	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134.9	-176.8	-176.3	173.3	174.2	0	0	110.9	T68 C69 W70 R77	T68-E79 WeakPolarHBondContact CB-OE1 3.38Å; T68-E79 PolarHBondContact OG1-OE1 3.48Å; C69-E79 WeakPolarHBondContact O-CA 3.3Å; W70-E79 HydrophobicContact CB-CB 4.22Å; W70-E79 HydrophobicContact CB-CG 4.47Å; R77-E79 IonicContact CZ-OE2 2.84Å; R77-E79 IonicContact NH1-OE2 2.77Å; R77-E79 IonicContact NH2-OE2 3.74Å; R77-E79 PolarHBondContact NH2-OE2 3.21Å
80	F	97.5	Very high	96.7	Very high	10 Å²	10	62.5 Å²	62.5	4%	0.044	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	144.5	-176.6	-48.4	-78.1	0	0	0	111	T68 C69 V99 L102 I150 V159	T68-F80 CarbonylContact C-O 3.43Å; T68-F80 VanDerWaalsContact CA-O 3.23Å; T68-F80 WeakPolarHBondContact CA-O 3.28Å; C69-F80 PolarHBondContact N-O 3.23Å; C69-F80 PolarHBondContact O-N 2.99Å; F80-V99 HydrophobicContact CB-CG1 3.7Å; F80-V99 HydrophobicContact CG-CG1 4.29Å; F80-L102 HydrophobicContact CD1-CD1 4.4Å; F80-L102 HydrophobicContact CD1-CD2 4.04Å; F80-L102 HydrophobicContact CD1-CG 4.27Å; F80-L102 HydrophobicContact CE1-CD1 4.47Å; F80-L102 HydrophobicContact CE1-CD2 3.79Å; F80-L102 HydrophobicContact CE1-CG 4.43Å; F80-I150 HydrophobicContact CD2-CD1 4.31Å; F80-I150 HydrophobicContact CE1-CD1 4.41Å; F80-I150 HydrophobicContact CE2-CD1 3.54Å; F80-I150 HydrophobicContact CE2-CG1 4.02Å; F80-I150 HydrophobicContact CE2-CG2 4.34Å; F80-I150 HydrophobicContact CZ-CD1 3.59Å; F80-I150 HydrophobicContact CZ-CG1 4.39Å; F80-I150 HydrophobicContact CZ-CG2 4.28Å; F80-V159 HydrophobicContact CE1-CG1 4.09Å; F80-V159 HydrophobicContact CE1-CG2 4.22Å; F80-V159 HydrophobicContact CZ-CG1 3.97Å; F80-V159 HydrophobicContact CZ-CG2 4.47Å
81	R	98	Very high	96.8	Very high	159 Å²	159	61.3 Å²	61.3	60%	0.6	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	138.2	169.5	-68.1	-179.2	66	176.6	-0.5	110.9	G67 T68 E101	G67-R81 WeakPolarHBondContact O-CA 3.32Å; T68-R81 HydrophobicContact CG2-CG 4.43Å; R81-E101 WeakPolarHBondContact CB-OE1 3.5Å; R81-E101 VanDerWaalsContact CG-OE1 3.3Å; R81-E101 WeakPolarHBondContact CG-OE1 3.43Å; R81-E101 PolarHBondContact N-OE1 2.83Å
82	V	98.2	Very high	96.8	Very high	3 Å²	3	64 Å²	64	2%	0.018	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.4	175.3	-60.2	0	0	0	0	110.1	L56 T66 G67 C69 A98 V99 L142	L56-V82 HydrophobicContact CD2-CG2 3.64Å; T66-V82 CarbonylContact C-O 3.49Å; T66-V82 WeakPolarHBondContact CA-O 3.33Å; G67-V82 PolarHBondContact N-O 3.19Å; G67-V82 PolarHBondContact O-N 3.27Å; C69-V82 HydrophobicContact CB-CG1 4Å; C69-V82 WeakPolarHBondContact SG-CG1 3.48Å; V82-A98 WeakPolarHBondContact CA-O 3.24Å; V82-V99 HydrophobicContact CG1-CG2 4.29Å; V82-L142 HydrophobicContact CG1-CD2 4Å
83	E	98.4	Very high	96.9	Very high	57 Å²	57	63 Å²	63	27%	0.266	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	151.3	171.9	63.7	178.3	-178.3	0	0	112.2	R64 W65 T66 A98 P100	R64-E83 IonicContact NH2-OE2 3.95Å; R64-E83 PolarHBondContact NH2-OE2 3.23Å; W65-E83 VanDerWaalsContact O-CA 3.28Å; W65-E83 WeakPolarHBondContact O-CA 3.32Å; T66-E83 HydrophobicContact CG2-CB 3.99Å; E83-A98 HydrophobicContact CG-CB 4.25Å; E83-A98 PolarHBondContact N-O 2.7Å; E83-A98 WeakPolarHBondContact O-CB 3.13Å; E83-A98 PolarHBondContact O-N 2.75Å; E83-P100 HydrophobicContact CG-CG 4.19Å
84	F	98.4	Very high	97.1	Very high	8 Å²	8	61.6 Å²	61.6	4%	0.035	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	154.1	171.1	53.4	-89.4	0	0	0	111.2	L56 W65 I86 P95 E96 V97 L134	L56-F84 HydrophobicContact CD1-CE1 4.19Å; L56-F84 HydrophobicContact CD1-CZ 4.2Å; L56-F84 HydrophobicContact CD2-CE1 4.06Å; W65-F84 HydrophobicContact CB-CD1 4.36Å; W65-F84 HydrophobicContact CB-CD2 3.93Å; W65-F84 HydrophobicContact CB-CE1 3.95Å; W65-F84 HydrophobicContact CB-CE2 3.47Å; W65-F84 VanDerWaalsContact CB-CE2 3.47Å; W65-F84 HydrophobicContact CB-CG 4.35Å; W65-F84 HydrophobicContact CB-CZ 3.48Å; W65-F84 VanDerWaalsContact CB-CZ 3.48Å; W65-F84 AromaticContact CD1-CE2 3.8Å; W65-F84 HydrophobicContact CD2-CE2 4.41Å; W65-F84 HydrophobicContact CD2-CZ 4.4Å; W65-F84 HydrophobicContact CG-CD2 4.33Å; W65-F84 AromaticContact CG-CE2 3.6Å; W65-F84 HydrophobicContact CG-CE2 3.6Å; W65-F84 AromaticContact CG-CZ 3.84Å; W65-F84 HydrophobicContact CG-CZ 3.84Å; W65-F84 PolarHBondContact N-O 2.8Å; W65-F84 PolarHBondContact O-N 3.5Å; F84-I86 HydrophobicContact CD2-CD1 4.29Å; F84-I86 HydrophobicContact CE2-CD1 4.06Å; F84-P95 HydrophobicContact CB-CB 4.34Å; F84-P95 HydrophobicContact CD2-CB 3.62Å; F84-P95 HydrophobicContact CD2-CG 4.23Å; F84-P95 HydrophobicContact CE2-CB 4.26Å; F84-P95 HydrophobicContact CE2-CG 4.44Å; F84-P95 HydrophobicContact CG-CB 4.21Å; F84-E96 WeakPolarHBondContact CB-O 3.38Å; F84-V97 HydrophobicContact CD1-CG1 4.48Å; F84-V97 HydrophobicContact CD1-CG2 4.18Å; F84-L134 HydrophobicContact CE2-CD1 4.24Å; F84-L134 HydrophobicContact CE2-CD2 3.72Å; F84-L134 HydrophobicContact CZ-CD1 4.4Å; F84-L134 HydrophobicContact CZ-CD2 4.18Å
85	D	98.3	Very high	97.3	Very high	97 Å²	97	54.5 Å²	54.5	52%	0.519	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	146.6	170.3	-64.1	-52.2	0	0	0	110.1	T63 R64 P87	T63-D85 WeakPolarHBondContact O-CA 3.36Å; R64-D85 WeakPolarHBondContact CB-OD1 3.32Å; R64-D85 WeakPolarHBondContact CD-OD1 3.41Å; R64-D85 VanDerWaalsContact CG-OD1 3.23Å; R64-D85 WeakPolarHBondContact CG-OD1 3.38Å; D85-P87 WeakPolarHBondContact O-CD 3.49Å
86	I	98.4	Very high	97.5	Very high	13 Å²	13	51.6 Å²	51.6	7%	0.067	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-75.4	119.3	172.8	-58.4	-54.7	0	0	0	108.3	P22 W28 G62 T63 F84 Y90 P95 L134	P22-I86 HydrophobicContact CG-CG2 4.17Å; W28-I86 HydrophobicContact CH2-CG2 4.03Å; G62-I86 VanDerWaalsContact O-CG1 3.29Å; G62-I86 WeakPolarHBondContact O-CG1 3.47Å; T63-I86 PolarHBondContact O-N 3.1Å; F84-I86 HydrophobicContact CD2-CD1 4.29Å; F84-I86 HydrophobicContact CE2-CD1 4.06Å; I86-Y90 VanDerWaalsContact CG2-CB 3.47Å; I86-Y90 HydrophobicContact CG2-CD1 3.87Å; I86-Y90 HydrophobicContact CG2-CD2 4.25Å; I86-Y90 HydrophobicContact CG2-CG 3.6Å; I86-P95 HydrophobicContact CD1-CG 3.92Å; I86-L134 HydrophobicContact CD1-CD1 4.33Å; I86-L134 HydrophobicContact CD1-CD2 3.85Å
87	P	97.9	Very high	97.7	Very high	33 Å²	33	49.4 Å²	49.4	21%	0.214	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-65.7	151.2	178	26.7	-31.9	0	0	0	110.2	D85 T89 Y90 T93	D85-P87 WeakPolarHBondContact O-CD 3.49Å; P87-T89 PolarHBondContact O-N 3.28Å; P87-T89 VanDerWaalsContact O-N 3.13Å; P87-Y90 HydrophobicContact CG-CD2 4.5Å; P87-Y90 WeakPolarHBondContact O-CB 3.23Å; P87-Y90 PolarHBondContact O-N 2.78Å; P87-T93 HydrophobicContact CG-CG2 4.43Å; P87-T93 VanDerWaalsContact CG-O 3.3Å; P87-T93 WeakPolarHBondContact CG-O 3.37Å
88	V	96.9	Very high	97.8	Very high	72 Å²	72	44.1 Å²	44.1	44%	0.436	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.7	176.6	165	0	0	0	0	112.3	R23 Y90	R23-V88 HydrophobicContact CG-CG1 4.11Å; V88-Y90 VanDerWaalsContact C-N 3.29Å
89	T	97.6	Very high	97.9	Very high	77 Å²	77	43.3 Å²	43.3	47%	0.472	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	7.4	179.4	49.2	0	0	0	0	113.1	P87 E92 T93	P87-T89 PolarHBondContact O-N 3.28Å; P87-T89 VanDerWaalsContact O-N 3.13Å; T89-E92 WeakPolarHBondContact O-CA 3.42Å; T89-E92 WeakPolarHBondContact O-CB 3.45Å; T89-E92 PolarHBondContact O-N 2.68Å; T89-T93 PolarHBondContact O-N 2.68Å; T89-T93 VanDerWaalsContact OG1-CB 3.27Å; T89-T93 WeakPolarHBondContact OG1-CB 3.49Å; T89-T93 PolarHBondContact OG1-OG1 2.84Å
90	Y	98.4	Very high	97.8	Very high	6 Å²	6	43 Å²	43	2%	0.024	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	139.9	173.6	-169.8	-101.3	0	0	0	110.8	G21 W28 R31 E35 I86 P87 V88 T93 P95 W125 G133 L134	G21-Y90 WeakPolarHBondContact CA-O 3.28Å; G21-Y90 PolarHBondContact N-O 3.26Å; W28-Y90 HydrophobicContact CH2-CD1 4.06Å; W28-Y90 HydrophobicContact CH2-CE1 4.22Å; W28-Y90 AromaticContact CZ3-CD1 3.8Å; W28-Y90 HydrophobicContact CZ3-CD1 3.8Å; W28-Y90 HydrophobicContact CZ3-CE1 4.08Å; R31-Y90 PolarHBondContact NH2-OH 3.17Å; E35-Y90 VanDerWaalsContact CD-OH 3.28Å; E35-Y90 WeakPolarHBondContact OE1-CE1 3.28Å; E35-Y90 PolarHBondContact OE1-OH 3.38Å; I86-Y90 VanDerWaalsContact CG2-CB 3.47Å; I86-Y90 HydrophobicContact CG2-CD1 3.87Å; I86-Y90 HydrophobicContact CG2-CD2 4.25Å; I86-Y90 HydrophobicContact CG2-CG 3.6Å; P87-Y90 HydrophobicContact CG-CD2 4.5Å; P87-Y90 WeakPolarHBondContact O-CB 3.23Å; P87-Y90 PolarHBondContact O-N 2.78Å; V88-Y90 VanDerWaalsContact C-N 3.29Å; Y90-T93 WeakPolarHBondContact CD2-O 3.4Å; Y90-P95 HydrophobicContact CD2-CG 4.04Å; Y90-P95 HydrophobicContact CE2-CG 3.93Å; Y90-W125 HydrophobicContact CE2-CH2 4.18Å; Y90-W125 AromaticContact CE2-CZ2 3.88Å; Y90-W125 HydrophobicContact CE2-CZ2 3.88Å; Y90-G133 WeakPolarHBondContact OH-CA 3.39Å; Y90-L134 HydrophobicContact CE2-CD2 4.4Å
91	P	98.1	Very high	97.7	Very high	2 Å²	2	46 Å²	46	1%	0.013	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.3	4.4	3.2	36.1	-36.8	0	0	0	115.6	T93 W125 V129 P130	P91-T93 VanDerWaalsContact C-N 3.27Å; P91-T93 PolarHBondContact O-N 3.25Å; P91-W125 PolarHBondContact O-NE1 2.86Å; P91-V129 HydrophobicContact CG-CG1 4.21Å; P91-P130 HydrophobicContact CG-CB 3.88Å
92	E	98.1	Very high	97.6	Very high	103 Å²	103	38.5 Å²	38.5	48%	0.481	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-40.4	177.9	-62.2	-65	158.7	0	0	111.7	H19 T89	H19-E92 IonicContact CD2-OE1 3.25Å; H19-E92 IonicContact CE1-OE1 2.95Å; H19-E92 PolarHBondContact CE1-OE1 3.46Å; H19-E92 VanDerWaalsContact CE1-OE1 3.25Å; H19-E92 IonicContact NE2-OE1 2.73Å; H19-E92 PolarHBondContact NE2-OE1 3.16Å; T89-E92 WeakPolarHBondContact O-CA 3.42Å; T89-E92 WeakPolarHBondContact O-CB 3.45Å; T89-E92 PolarHBondContact O-N 2.68Å
93	T	97.3	Very high	97.5	Very high	68 Å²	68	42 Å²	42	42%	0.417	23%	0.229	S	C	.	.	S	Bend	trans	-105.8	126.9	176.2	-47.8	0	0	0	0	110.4	P87 T89 Y90 P91	P87-T93 HydrophobicContact CG-CG2 4.43Å; P87-T93 VanDerWaalsContact CG-O 3.3Å; P87-T93 WeakPolarHBondContact CG-O 3.37Å; T89-T93 PolarHBondContact O-N 2.68Å; T89-T93 VanDerWaalsContact OG1-CB 3.27Å; T89-T93 WeakPolarHBondContact OG1-CB 3.49Å; T89-T93 PolarHBondContact OG1-OG1 2.84Å; Y90-T93 WeakPolarHBondContact CD2-O 3.4Å; P91-T93 VanDerWaalsContact C-N 3.27Å; P91-T93 PolarHBondContact O-N 3.25Å
94	A	97.9	Very high	97.3	Very high	19 Å²	19	42.8 Å²	42.8	16%	0.157	25%	0.252	C	S	.	.			trans	-64.9	141.7	172	0	0	0	0	0	111	F121 W125	A94-F121 HydrophobicContact CB-CE1 3.76Å; A94-F121 HydrophobicContact CB-CZ 4.39Å; A94-W125 HydrophobicContact CB-CD2 3.62Å; A94-W125 HydrophobicContact CB-CE3 3.9Å; A94-W125 HydrophobicContact CB-CG 4.05Å; A94-W125 HydrophobicContact CB-CH2 4.26Å; A94-W125 HydrophobicContact CB-CZ2 4Å; A94-W125 HydrophobicContact CB-CZ3 4.21Å
95	P	97.9	Very high	97.1	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.013	27%	0.268	C	S	.	.			trans	-59.9	145.5	169.7	-21.7	30.8	0	0	0	112.5	F84 I86 Y90 V97 L134 L137	F84-P95 HydrophobicContact CB-CB 4.34Å; F84-P95 HydrophobicContact CD2-CB 3.62Å; F84-P95 HydrophobicContact CD2-CG 4.23Å; F84-P95 HydrophobicContact CE2-CB 4.26Å; F84-P95 HydrophobicContact CE2-CG 4.44Å; F84-P95 HydrophobicContact CG-CB 4.21Å; I86-P95 HydrophobicContact CD1-CG 3.92Å; Y90-P95 HydrophobicContact CD2-CG 4.04Å; Y90-P95 HydrophobicContact CE2-CG 3.93Å; P95-V97 PolarHBondContact O-N 3.04Å; P95-L134 HydrophobicContact CG-CD2 3.87Å; P95-L137 HydrophobicContact CB-CD2 3.87Å; P95-L137 HydrophobicContact CG-CD2 3.98Å
96	E	97.2	Very high	97	Very high	112 Å²	112	42.7 Å²	42.7	52%	0.523	25%	0.249	S	C	.	.			trans	-88.7	102.6	175.2	-63.2	-179.7	115.1	0	0	109.8	F84 A98 K114	F84-E96 WeakPolarHBondContact CB-O 3.38Å; E96-A98 PolarHBondContact O-N 3.45Å; E96-K114 HydrophobicContact CB-CD 4.07Å; E96-K114 HydrophobicContact CB-CG 4.46Å; E96-K114 IonicContact OE2-NZ 3.52Å; E96-K114 PolarHBondContact OE2-NZ 2.84Å
97	V	97.9	Very high	96.7	Very high	1 Å²	1	47 Å²	47	1%	0.006	29%	0.286	C	S	.	.			trans	-68.8	128.2	178.5	-175.8	0	0	0	0	110.4	F84 P95 K114 I115 L137 L142	F84-V97 HydrophobicContact CD1-CG1 4.48Å; F84-V97 HydrophobicContact CD1-CG2 4.18Å; P95-V97 PolarHBondContact O-N 3.04Å; V97-K114 WeakPolarHBondContact O-CA 3.28Å; V97-I115 HydrophobicContact CB-CD1 3.96Å; V97-I115 HydrophobicContact CB-CG1 4.19Å; V97-I115 HydrophobicContact CG1-CD1 4.36Å; V97-I115 PolarHBondContact O-N 3.36Å; V97-L137 HydrophobicContact CG2-CD1 4.1Å; V97-L137 HydrophobicContact CG2-CD2 3.61Å; V97-L137 HydrophobicContact CG2-CG 3.83Å; V97-L142 HydrophobicContact CG1-CD1 4.25Å; V97-L142 HydrophobicContact CG1-CD2 4.08Å
98	A	98.2	Very high	96.4	Very high	8 Å²	8	50.8 Å²	50.8	7%	0.066	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-109.6	140.5	172.4	0	0	0	0	0	111.8	V82 E83 E96 G113 K114	V82-A98 WeakPolarHBondContact CA-O 3.24Å; E83-A98 HydrophobicContact CG-CB 4.25Å; E83-A98 PolarHBondContact N-O 2.7Å; E83-A98 WeakPolarHBondContact O-CB 3.13Å; E83-A98 PolarHBondContact O-N 2.75Å; E96-A98 PolarHBondContact O-N 3.45Å; A98-G113 CarbonylContact C-O 3.52Å; A98-G113 VanDerWaalsContact CA-O 3.26Å; A98-G113 WeakPolarHBondContact CA-O 3.29Å; A98-K114 HydrophobicContact CB-CG 4.26Å
99	V	97.9	Very high	96.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.284	C	S	.	.			trans	-122.4	81.4	169	-168.9	0	0	0	0	107.7	F80 V82 E101 L102 M109 G113 I115 L142	F80-V99 HydrophobicContact CB-CG1 3.7Å; F80-V99 HydrophobicContact CG-CG1 4.29Å; V82-V99 HydrophobicContact CG1-CG2 4.29Å; V99-E101 PolarHBondContact O-N 3.14Å; V99-E101 VanDerWaalsContact O-N 3.08Å; V99-L102 HydrophobicContact CB-CD1 4.3Å; V99-L102 HydrophobicContact CB-CG 4.47Å; V99-L102 HydrophobicContact CG1-CB 4.38Å; V99-L102 HydrophobicContact CG1-CD1 3.74Å; V99-L102 HydrophobicContact CG1-CG 3.8Å; V99-L102 PolarHBondContact O-N 3.18Å; V99-M109 HydrophobicContact CB-CE 4.43Å; V99-G113 PolarHBondContact N-O 2.92Å; V99-I115 HydrophobicContact CG2-CG2 3.89Å; V99-L142 HydrophobicContact CG2-CD1 4.18Å
100	P	96.2	Very high	95.9	Very high	52 Å²	52	50.3 Å²	50.3	34%	0.338	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-58.1	-29.7	-168.3	-27	35.8	0	0	0	114.4	E83 L102 D103	E83-P100 HydrophobicContact CG-CG 4.19Å; P100-L102 PolarHBondContact O-N 2.76Å; P100-L102 VanDerWaalsContact O-N 3.16Å; P100-D103 WeakPolarHBondContact O-CB 3.36Å; P100-D103 PolarHBondContact O-N 2.99Å
101	E	94.4	Very high	95.4	Very high	75 Å²	75	61.4 Å²	61.4	35%	0.35	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-65.9	-15.2	179.7	-64	-179.6	-118.5	0	0	114.1	R81 V99 K105	R81-E101 WeakPolarHBondContact CB-OE1 3.5Å; R81-E101 VanDerWaalsContact CG-OE1 3.3Å; R81-E101 WeakPolarHBondContact CG-OE1 3.43Å; R81-E101 PolarHBondContact N-OE1 2.83Å; V99-E101 PolarHBondContact O-N 3.14Å; V99-E101 VanDerWaalsContact O-N 3.08Å; E101-K105 WeakPolarHBondContact O-CE 3.3Å; E101-K105 PolarHBondContact O-NZ 3.4Å
102	L	96	Very high	94.9	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-105.9	1.6	-179.5	-56.8	-176.8	0	0	0	113	F80 V99 P100 G104 K105 M109 W145 I150 L153 V159	F80-L102 HydrophobicContact CD1-CD1 4.4Å; F80-L102 HydrophobicContact CD1-CD2 4.04Å; F80-L102 HydrophobicContact CD1-CG 4.27Å; F80-L102 HydrophobicContact CE1-CD1 4.47Å; F80-L102 HydrophobicContact CE1-CD2 3.79Å; F80-L102 HydrophobicContact CE1-CG 4.43Å; V99-L102 HydrophobicContact CB-CD1 4.3Å; V99-L102 HydrophobicContact CB-CG 4.47Å; V99-L102 HydrophobicContact CG1-CB 4.38Å; V99-L102 HydrophobicContact CG1-CD1 3.74Å; V99-L102 HydrophobicContact CG1-CG 3.8Å; V99-L102 PolarHBondContact O-N 3.18Å; P100-L102 PolarHBondContact O-N 2.76Å; P100-L102 VanDerWaalsContact O-N 3.16Å; L102-G104 PolarHBondContact O-N 3.39Å; L102-K105 HydrophobicContact CD2-CD 4.36Å; L102-K105 WeakPolarHBondContact O-CB 3.41Å; L102-K105 PolarHBondContact O-N 2.95Å; L102-M109 HydrophobicContact CB-CE 3.62Å; L102-M109 HydrophobicContact CB-SD 4.16Å; L102-M109 VanDerWaalsContact O-SD 3.35Å; L102-W145 HydrophobicContact CD1-CH2 3.73Å; L102-W145 HydrophobicContact CD1-CZ3 3.8Å; L102-I150 HydrophobicContact CD1-CD1 3.68Å; L102-L153 HydrophobicContact CD1-CD1 4.13Å; L102-L153 HydrophobicContact CD2-CD1 4.06Å; L102-V159 HydrophobicContact CD2-CG2 3.61Å
103	D	96	Very high	94.7	Very high	75 Å²	75	58.5 Å²	58.5	40%	0.401	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	129.8	-179.8	-164.2	23.3	0	0	0	111.1	P100 K105 M109 G112 G113	P100-D103 WeakPolarHBondContact O-CB 3.36Å; P100-D103 PolarHBondContact O-N 2.99Å; D103-K105 PolarHBondContact O-N 3.44Å; D103-M109 VanDerWaalsContact CA-SD 3.55Å; D103-M109 HydrophobicContact CB-SD 4.43Å; D103-G112 PolarHBondContact OD1-N 3.14Å; D103-G112 WeakPolarHBondContact OD2-CA 3.48Å; D103-G112 PolarHBondContact OD2-N 3.03Å; D103-G113 VanDerWaalsContact CG-N 3.32Å; D103-G113 PolarHBondContact OD1-N 2.75Å
104	G	94.1	Very high	94.6	Very high	74 Å²	74	58.8 Å²	58.8	76%	0.763	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	0.6	-176.7	0	0	0	0	0	116.3	L102	L102-G104 PolarHBondContact O-N 3.39Å
105	K	94.9	Very high	94.5	Very high	83 Å²	83	58.4 Å²	58.4	36%	0.361	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-20.1	-179.6	-60.2	-176	-178	168.4	0	114.1	E101 L102 D103 L153 H158	E101-K105 WeakPolarHBondContact O-CE 3.3Å; E101-K105 PolarHBondContact O-NZ 3.4Å; L102-K105 HydrophobicContact CD2-CD 4.36Å; L102-K105 WeakPolarHBondContact O-CB 3.41Å; L102-K105 PolarHBondContact O-N 2.95Å; D103-K105 PolarHBondContact O-N 3.44Å; K105-L153 HydrophobicContact CB-CD2 3.85Å; K105-L153 WeakPolarHBondContact O-CD2 3.44Å; K105-H158 HydrophobicContact CB-CB 4.26Å; K105-H158 HydrophobicContact CD-CB 4.24Å; K105-H158 HydrophobicContact CG-CB 4.48Å; K105-H158 PolarHBondContact NZ-O 2.94Å
106	T	94.7	Very high	94.3	Very high	21 Å²	21	60 Å²	60	13%	0.129	33%	0.327	C	S	.	.			trans	-133.8	150.1	176.2	172	0	0	0	0	111.2	K108 M109 W145 E149	T106-K108 PolarHBondContact O-N 2.88Å; T106-K108 PolarHBondContact OG1-N 2.84Å; T106-M109 HydrophobicContact CG2-CB 3.95Å; T106-M109 HydrophobicContact CG2-CE 4.28Å; T106-W145 HydrophobicContact CG2-CH2 4.22Å; T106-W145 HydrophobicContact CG2-CZ2 3.83Å; T106-E149 WeakPolarHBondContact CB-OE2 3.15Å; T106-E149 PolarHBondContact OG1-OE2 3.28Å
107	A	92.5	Very high	94.1	Very high	102 Å²	102	56.9 Å²	56.9	84%	0.843	31%	0.314	S	S	*	.	S	Bend	trans	-72.3	-15.9	171.2	0	0	0	0	0	113.1	M109	A107-M109 PolarHBondContact O-N 2.92Å
108	K	93.1	Very high	93.7	Very high	113 Å²	113	61.3 Å²	61.3	49%	0.491	34%	0.341	S	S	.	.	S	Bend	trans	-89.2	39.8	178.1	-64.1	-61.7	-164.7	176.3	0	112.2	T106 C116 W145 E149	T106-K108 PolarHBondContact O-N 2.88Å; T106-K108 PolarHBondContact OG1-N 2.84Å; K108-C116 HydrophobicContact CB-CB 4.47Å; K108-C116 VanDerWaalsContact O-CB 3.26Å; K108-C116 WeakPolarHBondContact O-CB 3.4Å; K108-C116 PolarHBondContact O-N 3.22Å; K108-W145 PolarHBondContact O-NE1 2.96Å; K108-E149 HydrophobicContact CB-CG 4.34Å; K108-E149 VanDerWaalsContact CG-OE1 3.3Å; K108-E149 WeakPolarHBondContact CG-OE1 3.47Å
109	M	92.6	Very high	93.3	Very high	21 Å²	21	68.7 Å²	68.7	10%	0.103	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	137.4	179.7	-171.7	166.3	-73	0	0	109.5	V99 L102 D103 T106 A107 G113 K114 I115 W145	V99-M109 HydrophobicContact CB-CE 4.43Å; L102-M109 HydrophobicContact CB-CE 3.62Å; L102-M109 HydrophobicContact CB-SD 4.16Å; L102-M109 VanDerWaalsContact O-SD 3.35Å; D103-M109 VanDerWaalsContact CA-SD 3.55Å; D103-M109 HydrophobicContact CB-SD 4.43Å; T106-M109 HydrophobicContact CG2-CB 3.95Å; T106-M109 HydrophobicContact CG2-CE 4.28Å; A107-M109 PolarHBondContact O-N 2.92Å; M109-G113 WeakPolarHBondContact SD-CA 3.41Å; M109-K114 CarbonylContact C-O 3.54Å; M109-K114 WeakPolarHBondContact CA-O 2.96Å; M109-K114 VanDerWaalsContact CG-O 3.31Å; M109-K114 WeakPolarHBondContact CG-O 3.37Å; M109-I115 HydrophobicContact CE-CG2 4.14Å; M109-W145 HydrophobicContact CE-CH2 3.45Å; M109-W145 VanDerWaalsContact CE-CH2 3.45Å; M109-W145 HydrophobicContact CE-CZ2 3.53Å
110	F	91.4	Very high	93	Very high	118 Å²	118	74.8 Å²	74.8	52%	0.518	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	162.4	169.9	-56.9	-71.8	0	0	0	110.2	G112 G113 K114 C116	F110-G112 PolarHBondContact O-N 2.8Å; F110-G113 PolarHBondContact O-N 2.73Å; F110-K114 HydrophobicContact CB-CB 4.21Å; F110-K114 PolarHBondContact N-O 2.83Å; F110-K114 PolarHBondContact O-N 3.28Å; F110-C116 HydrophobicContact CD2-CB 4.24Å; F110-C116 HydrophobicContact CE2-CB 3.81Å; F110-C116 HydrophobicContact CZ-CB 4.1Å; F110-C116 VanDerWaalsContact CZ-SG 3.53Å
111	R	86.5	Confident	93	Very high	240 Å²	240	72.9 Å²	72.9	91%	0.906	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	134.3	179.4	-175.9	178.3	-179.9	179.7	0.6	111.7
112	G	88.4	Confident	93	Very high	43 Å²	43	72.5 Å²	72.5	44%	0.443	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	23.3	179	0	0	0	0	0	113.3	D103 F110 K114	D103-G112 PolarHBondContact OD1-N 3.14Å; D103-G112 WeakPolarHBondContact OD2-CA 3.48Å; D103-G112 PolarHBondContact OD2-N 3.03Å; F110-G112 PolarHBondContact O-N 2.8Å; G112-K114 PolarHBondContact O-N 3.26Å
113	G	93.1	Very high	93	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	1.2	171.9	0	0	0	0	0	115.7	A98 V99 D103 M109 F110 I115	A98-G113 CarbonylContact C-O 3.52Å; A98-G113 VanDerWaalsContact CA-O 3.26Å; A98-G113 WeakPolarHBondContact CA-O 3.29Å; V99-G113 PolarHBondContact N-O 2.92Å; D103-G113 VanDerWaalsContact CG-N 3.32Å; D103-G113 PolarHBondContact OD1-N 2.75Å; M109-G113 WeakPolarHBondContact SD-CA 3.41Å; F110-G113 PolarHBondContact O-N 2.73Å; G113-I115 PolarHBondContact O-N 2.92Å
114	K	96.1	Very high	93	Very high	75 Å²	75	75.1 Å²	75.1	33%	0.326	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.8	-176.4	-69.5	-179.8	178.9	-172.9	0	110.8	E96 V97 A98 M109 F110 G112 C116	E96-K114 HydrophobicContact CB-CD 4.07Å; E96-K114 HydrophobicContact CB-CG 4.46Å; E96-K114 IonicContact OE2-NZ 3.52Å; E96-K114 PolarHBondContact OE2-NZ 2.84Å; V97-K114 WeakPolarHBondContact O-CA 3.28Å; A98-K114 HydrophobicContact CB-CG 4.26Å; M109-K114 CarbonylContact C-O 3.54Å; M109-K114 WeakPolarHBondContact CA-O 2.96Å; M109-K114 VanDerWaalsContact CG-O 3.31Å; M109-K114 WeakPolarHBondContact CG-O 3.37Å; F110-K114 HydrophobicContact CB-CB 4.21Å; F110-K114 PolarHBondContact N-O 2.83Å; F110-K114 PolarHBondContact O-N 3.28Å; G112-K114 PolarHBondContact O-N 3.26Å; K114-C116 PolarHBondContact O-N 3.25Å
115	I	96.3	Very high	93.2	Very high	10 Å²	10	72 Å²	72	5%	0.051	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	138	-177.5	70	179.4	0	0	0	110.8	V97 V99 M109 G113 L117 L142 W145	V97-I115 HydrophobicContact CB-CD1 3.96Å; V97-I115 HydrophobicContact CB-CG1 4.19Å; V97-I115 HydrophobicContact CG1-CD1 4.36Å; V97-I115 PolarHBondContact O-N 3.36Å; V99-I115 HydrophobicContact CG2-CG2 3.89Å; M109-I115 HydrophobicContact CE-CG2 4.14Å; G113-I115 PolarHBondContact O-N 2.92Å; I115-L117 HydrophobicContact CD1-CD2 3.71Å; I115-L117 HydrophobicContact CD1-CG 4.41Å; I115-L117 HydrophobicContact CG1-CD2 4.04Å; I115-L117 HydrophobicContact CG1-CG 4.22Å; I115-L117 PolarHBondContact O-N 3.4Å; I115-L142 HydrophobicContact CD1-CB 4.34Å; I115-L142 HydrophobicContact CD1-CD1 3.83Å; I115-W145 HydrophobicContact CB-CD2 3.97Å; I115-W145 HydrophobicContact CB-CG 4.14Å; I115-W145 HydrophobicContact CB-CZ2 4.25Å; I115-W145 HydrophobicContact CD1-CB 4.29Å; I115-W145 HydrophobicContact CD1-CG 4.22Å; I115-W145 HydrophobicContact CG2-CD2 3.83Å; I115-W145 HydrophobicContact CG2-CE3 4Å; I115-W145 HydrophobicContact CG2-CG 4.46Å; I115-W145 HydrophobicContact CG2-CH2 4.09Å; I115-W145 HydrophobicContact CG2-CZ2 3.87Å; I115-W145 HydrophobicContact CG2-CZ3 4.13Å
116	C	93.6	Very high	93.3	Very high	36 Å²	36	71.1 Å²	71.1	24%	0.243	39%	0.389	C	S	.	.			trans	-84.8	101.2	172	-172.7	0	0	0	0	108.8	K108 F110 K114	K108-C116 HydrophobicContact CB-CB 4.47Å; K108-C116 VanDerWaalsContact O-CB 3.26Å; K108-C116 WeakPolarHBondContact O-CB 3.4Å; K108-C116 PolarHBondContact O-N 3.22Å; F110-C116 HydrophobicContact CD2-CB 4.24Å; F110-C116 HydrophobicContact CE2-CB 3.81Å; F110-C116 HydrophobicContact CZ-CB 4.1Å; F110-C116 VanDerWaalsContact CZ-SG 3.53Å; K114-C116 PolarHBondContact O-N 3.25Å
117	L	92.4	Very high	93.4	Very high	47 Å²	47	80.1 Å²	80.1	25%	0.246	42%	0.42	C	S	.	.			trans	-68.1	158.6	175.6	-65.7	172.5	0	0	0	111	I115 F121 G141	I115-L117 HydrophobicContact CD1-CD2 3.71Å; I115-L117 HydrophobicContact CD1-CG 4.41Å; I115-L117 HydrophobicContact CG1-CD2 4.04Å; I115-L117 HydrophobicContact CG1-CG 4.22Å; I115-L117 PolarHBondContact O-N 3.4Å; L117-F121 HydrophobicContact CB-CB 4.15Å; L117-F121 HydrophobicContact CB-CD1 4.37Å; L117-F121 HydrophobicContact CB-CG 4.29Å; L117-F121 HydrophobicContact CD1-CD1 3.51Å; L117-F121 HydrophobicContact CD1-CE1 3.59Å; L117-F121 HydrophobicContact CD1-CG 4Å; L117-F121 HydrophobicContact CD1-CZ 4.15Å; L117-F121 HydrophobicContact CG-CD1 4.48Å; L117-G141 VanDerWaalsContact CD2-CA 3.49Å
118	T	89.4	Confident	93.7	Very high	93 Å²	93	77 Å²	77	57%	0.571	39%	0.389	S	S	*	.			trans	-66.3	152.5	177.9	70.2	0	0	0	0	111.5	H120 F121	T118-H120 PolarHBondContact O-N 2.98Å; T118-F121 WeakPolarHBondContact O-CB 3.29Å; T118-F121 PolarHBondContact O-N 2.96Å
119	E	90	Very high	93.9	Very high	163 Å²	163	73 Å²	73	76%	0.762	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.8	174.8	68.1	-175.3	161.6	0	0	113.3	F121 P123	E119-F121 VanDerWaalsContact C-N 3.34Å; E119-P123 WeakPolarHBondContact O-CD 3.18Å
120	H	91.5	Very high	94.1	Very high	128 Å²	128	73.3 Å²	73.3	59%	0.593	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-19.9	179.1	-62.8	88.1	0	0	0	113	T118 L124	T118-H120 PolarHBondContact O-N 2.98Å; H120-L124 VanDerWaalsContact O-CB 3.31Å; H120-L124 WeakPolarHBondContact O-CB 3.46Å; H120-L124 PolarHBondContact O-N 3.42Å
121	F	95.1	Very high	94.5	Very high	13 Å²	13	73.8 Å²	73.8	6%	0.057	38%	0.376	C	S	.	.	H	α-helix	trans	-70.2	-47.6	-174.8	-177.6	-91.2	0	0	0	112.1	A94 L117 T118 E119 L124 W125 L137 L140	A94-F121 HydrophobicContact CB-CE1 3.76Å; A94-F121 HydrophobicContact CB-CZ 4.39Å; L117-F121 HydrophobicContact CB-CB 4.15Å; L117-F121 HydrophobicContact CB-CD1 4.37Å; L117-F121 HydrophobicContact CB-CG 4.29Å; L117-F121 HydrophobicContact CD1-CD1 3.51Å; L117-F121 HydrophobicContact CD1-CE1 3.59Å; L117-F121 HydrophobicContact CD1-CG 4Å; L117-F121 HydrophobicContact CD1-CZ 4.15Å; L117-F121 HydrophobicContact CG-CD1 4.48Å; T118-F121 WeakPolarHBondContact O-CB 3.29Å; T118-F121 PolarHBondContact O-N 2.96Å; E119-F121 VanDerWaalsContact C-N 3.34Å; F121-L124 WeakPolarHBondContact O-CB 3.48Å; F121-L124 PolarHBondContact O-N 2.85Å; F121-L124 VanDerWaalsContact O-N 3.17Å; F121-W125 HydrophobicContact CE1-CB 4.35Å; F121-W125 HydrophobicContact CE1-CE3 4.12Å; F121-W125 AromaticContact CZ-CE3 3.73Å; F121-W125 HydrophobicContact CZ-CE3 3.73Å; F121-W125 HydrophobicContact CZ-CZ3 4.3Å; F121-W125 PolarHBondContact O-N 2.99Å; F121-L137 HydrophobicContact CE1-CD1 4.19Å; F121-L137 HydrophobicContact CE2-CD1 4.45Å; F121-L137 HydrophobicContact CZ-CD1 3.61Å; F121-L140 HydrophobicContact CD2-CB 4.44Å; F121-L140 HydrophobicContact CE2-CB 4.06Å
122	A	95.1	Very high	95	Very high	66 Å²	66	63.2 Å²	63.2	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-62.2	-45.4	-176.8	0	0	0	0	0	113.1	L124 W125 A126	A122-L124 VanDerWaalsContact C-N 3.32Å; A122-L124 PolarHBondContact O-N 2.93Å; A122-W125 PolarHBondContact O-N 3.47Å; A122-A126 WeakPolarHBondContact O-CB 3.44Å; A122-A126 PolarHBondContact O-N 2.95Å
123	P	96.7	Very high	95.5	Very high	63 Å²	63	61.1 Å²	61.1	41%	0.409	32%	0.316	S	S	.	.	H	α-helix	trans	-63.1	-35.6	173.1	-23.2	34.2	0	0	0	113.5	E119 R127	E119-P123 WeakPolarHBondContact O-CD 3.18Å; P123-R127 VanDerWaalsContact O-CG 3.26Å; P123-R127 WeakPolarHBondContact O-CG 3.45Å; P123-R127 PolarHBondContact O-N 3.44Å
124	L	95.7	Very high	95.8	Very high	69 Å²	69	61.2 Å²	61.2	36%	0.361	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-45	176.9	175.3	62.8	0	0	0	111.3	H120 F121 A122 N128 F132 L140	H120-L124 VanDerWaalsContact O-CB 3.31Å; H120-L124 WeakPolarHBondContact O-CB 3.46Å; H120-L124 PolarHBondContact O-N 3.42Å; F121-L124 WeakPolarHBondContact O-CB 3.48Å; F121-L124 PolarHBondContact O-N 2.85Å; F121-L124 VanDerWaalsContact O-N 3.17Å; A122-L124 VanDerWaalsContact C-N 3.32Å; A122-L124 PolarHBondContact O-N 2.93Å; L124-N128 PolarHBondContact O-ND2 2.82Å; L124-F132 HydrophobicContact CD1-CE2 4.38Å; L124-F132 HydrophobicContact CG-CE2 4.1Å; L124-L140 HydrophobicContact CD2-CD1 4.04Å; L124-L140 HydrophobicContact CD2-CD2 4.4Å
125	W	97.7	Very high	95.9	Very high	9 Å²	9	57.6 Å²	57.6	3%	0.034	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-53.9	175.6	-175.8	-84.6	0	0	0	110.9	Y90 P91 A94 F121 A122 R127 N128 V129 F132 L137	Y90-W125 HydrophobicContact CE2-CH2 4.18Å; Y90-W125 AromaticContact CE2-CZ2 3.88Å; Y90-W125 HydrophobicContact CE2-CZ2 3.88Å; P91-W125 PolarHBondContact O-NE1 2.86Å; A94-W125 HydrophobicContact CB-CD2 3.62Å; A94-W125 HydrophobicContact CB-CE3 3.9Å; A94-W125 HydrophobicContact CB-CG 4.05Å; A94-W125 HydrophobicContact CB-CH2 4.26Å; A94-W125 HydrophobicContact CB-CZ2 4Å; A94-W125 HydrophobicContact CB-CZ3 4.21Å; F121-W125 HydrophobicContact CE1-CB 4.35Å; F121-W125 HydrophobicContact CE1-CE3 4.12Å; F121-W125 AromaticContact CZ-CE3 3.73Å; F121-W125 HydrophobicContact CZ-CE3 3.73Å; F121-W125 HydrophobicContact CZ-CZ3 4.3Å; F121-W125 PolarHBondContact O-N 2.99Å; A122-W125 PolarHBondContact O-N 3.47Å; W125-R127 VanDerWaalsContact C-N 3.28Å; W125-R127 PolarHBondContact O-N 2.95Å; W125-N128 CarbonylContact O-C 3.52Å; W125-N128 WeakPolarHBondContact O-CA 3.4Å; W125-N128 PolarHBondContact O-N 3.36Å; W125-V129 WeakPolarHBondContact O-CG2 3.47Å; W125-V129 PolarHBondContact O-N 2.95Å; W125-V129 VanDerWaalsContact O-N 3.15Å; W125-F132 HydrophobicContact CE3-CB 4.22Å; W125-F132 HydrophobicContact CE3-CD2 4.3Å; W125-F132 HydrophobicContact CH2-CB 4.44Å; W125-F132 HydrophobicContact CZ3-CB 4.15Å; W125-L137 HydrophobicContact CZ3-CB 4.05Å
126	A	97.3	Very high	96	Very high	64 Å²	64	57.1 Å²	57.1	53%	0.529	30%	0.298	S	S	.	.	H	α-helix	trans	-55.3	-40.3	-176.8	0	0	0	0	0	113	A122 N128	A122-A126 WeakPolarHBondContact O-CB 3.44Å; A122-A126 PolarHBondContact O-N 2.95Å; A126-N128 PolarHBondContact O-N 3.13Å
127	R	97.5	Very high	96.2	Very high	210 Å²	210	55.4 Å²	55.4	79%	0.792	29%	0.286	S	S	*	.	H	α-helix	trans	-68.8	-17.9	177.9	-71.1	172.6	-174.9	-171.4	2.6	114.1	P123 W125	P123-R127 VanDerWaalsContact O-CG 3.26Å; P123-R127 WeakPolarHBondContact O-CG 3.45Å; P123-R127 PolarHBondContact O-N 3.44Å; W125-R127 VanDerWaalsContact C-N 3.28Å; W125-R127 PolarHBondContact O-N 2.95Å
128	N	97.8	Very high	96.4	Very high	35 Å²	35	53.2 Å²	53.2	19%	0.187	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	6.9	-176.1	-71.3	-81.5	0	0	0	112.9	L124 W125 A126 P130 R131 F132	L124-N128 PolarHBondContact O-ND2 2.82Å; W125-N128 CarbonylContact O-C 3.52Å; W125-N128 WeakPolarHBondContact O-CA 3.4Å; W125-N128 PolarHBondContact O-N 3.36Å; A126-N128 PolarHBondContact O-N 3.13Å; N128-P130 CarbonylContact O-C 3.59Å; N128-R131 WeakPolarHBondContact O-CA 3.44Å; N128-R131 VanDerWaalsContact O-CB 3.28Å; N128-R131 WeakPolarHBondContact O-CB 3.22Å; N128-R131 PolarHBondContact O-N 2.97Å; N128-F132 HydrophobicContact CB-CB 4.35Å; N128-F132 HydrophobicContact CB-CD1 3.56Å; N128-F132 HydrophobicContact CB-CD2 3.65Å; N128-F132 HydrophobicContact CB-CE1 3.63Å; N128-F132 HydrophobicContact CB-CE2 3.73Å; N128-F132 HydrophobicContact CB-CG 3.56Å; N128-F132 HydrophobicContact CB-CZ 3.72Å; N128-F132 VanDerWaalsContact CG-CZ 3.47Å; N128-F132 PolarHBondContact O-N 3.35Å; N128-F132 VanDerWaalsContact O-N 3.14Å
129	V	97.6	Very high	96.8	Very high	29 Å²	29	49.2 Å²	49.2	18%	0.176	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	135.3	170.1	-179.9	0	0	0	0	109.3	P91 W125	P91-V129 HydrophobicContact CG-CG1 4.21Å; W125-V129 WeakPolarHBondContact O-CG2 3.47Å; W125-V129 PolarHBondContact O-N 2.95Å; W125-V129 VanDerWaalsContact O-N 3.15Å
130	P	97.8	Very high	97.1	Very high	28 Å²	28	42.9 Å²	42.9	18%	0.182	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	cis	-94.2	10.2	-2.1	38.7	-37.5	0	0	0	114.2	H19 R31 P91 N128 F132	H19-P130 HydrophobicContact CB-CB 3.92Å; H19-P130 HydrophobicContact CB-CG 3.95Å; R31-P130 PolarHBondContact NH1-O 2.85Å; P91-P130 HydrophobicContact CG-CB 3.88Å; N128-P130 CarbonylContact O-C 3.59Å; P130-F132 VanDerWaalsContact C-N 3.31Å; P130-F132 PolarHBondContact O-N 3.3Å
131	R	98.2	Very high	97.3	Very high	129 Å²	129	36.9 Å²	36.9	49%	0.487	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-29.5	-171.2	-57.6	172	68.9	-167.3	3.9	113.3	L15 L16 N128	L15-R131 HydrophobicContact CB-CB 4.45Å; L15-R131 HydrophobicContact CD2-CB 4.44Å; L16-R131 PolarHBondContact N-O 2.89Å; L16-R131 WeakPolarHBondContact O-CA 3.38Å; N128-R131 WeakPolarHBondContact O-CA 3.44Å; N128-R131 VanDerWaalsContact O-CB 3.28Å; N128-R131 WeakPolarHBondContact O-CB 3.22Å; N128-R131 PolarHBondContact O-N 2.97Å
132	F	98.4	Very high	97.4	Very high	17 Å²	17	36.3 Å²	36.3	8%	0.075	19%	0.193	C	C	.	.			trans	-81.7	153	173.1	-77.1	8.2	0	0	0	111.8	R31 L124 W125 N128 P130 H136 L140	R31-F132 PolarHBondContact NH2-O 2.87Å; L124-F132 HydrophobicContact CD1-CE2 4.38Å; L124-F132 HydrophobicContact CG-CE2 4.1Å; W125-F132 HydrophobicContact CE3-CB 4.22Å; W125-F132 HydrophobicContact CE3-CD2 4.3Å; W125-F132 HydrophobicContact CH2-CB 4.44Å; W125-F132 HydrophobicContact CZ3-CB 4.15Å; N128-F132 HydrophobicContact CB-CB 4.35Å; N128-F132 HydrophobicContact CB-CD1 3.56Å; N128-F132 HydrophobicContact CB-CD2 3.65Å; N128-F132 HydrophobicContact CB-CE1 3.63Å; N128-F132 HydrophobicContact CB-CE2 3.73Å; N128-F132 HydrophobicContact CB-CG 3.56Å; N128-F132 HydrophobicContact CB-CZ 3.72Å; N128-F132 VanDerWaalsContact CG-CZ 3.47Å; N128-F132 PolarHBondContact O-N 3.35Å; N128-F132 VanDerWaalsContact O-N 3.14Å; P130-F132 VanDerWaalsContact C-N 3.31Å; P130-F132 PolarHBondContact O-N 3.3Å; F132-H136 HydrophobicContact CB-CB 4.03Å; F132-H136 HydrophobicContact CD1-CB 4.31Å; F132-H136 AromaticContact CD1-CD2 3.42Å; F132-H136 VanDerWaalsContact CD1-CD2 3.42Å; F132-H136 WeakPolarHBondContact CD1-CD2 3.34Å; F132-H136 AromaticContact CD1-CG 3.8Å; F132-H136 AromaticContact CD1-NE2 3.77Å; F132-H136 HydrophobicContact CD2-CB 4.2Å; F132-H136 AromaticContact CE1-CD2 3.65Å; F132-H136 HydrophobicContact CG-CB 3.94Å; F132-H136 AromaticContact CG-CD2 3.96Å; F132-H136 AromaticContact CG-CG 3.91Å; F132-L140 HydrophobicContact CD2-CD1 4.31Å; F132-L140 HydrophobicContact CE2-CD1 3.57Å; F132-L140 HydrophobicContact CZ-CD1 3.92Å
133	G	98.4	Very high	97.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.178	C	C	.	.			trans	-152.4	-162.5	-177.8	0	0	0	0	0	111.8	E35 Y90 A135 H136 L137	E35-G133 WeakPolarHBondContact OE2-CA 3.37Å; Y90-G133 WeakPolarHBondContact OH-CA 3.39Å; G133-A135 PolarHBondContact O-N 2.84Å; G133-H136 PolarHBondContact N-ND1 3.28Å; G133-H136 VanDerWaalsContact N-ND1 3.18Å; G133-H136 WeakPolarHBondContact O-CA 3.33Å; G133-H136 WeakPolarHBondContact O-CB 3.47Å; G133-H136 PolarHBondContact O-N 2.77Å; G133-L137 PolarHBondContact O-N 2.8Å
134	L	98.6	Very high	97.3	Very high	1 Å²	1	34 Å²	34	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-63.2	-40.1	-173	-59.3	-175.9	0	0	0	112.7	E35 L39 W65 F84 I86 Y90 P95 H136 L137 M138	E35-L134 HydrophobicContact CG-CG 4.48Å; E35-L134 PolarHBondContact OE2-N 2.49Å; L39-L134 HydrophobicContact CD1-CB 4.19Å; L39-L134 HydrophobicContact CD1-CD1 4.37Å; L39-L134 HydrophobicContact CD2-CB 4.27Å; L39-L134 HydrophobicContact CG-CB 4.38Å; W65-L134 HydrophobicContact CD2-CD1 3.7Å; W65-L134 HydrophobicContact CE3-CD1 4.14Å; W65-L134 HydrophobicContact CG-CD1 4.3Å; W65-L134 HydrophobicContact CH2-CD1 3.84Å; W65-L134 HydrophobicContact CZ2-CD1 3.37Å; W65-L134 HydrophobicContact CZ3-CD1 4.2Å; F84-L134 HydrophobicContact CE2-CD1 4.24Å; F84-L134 HydrophobicContact CE2-CD2 3.72Å; F84-L134 HydrophobicContact CZ-CD1 4.4Å; F84-L134 HydrophobicContact CZ-CD2 4.18Å; I86-L134 HydrophobicContact CD1-CD1 4.33Å; I86-L134 HydrophobicContact CD1-CD2 3.85Å; Y90-L134 HydrophobicContact CE2-CD2 4.4Å; P95-L134 HydrophobicContact CG-CD2 3.87Å; L134-H136 PolarHBondContact O-N 2.9Å; L134-L137 HydrophobicContact CD2-CD2 4.45Å; L134-L137 WeakPolarHBondContact O-CB 3.23Å; L134-L137 PolarHBondContact O-N 3.44Å; L134-L137 VanDerWaalsContact O-N 3.14Å; L134-M138 VanDerWaalsContact O-CG 3.32Å; L134-M138 WeakPolarHBondContact O-CG 3.49Å; L134-M138 PolarHBondContact O-N 2.89Å
135	A	98.3	Very high	97.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-58.4	-37.8	174.2	0	0	0	0	0	112.2	I13 A38 L39 F42 G133 M138 A139	I13-A135 HydrophobicContact CG2-CB 3.62Å; A38-A135 HydrophobicContact CB-CB 4.06Å; L39-A135 HydrophobicContact CD2-CB 4.06Å; L39-A135 HydrophobicContact CG-CB 4.37Å; F42-A135 HydrophobicContact CB-CB 4.25Å; F42-A135 HydrophobicContact CD1-CB 4.31Å; G133-A135 PolarHBondContact O-N 2.84Å; A135-M138 PolarHBondContact O-N 3.25Å; A135-A139 WeakPolarHBondContact O-CB 3.32Å; A135-A139 PolarHBondContact O-N 3.35Å
136	H	98.2	Very high	97.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71	-39.2	176.7	-57.7	84.9	0	0	0	111.7	I13 L15 F132 G133 L134 M138 A139 L140	I13-H136 VanDerWaalsContact CG2-CE1 3.42Å; I13-H136 WeakPolarHBondContact CG2-CE1 3.09Å; L15-H136 WeakPolarHBondContact CD2-NE2 3.41Å; F132-H136 HydrophobicContact CB-CB 4.03Å; F132-H136 HydrophobicContact CD1-CB 4.31Å; F132-H136 AromaticContact CD1-CD2 3.42Å; F132-H136 VanDerWaalsContact CD1-CD2 3.42Å; F132-H136 WeakPolarHBondContact CD1-CD2 3.34Å; F132-H136 AromaticContact CD1-CG 3.8Å; F132-H136 AromaticContact CD1-NE2 3.77Å; F132-H136 HydrophobicContact CD2-CB 4.2Å; F132-H136 AromaticContact CE1-CD2 3.65Å; F132-H136 HydrophobicContact CG-CB 3.94Å; F132-H136 AromaticContact CG-CD2 3.96Å; F132-H136 AromaticContact CG-CG 3.91Å; G133-H136 PolarHBondContact N-ND1 3.28Å; G133-H136 VanDerWaalsContact N-ND1 3.18Å; G133-H136 WeakPolarHBondContact O-CA 3.33Å; G133-H136 WeakPolarHBondContact O-CB 3.47Å; G133-H136 PolarHBondContact O-N 2.77Å; L134-H136 PolarHBondContact O-N 2.9Å; H136-M138 VanDerWaalsContact C-N 3.31Å; H136-M138 PolarHBondContact O-N 3.05Å; H136-A139 PolarHBondContact O-N 3.39Å; H136-L140 HydrophobicContact CB-CD1 4.5Å; H136-L140 VanDerWaalsContact O-CB 3.27Å; H136-L140 WeakPolarHBondContact O-CB 3.2Å; H136-L140 PolarHBondContact O-N 2.96Å
137	L	98.1	Very high	97.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-57.9	-44.5	172.7	175.3	65.8	0	0	0	111.3	P95 V97 F121 W125 G133 L134 G141 L142	P95-L137 HydrophobicContact CB-CD2 3.87Å; P95-L137 HydrophobicContact CG-CD2 3.98Å; V97-L137 HydrophobicContact CG2-CD1 4.1Å; V97-L137 HydrophobicContact CG2-CD2 3.61Å; V97-L137 HydrophobicContact CG2-CG 3.83Å; F121-L137 HydrophobicContact CE1-CD1 4.19Å; F121-L137 HydrophobicContact CE2-CD1 4.45Å; F121-L137 HydrophobicContact CZ-CD1 3.61Å; W125-L137 HydrophobicContact CZ3-CB 4.05Å; G133-L137 PolarHBondContact O-N 2.8Å; L134-L137 HydrophobicContact CD2-CD2 4.45Å; L134-L137 WeakPolarHBondContact O-CB 3.23Å; L134-L137 PolarHBondContact O-N 3.44Å; L134-L137 VanDerWaalsContact O-N 3.14Å; L137-G141 WeakPolarHBondContact O-CA 3.44Å; L137-G141 PolarHBondContact O-N 2.92Å; L137-L142 PolarHBondContact O-N 3.36Å
138	M	97.8	Very high	97.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	I	π-helix	trans	-63.9	-48.8	177.5	-62.9	-53.8	-78	0	0	111.1	F42 W53 F54 L56 L134 A135 H136 L142 A143	F42-M138 HydrophobicContact CE1-CB 4.49Å; W53-M138 HydrophobicContact CH2-CB 3.78Å; W53-M138 HydrophobicContact CH2-CE 3.9Å; W53-M138 VanDerWaalsContact CH2-O 3.31Å; W53-M138 WeakPolarHBondContact CH2-O 3.32Å; W53-M138 HydrophobicContact CZ2-CB 3.94Å; W53-M138 HydrophobicContact CZ3-CE 4.09Å; F54-M138 HydrophobicContact CB-CE 4.16Å; F54-M138 HydrophobicContact CD2-CE 3.86Å; F54-M138 HydrophobicContact CE2-CE 4.44Å; F54-M138 HydrophobicContact CE2-CG 4.29Å; F54-M138 HydrophobicContact CG-CE 3.97Å; F54-M138 HydrophobicContact CZ-CB 4.44Å; F54-M138 HydrophobicContact CZ-CG 4.49Å; L56-M138 HydrophobicContact CD1-CE 3.9Å; L56-M138 HydrophobicContact CD1-CG 3.91Å; L56-M138 HydrophobicContact CD1-SD 3.81Å; L56-M138 HydrophobicContact CG-CE 4.36Å; L134-M138 VanDerWaalsContact O-CG 3.32Å; L134-M138 WeakPolarHBondContact O-CG 3.49Å; L134-M138 PolarHBondContact O-N 2.89Å; A135-M138 PolarHBondContact O-N 3.25Å; H136-M138 VanDerWaalsContact C-N 3.31Å; H136-M138 PolarHBondContact O-N 3.05Å; M138-L142 HydrophobicContact CE-CD2 3.4Å; M138-L142 PolarHBondContact O-N 3.47Å; M138-L142 HydrophobicContact SD-CB 4.46Å; M138-L142 HydrophobicContact SD-CD2 4Å; M138-A143 WeakPolarHBondContact O-CB 3.39Å; M138-A143 PolarHBondContact O-N 3.05Å
139	A	96.4	Very high	97.1	Very high	10 Å²	10	24.4 Å²	24.4	8%	0.083	14%	0.14	C	C	.	.	I	π-helix	trans	-71.2	-38	-175.9	0	0	0	0	0	114.5	V10 I13 F42 A135 H136 P144	V10-A139 HydrophobicContact CG2-CB 4Å; I13-A139 HydrophobicContact CD1-CB 3.74Å; F42-A139 HydrophobicContact CE1-CB 3.87Å; F42-A139 HydrophobicContact CE2-CB 4.4Å; F42-A139 HydrophobicContact CZ-CB 3.65Å; A135-A139 WeakPolarHBondContact O-CB 3.32Å; A135-A139 PolarHBondContact O-N 3.35Å; H136-A139 PolarHBondContact O-N 3.39Å; A139-P144 WeakPolarHBondContact O-CD 3.48Å
140	L	96.1	Very high	97.1	Very high	29 Å²	29	23 Å²	23	15%	0.152	13%	0.132	C	C	.	.	I	π-helix	trans	-102.9	-17.3	-173.4	-67.4	169.3	0	0	0	113.7	T6 V10 F121 L124 F132 H136	T6-L140 HydrophobicContact CG2-CD2 4.08Å; V10-L140 HydrophobicContact CG1-CD1 4.05Å; V10-L140 HydrophobicContact CG1-CD2 4.4Å; V10-L140 HydrophobicContact CG1-CG 4.31Å; V10-L140 HydrophobicContact CG2-CD1 4.46Å; V10-L140 HydrophobicContact CG2-CD2 3.61Å; V10-L140 HydrophobicContact CG2-CG 3.82Å; F121-L140 HydrophobicContact CD2-CB 4.44Å; F121-L140 HydrophobicContact CE2-CB 4.06Å; L124-L140 HydrophobicContact CD2-CD1 4.04Å; L124-L140 HydrophobicContact CD2-CD2 4.4Å; F132-L140 HydrophobicContact CD2-CD1 4.31Å; F132-L140 HydrophobicContact CE2-CD1 3.57Å; F132-L140 HydrophobicContact CZ-CD1 3.92Å; H136-L140 HydrophobicContact CB-CD1 4.5Å; H136-L140 VanDerWaalsContact O-CB 3.27Å; H136-L140 WeakPolarHBondContact O-CB 3.2Å; H136-L140 PolarHBondContact O-N 2.96Å
141	G	95.8	Very high	97	Very high	3 Å²	3	23.2 Å²	23.2	3%	0.031	13%	0.133	C	C	.	.	I	π-helix	trans	-106.9	-70.8	-179.4	0	0	0	0	0	111.7	L117 L137 W145	L117-G141 VanDerWaalsContact CD2-CA 3.49Å; L137-G141 WeakPolarHBondContact O-CA 3.44Å; L137-G141 PolarHBondContact O-N 2.92Å; G141-W145 WeakPolarHBondContact O-CB 3.38Å; G141-W145 PolarHBondContact O-N 3.2Å
142	L	97.2	Very high	97	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	12%	0.124	C	C	.	.	I	π-helix	trans	-69.4	-45.5	-172.4	-178.3	58.6	0	0	0	113	W53 C69 V82 V97 V99 I115 L137 M138 W145 L146	W53-L142 HydrophobicContact CH2-CB 4.4Å; W53-L142 HydrophobicContact CH2-CD2 4.43Å; W53-L142 HydrophobicContact CH2-CG 4.45Å; W53-L142 HydrophobicContact CZ3-CD2 4.06Å; W53-L142 HydrophobicContact CZ3-CG 4.17Å; C69-L142 HydrophobicContact CB-CD2 4.37Å; V82-L142 HydrophobicContact CG1-CD2 4Å; V97-L142 HydrophobicContact CG1-CD1 4.25Å; V97-L142 HydrophobicContact CG1-CD2 4.08Å; V99-L142 HydrophobicContact CG2-CD1 4.18Å; I115-L142 HydrophobicContact CD1-CB 4.34Å; I115-L142 HydrophobicContact CD1-CD1 3.83Å; L137-L142 PolarHBondContact O-N 3.36Å; M138-L142 HydrophobicContact CE-CD2 3.4Å; M138-L142 PolarHBondContact O-N 3.47Å; M138-L142 HydrophobicContact SD-CB 4.46Å; M138-L142 HydrophobicContact SD-CD2 4Å; L142-W145 HydrophobicContact CD1-CE3 4.41Å; L142-W145 WeakPolarHBondContact O-CB 3.45Å; L142-W145 PolarHBondContact O-N 2.86Å; L142-L146 HydrophobicContact CD1-CD1 4.17Å; L142-L146 HydrophobicContact CD1-CD2 4.28Å; L142-L146 HydrophobicContact CD1-CG 3.92Å; L142-L146 HydrophobicContact CG-CD1 3.91Å; L142-L146 HydrophobicContact CG-CG 4.16Å; L142-L146 WeakPolarHBondContact O-CG 3.47Å; L142-L146 PolarHBondContact O-N 2.74Å
143	A	95.9	Very high	96.9	Very high	28 Å²	28	18.8 Å²	18.8	23%	0.231	12%	0.12	C	C	.	.	H	α-helix	trans	-60.4	-48.3	-177.3	0	0	0	0	0	113.3	W53 M138 W145 L146 A147	W53-A143 HydrophobicContact CH2-CB 3.84Å; W53-A143 HydrophobicContact CZ2-CB 3.8Å; W53-A143 HydrophobicContact CZ3-CB 4.38Å; M138-A143 WeakPolarHBondContact O-CB 3.39Å; M138-A143 PolarHBondContact O-N 3.05Å; A143-W145 VanDerWaalsContact C-N 3.3Å; A143-W145 PolarHBondContact O-N 2.82Å; A143-L146 PolarHBondContact O-N 3.17Å; A143-A147 PolarHBondContact O-N 3.36Å
144	P	94.9	Very high	96.8	Very high	52 Å²	52	20.1 Å²	20.1	34%	0.338	13%	0.127	S	C	.	.	H	α-helix	trans	-62.7	-35.2	174.4	-25	35.5	0	0	0	113.2	A139 A147 V148	A139-P144 WeakPolarHBondContact O-CD 3.48Å; P144-A147 PolarHBondContact O-N 3.45Å; P144-V148 WeakPolarHBondContact O-CG2 3.45Å; P144-V148 PolarHBondContact O-N 2.87Å
145	W	96.6	Very high	96.7	Very high	16 Å²	16	24.6 Å²	24.6	6%	0.061	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-45.9	175.8	-173.9	95	0	0	0	111.1	L102 T106 K108 M109 I115 G141 L142 A143 A147 V148 E149 I150	L102-W145 HydrophobicContact CD1-CH2 3.73Å; L102-W145 HydrophobicContact CD1-CZ3 3.8Å; T106-W145 HydrophobicContact CG2-CH2 4.22Å; T106-W145 HydrophobicContact CG2-CZ2 3.83Å; K108-W145 PolarHBondContact O-NE1 2.96Å; M109-W145 HydrophobicContact CE-CH2 3.45Å; M109-W145 VanDerWaalsContact CE-CH2 3.45Å; M109-W145 HydrophobicContact CE-CZ2 3.53Å; I115-W145 HydrophobicContact CB-CD2 3.97Å; I115-W145 HydrophobicContact CB-CG 4.14Å; I115-W145 HydrophobicContact CB-CZ2 4.25Å; I115-W145 HydrophobicContact CD1-CB 4.29Å; I115-W145 HydrophobicContact CD1-CG 4.22Å; I115-W145 HydrophobicContact CG2-CD2 3.83Å; I115-W145 HydrophobicContact CG2-CE3 4Å; I115-W145 HydrophobicContact CG2-CG 4.46Å; I115-W145 HydrophobicContact CG2-CH2 4.09Å; I115-W145 HydrophobicContact CG2-CZ2 3.87Å; I115-W145 HydrophobicContact CG2-CZ3 4.13Å; G141-W145 WeakPolarHBondContact O-CB 3.38Å; G141-W145 PolarHBondContact O-N 3.2Å; L142-W145 HydrophobicContact CD1-CE3 4.41Å; L142-W145 WeakPolarHBondContact O-CB 3.45Å; L142-W145 PolarHBondContact O-N 2.86Å; A143-W145 VanDerWaalsContact C-N 3.3Å; A143-W145 PolarHBondContact O-N 2.82Å; W145-A147 VanDerWaalsContact C-N 3.32Å; W145-A147 PolarHBondContact O-N 2.86Å; W145-V148 PolarHBondContact O-N 3.32Å; W145-E149 HydrophobicContact CD2-CB 4.2Å; W145-E149 HydrophobicContact CD2-CG 3.83Å; W145-E149 HydrophobicContact CE3-CB 4.2Å; W145-E149 HydrophobicContact CE3-CG 4.34Å; W145-E149 HydrophobicContact CG-CG 4.22Å; W145-E149 HydrophobicContact CH2-CB 3.98Å; W145-E149 HydrophobicContact CH2-CG 4.28Å; W145-E149 HydrophobicContact CZ2-CB 4.02Å; W145-E149 HydrophobicContact CZ2-CG 3.8Å; W145-E149 HydrophobicContact CZ3-CB 4.08Å; W145-E149 WeakPolarHBondContact O-CB 3.48Å; W145-E149 WeakPolarHBondContact O-CG 3.49Å; W145-E149 PolarHBondContact O-N 2.93Å; W145-I150 HydrophobicContact CZ3-CD1 4.5Å
146	L	97	Very high	96.5	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-60.2	-42.3	176.2	-69.6	170.8	0	0	0	111.7	W53 C69 F71 L142 A143 V148 I150	W53-L146 HydrophobicContact CE3-CD1 4.16Å; W53-L146 HydrophobicContact CZ3-CD1 3.94Å; C69-L146 HydrophobicContact CB-CD1 4.34Å; F71-L146 HydrophobicContact CD2-CB 4.09Å; L142-L146 HydrophobicContact CD1-CD1 4.17Å; L142-L146 HydrophobicContact CD1-CD2 4.28Å; L142-L146 HydrophobicContact CD1-CG 3.92Å; L142-L146 HydrophobicContact CG-CD1 3.91Å; L142-L146 HydrophobicContact CG-CG 4.16Å; L142-L146 WeakPolarHBondContact O-CG 3.47Å; L142-L146 PolarHBondContact O-N 2.74Å; A143-L146 PolarHBondContact O-N 3.17Å; L146-V148 PolarHBondContact O-N 2.88Å; L146-I150 HydrophobicContact CB-CG1 4.12Å; L146-I150 HydrophobicContact CD2-CD1 3.85Å; L146-I150 HydrophobicContact CD2-CG1 3.62Å; L146-I150 HydrophobicContact CG-CG1 4.49Å; L146-I150 VanDerWaalsContact O-CB 3.3Å; L146-I150 WeakPolarHBondContact O-CB 3.34Å; L146-I150 WeakPolarHBondContact O-CG1 3.19Å; L146-I150 PolarHBondContact O-N 2.81Å
147	A	95.1	Very high	96.4	Very high	54 Å²	54	32.3 Å²	32.3	45%	0.446	20%	0.204	S	C	.	.	H	α-helix	trans	-62.9	-24.8	-179.3	0	0	0	0	0	113.9	F71 A143 P144 W145	F71-A147 HydrophobicContact CE2-CB 4.23Å; A143-A147 PolarHBondContact O-N 3.36Å; P144-A147 PolarHBondContact O-N 3.45Å; W145-A147 VanDerWaalsContact C-N 3.32Å; W145-A147 PolarHBondContact O-N 2.86Å
148	V	95.4	Very high	96.2	Very high	96 Å²	96	36.8 Å²	36.8	58%	0.582	23%	0.225	S	C	*	.	H	α-helix	trans	-94.5	-48.7	177.2	176.1	0	0	0	0	111.2	P144 W145 L146	P144-V148 WeakPolarHBondContact O-CG2 3.45Å; P144-V148 PolarHBondContact O-N 2.87Å; W145-V148 PolarHBondContact O-N 3.32Å; L146-V148 PolarHBondContact O-N 2.88Å
149	E	97	Very high	96.1	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-83.9	-35.9	-167.1	-61.9	-63.3	133.8	0	0	112.8	T106 K108 W145 D152 L153	T106-E149 WeakPolarHBondContact CB-OE2 3.15Å; T106-E149 PolarHBondContact OG1-OE2 3.28Å; K108-E149 HydrophobicContact CB-CG 4.34Å; K108-E149 VanDerWaalsContact CG-OE1 3.3Å; K108-E149 WeakPolarHBondContact CG-OE1 3.47Å; W145-E149 HydrophobicContact CD2-CB 4.2Å; W145-E149 HydrophobicContact CD2-CG 3.83Å; W145-E149 HydrophobicContact CE3-CB 4.2Å; W145-E149 HydrophobicContact CE3-CG 4.34Å; W145-E149 HydrophobicContact CG-CG 4.22Å; W145-E149 HydrophobicContact CH2-CB 3.98Å; W145-E149 HydrophobicContact CH2-CG 4.28Å; W145-E149 HydrophobicContact CZ2-CB 4.02Å; W145-E149 HydrophobicContact CZ2-CG 3.8Å; W145-E149 HydrophobicContact CZ3-CB 4.08Å; W145-E149 WeakPolarHBondContact O-CB 3.48Å; W145-E149 WeakPolarHBondContact O-CG 3.49Å; W145-E149 PolarHBondContact O-N 2.93Å; E149-D152 PolarHBondContact O-N 3.16Å; E149-L153 WeakPolarHBondContact O-CB 3.25Å; E149-L153 WeakPolarHBondContact O-CG 3.28Å; E149-L153 PolarHBondContact O-N 3.18Å
150	I	97.3	Very high	95.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.6	-47	-177.5	-59.1	-53.5	0	0	0	112.1	F71 F80 L102 W145 L146 D152 L153 I154	F71-I150 HydrophobicContact CB-CG1 4.37Å; F71-I150 HydrophobicContact CB-CG2 4.21Å; F71-I150 HydrophobicContact CD1-CB 3.92Å; F71-I150 HydrophobicContact CD1-CG2 3.64Å; F71-I150 HydrophobicContact CE1-CB 4.38Å; F71-I150 HydrophobicContact CE1-CG2 4.37Å; F71-I150 HydrophobicContact CG-CB 4.22Å; F71-I150 HydrophobicContact CG-CG1 4.42Å; F71-I150 HydrophobicContact CG-CG2 4.16Å; F80-I150 HydrophobicContact CD2-CD1 4.31Å; F80-I150 HydrophobicContact CE1-CD1 4.41Å; F80-I150 HydrophobicContact CE2-CD1 3.54Å; F80-I150 HydrophobicContact CE2-CG1 4.02Å; F80-I150 HydrophobicContact CE2-CG2 4.34Å; F80-I150 HydrophobicContact CZ-CD1 3.59Å; F80-I150 HydrophobicContact CZ-CG1 4.39Å; F80-I150 HydrophobicContact CZ-CG2 4.28Å; L102-I150 HydrophobicContact CD1-CD1 3.68Å; W145-I150 HydrophobicContact CZ3-CD1 4.5Å; L146-I150 HydrophobicContact CB-CG1 4.12Å; L146-I150 HydrophobicContact CD2-CD1 3.85Å; L146-I150 HydrophobicContact CD2-CG1 3.62Å; L146-I150 HydrophobicContact CG-CG1 4.49Å; L146-I150 VanDerWaalsContact O-CB 3.3Å; L146-I150 WeakPolarHBondContact O-CB 3.34Å; L146-I150 WeakPolarHBondContact O-CG1 3.19Å; L146-I150 PolarHBondContact O-N 2.81Å; I150-D152 VanDerWaalsContact C-N 3.34Å; I150-D152 PolarHBondContact O-N 2.78Å; I150-L153 HydrophobicContact CD1-CD1 4.44Å; I150-L153 PolarHBondContact O-N 3.47Å; I150-I154 HydrophobicContact CG2-CD1 3.65Å; I150-I154 HydrophobicContact CG2-CG1 4.26Å; I150-I154 VanDerWaalsContact O-CG1 3.25Å; I150-I154 WeakPolarHBondContact O-CG1 3.41Å; I150-I154 PolarHBondContact O-N 3.49Å
151	P	96.9	Very high	95.6	Very high	32 Å²	32	42 Å²	42	21%	0.208	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-42.3	174.9	-26	36.4	0	0	0	113.3	F71 I154 S155	F71-P151 HydrophobicContact CE1-CG 3.96Å; F71-P151 HydrophobicContact CZ-CG 4.24Å; P151-I154 PolarHBondContact O-N 3.14Å; P151-S155 WeakPolarHBondContact O-CB 3.36Å; P151-S155 PolarHBondContact O-N 2.98Å
152	D	96.7	Very high	95	Very high	53 Å²	53	50.1 Å²	50.1	28%	0.283	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-45.8	177.3	175.2	78.8	0	0	0	111.4	E149 I150 I154 S155 K156	E149-D152 PolarHBondContact O-N 3.16Å; I150-D152 VanDerWaalsContact C-N 3.34Å; I150-D152 PolarHBondContact O-N 2.78Å; D152-I154 PolarHBondContact O-N 2.88Å; D152-S155 PolarHBondContact O-N 2.61Å; D152-S155 PolarHBondContact O-OG 3.16Å; D152-K156 WeakPolarHBondContact O-CG 3.44Å; D152-K156 PolarHBondContact O-N 3.02Å; D152-K156 WeakPolarHBondContact OD1-CE 3.48Å; D152-K156 IonicContact OD1-NZ 2.92Å; D152-K156 PolarHBondContact OD1-NZ 3.24Å; D152-K156 VanDerWaalsContact OD2-CE 3.32Å; D152-K156 WeakPolarHBondContact OD2-CE 3.27Å; D152-K156 IonicContact OD2-NZ 2.66Å; D152-K156 PolarHBondContact OD2-NZ 3.05Å
153	L	97.1	Very high	93.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-35.6	177.7	-70.2	175.4	0	0	0	113.4	L102 K105 E149 I150 G157 H158 V159	L102-L153 HydrophobicContact CD1-CD1 4.13Å; L102-L153 HydrophobicContact CD2-CD1 4.06Å; K105-L153 HydrophobicContact CB-CD2 3.85Å; K105-L153 WeakPolarHBondContact O-CD2 3.44Å; E149-L153 WeakPolarHBondContact O-CB 3.25Å; E149-L153 WeakPolarHBondContact O-CG 3.28Å; E149-L153 PolarHBondContact O-N 3.18Å; I150-L153 HydrophobicContact CD1-CD1 4.44Å; I150-L153 PolarHBondContact O-N 3.47Å; L153-G157 PolarHBondContact O-N 3.02Å; L153-H158 HydrophobicContact CD2-CB 4.04Å; L153-H158 PolarHBondContact O-N 2.93Å; L153-V159 HydrophobicContact CB-CB 4.22Å; L153-V159 HydrophobicContact CB-CG2 3.76Å; L153-V159 HydrophobicContact CD1-CG2 4.16Å; L153-V159 PolarHBondContact O-N 3.35Å
154	I	96.7	Very high	91.7	Very high	27 Å²	27	63.8 Å²	63.8	14%	0.138	35%	0.345	C	S	.	.	H	α-helix	trans	-65.9	-47.9	173.1	-69	164.1	0	0	0	109.6	H73 Y78 I150 P151 D152 K156 G157 V159	H73-I154 HydrophobicContact CB-CD1 3.8Å; Y78-I154 HydrophobicContact CD1-CD1 4.21Å; Y78-I154 HydrophobicContact CD1-CG1 4.39Å; Y78-I154 HydrophobicContact CD2-CD1 3.82Å; Y78-I154 HydrophobicContact CE1-CD1 3.85Å; Y78-I154 HydrophobicContact CE1-CG1 3.91Å; Y78-I154 HydrophobicContact CE2-CD1 3.47Å; Y78-I154 VanDerWaalsContact CE2-CD1 3.47Å; Y78-I154 HydrophobicContact CE2-CG1 4.4Å; Y78-I154 HydrophobicContact CG-CD1 4.18Å; Y78-I154 VanDerWaalsContact CZ-CD1 3.47Å; I150-I154 HydrophobicContact CG2-CD1 3.65Å; I150-I154 HydrophobicContact CG2-CG1 4.26Å; I150-I154 VanDerWaalsContact O-CG1 3.25Å; I150-I154 WeakPolarHBondContact O-CG1 3.41Å; I150-I154 PolarHBondContact O-N 3.49Å; P151-I154 PolarHBondContact O-N 3.14Å; D152-I154 PolarHBondContact O-N 2.88Å; I154-K156 PolarHBondContact O-N 3.34Å; I154-G157 PolarHBondContact O-N 3.29Å; I154-V159 HydrophobicContact CG1-CB 4.14Å; I154-V159 HydrophobicContact CG1-CG1 4Å
155	S	95.6	Very high	89.4	Confident	95 Å²	95	66 Å²	66	66%	0.664	36%	0.359	S	S	*	.	H	α-helix	trans	-60.7	-33	-179.5	78.4	0	0	0	0	112.9	P151 D152 G157	P151-S155 WeakPolarHBondContact O-CB 3.36Å; P151-S155 PolarHBondContact O-N 2.98Å; D152-S155 PolarHBondContact O-N 2.61Å; D152-S155 PolarHBondContact O-OG 3.16Å; S155-G157 VanDerWaalsContact C-N 3.3Å
156	K	95.6	Very high	86.9	Confident	117 Å²	117	76.5 Å²	76.5	51%	0.509	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.1	175.5	-69.1	171.2	-178.7	165.5	0	113.7	D152 I154 H158	D152-K156 WeakPolarHBondContact O-CG 3.44Å; D152-K156 PolarHBondContact O-N 3.02Å; D152-K156 WeakPolarHBondContact OD1-CE 3.48Å; D152-K156 IonicContact OD1-NZ 2.92Å; D152-K156 PolarHBondContact OD1-NZ 3.24Å; D152-K156 VanDerWaalsContact OD2-CE 3.32Å; D152-K156 WeakPolarHBondContact OD2-CE 3.27Å; D152-K156 IonicContact OD2-NZ 2.66Å; D152-K156 PolarHBondContact OD2-NZ 3.05Å; I154-K156 PolarHBondContact O-N 3.34Å; K156-H158 VanDerWaalsContact C-N 3.25Å; K156-H158 PolarHBondContact O-N 3Å
157	G	94.9	Very high	84.7	Confident	45 Å²	45	83.5 Å²	83.5	46%	0.464	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	15.7	-177.2	0	0	0	0	0	114.6	L153 I154 S155	L153-G157 PolarHBondContact O-N 3.02Å; I154-G157 PolarHBondContact O-N 3.29Å; S155-G157 VanDerWaalsContact C-N 3.3Å
158	H	94.8	Very high	82.5	Confident	94 Å²	94	87.5 Å²	87.5	44%	0.435	46%	0.455	S	S	.	.	S	Bend	trans	-81.8	-22.6	177.5	-65.6	-29.5	0	0	0	112.9	K105 L153 K156	K105-H158 HydrophobicContact CB-CB 4.26Å; K105-H158 HydrophobicContact CD-CB 4.24Å; K105-H158 HydrophobicContact CG-CB 4.48Å; K105-H158 PolarHBondContact NZ-O 2.94Å; L153-H158 HydrophobicContact CD2-CB 4.04Å; L153-H158 PolarHBondContact O-N 2.93Å; K156-H158 VanDerWaalsContact C-N 3.25Å; K156-H158 PolarHBondContact O-N 3Å
159	V	94.9	Very high	79.9	Confident	13 Å²	13	87.4 Å²	87.4	8%	0.079	46%	0.464	C	S	.	.	S	Bend	trans	-117.9	122.3	170.1	170.2	0	0	0	0	107.6	Y78 F80 L102 L153 I154	Y78-V159 HydrophobicContact CD1-CG1 3.47Å; Y78-V159 VanDerWaalsContact CD1-CG1 3.47Å; Y78-V159 HydrophobicContact CE1-CG1 3.92Å; Y78-V159 HydrophobicContact CG-CG1 4.36Å; F80-V159 HydrophobicContact CE1-CG1 4.09Å; F80-V159 HydrophobicContact CE1-CG2 4.22Å; F80-V159 HydrophobicContact CZ-CG1 3.97Å; F80-V159 HydrophobicContact CZ-CG2 4.47Å; L102-V159 HydrophobicContact CD2-CG2 3.61Å; L153-V159 HydrophobicContact CB-CB 4.22Å; L153-V159 HydrophobicContact CB-CG2 3.76Å; L153-V159 HydrophobicContact CD1-CG2 4.16Å; L153-V159 PolarHBondContact O-N 3.35Å; I154-V159 HydrophobicContact CG1-CB 4.14Å; I154-V159 HydrophobicContact CG1-CG1 4Å
160	V	91.9	Very high	77	Confident	99 Å²	99	99 Å²	99	60%	0.6	52%	0.519	S	S	*	.			trans	-120.9	135.6	178.7	-175.7	0	0	0	0	108
161	H	91.4	Very high	76	Confident	37 Å²	37	104 Å²	104	17%	0.171	55%	0.545	C	S	.	.			trans	-63.6	140.2	177.6	-169.5	-100.4	0	0	0	110.3	L76 R77 Y78 E163	L76-H161 HydrophobicContact CD1-CB 4.13Å; R77-H161 PolarHBondContact O-CD2 2.89Å; R77-H161 PolarHBondContact O-NE2 2.81Å; R77-H161 VanDerWaalsContact O-NE2 3.16Å; Y78-H161 HydrophobicContact CD1-CB 4.43Å; Y78-H161 HydrophobicContact CE1-CB 3.74Å; H161-E163 PolarHBondContact ND1-N 2.86Å; H161-E163 PolarHBondContact ND1-O 3.04Å; H161-E163 PolarHBondContact O-N 2.93Å
162	K	81.1	Confident	74.9	Confident	174 Å²	174	107.8 Å²	107.8	76%	0.757	56%	0.562	S	S	*	*	S	Bend	trans	-62.9	-27.2	-175.4	-69.2	-179.8	-178.9	171.1	0	112.8
163	E	67.8	Low	73.7	Confident	148 Å²	148	110.8 Å²	110.8	69%	0.692	58%	0.578	S	S	*	*	S	Bend	trans	-113.5	105.7	174.2	-63.2	178.8	174.2	0	0	108.5	H161	H161-E163 PolarHBondContact ND1-N 2.86Å; H161-E163 PolarHBondContact ND1-O 3.04Å; H161-E163 PolarHBondContact O-N 2.93Å
164	K	56.4	Low	72.3	Confident	166 Å²	166	117.4 Å²	117.4	72%	0.722	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-65.5	135.3	162.1	-84.2	-174.9	172.5	-173	0	107.7	R166	K164-R166 PolarHBondContact O-N 3.23Å
165	P	46.5	Very low	70.8	Confident	98 Å²	98	123 Å²	123	64%	0.636	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-53.4	133.9	159.9	-15.1	28	0	0	0	107.2	D167	P165-D167 PolarHBondContact O-N 2.93Å; P165-D167 VanDerWaalsContact O-N 3.12Å
166	R	45.9	Very low	69.2	Low	238 Å²	238	124.9 Å²	124.9	90%	0.898	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-51.2	124.1	166.7	-81.2	176.6	175.1	165.3	-1.6	106.7	K164 V168	K164-R166 PolarHBondContact O-N 3.23Å; R166-V168 PolarHBondContact O-N 3.09Å
167	D	49.1	Very low	67.3	Low	150 Å²	150	125.4 Å²	125.4	80%	0.802	65%	0.649	S	S	*	*			trans	-49.9	112.3	167.8	-67.7	-48.4	0	0	0	106.8	P165 A169	P165-D167 PolarHBondContact O-N 2.93Å; P165-D167 VanDerWaalsContact O-N 3.12Å; D167-A169 PolarHBondContact O-N 3.08Å
168	V	48.9	Very low	65.1	Low	137 Å²	137	131.6 Å²	131.6	83%	0.83	66%	0.664	S	S	*	*			trans	-72.6	93.3	167.6	-174.5	0	0	0	0	103.7	R166 E170	R166-V168 PolarHBondContact O-N 3.09Å; V168-E170 PolarHBondContact O-N 3.25Å; V168-E170 VanDerWaalsContact O-N 3.12Å
169	A	41.6	Very low	62.7	Low	94 Å²	94	134.8 Å²	134.8	78%	0.777	68%	0.683	S	S	*	*			trans	-60.6	111.5	170.2	0	0	0	0	0	107.8	D167	D167-A169 PolarHBondContact O-N 3.08Å
170	E	36.6	Very low	59.7	Low	263 Å²	263	145.8 Å²	145.8	100%	1.229	74%	0.738	S	S	*	*			trans	-75.7	0	156.7	-79.4	-173.7	146.6	0	0	110.3	V168	V168-E170 PolarHBondContact O-N 3.25Å; V168-E170 VanDerWaalsContact O-N 3.12Å

Retrieved 170 of 170 residues in 271.7 ms (Link to these results)

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