TNR12_HUMAN Loading...

Tumor necrosis factor receptor superfamily member 12A

Receptor for TNFSF12/TWEAK. Weak inducer of apoptosis in some cell types. Promotes angiogenesis and the proliferation of endothelial cells. May modulate cellular adhesion to matrix proteins.

AlphaFold DB , UniProt , Accession Q9NP84, Species HUMAN (Homo sapiens, Human), Gene TNFRSF12A, Length 129 aa.

						>TNR12_HUMAN|Q9NP84|TNFRSF12A
MARGSLRRLLRLLVLGLWLALLRSVAGEQAPGTAPCSRGSSWSADLDKCMDCASCRARPHSDFCLGCAAAPPAPFRLLWPILGGALSLTFVLGLLSGFLVWRRCRRREKFTTPIEETGGEGCPAVALIQ
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46	Very low	71	Confident	230 Å²	230	115.9 Å²	115.9	100%	1.133	55%	0.545	S	S	*	.				0	-32.9	0	-55.1	-172	-140.2	0	0	114.7	R3 G4	M1-R3 PolarHBondContact O-N 3.08Å; M1-G4 PolarHBondContact O-N 3.4Å
2	A	57.1	Low	72.3	Confident	36 Å²	36	116.5 Å²	116.5	30%	0.298	55%	0.553	S	S	.	*	H	α-helix	trans	-62	-39.2	-175.5	0	0	0	0	0	116.9	G4 L6 R105	A2-G4 VanDerWaalsContact C-N 3.27Å; A2-G4 PolarHBondContact O-N 3.11Å; A2-L6 PolarHBondContact O-N 2.84Å; A2-R105 VanDerWaalsContact CA-NH1 3.26Å
3	R	57.3	Low	73.3	Confident	214 Å²	214	112.6 Å²	112.6	81%	0.808	54%	0.537	S	S	*	.	H	α-helix	trans	-64.7	-30.5	-177.6	-66.8	-178.7	-177.9	163	0.2	112.7	M1 R7	M1-R3 PolarHBondContact O-N 3.08Å; R3-R7 PolarHBondContact O-N 3.49Å; R3-R7 VanDerWaalsContact O-N 3.13Å
4	G	67.9	Low	74.2	Confident	41 Å²	41	110.7 Å²	110.7	42%	0.423	54%	0.536	S	S	.	.	H	α-helix	trans	-69.8	-48	-179.2	0	0	0	0	0	112.8	M1 A2 L6 R7 R8	M1-G4 PolarHBondContact O-N 3.4Å; A2-G4 VanDerWaalsContact C-N 3.27Å; A2-G4 PolarHBondContact O-N 3.11Å; G4-L6 PolarHBondContact O-N 3.37Å; G4-R7 PolarHBondContact O-N 3.23Å; G4-R8 WeakPolarHBondContact O-CG 2.83Å; G4-R8 PolarHBondContact O-N 2.87Å
5	S	71.7	Confident	75.2	Confident	60 Å²	60	110.1 Å²	110.1	42%	0.42	54%	0.536	S	S	.	.	H	α-helix	trans	-58.4	-40.7	176.4	165.3	0	0	0	0	111.2	R8 L9	S5-R8 WeakPolarHBondContact O-CB 3.37Å; S5-R8 PolarHBondContact O-N 3.35Å; S5-L9 PolarHBondContact O-N 3.02Å
6	L	70.3	Confident	75.9	Confident	18 Å²	18	105.9 Å²	105.9	9%	0.094	53%	0.53	C	S	.	.	H	α-helix	trans	-67.7	-41.9	-179.6	-155.3	67	0	0	0	114.3	A2 G4 R8 L9 L10 F98 W101 R102	A2-L6 PolarHBondContact O-N 2.84Å; G4-L6 PolarHBondContact O-N 3.37Å; L6-R8 VanDerWaalsContact C-N 3.25Å; L6-R8 PolarHBondContact O-N 3.39Å; L6-L9 PolarHBondContact O-N 3.4Å; L6-L10 WeakPolarHBondContact O-CB 3.07Å; L6-L10 PolarHBondContact O-N 2.03Å; L6-F98 HydrophobicContact CD1-CD2 3.43Å; L6-F98 VanDerWaalsContact CD1-CD2 3.43Å; L6-F98 HydrophobicContact CD1-CE1 4.42Å; L6-F98 HydrophobicContact CD1-CE2 2.89Å; L6-F98 HydrophobicContact CD1-CG 4.43Å; L6-F98 HydrophobicContact CD1-CZ 3.47Å; L6-F98 VanDerWaalsContact CD1-CZ 3.47Å; L6-F98 HydrophobicContact CD2-CE1 4.16Å; L6-F98 HydrophobicContact CD2-CE2 3.79Å; L6-F98 HydrophobicContact CD2-CZ 3.38Å; L6-F98 HydrophobicContact CG-CD2 4.26Å; L6-F98 HydrophobicContact CG-CE1 4.5Å; L6-F98 HydrophobicContact CG-CE2 3.25Å; L6-F98 HydrophobicContact CG-CZ 3.39Å; L6-W101 HydrophobicContact CD1-CE3 3.91Å; L6-W101 HydrophobicContact CD1-CH2 3.89Å; L6-W101 HydrophobicContact CD1-CZ3 3.22Å; L6-W101 HydrophobicContact CD2-CZ3 4.39Å; L6-W101 HydrophobicContact CG-CZ3 4.28Å; L6-R102 HydrophobicContact CD2-CG 4.31Å; L6-R102 VanDerWaalsContact CD2-CZ 3.49Å
7	R	80.9	Confident	76.5	Confident	164 Å²	164	106.2 Å²	106.2	62%	0.619	53%	0.533	S	S	*	.	H	α-helix	trans	-65	-34.1	175.5	-164.4	178.2	-173.5	-154.7	3.3	110.7	R3 G4 R11	R3-R7 PolarHBondContact O-N 3.49Å; R3-R7 VanDerWaalsContact O-N 3.13Å; G4-R7 PolarHBondContact O-N 3.23Å; R7-R11 WeakPolarHBondContact O-CB 3.4Å; R7-R11 WeakPolarHBondContact O-CG 3.49Å; R7-R11 PolarHBondContact O-N 3.28Å; R7-R11 VanDerWaalsContact O-N 3.08Å
8	R	82.5	Confident	77	Confident	187 Å²	187	109.4 Å²	109.4	71%	0.706	54%	0.538	S	S	*	.	H	α-helix	trans	-65.6	-46.8	172.1	-72.9	-178.7	-174.7	-154.7	0.9	111.4	G4 S5 L6 R11 L12	G4-R8 WeakPolarHBondContact O-CG 2.83Å; G4-R8 PolarHBondContact O-N 2.87Å; S5-R8 WeakPolarHBondContact O-CB 3.37Å; S5-R8 PolarHBondContact O-N 3.35Å; L6-R8 VanDerWaalsContact C-N 3.25Å; L6-R8 PolarHBondContact O-N 3.39Å; R8-R11 WeakPolarHBondContact O-CB 3.39Å; R8-R11 PolarHBondContact O-N 2.86Å; R8-L12 WeakPolarHBondContact O-CG 2.96Å; R8-L12 PolarHBondContact O-N 3.36Å
9	L	78.6	Confident	77.5	Confident	83 Å²	83	107.8 Å²	107.8	44%	0.435	53%	0.531	S	S	.	.	H	α-helix	trans	-64.5	-44.3	-178	-140.3	140.5	0	0	0	111.9	S5 L6 R11 L12 L13	S5-L9 PolarHBondContact O-N 3.02Å; L6-L9 PolarHBondContact O-N 3.4Å; L9-R11 VanDerWaalsContact C-N 3.35Å; L9-R11 PolarHBondContact O-N 3.05Å; L9-L12 PolarHBondContact O-N 3.18Å; L9-L13 HydrophobicContact CD2-CD1 4.29Å; L9-L13 WeakPolarHBondContact O-CG 3.3Å; L9-L13 PolarHBondContact O-N 3.5Å
10	L	81.7	Confident	77.7	Confident	100 Å²	100	105.3 Å²	105.3	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-60.5	-43.8	173.2	-171.2	78.9	0	0	0	111.5	L6 L12 L13 V14	L6-L10 WeakPolarHBondContact O-CB 3.07Å; L6-L10 PolarHBondContact O-N 2.03Å; L10-L12 PolarHBondContact O-N 3.08Å; L10-L13 PolarHBondContact O-N 2.92Å; L10-V14 VanDerWaalsContact O-CG2 3.31Å; L10-V14 WeakPolarHBondContact O-CG2 3.33Å; L10-V14 PolarHBondContact O-N 3.38Å
11	R	86.9	Confident	77.9	Confident	142 Å²	142	105.4 Å²	105.4	54%	0.536	53%	0.53	S	S	.	.	H	α-helix	trans	-61.1	-43.2	176.8	-81	174.6	175.1	-168.4	-4	111.9	R7 R8 L9 V14 L15	R7-R11 WeakPolarHBondContact O-CB 3.4Å; R7-R11 WeakPolarHBondContact O-CG 3.49Å; R7-R11 PolarHBondContact O-N 3.28Å; R7-R11 VanDerWaalsContact O-N 3.08Å; R8-R11 WeakPolarHBondContact O-CB 3.39Å; R8-R11 PolarHBondContact O-N 2.86Å; L9-R11 VanDerWaalsContact C-N 3.35Å; L9-R11 PolarHBondContact O-N 3.05Å; R11-V14 PolarHBondContact O-N 2.9Å; R11-L15 WeakPolarHBondContact O-CB 3.47Å; R11-L15 WeakPolarHBondContact O-CD1 3.48Å; R11-L15 PolarHBondContact O-N 3.08Å
12	L	86.3	Confident	79.4	Confident	123 Å²	123	98.2 Å²	98.2	64%	0.644	50%	0.496	S	S	*	.	H	α-helix	trans	-63.7	-41.1	178	-71.2	171.1	0	0	0	111.8	R8 L9 L10 L15 G16	R8-L12 WeakPolarHBondContact O-CG 2.96Å; R8-L12 PolarHBondContact O-N 3.36Å; L9-L12 PolarHBondContact O-N 3.18Å; L10-L12 PolarHBondContact O-N 3.08Å; L12-L15 PolarHBondContact O-N 2.96Å; L12-G16 PolarHBondContact O-N 2.85Å
13	L	86.3	Confident	80.4	Confident	66 Å²	66	105.2 Å²	105.2	35%	0.346	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-45.1	175.3	-72.3	174.6	0	0	0	112.1	L9 L10 G16 L17 L94	L9-L13 HydrophobicContact CD2-CD1 4.29Å; L9-L13 WeakPolarHBondContact O-CG 3.3Å; L9-L13 PolarHBondContact O-N 3.5Å; L10-L13 PolarHBondContact O-N 2.92Å; L13-G16 PolarHBondContact O-N 3.39Å; L13-L17 WeakPolarHBondContact O-CB 3.39Å; L13-L17 PolarHBondContact O-N 2.87Å; L13-L94 HydrophobicContact CD1-CD1 3.99Å; L13-L94 HydrophobicContact CD2-CD1 3.39Å; L13-L94 HydrophobicContact CG-CD1 4.34Å
14	V	85.5	Confident	81	Confident	86 Å²	86	99 Å²	99	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-46.9	176.7	173.1	0	0	0	0	110.4	L10 R11 L17 W18	L10-V14 VanDerWaalsContact O-CG2 3.31Å; L10-V14 WeakPolarHBondContact O-CG2 3.33Å; L10-V14 PolarHBondContact O-N 3.38Å; R11-V14 PolarHBondContact O-N 2.9Å; V14-L17 PolarHBondContact O-N 3.39Å; V14-W18 WeakPolarHBondContact O-CB 3.43Å; V14-W18 PolarHBondContact O-N 3.31Å
15	L	89.2	Confident	81	Confident	101 Å²	101	102.9 Å²	102.9	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-61.1	-43.8	176.7	-99.1	137	0	0	0	112.4	R11 L12 W18 L19	R11-L15 WeakPolarHBondContact O-CB 3.47Å; R11-L15 WeakPolarHBondContact O-CD1 3.48Å; R11-L15 PolarHBondContact O-N 3.08Å; L12-L15 PolarHBondContact O-N 2.96Å; L15-W18 PolarHBondContact O-N 3.36Å; L15-L19 HydrophobicContact CD2-CD1 4.27Å; L15-L19 VanDerWaalsContact O-CD1 3.32Å; L15-L19 WeakPolarHBondContact O-CD1 3.21Å; L15-L19 PolarHBondContact O-N 3.15Å
16	G	85.9	Confident	80.7	Confident	43 Å²	43	103.1 Å²	103.1	44%	0.443	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-44.3	177.9	0	0	0	0	0	112	L12 L13 W18 L19 A20	L12-G16 PolarHBondContact O-N 2.85Å; L13-G16 PolarHBondContact O-N 3.39Å; G16-W18 VanDerWaalsContact C-N 3.35Å; G16-L19 PolarHBondContact O-N 2.87Å; G16-A20 WeakPolarHBondContact O-CB 3.19Å; G16-A20 PolarHBondContact O-N 2.96Å
17	L	86.2	Confident	79.8	Confident	112 Å²	112	105 Å²	105	59%	0.586	55%	0.548	S	S	*	.	H	α-helix	trans	-63.2	-42.8	175.2	-166.7	76.4	0	0	0	111.1	L13 V14 A20 L21	L13-L17 WeakPolarHBondContact O-CB 3.39Å; L13-L17 PolarHBondContact O-N 2.87Å; V14-L17 PolarHBondContact O-N 3.39Å; L17-A20 PolarHBondContact O-N 2.91Å; L17-L21 WeakPolarHBondContact O-CB 3.37Å; L17-L21 PolarHBondContact O-N 2.9Å
18	W	86	Confident	78.4	Confident	164 Å²	164	104.8 Å²	104.8	62%	0.621	55%	0.554	S	S	*	*	H	α-helix	trans	-62.2	-47.8	177.1	-139.3	82.3	0	0	0	111.1	V14 L15 G16 A20 L21 L22	V14-W18 WeakPolarHBondContact O-CB 3.43Å; V14-W18 PolarHBondContact O-N 3.31Å; L15-W18 PolarHBondContact O-N 3.36Å; G16-W18 VanDerWaalsContact C-N 3.35Å; W18-A20 PolarHBondContact O-N 2.9Å; W18-L21 WeakPolarHBondContact O-CB 3.49Å; W18-L21 PolarHBondContact O-N 3.43Å; W18-L22 HydrophobicContact CD2-CD1 3.67Å; W18-L22 HydrophobicContact CE3-CD1 3.19Å; W18-L22 HydrophobicContact CE3-CD2 3.99Å; W18-L22 HydrophobicContact CE3-CG 4.21Å; W18-L22 HydrophobicContact CG-CD1 4.47Å; W18-L22 HydrophobicContact CH2-CD1 3.73Å; W18-L22 HydrophobicContact CH2-CD2 4.26Å; W18-L22 HydrophobicContact CZ2-CD1 4.17Å; W18-L22 HydrophobicContact CZ3-CD1 3.23Å; W18-L22 HydrophobicContact CZ3-CD2 3.47Å; W18-L22 VanDerWaalsContact CZ3-CD2 3.47Å; W18-L22 HydrophobicContact CZ3-CG 3.98Å; W18-L22 WeakPolarHBondContact O-CD1 3.37Å; W18-L22 PolarHBondContact O-N 2.99Å
19	L	86.2	Confident	76.8	Confident	79 Å²	79	102.8 Å²	102.8	41%	0.414	55%	0.553	S	S	.	*	H	α-helix	trans	-62.1	-39.5	175.5	-100.3	91.2	0	0	0	112.9	L15 G16 L21 L22 R23	L15-L19 HydrophobicContact CD2-CD1 4.27Å; L15-L19 VanDerWaalsContact O-CD1 3.32Å; L15-L19 WeakPolarHBondContact O-CD1 3.21Å; L15-L19 PolarHBondContact O-N 3.15Å; G16-L19 PolarHBondContact O-N 2.87Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L19-L22 PolarHBondContact O-N 3.34Å; L19-R23 WeakPolarHBondContact O-CB 3.35Å; L19-R23 WeakPolarHBondContact O-CG 3.15Å; L19-R23 PolarHBondContact O-N 2.93Å
20	A	81.6	Confident	75	Confident	56 Å²	56	102.9 Å²	102.9	46%	0.463	57%	0.565	S	S	.	*	H	α-helix	trans	-64.2	-42.3	176.7	0	0	0	0	0	110.9	G16 L17 W18 R23 S24	G16-A20 WeakPolarHBondContact O-CB 3.19Å; G16-A20 PolarHBondContact O-N 2.96Å; L17-A20 PolarHBondContact O-N 2.91Å; W18-A20 PolarHBondContact O-N 2.9Å; A20-R23 PolarHBondContact O-N 3.4Å; A20-S24 PolarHBondContact O-N 2.95Å
21	L	81.8	Confident	73.3	Confident	108 Å²	108	103.7 Å²	103.7	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-63	-44.9	175.5	-154.3	78.1	0	0	0	110.9	L17 W18 L19 R23 S24 V25	L17-L21 WeakPolarHBondContact O-CB 3.37Å; L17-L21 PolarHBondContact O-N 2.9Å; W18-L21 WeakPolarHBondContact O-CB 3.49Å; W18-L21 PolarHBondContact O-N 3.43Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L21-R23 PolarHBondContact O-N 2.88Å; L21-S24 PolarHBondContact O-N 3.21Å; L21-S24 VanDerWaalsContact O-N 3.17Å; L21-S24 PolarHBondContact O-OG 2.9Å; L21-V25 PolarHBondContact O-N 3.39Å
22	L	78.7	Confident	71.4	Confident	79 Å²	79	99.6 Å²	99.6	41%	0.414	58%	0.579	S	S	.	*	H	α-helix	trans	-62.6	-41.8	176.2	-94.3	75.4	0	0	0	112	W18 L19 S24 V25 A26	W18-L22 HydrophobicContact CD2-CD1 3.67Å; W18-L22 HydrophobicContact CE3-CD1 3.19Å; W18-L22 HydrophobicContact CE3-CD2 3.99Å; W18-L22 HydrophobicContact CE3-CG 4.21Å; W18-L22 HydrophobicContact CG-CD1 4.47Å; W18-L22 HydrophobicContact CH2-CD1 3.73Å; W18-L22 HydrophobicContact CH2-CD2 4.26Å; W18-L22 HydrophobicContact CZ2-CD1 4.17Å; W18-L22 HydrophobicContact CZ3-CD1 3.23Å; W18-L22 HydrophobicContact CZ3-CD2 3.47Å; W18-L22 VanDerWaalsContact CZ3-CD2 3.47Å; W18-L22 HydrophobicContact CZ3-CG 3.98Å; W18-L22 WeakPolarHBondContact O-CD1 3.37Å; W18-L22 PolarHBondContact O-N 2.99Å; L19-L22 PolarHBondContact O-N 3.34Å; L22-S24 VanDerWaalsContact C-N 3.29Å; L22-S24 PolarHBondContact O-N 2.97Å; L22-V25 PolarHBondContact O-N 3.34Å; L22-A26 VanDerWaalsContact O-CB 3.28Å; L22-A26 WeakPolarHBondContact O-CB 3.09Å; L22-A26 PolarHBondContact O-N 3.4Å
23	R	76.9	Confident	69.5	Low	184 Å²	184	100.5 Å²	100.5	69%	0.694	59%	0.59	S	S	*	*	H	α-helix	trans	-62.7	-36.3	175.1	-81.3	-171.8	172.5	107.5	-1.9	112.4	L19 A20 L21 V25 A26 G27	L19-R23 WeakPolarHBondContact O-CB 3.35Å; L19-R23 WeakPolarHBondContact O-CG 3.15Å; L19-R23 PolarHBondContact O-N 2.93Å; A20-R23 PolarHBondContact O-N 3.4Å; L21-R23 PolarHBondContact O-N 2.88Å; R23-V25 VanDerWaalsContact C-N 3.32Å; R23-A26 PolarHBondContact O-N 3.45Å; R23-G27 PolarHBondContact O-N 2.91Å
24	S	69.3	Low	68.1	Low	84 Å²	84	100.7 Å²	100.7	59%	0.587	60%	0.6	S	S	*	*	H	α-helix	trans	-68.1	-33.3	176.7	72.7	0	0	0	0	112.6	A20 L21 L22	A20-S24 PolarHBondContact O-N 2.95Å; L21-S24 PolarHBondContact O-N 3.21Å; L21-S24 VanDerWaalsContact O-N 3.17Å; L21-S24 PolarHBondContact O-OG 2.9Å; L22-S24 VanDerWaalsContact C-N 3.29Å; L22-S24 PolarHBondContact O-N 2.97Å
25	V	68.9	Low	67.5	Low	121 Å²	121	101.1 Å²	101.1	73%	0.733	61%	0.605	S	S	*	*	H	α-helix	trans	-76.8	-38.4	175.3	170.9	0	0	0	0	111.4	L21 L22 R23 G27	L21-V25 PolarHBondContact O-N 3.39Å; L22-V25 PolarHBondContact O-N 3.34Å; R23-V25 VanDerWaalsContact C-N 3.32Å; V25-G27 PolarHBondContact O-N 3.23Å
26	A	65.2	Low	67	Low	65 Å²	65	97.2 Å²	97.2	54%	0.537	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	19.3	177.7	0	0	0	0	0	113.4	L22 R23 E28	L22-A26 VanDerWaalsContact O-CB 3.28Å; L22-A26 WeakPolarHBondContact O-CB 3.09Å; L22-A26 PolarHBondContact O-N 3.4Å; R23-A26 PolarHBondContact O-N 3.45Å; A26-E28 PolarHBondContact O-N 2.92Å
27	G	52.2	Low	66.8	Low	57 Å²	57	99.7 Å²	99.7	59%	0.588	60%	0.596	S	S	*	*			trans	-62.6	79.4	160.3	0	0	0	0	0	108.6	R23 V25 Q29	R23-G27 PolarHBondContact O-N 2.91Å; V25-G27 PolarHBondContact O-N 3.23Å; G27-Q29 PolarHBondContact O-N 3.44Å
28	E	50.4	Low	66.5	Low	161 Å²	161	104 Å²	104	75%	0.752	61%	0.605	S	S	*	*			trans	-49.6	108.4	-176.4	-162.5	73.4	-179.1	0	0	108.4	A26 A30	A26-E28 PolarHBondContact O-N 2.92Å; E28-A30 PolarHBondContact O-N 2.95Å
29	Q	48.8	Very low	66.3	Low	145 Å²	145	98.4 Å²	98.4	68%	0.678	60%	0.598	S	S	*	*			trans	-68.1	87.9	161.1	-69.7	-165.8	16.9	0	0	105.2	G27 P31	G27-Q29 PolarHBondContact O-N 3.44Å; Q29-P31 WeakPolarHBondContact O-CD 3.34Å
30	A	41.6	Very low	66.2	Low	84 Å²	84	96.6 Å²	96.6	69%	0.694	59%	0.592	S	S	*	*			trans	-53.9	108.3	166.8	0	0	0	0	0	106	E28 G32	E28-A30 PolarHBondContact O-N 2.95Å; A30-G32 PolarHBondContact O-N 3.03Å
31	P	45.1	Very low	66.5	Low	118 Å²	118	94.7 Å²	94.7	77%	0.766	58%	0.575	S	S	*	*			trans	-78.5	68.1	165.6	21.6	-2.9	0	0	0	103.4	Q29 T33	Q29-P31 WeakPolarHBondContact O-CD 3.34Å; P31-T33 PolarHBondContact O-N 3.46Å; P31-T33 VanDerWaalsContact O-N 3.07Å
32	G	47.5	Very low	66.8	Low	56 Å²	56	94.7 Å²	94.7	58%	0.577	57%	0.568	S	S	*	*			trans	-52.7	122.2	158.2	0	0	0	0	0	103.8	A30 A34	A30-G32 PolarHBondContact O-N 3.03Å; G32-A34 PolarHBondContact O-N 3.08Å
33	T	47.2	Very low	67.2	Low	142 Å²	142	90.9 Å²	90.9	87%	0.871	55%	0.548	S	S	*	.			trans	-60.1	52.8	171	50.2	0	0	0	0	109.6	P31	P31-T33 PolarHBondContact O-N 3.46Å; P31-T33 VanDerWaalsContact O-N 3.07Å
34	A	56.9	Low	67.7	Low	69 Å²	69	85.5 Å²	85.5	57%	0.57	54%	0.543	S	S	*	.			trans	-66	123.9	168.4	0	0	0	0	0	104	G32 C36	G32-A34 PolarHBondContact O-N 3.08Å; A34-C36 PolarHBondContact O-N 3.32Å
35	P	71.1	Confident	68.5	Low	96 Å²	96	87.9 Å²	87.9	62%	0.623	55%	0.549	S	S	*	.	S	Bend	trans	-59.2	-13.5	-177.4	22.8	-33.1	0	0	0	112.5	W42 C49	P35-W42 HydrophobicContact CB-CE3 4.01Å; P35-W42 HydrophobicContact CB-CZ3 4.27Å; P35-W42 HydrophobicContact CG-CB 4.44Å; P35-W42 HydrophobicContact CG-CD2 4.36Å; P35-W42 HydrophobicContact CG-CE3 4.02Å; P35-C49 PolarHBondContact O-SG 2.84Å; P35-C49 VanDerWaalsContact O-SG 3.34Å
36	C	79	Confident	69.3	Low	18 Å²	18	86.6 Å²	86.6	12%	0.122	54%	0.537	C	S	.	.	S	Bend	trans	-115.8	141.8	-174.7	-55.5	0	0	0	0	112.7	A34 W42 C49	A34-C36 PolarHBondContact O-N 3.32Å; C36-W42 PolarHBondContact SG-N 2.82Å; C36-C49 WeakPolarHBondContact CA-SG 3.32Å; C36-C49 HydrophobicContact CB-CB 3.8Å; C36-C49 WeakPolarHBondContact CB-SG 3.47Å; C36-C49 VanDerWaalsContact SG-CA 3.59Å; C36-C49 WeakPolarHBondContact SG-CB 3.19Å; C36-C49 CovalentContact SG-SG 2.04Å; C36-C49 PolarHBondContact SG-SG 3.35Å
37	S	82.3	Confident	70.4	Confident	95 Å²	95	89.3 Å²	89.3	66%	0.664	54%	0.543	S	S	*	.			trans	-55.6	154.8	169.5	-63.2	0	0	0	0	111.8	G39 S40	S37-G39 PolarHBondContact O-N 3.13Å; S37-S40 WeakPolarHBondContact O-CB 3.43Å; S37-S40 PolarHBondContact O-N 3.28Å
38	R	80	Confident	72.3	Confident	203 Å²	203	91.8 Å²	91.8	77%	0.766	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	124	178.6	-155.1	-174.1	-61.8	174.7	-0.1	110
39	G	81.2	Confident	74.1	Confident	47 Å²	47	86.3 Å²	86.3	49%	0.485	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	-0.8	-174.8	0	0	0	0	0	114.5	S37 C52	S37-G39 PolarHBondContact O-N 3.13Å; G39-C52 WeakPolarHBondContact O-CB 3.42Å; G39-C52 PolarHBondContact O-N 2.88Å; G39-C52 VanDerWaalsContact O-N 3.09Å; G39-C52 PolarHBondContact O-SG 2.91Å
40	S	85.3	Confident	76	Confident	41 Å²	41	81 Å²	81	29%	0.287	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	151.5	170.8	-54.4	0	0	0	0	110.2	S37 M50	S37-S40 WeakPolarHBondContact O-CB 3.43Å; S37-S40 PolarHBondContact O-N 3.28Å; S40-M50 CarbonylContact C-O 3.47Å; S40-M50 WeakPolarHBondContact CA-O 3.31Å; S40-M50 VanDerWaalsContact CB-O 3.22Å; S40-M50 WeakPolarHBondContact CB-O 3.31Å
41	S	86.7	Confident	78.4	Confident	15 Å²	15	81.3 Å²	81.3	11%	0.105	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	151.5	175.9	-164.7	0	0	0	0	111	C49 M50 F63 G66 C67	S41-C49 WeakPolarHBondContact O-CA 3.33Å; S41-M50 PolarHBondContact N-O 2.77Å; S41-M50 PolarHBondContact O-N 2.94Å; S41-F63 VanDerWaalsContact CB-O 3.3Å; S41-F63 WeakPolarHBondContact CB-O 3.48Å; S41-F63 PolarHBondContact OG-O 3.2Å; S41-G66 WeakPolarHBondContact OG-CA 3.49Å; S41-C67 VanDerWaalsContact CB-SG 3.51Å
42	W	88.2	Confident	80.5	Confident	108 Å²	108	77.2 Å²	77.2	41%	0.409	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	129.6	179.9	-174.1	-98.2	0	0	0	110	P35 C36 D47 F63	P35-W42 HydrophobicContact CB-CE3 4.01Å; P35-W42 HydrophobicContact CB-CZ3 4.27Å; P35-W42 HydrophobicContact CG-CB 4.44Å; P35-W42 HydrophobicContact CG-CD2 4.36Å; P35-W42 HydrophobicContact CG-CE3 4.02Å; C36-W42 PolarHBondContact SG-N 2.82Å; W42-D47 WeakPolarHBondContact CH2-O 3.2Å; W42-D47 WeakPolarHBondContact CZ2-OD1 3.49Å; W42-F63 WeakPolarHBondContact O-CB 3.34Å
43	S	88.3	Confident	82.3	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.3	167.2	175.6	0	0	0	0	108.5	D45 L46 D47 K48 D62	S43-D45 VanDerWaalsContact C-N 3.33Å; S43-L46 PolarHBondContact OG-N 3.37Å; S43-D47 WeakPolarHBondContact O-CA 3.42Å; S43-D47 PolarHBondContact O-N 2.94Å; S43-K48 PolarHBondContact N-O 3.03Å; S43-K48 PolarHBondContact O-N 3.47Å; S43-D62 VanDerWaalsContact CA-OD2 3.3Å; S43-D62 WeakPolarHBondContact CA-OD2 3.31Å; S43-D62 PolarHBondContact OG-OD1 3.5Å; S43-D62 PolarHBondContact OG-OD2 2.99Å
44	A	86	Confident	84.2	Confident	71 Å²	71	73.1 Å²	73.1	59%	0.587	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-34	175.4	0	0	0	0	0	110.7	D62	A44-D62 PolarHBondContact N-OD2 3.49Å
45	D	86.4	Confident	85.7	Confident	133 Å²	133	70.9 Å²	70.9	71%	0.711	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-31.4	-178.5	-64.6	-30.3	0	0	0	112.7	S43 D62	S43-D45 VanDerWaalsContact C-N 3.33Å; D45-D62 PolarHBondContact N-OD2 2.87Å
46	L	86.9	Confident	86.3	Confident	94 Å²	94	77.5 Å²	77.5	49%	0.492	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-5.6	-179	-63.2	171.3	0	0	0	113.6	S43 K48 M50	S43-L46 PolarHBondContact OG-N 3.37Å; L46-K48 HydrophobicContact CB-CD 4.43Å; L46-K48 HydrophobicContact CB-CG 3.8Å; L46-K48 WeakPolarHBondContact O-CG 3.49Å; L46-K48 PolarHBondContact O-N 3.38Å; L46-K48 VanDerWaalsContact O-N 3.15Å; L46-M50 HydrophobicContact CD1-CE 3.79Å; L46-M50 HydrophobicContact CD1-CG 4.13Å; L46-M50 HydrophobicContact CD1-SD 3.97Å
47	D	87.9	Confident	86.7	Confident	122 Å²	122	80.6 Å²	80.6	65%	0.652	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	37.8	-176.5	-150.8	39.7	0	0	0	113	W42 S43	W42-D47 WeakPolarHBondContact CH2-O 3.2Å; W42-D47 WeakPolarHBondContact CZ2-OD1 3.49Å; S43-D47 WeakPolarHBondContact O-CA 3.42Å; S43-D47 PolarHBondContact O-N 2.94Å
48	K	90.7	Very high	86.8	Confident	109 Å²	109	85.1 Å²	85.1	47%	0.474	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	163	-178.6	65.7	176.8	157.6	164.5	0	112.2	S43 L46 M50	S43-K48 PolarHBondContact N-O 3.03Å; S43-K48 PolarHBondContact O-N 3.47Å; L46-K48 HydrophobicContact CB-CD 4.43Å; L46-K48 HydrophobicContact CB-CG 3.8Å; L46-K48 WeakPolarHBondContact O-CG 3.49Å; L46-K48 PolarHBondContact O-N 3.38Å; L46-K48 VanDerWaalsContact O-N 3.15Å; K48-M50 HydrophobicContact CD-CE 3.4Å; K48-M50 HydrophobicContact CG-CE 3.51Å
49	C	89.9	Confident	87	Confident	47 Å²	47	79.4 Å²	79.4	32%	0.318	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	128.8	172.4	-62.6	0	0	0	0	111.7	P35 C36 S41	P35-C49 PolarHBondContact O-SG 2.84Å; P35-C49 VanDerWaalsContact O-SG 3.34Å; C36-C49 WeakPolarHBondContact CA-SG 3.32Å; C36-C49 HydrophobicContact CB-CB 3.8Å; C36-C49 WeakPolarHBondContact CB-SG 3.47Å; C36-C49 VanDerWaalsContact SG-CA 3.59Å; C36-C49 WeakPolarHBondContact SG-CB 3.19Å; C36-C49 CovalentContact SG-SG 2.04Å; C36-C49 PolarHBondContact SG-SG 3.35Å; S41-C49 WeakPolarHBondContact O-CA 3.33Å
50	M	88.7	Confident	87.2	Confident	34 Å²	34	86.1 Å²	86.1	17%	0.167	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	150.1	172.8	-76.4	-66.8	119.7	0	0	111	S40 S41 L46 K48 F63	S40-M50 CarbonylContact C-O 3.47Å; S40-M50 WeakPolarHBondContact CA-O 3.31Å; S40-M50 VanDerWaalsContact CB-O 3.22Å; S40-M50 WeakPolarHBondContact CB-O 3.31Å; S41-M50 PolarHBondContact N-O 2.77Å; S41-M50 PolarHBondContact O-N 2.94Å; L46-M50 HydrophobicContact CD1-CE 3.79Å; L46-M50 HydrophobicContact CD1-CG 4.13Å; L46-M50 HydrophobicContact CD1-SD 3.97Å; K48-M50 HydrophobicContact CD-CE 3.4Å; K48-M50 HydrophobicContact CG-CE 3.51Å; M50-F63 HydrophobicContact CB-CB 4.43Å; M50-F63 HydrophobicContact CB-CD1 3.96Å; M50-F63 HydrophobicContact CB-CD2 3.57Å; M50-F63 HydrophobicContact CB-CE1 4.04Å; M50-F63 HydrophobicContact CB-CE2 3.67Å; M50-F63 HydrophobicContact CB-CG 3.73Å; M50-F63 HydrophobicContact CB-CZ 3.92Å; M50-F63 HydrophobicContact CG-CD1 3.82Å; M50-F63 HydrophobicContact CG-CD2 4.35Å; M50-F63 HydrophobicContact CG-CE1 3.84Å; M50-F63 HydrophobicContact CG-CE2 4.38Å; M50-F63 HydrophobicContact CG-CG 4.09Å; M50-F63 HydrophobicContact CG-CZ 4.14Å
51	D	90.9	Very high	87.1	Confident	90 Å²	90	85.4 Å²	85.4	48%	0.481	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	128.3	172.6	-164.7	-43.7	0	0	0	110.5	A53 S54	D51-A53 PolarHBondContact O-N 2.93Å; D51-A53 VanDerWaalsContact O-N 3.14Å; D51-A53 VanDerWaalsContact OD1-CB 3.24Å; D51-A53 WeakPolarHBondContact OD1-CB 3.3Å; D51-A53 PolarHBondContact OD1-N 3.41Å; D51-S54 WeakPolarHBondContact O-CB 3.33Å; D51-S54 PolarHBondContact O-N 2.93Å; D51-S54 PolarHBondContact O-OG 3.38Å
52	C	88.6	Confident	87.2	Confident	32 Å²	32	87 Å²	87	22%	0.216	46%	0.46	C	S	.	.	G	3₁₀ helix	trans	-61.4	-18.8	177.2	-68.2	0	0	0	0	113.6	G39 S54 C55 C67	G39-C52 WeakPolarHBondContact O-CB 3.42Å; G39-C52 PolarHBondContact O-N 2.88Å; G39-C52 VanDerWaalsContact O-N 3.09Å; G39-C52 PolarHBondContact O-SG 2.91Å; C52-S54 PolarHBondContact O-N 2.89Å; C52-C55 VanDerWaalsContact O-CB 3.3Å; C52-C55 WeakPolarHBondContact O-CB 3.28Å; C52-C55 PolarHBondContact O-N 3.34Å; C52-C67 WeakPolarHBondContact CA-SG 3.23Å; C52-C67 HydrophobicContact CB-CB 3.72Å; C52-C67 WeakPolarHBondContact CB-SG 3.48Å; C52-C67 VanDerWaalsContact SG-CA 3.59Å; C52-C67 WeakPolarHBondContact SG-CB 3.38Å; C52-C67 CovalentContact SG-SG 2.03Å; C52-C67 PolarHBondContact SG-SG 3.44Å
53	A	86.9	Confident	87	Confident	61 Å²	61	82.5 Å²	82.5	50%	0.504	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-60.1	-29	170.9	0	0	0	0	0	112.4	D51 C55 R56	D51-A53 PolarHBondContact O-N 2.93Å; D51-A53 VanDerWaalsContact O-N 3.14Å; D51-A53 VanDerWaalsContact OD1-CB 3.24Å; D51-A53 WeakPolarHBondContact OD1-CB 3.3Å; D51-A53 PolarHBondContact OD1-N 3.41Å; A53-C55 PolarHBondContact O-N 3.01Å; A53-R56 PolarHBondContact O-N 2.89Å
54	S	86.2	Confident	86.9	Confident	50 Å²	50	83.6 Å²	83.6	35%	0.35	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-63.3	-25.9	178.4	-52.3	0	0	0	0	112.6	D51 C52 R56 A57 R58	D51-S54 WeakPolarHBondContact O-CB 3.33Å; D51-S54 PolarHBondContact O-N 2.93Å; D51-S54 PolarHBondContact O-OG 3.38Å; C52-S54 PolarHBondContact O-N 2.89Å; S54-R56 PolarHBondContact O-N 2.97Å; S54-A57 PolarHBondContact O-N 3.46Å; S54-R58 PolarHBondContact O-N 3.21Å
55	C	87.6	Confident	86.8	Confident	22 Å²	22	88 Å²	88	15%	0.149	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-62.9	-23	177.7	-62	0	0	0	0	113.2	C52 A53 A57 R58 P59 F63 C64	C52-C55 VanDerWaalsContact O-CB 3.3Å; C52-C55 WeakPolarHBondContact O-CB 3.28Å; C52-C55 PolarHBondContact O-N 3.34Å; A53-C55 PolarHBondContact O-N 3.01Å; C55-A57 VanDerWaalsContact C-N 3.32Å; C55-R58 CarbonylContact O-C 3.32Å; C55-R58 PolarHBondContact O-N 3.48Å; C55-P59 VanDerWaalsContact O-CA 3.27Å; C55-P59 WeakPolarHBondContact O-CA 3.33Å; C55-P59 VanDerWaalsContact O-N 3.15Å; C55-F63 VanDerWaalsContact SG-CE2 3.55Å; C55-C64 WeakPolarHBondContact CA-SG 3.35Å; C55-C64 HydrophobicContact CB-CB 3.96Å; C55-C64 WeakPolarHBondContact CB-SG 3.47Å; C55-C64 WeakPolarHBondContact SG-CA 3.39Å; C55-C64 WeakPolarHBondContact SG-CB 3.3Å; C55-C64 CovalentContact SG-SG 2.03Å; C55-C64 PolarHBondContact SG-SG 3.28Å
56	R	84.8	Confident	86.5	Confident	235 Å²	235	84 Å²	84	89%	0.887	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-65.9	-37.2	173.3	-70.2	-174.7	178.9	174.4	0.8	112.1	A53 S54	A53-R56 PolarHBondContact O-N 2.89Å; S54-R56 PolarHBondContact O-N 2.97Å
57	A	86.7	Confident	86.3	Confident	83 Å²	83	80.5 Å²	80.5	69%	0.686	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-33.4	177	0	0	0	0	0	111.7	S54 C55	S54-A57 PolarHBondContact O-N 3.46Å; C55-A57 VanDerWaalsContact C-N 3.32Å
58	R	84.2	Confident	85.4	Confident	191 Å²	191	79.1 Å²	79.1	72%	0.721	44%	0.442	S	S	*	.			trans	-138.1	84.9	-176	-64.7	172.8	-157.6	-166.4	2.6	110.3	S54 C55 H60 S61	S54-R58 PolarHBondContact O-N 3.21Å; C55-R58 CarbonylContact O-C 3.32Å; C55-R58 PolarHBondContact O-N 3.48Å; R58-H60 PolarHBondContact O-N 3.38Å; R58-S61 PolarHBondContact O-OG 3.48Å; R58-S61 VanDerWaalsContact O-OG 3.13Å
59	P	84.1	Confident	84	Confident	83 Å²	83	78.2 Å²	78.2	54%	0.539	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-16	-175.1	25.9	-33.3	0	0	0	114.1	C55	C55-P59 VanDerWaalsContact O-CA 3.27Å; C55-P59 WeakPolarHBondContact O-CA 3.33Å; C55-P59 VanDerWaalsContact O-N 3.15Å
60	H	85.8	Confident	82.4	Confident	187 Å²	187	80.1 Å²	80.1	87%	0.866	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	9.9	-174.2	-60.1	99.4	0	0	0	114.4	R58	R58-H60 PolarHBondContact O-N 3.38Å
61	S	84.7	Confident	80.7	Confident	27 Å²	27	83.8 Å²	83.8	19%	0.189	50%	0.501	C	S	.	.	S	Bend	trans	-75.4	146.5	174.5	43.7	0	0	0	0	111.8	R58 F63 C64	R58-S61 PolarHBondContact O-OG 3.48Å; R58-S61 VanDerWaalsContact O-OG 3.13Å; S61-F63 VanDerWaalsContact C-N 3.3Å; S61-F63 PolarHBondContact O-N 2.87Å; S61-F63 WeakPolarHBondContact OG-CE1 3.33Å; S61-F63 WeakPolarHBondContact OG-CZ 3.48Å; S61-C64 WeakPolarHBondContact O-CB 3.36Å; S61-C64 PolarHBondContact O-N 2.87Å; S61-C64 PolarHBondContact OG-SG 2.9Å
62	D	87.5	Confident	79	Confident	48 Å²	48	83.2 Å²	83.2	26%	0.257	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-45.5	-47.8	176.4	62	-35.8	0	0	0	113.3	S43 A44 D45 C64 L65	S43-D62 VanDerWaalsContact CA-OD2 3.3Å; S43-D62 WeakPolarHBondContact CA-OD2 3.31Å; S43-D62 PolarHBondContact OG-OD1 3.5Å; S43-D62 PolarHBondContact OG-OD2 2.99Å; A44-D62 PolarHBondContact N-OD2 3.49Å; D45-D62 PolarHBondContact N-OD2 2.87Å; D62-C64 PolarHBondContact O-N 3.44Å; D62-L65 PolarHBondContact O-N 3.42Å
63	F	84.6	Confident	77.7	Confident	14 Å²	14	85.1 Å²	85.1	6%	0.061	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-68.4	-19.5	-177.6	67.4	-93.2	0	0	0	114	S41 W42 M50 C55 S61 L65 G66 C67	S41-F63 VanDerWaalsContact CB-O 3.3Å; S41-F63 WeakPolarHBondContact CB-O 3.48Å; S41-F63 PolarHBondContact OG-O 3.2Å; W42-F63 WeakPolarHBondContact O-CB 3.34Å; M50-F63 HydrophobicContact CB-CB 4.43Å; M50-F63 HydrophobicContact CB-CD1 3.96Å; M50-F63 HydrophobicContact CB-CD2 3.57Å; M50-F63 HydrophobicContact CB-CE1 4.04Å; M50-F63 HydrophobicContact CB-CE2 3.67Å; M50-F63 HydrophobicContact CB-CG 3.73Å; M50-F63 HydrophobicContact CB-CZ 3.92Å; M50-F63 HydrophobicContact CG-CD1 3.82Å; M50-F63 HydrophobicContact CG-CD2 4.35Å; M50-F63 HydrophobicContact CG-CE1 3.84Å; M50-F63 HydrophobicContact CG-CE2 4.38Å; M50-F63 HydrophobicContact CG-CG 4.09Å; M50-F63 HydrophobicContact CG-CZ 4.14Å; C55-F63 VanDerWaalsContact SG-CE2 3.55Å; S61-F63 VanDerWaalsContact C-N 3.3Å; S61-F63 PolarHBondContact O-N 2.87Å; S61-F63 WeakPolarHBondContact OG-CE1 3.33Å; S61-F63 WeakPolarHBondContact OG-CZ 3.48Å; F63-L65 PolarHBondContact O-N 2.82Å; F63-G66 PolarHBondContact O-N 3.45Å; F63-G66 VanDerWaalsContact O-N 3.15Å; F63-C67 PolarHBondContact O-N 3.09Å
64	C	86	Confident	76.5	Confident	22 Å²	22	85.9 Å²	85.9	15%	0.149	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-70.2	-20.7	-178.5	-67.9	0	0	0	0	112.8	C55 S61 D62 G66 C67	C55-C64 WeakPolarHBondContact CA-SG 3.35Å; C55-C64 HydrophobicContact CB-CB 3.96Å; C55-C64 WeakPolarHBondContact CB-SG 3.47Å; C55-C64 WeakPolarHBondContact SG-CA 3.39Å; C55-C64 WeakPolarHBondContact SG-CB 3.3Å; C55-C64 CovalentContact SG-SG 2.03Å; C55-C64 PolarHBondContact SG-SG 3.28Å; S61-C64 WeakPolarHBondContact O-CB 3.36Å; S61-C64 PolarHBondContact O-N 2.87Å; S61-C64 PolarHBondContact OG-SG 2.9Å; D62-C64 PolarHBondContact O-N 3.44Å; C64-G66 VanDerWaalsContact C-N 3.28Å; C64-G66 PolarHBondContact O-N 3.46Å; C64-C67 PolarHBondContact O-N 3.49Å
65	L	83.2	Confident	75.3	Confident	163 Å²	163	89.9 Å²	89.9	85%	0.853	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-64.4	-34.6	172.6	-65.4	168.6	0	0	0	111.9	D62 F63	D62-L65 PolarHBondContact O-N 3.42Å; F63-L65 PolarHBondContact O-N 2.82Å
66	G	81.4	Confident	74.4	Confident	51 Å²	51	98.5 Å²	98.5	53%	0.526	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.2	-11.6	177.7	0	0	0	0	0	113.8	S41 F63 C64 A68	S41-G66 WeakPolarHBondContact OG-CA 3.49Å; F63-G66 PolarHBondContact O-N 3.45Å; F63-G66 VanDerWaalsContact O-N 3.15Å; C64-G66 VanDerWaalsContact C-N 3.28Å; C64-G66 PolarHBondContact O-N 3.46Å; G66-A68 VanDerWaalsContact C-N 3.28Å; G66-A68 PolarHBondContact O-N 3.25Å
67	C	81.5	Confident	73.7	Confident	20 Å²	20	93.2 Å²	93.2	14%	0.135	55%	0.549	C	S	.	.			trans	-75.7	83.1	171.8	-71.8	0	0	0	0	109.2	S41 C52 F63 C64 A69	S41-C67 VanDerWaalsContact CB-SG 3.51Å; C52-C67 WeakPolarHBondContact CA-SG 3.23Å; C52-C67 HydrophobicContact CB-CB 3.72Å; C52-C67 WeakPolarHBondContact CB-SG 3.48Å; C52-C67 VanDerWaalsContact SG-CA 3.59Å; C52-C67 WeakPolarHBondContact SG-CB 3.38Å; C52-C67 CovalentContact SG-SG 2.03Å; C52-C67 PolarHBondContact SG-SG 3.44Å; F63-C67 PolarHBondContact O-N 3.09Å; C64-C67 PolarHBondContact O-N 3.49Å; C67-A69 PolarHBondContact O-N 2.91Å
68	A	69.2	Low	73.1	Confident	92 Å²	92	93.2 Å²	93.2	76%	0.76	54%	0.537	S	S	*	.			trans	-52.4	108.2	164.2	0	0	0	0	0	106.9	G66 A70	G66-A68 VanDerWaalsContact C-N 3.28Å; G66-A68 PolarHBondContact O-N 3.25Å; A68-A70 PolarHBondContact O-N 2.85Å
69	A	60.6	Low	72.9	Confident	91 Å²	91	93.9 Å²	93.9	75%	0.752	54%	0.54	S	S	*	.			trans	-49.8	111.3	-179.3	0	0	0	0	0	106.9	C67 P71	C67-A69 PolarHBondContact O-N 2.91Å; A69-P71 WeakPolarHBondContact O-CD 3.35Å
70	A	56.3	Low	72.6	Confident	86 Å²	86	93.6 Å²	93.6	71%	0.711	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-50.3	116.7	-175.9	0	0	0	0	0	106.6	A68 P72	A68-A70 PolarHBondContact O-N 2.85Å; A70-P72 VanDerWaalsContact O-N 3.14Å
71	P	55	Low	72.3	Confident	112 Å²	112	90 Å²	90	73%	0.727	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-56.4	129.2	-172.8	17.4	-28.8	0	0	0	106.9	A69 A73	A69-P71 WeakPolarHBondContact O-CD 3.35Å; P71-A73 PolarHBondContact O-N 3.44Å; P71-A73 VanDerWaalsContact O-N 3.17Å
72	P	54.8	Low	72.2	Confident	78 Å²	78	93.3 Å²	93.3	51%	0.506	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-54.1	128.7	-166.9	18.9	-31.5	0	0	0	109.5	A70 P74 F75	A70-P72 VanDerWaalsContact O-N 3.14Å; P72-P74 VanDerWaalsContact C-N 3.26Å; P72-P74 HydrophobicContact CB-CG 4.15Å; P72-P74 WeakPolarHBondContact O-CD 3.19Å; P72-F75 HydrophobicContact CG-CD2 3.87Å; P72-F75 HydrophobicContact CG-CE2 3.72Å; P72-F75 WeakPolarHBondContact O-CD2 2.92Å; P72-F75 PolarHBondContact O-N 3.33Å
73	A	60.4	Low	71.9	Confident	72 Å²	72	92.8 Å²	92.8	60%	0.595	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.2	-31.4	-176.6	0	0	0	0	0	117	P71 F75 R76	P71-A73 PolarHBondContact O-N 3.44Å; P71-A73 VanDerWaalsContact O-N 3.17Å; A73-F75 PolarHBondContact O-N 3.34Å; A73-F75 VanDerWaalsContact O-N 3.15Å; A73-R76 PolarHBondContact O-N 3.27Å; A73-R76 VanDerWaalsContact O-N 3.07Å
74	P	61.2	Low	72	Confident	76 Å²	76	93.8 Å²	93.8	49%	0.494	56%	0.559	S	S	.	*	H	α-helix	trans	-52.3	-38.3	179	17	-35.3	0	0	0	114.2	P72 R76 L77 L78	P72-P74 VanDerWaalsContact C-N 3.26Å; P72-P74 HydrophobicContact CB-CG 4.15Å; P72-P74 WeakPolarHBondContact O-CD 3.19Å; P74-R76 VanDerWaalsContact C-N 3.27Å; P74-R76 PolarHBondContact O-N 2.88Å; P74-L77 PolarHBondContact O-N 2.87Å; P74-L78 PolarHBondContact O-N 3.15Å; P74-L78 VanDerWaalsContact O-N 3.09Å
75	F	62.8	Low	72	Confident	135 Å²	135	95.2 Å²	95.2	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-68.6	-28.2	-176.8	-61.8	-67	0	0	0	112.9	P72 A73 L77 L78 W79	P72-F75 HydrophobicContact CG-CD2 3.87Å; P72-F75 HydrophobicContact CG-CE2 3.72Å; P72-F75 WeakPolarHBondContact O-CD2 2.92Å; P72-F75 PolarHBondContact O-N 3.33Å; A73-F75 PolarHBondContact O-N 3.34Å; A73-F75 VanDerWaalsContact O-N 3.15Å; F75-L77 VanDerWaalsContact C-N 3.35Å; F75-L77 PolarHBondContact O-N 3.39Å; F75-L78 PolarHBondContact O-N 3.33Å; F75-W79 WeakPolarHBondContact O-CB 3.22Å; F75-W79 PolarHBondContact O-N 3.48Å
76	R	68.3	Low	72.2	Confident	203 Å²	203	93.2 Å²	93.2	77%	0.766	56%	0.562	S	S	*	*	H	α-helix	trans	-69.6	-30.3	178.9	-105.2	-159.9	176.6	-156.8	-1.1	113.4	A73 P74 P80	A73-R76 PolarHBondContact O-N 3.27Å; A73-R76 VanDerWaalsContact O-N 3.07Å; P74-R76 VanDerWaalsContact C-N 3.27Å; P74-R76 PolarHBondContact O-N 2.88Å; R76-P80 WeakPolarHBondContact O-CD 3.12Å; R76-P80 WeakPolarHBondContact O-CG 3.4Å
77	L	69.2	Low	72.5	Confident	123 Å²	123	93.7 Å²	93.7	64%	0.644	56%	0.558	S	S	*	*	H	α-helix	trans	-86.1	-33.7	174.1	-91.2	75.3	0	0	0	111.9	P74 F75 W79 P80 I81	P74-L77 PolarHBondContact O-N 2.87Å; F75-L77 VanDerWaalsContact C-N 3.35Å; F75-L77 PolarHBondContact O-N 3.39Å; L77-W79 VanDerWaalsContact C-N 3.34Å; L77-W79 PolarHBondContact O-N 2.66Å; L77-P80 WeakPolarHBondContact O-CD 3.49Å; L77-P80 WeakPolarHBondContact O-CG 3.49Å; L77-I81 WeakPolarHBondContact O-CD1 3.32Å; L77-I81 VanDerWaalsContact O-CG1 3.28Å; L77-I81 WeakPolarHBondContact O-CG1 3.33Å; L77-I81 PolarHBondContact O-N 2.95Å
78	L	74.7	Confident	72.9	Confident	83 Å²	83	97.9 Å²	97.9	44%	0.435	58%	0.578	S	S	.	*	H	α-helix	trans	-64.1	-38.8	175.3	-93.8	154.6	0	0	0	112.4	P74 F75 I81 L82	P74-L78 PolarHBondContact O-N 3.15Å; P74-L78 VanDerWaalsContact O-N 3.09Å; F75-L78 PolarHBondContact O-N 3.33Å; L78-I81 PolarHBondContact O-N 3.33Å; L78-L82 WeakPolarHBondContact O-CB 3.5Å; L78-L82 WeakPolarHBondContact O-CG 3.38Å; L78-L82 PolarHBondContact O-N 3.07Å
79	W	79.1	Confident	73.9	Confident	205 Å²	205	97.8 Å²	97.8	78%	0.777	57%	0.568	S	S	*	*	H	α-helix	trans	-56.9	-50.8	-179.4	-166.9	-97.4	0	0	0	114.7	F75 L77 I81 L82 G83	F75-W79 WeakPolarHBondContact O-CB 3.22Å; F75-W79 PolarHBondContact O-N 3.48Å; L77-W79 VanDerWaalsContact C-N 3.34Å; L77-W79 PolarHBondContact O-N 2.66Å; W79-I81 VanDerWaalsContact C-N 3.32Å; W79-I81 PolarHBondContact O-N 3.42Å; W79-L82 PolarHBondContact O-N 3.17Å; W79-G83 PolarHBondContact O-N 2.88Å
80	P	78.3	Confident	75.2	Confident	77 Å²	77	99.8 Å²	99.8	50%	0.5	56%	0.56	S	S	.	*	H	α-helix	trans	-68.3	-29.1	176	26.7	-35.3	0	0	0	112.8	R76 L77 G84	R76-P80 WeakPolarHBondContact O-CD 3.12Å; R76-P80 WeakPolarHBondContact O-CG 3.4Å; L77-P80 WeakPolarHBondContact O-CD 3.49Å; L77-P80 WeakPolarHBondContact O-CG 3.49Å; P80-G84 WeakPolarHBondContact O-CA 3.46Å; P80-G84 PolarHBondContact O-N 3.41Å
81	I	79.7	Confident	76.8	Confident	112 Å²	112	99.3 Å²	99.3	57%	0.574	55%	0.548	S	S	*	.	H	α-helix	trans	-67.2	-48.8	175	-64.2	167	0	0	0	109.9	L77 L78 W79 G84 A85	L77-I81 WeakPolarHBondContact O-CD1 3.32Å; L77-I81 VanDerWaalsContact O-CG1 3.28Å; L77-I81 WeakPolarHBondContact O-CG1 3.33Å; L77-I81 PolarHBondContact O-N 2.95Å; L78-I81 PolarHBondContact O-N 3.33Å; W79-I81 VanDerWaalsContact C-N 3.32Å; W79-I81 PolarHBondContact O-N 3.42Å; I81-G84 PolarHBondContact O-N 3.22Å; I81-A85 VanDerWaalsContact O-CB 3.31Å; I81-A85 WeakPolarHBondContact O-CB 3.46Å; I81-A85 PolarHBondContact O-N 3.07Å
82	L	81.6	Confident	78.5	Confident	96 Å²	96	98.9 Å²	98.9	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-63.2	-45.6	177.4	-70.6	169.7	0	0	0	111.3	L78 W79 G84 A85 L86	L78-L82 WeakPolarHBondContact O-CB 3.5Å; L78-L82 WeakPolarHBondContact O-CG 3.38Å; L78-L82 PolarHBondContact O-N 3.07Å; W79-L82 PolarHBondContact O-N 3.17Å; L82-G84 PolarHBondContact O-N 3.33Å; L82-A85 PolarHBondContact O-N 3.45Å; L82-L86 WeakPolarHBondContact O-CB 3.28Å; L82-L86 VanDerWaalsContact O-CG 3.23Å; L82-L86 WeakPolarHBondContact O-CG 3.22Å; L82-L86 PolarHBondContact O-N 3.17Å
83	G	82.5	Confident	80.3	Confident	37 Å²	37	97.1 Å²	97.1	38%	0.381	54%	0.536	S	S	.	.	H	α-helix	trans	-64.6	-38.4	176	0	0	0	0	0	113	W79 S87	W79-G83 PolarHBondContact O-N 2.88Å; G83-S87 WeakPolarHBondContact O-CB 3.24Å; G83-S87 PolarHBondContact O-N 3.49Å; G83-S87 PolarHBondContact O-OG 3.05Å
84	G	85.7	Confident	81.6	Confident	35 Å²	35	96.5 Å²	96.5	36%	0.361	52%	0.522	S	S	.	.	H	α-helix	trans	-66	-47.2	175.9	0	0	0	0	0	112.1	P80 I81 L82 S87 L88	P80-G84 WeakPolarHBondContact O-CA 3.46Å; P80-G84 PolarHBondContact O-N 3.41Å; I81-G84 PolarHBondContact O-N 3.22Å; L82-G84 PolarHBondContact O-N 3.33Å; G84-S87 WeakPolarHBondContact CA-OG 2.96Å; G84-S87 PolarHBondContact O-N 3.02Å; G84-S87 PolarHBondContact O-OG 2.72Å; G84-L88 WeakPolarHBondContact O-CB 3.03Å; G84-L88 PolarHBondContact O-N 2.84Å
85	A	86.8	Confident	83	Confident	53 Å²	53	97.8 Å²	97.8	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-43.5	176.4	0	0	0	0	0	112.1	I81 L82 L88 T89	I81-A85 VanDerWaalsContact O-CB 3.31Å; I81-A85 WeakPolarHBondContact O-CB 3.46Å; I81-A85 PolarHBondContact O-N 3.07Å; L82-A85 PolarHBondContact O-N 3.45Å; A85-L88 PolarHBondContact O-N 2.82Å; A85-T89 WeakPolarHBondContact O-CB 3.43Å; A85-T89 VanDerWaalsContact O-CG2 3.31Å; A85-T89 WeakPolarHBondContact O-CG2 3.27Å; A85-T89 PolarHBondContact O-N 2.84Å; A85-T89 PolarHBondContact O-OG1 3.04Å
86	L	87.8	Confident	84.2	Confident	120 Å²	120	94.4 Å²	94.4	63%	0.628	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-43.2	176.5	-74.1	169.7	0	0	0	112.1	L82 T89 F90	L82-L86 WeakPolarHBondContact O-CB 3.28Å; L82-L86 VanDerWaalsContact O-CG 3.23Å; L82-L86 WeakPolarHBondContact O-CG 3.22Å; L82-L86 PolarHBondContact O-N 3.17Å; L86-T89 WeakPolarHBondContact CA-OG1 2.96Å; L86-T89 PolarHBondContact O-OG1 3.2Å; L86-F90 VanDerWaalsContact O-CB 3.3Å; L86-F90 WeakPolarHBondContact O-CB 3.35Å; L86-F90 PolarHBondContact O-N 3.48Å
87	S	87.4	Confident	85.1	Confident	62 Å²	62	86.6 Å²	86.6	43%	0.434	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-41.9	177.3	59.5	0	0	0	0	112.1	G83 G84 F90 V91	G83-S87 WeakPolarHBondContact O-CB 3.24Å; G83-S87 PolarHBondContact O-N 3.49Å; G83-S87 PolarHBondContact O-OG 3.05Å; G84-S87 WeakPolarHBondContact CA-OG 2.96Å; G84-S87 PolarHBondContact O-N 3.02Å; G84-S87 PolarHBondContact O-OG 2.72Å; S87-F90 PolarHBondContact O-N 3.19Å; S87-V91 VanDerWaalsContact O-CG2 3.3Å; S87-V91 WeakPolarHBondContact O-CG2 2.98Å; S87-V91 PolarHBondContact O-N 2.03Å
88	L	88.9	Confident	85.9	Confident	107 Å²	107	82.6 Å²	82.6	56%	0.56	48%	0.478	S	S	*	.	H	α-helix	trans	-61.4	-51.1	177.3	-177.5	62.8	0	0	0	111.1	G84 A85 F90 V91 L92	G84-L88 WeakPolarHBondContact O-CB 3.03Å; G84-L88 PolarHBondContact O-N 2.84Å; A85-L88 PolarHBondContact O-N 2.82Å; L88-F90 VanDerWaalsContact C-N 3.31Å; L88-F90 PolarHBondContact O-N 2.03Å; L88-V91 PolarHBondContact O-N 2.86Å; L88-L92 HydrophobicContact CD1-CD1 3.63Å; L88-L92 HydrophobicContact CD2-CD1 4.48Å; L88-L92 HydrophobicContact CG-CD1 3.62Å; L88-L92 WeakPolarHBondContact O-CB 3.36Å; L88-L92 WeakPolarHBondContact O-CD1 3Å; L88-L92 PolarHBondContact O-N 2.95Å
89	T	89.8	Confident	86.4	Confident	90 Å²	90	83.3 Å²	83.3	55%	0.552	48%	0.481	S	S	*	.	H	α-helix	trans	-59.4	-40.8	177.6	49.6	0	0	0	0	112.1	A85 L86 L92 G93	A85-T89 WeakPolarHBondContact O-CB 3.43Å; A85-T89 VanDerWaalsContact O-CG2 3.31Å; A85-T89 WeakPolarHBondContact O-CG2 3.27Å; A85-T89 PolarHBondContact O-N 2.84Å; A85-T89 PolarHBondContact O-OG1 3.04Å; L86-T89 WeakPolarHBondContact CA-OG1 2.96Å; L86-T89 PolarHBondContact O-OG1 3.2Å; T89-L92 PolarHBondContact O-N 3.25Å; T89-G93 PolarHBondContact O-N 3.29Å
90	F	89.2	Confident	86.7	Confident	134 Å²	134	77.6 Å²	77.6	59%	0.588	47%	0.469	S	S	*	.	H	α-helix	trans	-62.5	-45.3	175.5	-172.8	-106.2	0	0	0	112.4	L86 S87 L88 G93 L94	L86-F90 VanDerWaalsContact O-CB 3.3Å; L86-F90 WeakPolarHBondContact O-CB 3.35Å; L86-F90 PolarHBondContact O-N 3.48Å; S87-F90 PolarHBondContact O-N 3.19Å; L88-F90 VanDerWaalsContact C-N 3.31Å; L88-F90 PolarHBondContact O-N 2.03Å; F90-G93 PolarHBondContact O-N 2.97Å; F90-L94 HydrophobicContact CD1-CD1 3.68Å; F90-L94 HydrophobicContact CD1-CG 4.48Å; F90-L94 HydrophobicContact CE1-CD1 3.29Å; F90-L94 HydrophobicContact CE1-CG 4.25Å; F90-L94 HydrophobicContact CE2-CD1 4.43Å; F90-L94 HydrophobicContact CG-CD1 4.4Å; F90-L94 HydrophobicContact CZ-CD1 3.72Å; F90-L94 HydrophobicContact CZ-CG 4.31Å; F90-L94 WeakPolarHBondContact O-CB 3.3Å; F90-L94 WeakPolarHBondContact O-CG 3.42Å; F90-L94 PolarHBondContact O-N 3.49Å
91	V	89.5	Confident	86.9	Confident	76 Å²	76	78.7 Å²	78.7	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-63.9	-44.5	177.5	171.1	0	0	0	0	111.3	S87 L88 L94 L95	S87-V91 VanDerWaalsContact O-CG2 3.3Å; S87-V91 WeakPolarHBondContact O-CG2 2.98Å; S87-V91 PolarHBondContact O-N 2.03Å; L88-V91 PolarHBondContact O-N 2.86Å; V91-L94 PolarHBondContact O-N 3.14Å; V91-L95 WeakPolarHBondContact O-CB 3.21Å; V91-L95 PolarHBondContact O-N 2.81Å
92	L	91.9	Very high	86.8	Confident	102 Å²	102	79.2 Å²	79.2	53%	0.534	46%	0.458	S	S	.	.	H	α-helix	trans	-62.7	-42.5	176.2	-89.9	132.2	0	0	0	112.3	L88 T89 L95 S96	L88-L92 HydrophobicContact CD1-CD1 3.63Å; L88-L92 HydrophobicContact CD2-CD1 4.48Å; L88-L92 HydrophobicContact CG-CD1 3.62Å; L88-L92 WeakPolarHBondContact O-CB 3.36Å; L88-L92 WeakPolarHBondContact O-CD1 3Å; L88-L92 PolarHBondContact O-N 2.95Å; T89-L92 PolarHBondContact O-N 3.25Å; L92-L95 PolarHBondContact O-N 3.2Å; L92-S96 WeakPolarHBondContact O-CB 3.21Å; L92-S96 PolarHBondContact O-N 3.02Å; L92-S96 PolarHBondContact O-OG 2.92Å
93	G	90.6	Very high	86.7	Confident	42 Å²	42	83.4 Å²	83.4	43%	0.433	47%	0.467	S	S	.	.	H	α-helix	trans	-61.6	-44.5	175.7	0	0	0	0	0	112.2	T89 F90 S96 G97	T89-G93 PolarHBondContact O-N 3.29Å; F90-G93 PolarHBondContact O-N 2.97Å; G93-S96 PolarHBondContact O-OG 3.23Å; G93-G97 PolarHBondContact O-N 2.83Å
94	L	88.8	Confident	86.3	Confident	59 Å²	59	82.7 Å²	82.7	31%	0.309	46%	0.456	S	S	.	.	H	α-helix	trans	-66	-42.4	176.2	-72.9	173.3	0	0	0	112.5	L13 F90 V91 F98	L13-L94 HydrophobicContact CD1-CD1 3.99Å; L13-L94 HydrophobicContact CD2-CD1 3.39Å; L13-L94 HydrophobicContact CG-CD1 4.34Å; F90-L94 HydrophobicContact CD1-CD1 3.68Å; F90-L94 HydrophobicContact CD1-CG 4.48Å; F90-L94 HydrophobicContact CE1-CD1 3.29Å; F90-L94 HydrophobicContact CE1-CG 4.25Å; F90-L94 HydrophobicContact CE2-CD1 4.43Å; F90-L94 HydrophobicContact CG-CD1 4.4Å; F90-L94 HydrophobicContact CZ-CD1 3.72Å; F90-L94 HydrophobicContact CZ-CG 4.31Å; F90-L94 WeakPolarHBondContact O-CB 3.3Å; F90-L94 WeakPolarHBondContact O-CG 3.42Å; F90-L94 PolarHBondContact O-N 3.49Å; V91-L94 PolarHBondContact O-N 3.14Å; L94-F98 WeakPolarHBondContact O-CB 3.11Å; L94-F98 PolarHBondContact O-N 3.07Å
95	L	89.5	Confident	85.8	Confident	103 Å²	103	85.3 Å²	85.3	54%	0.539	46%	0.455	S	S	.	.	H	α-helix	trans	-67	-45.2	-179.2	-163.9	76.1	0	0	0	111.2	V91 L92 F98 L99	V91-L95 WeakPolarHBondContact O-CB 3.21Å; V91-L95 PolarHBondContact O-N 2.81Å; L92-L95 PolarHBondContact O-N 3.2Å; L95-F98 PolarHBondContact O-N 2.99Å; L95-L99 HydrophobicContact CG-CD1 4.34Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 WeakPolarHBondContact O-CG 3.21Å; L95-L99 PolarHBondContact O-N 3.23Å
96	S	89.9	Confident	84.8	Confident	63 Å²	63	91.4 Å²	91.4	44%	0.441	47%	0.466	S	S	.	.	H	α-helix	trans	-62.5	-49.9	176.4	57.1	0	0	0	0	111.5	L92 G93 F98 L99 V100	L92-S96 WeakPolarHBondContact O-CB 3.21Å; L92-S96 PolarHBondContact O-N 3.02Å; L92-S96 PolarHBondContact O-OG 2.92Å; G93-S96 PolarHBondContact O-OG 3.23Å; S96-F98 VanDerWaalsContact C-N 3.28Å; S96-F98 PolarHBondContact O-N 3.02Å; S96-L99 PolarHBondContact O-N 3.09Å; S96-L99 VanDerWaalsContact O-N 3.15Å; S96-V100 WeakPolarHBondContact O-CG2 3.06Å; S96-V100 PolarHBondContact O-N 3.13Å
97	G	86.8	Confident	83.5	Confident	40 Å²	40	94.6 Å²	94.6	41%	0.412	47%	0.47	S	S	.	.	H	α-helix	trans	-58.2	-39.5	175.9	0	0	0	0	0	112.6	G93 W101	G93-G97 PolarHBondContact O-N 2.83Å; G97-W101 WeakPolarHBondContact O-CB 3.37Å; G97-W101 PolarHBondContact O-N 3.38Å
98	F	85.4	Confident	82.2	Confident	39 Å²	39	98.6 Å²	98.6	17%	0.171	48%	0.482	C	S	.	.	H	α-helix	trans	-66.8	-41.4	175.7	177.6	-83.4	0	0	0	113.2	L6 L94 L95 S96 R102	L6-F98 HydrophobicContact CD1-CD2 3.43Å; L6-F98 VanDerWaalsContact CD1-CD2 3.43Å; L6-F98 HydrophobicContact CD1-CE1 4.42Å; L6-F98 HydrophobicContact CD1-CE2 2.89Å; L6-F98 HydrophobicContact CD1-CG 4.43Å; L6-F98 HydrophobicContact CD1-CZ 3.47Å; L6-F98 VanDerWaalsContact CD1-CZ 3.47Å; L6-F98 HydrophobicContact CD2-CE1 4.16Å; L6-F98 HydrophobicContact CD2-CE2 3.79Å; L6-F98 HydrophobicContact CD2-CZ 3.38Å; L6-F98 HydrophobicContact CG-CD2 4.26Å; L6-F98 HydrophobicContact CG-CE1 4.5Å; L6-F98 HydrophobicContact CG-CE2 3.25Å; L6-F98 HydrophobicContact CG-CZ 3.39Å; L94-F98 WeakPolarHBondContact O-CB 3.11Å; L94-F98 PolarHBondContact O-N 3.07Å; L95-F98 PolarHBondContact O-N 2.99Å; S96-F98 VanDerWaalsContact C-N 3.28Å; S96-F98 PolarHBondContact O-N 3.02Å; F98-R102 HydrophobicContact CD1-CG 4.37Å; F98-R102 HydrophobicContact CE1-CG 4.22Å; F98-R102 VanDerWaalsContact CE1-NE 3.35Å; F98-R102 WeakPolarHBondContact O-CB 3.3Å; F98-R102 PolarHBondContact O-N 3.47Å
99	L	85	Confident	80.7	Confident	97 Å²	97	102.1 Å²	102.1	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-66.6	-43.2	177.3	-72.1	173.4	0	0	0	110.9	L95 S96 R102 R103	L95-L99 HydrophobicContact CG-CD1 4.34Å; L95-L99 WeakPolarHBondContact O-CB 3.43Å; L95-L99 WeakPolarHBondContact O-CG 3.21Å; L95-L99 PolarHBondContact O-N 3.23Å; S96-L99 PolarHBondContact O-N 3.09Å; S96-L99 VanDerWaalsContact O-N 3.15Å; L99-R102 PolarHBondContact O-N 3.23Å; L99-R103 WeakPolarHBondContact O-CB 3.35Å; L99-R103 PolarHBondContact O-N 3.03Å
100	V	86.1	Confident	78.7	Confident	85 Å²	85	106.7 Å²	106.7	52%	0.515	51%	0.505	S	S	.	.	H	α-helix	trans	-60.5	-50.1	173.4	172.6	0	0	0	0	110.2	S96 R102 R103 C104	S96-V100 WeakPolarHBondContact O-CG2 3.06Å; S96-V100 PolarHBondContact O-N 3.13Å; V100-R102 VanDerWaalsContact C-N 3.34Å; V100-R102 PolarHBondContact O-N 3.3Å; V100-R103 WeakPolarHBondContact O-CB 3.4Å; V100-R103 PolarHBondContact O-N 3.3Å; V100-R103 VanDerWaalsContact O-N 3.08Å; V100-C104 WeakPolarHBondContact O-CB 3.22Å; V100-C104 PolarHBondContact O-N 3.39Å; V100-C104 PolarHBondContact O-SG 3.15Å; V100-C104 VanDerWaalsContact O-SG 3.38Å
101	W	81.5	Confident	77	Confident	101 Å²	101	104.6 Å²	104.6	38%	0.383	50%	0.504	S	S	.	.	H	α-helix	trans	-58.9	-42.9	177.8	177.9	82	0	0	0	112.5	L6 G97 R103 R105	L6-W101 HydrophobicContact CD1-CE3 3.91Å; L6-W101 HydrophobicContact CD1-CH2 3.89Å; L6-W101 HydrophobicContact CD1-CZ3 3.22Å; L6-W101 HydrophobicContact CD2-CZ3 4.39Å; L6-W101 HydrophobicContact CG-CZ3 4.28Å; G97-W101 WeakPolarHBondContact O-CB 3.37Å; G97-W101 PolarHBondContact O-N 3.38Å; W101-R103 PolarHBondContact O-N 3.28Å; W101-R105 VanDerWaalsContact O-CB 3.3Å; W101-R105 WeakPolarHBondContact O-CB 3.48Å; W101-R105 PolarHBondContact O-N 2.88Å
102	R	79	Confident	75.1	Confident	123 Å²	123	108 Å²	108	46%	0.464	53%	0.525	S	S	.	.	H	α-helix	trans	-61	-43.9	174	-91.7	-170.5	169.5	171.5	8.9	111.8	L6 F98 L99 V100 R106	L6-R102 HydrophobicContact CD2-CG 4.31Å; L6-R102 VanDerWaalsContact CD2-CZ 3.49Å; F98-R102 HydrophobicContact CD1-CG 4.37Å; F98-R102 HydrophobicContact CE1-CG 4.22Å; F98-R102 VanDerWaalsContact CE1-NE 3.35Å; F98-R102 WeakPolarHBondContact O-CB 3.3Å; F98-R102 PolarHBondContact O-N 3.47Å; L99-R102 PolarHBondContact O-N 3.23Å; V100-R102 VanDerWaalsContact C-N 3.34Å; V100-R102 PolarHBondContact O-N 3.3Å; R102-R106 WeakPolarHBondContact O-CB 3.04Å; R102-R106 WeakPolarHBondContact O-CG 3.3Å; R102-R106 PolarHBondContact O-N 2.81Å; R102-R106 VanDerWaalsContact O-N 3.08Å
103	R	78.3	Confident	73.2	Confident	184 Å²	184	107.8 Å²	107.8	69%	0.694	53%	0.53	S	S	*	.	H	α-helix	trans	-64.5	-47.4	-179.4	-174.1	177.3	175.7	122.9	-3.7	110.7	L99 V100 W101 R106 R107	L99-R103 WeakPolarHBondContact O-CB 3.35Å; L99-R103 PolarHBondContact O-N 3.03Å; V100-R103 WeakPolarHBondContact O-CB 3.4Å; V100-R103 PolarHBondContact O-N 3.3Å; V100-R103 VanDerWaalsContact O-N 3.08Å; W101-R103 PolarHBondContact O-N 3.28Å; R103-R106 PolarHBondContact O-N 3.19Å; R103-R107 PolarHBondContact O-N 2.04Å
104	C	75.2	Confident	71.4	Confident	22 Å²	22	113.1 Å²	113.1	15%	0.149	55%	0.546	C	S	.	.	H	α-helix	trans	-56.4	-54.7	175.1	-72.6	0	0	0	0	111.4	V100 R106 R107 E108 C122	V100-C104 WeakPolarHBondContact O-CB 3.22Å; V100-C104 PolarHBondContact O-N 3.39Å; V100-C104 PolarHBondContact O-SG 3.15Å; V100-C104 VanDerWaalsContact O-SG 3.38Å; C104-R106 PolarHBondContact O-N 3.46Å; C104-R107 WeakPolarHBondContact O-CB 3.04Å; C104-R107 PolarHBondContact O-N 3.34Å; C104-E108 PolarHBondContact O-N 2.91Å; C104-C122 HydrophobicContact CB-CB 4.35Å; C104-C122 WeakPolarHBondContact CB-SG 3.22Å; C104-C122 WeakPolarHBondContact SG-CB 3.33Å; C104-C122 CovalentContact SG-SG 2.03Å; C104-C122 PolarHBondContact SG-SG 3.24Å
105	R	73.5	Confident	69.4	Low	89 Å²	89	118.5 Å²	118.5	34%	0.336	57%	0.57	S	S	.	*	H	α-helix	trans	-64.9	-26	-176.9	-158.2	-178	-164.9	172.9	8.2	114	A2 W101	A2-R105 VanDerWaalsContact CA-NH1 3.26Å; W101-R105 VanDerWaalsContact O-CB 3.3Å; W101-R105 WeakPolarHBondContact O-CB 3.48Å; W101-R105 PolarHBondContact O-N 2.88Å
106	R	67.3	Low	67.3	Low	181 Å²	181	121.3 Å²	121.3	68%	0.683	58%	0.58	S	S	*	*	H	α-helix	trans	-73	-30.9	175.4	-77.4	-81.1	-106.1	-114.4	-1.3	112	R102 R103 C104	R102-R106 WeakPolarHBondContact O-CB 3.04Å; R102-R106 WeakPolarHBondContact O-CG 3.3Å; R102-R106 PolarHBondContact O-N 2.81Å; R102-R106 VanDerWaalsContact O-N 3.08Å; R103-R106 PolarHBondContact O-N 3.19Å; C104-R106 PolarHBondContact O-N 3.46Å
107	R	60.9	Low	65.3	Low	187 Å²	187	124.2 Å²	124.2	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-73.5	-42	176.7	-67.6	-66.2	-170	-178.2	3.4	111.7	R103 C104 K109 F110	R103-R107 PolarHBondContact O-N 2.04Å; C104-R107 WeakPolarHBondContact O-CB 3.04Å; C104-R107 PolarHBondContact O-N 3.34Å; R107-K109 PolarHBondContact O-N 2.64Å; R107-F110 PolarHBondContact O-N 3.27Å
108	E	59.3	Low	63.3	Low	146 Å²	146	126.4 Å²	126.4	68%	0.682	62%	0.618	S	S	*	*	H	α-helix	trans	-61	-29.2	177.6	-67.6	173.7	179.6	0	0	113.5	C104 F110	C104-E108 PolarHBondContact O-N 2.91Å; E108-F110 VanDerWaalsContact C-N 3.34Å; E108-F110 PolarHBondContact O-N 2.88Å
109	K	57.5	Low	61.2	Low	181 Å²	181	127.6 Å²	127.6	79%	0.787	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	1	-171.7	-153.6	72.6	-172.7	172.5	0	114.7	R107	R107-K109 PolarHBondContact O-N 2.64Å
110	F	48.5	Very low	59.4	Low	186 Å²	186	132.1 Å²	132.1	82%	0.816	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	11.9	-173.8	-100.3	-75.7	0	0	0	116.1	R107 E108	R107-F110 PolarHBondContact O-N 3.27Å; E108-F110 VanDerWaalsContact C-N 3.34Å; E108-F110 PolarHBondContact O-N 2.88Å
111	T	53.1	Low	57.6	Low	91 Å²	91	131.7 Å²	131.7	56%	0.558	67%	0.673	S	S	*	*			trans	-142.5	99	-174.9	127.6	0	0	0	0	110.2	P113	T111-P113 VanDerWaalsContact CA-CD 3.41Å; T111-P113 WeakPolarHBondContact O-CD 3.44Å; T111-P113 WeakPolarHBondContact OG1-CD 3.44Å; T111-P113 WeakPolarHBondContact OG1-CG 3.3Å
112	T	48.5	Very low	56.1	Low	148 Å²	148	130.3 Å²	130.3	91%	0.908	68%	0.678	S	S	*	*			trans	-101.8	65.1	146.5	53.8	0	0	0	0	109.3
113	P	52.8	Low	54.9	Low	97 Å²	97	129.6 Å²	129.6	63%	0.63	69%	0.689	S	S	*	*			trans	-80.3	128.3	155.9	33.8	-28.6	0	0	0	106.7	T111	T111-P113 VanDerWaalsContact CA-CD 3.41Å; T111-P113 WeakPolarHBondContact O-CD 3.44Å; T111-P113 WeakPolarHBondContact OG1-CD 3.44Å; T111-P113 WeakPolarHBondContact OG1-CG 3.3Å
114	I	51.9	Low	53.4	Low	153 Å²	153	125.4 Å²	125.4	79%	0.785	69%	0.693	S	S	*	*			trans	-40.9	138.8	170.8	-57.9	158.5	0	0	0	108.9	E116	I114-E116 PolarHBondContact O-N 2.81Å
115	E	47.4	Very low	52	Low	173 Å²	173	130.7 Å²	130.7	81%	0.808	73%	0.725	S	S	*	*	S	Bend	trans	1.5	110.2	165	-66.2	171.2	130.4	0	0	114.5
116	E	46.5	Very low	50.9	Low	161 Å²	161	130.5 Å²	130.5	75%	0.752	74%	0.743	S	S	*	*			trans	176	133	132.5	-94.2	-48.8	151.5	0	0	109.5	I114	I114-E116 PolarHBondContact O-N 2.81Å
117	T	47.5	Very low	49.7	Very low	125 Å²	125	129.8 Å²	129.8	77%	0.767	75%	0.751	S	S	*	*			trans	63.8	113.7	160.8	62	0	0	0	0	118.9
118	G	43.7	Very low	48.7	Very low	85 Å²	85	128.8 Å²	128.8	88%	0.876	76%	0.758	S	S	*	*			trans	-67.3	175.3	176.5	0	0	0	0	0	114.9
119	G	42.4	Very low	48.1	Very low	65 Å²	65	134.2 Å²	134.2	67%	0.67	78%	0.784	S	S	*	*			trans	174.5	84.8	173.8	0	0	0	0	0	110.8
120	E	46.9	Very low	47.6	Very low	192 Å²	192	131.9 Å²	131.9	90%	0.897	78%	0.784	S	S	*	*			trans	43	111.5	155	-75.4	140.1	131	0	0	119.5
121	G	48.8	Very low	47.6	Very low	75 Å²	75	129.1 Å²	129.1	77%	0.773	78%	0.782	S	S	*	*	S	Bend	trans	-51.3	150.8	162.2	0	0	0	0	0	112
122	C	50.3	Low	47.2	Very low	72 Å²	72	131.2 Å²	131.2	49%	0.486	79%	0.794	S	S	.	*	S	Bend	trans	-26.5	141.6	-170.2	-83.6	0	0	0	0	118.2	C104 A124	C104-C122 HydrophobicContact CB-CB 4.35Å; C104-C122 WeakPolarHBondContact CB-SG 3.22Å; C104-C122 WeakPolarHBondContact SG-CB 3.33Å; C104-C122 CovalentContact SG-SG 2.03Å; C104-C122 PolarHBondContact SG-SG 3.24Å; C122-A124 PolarHBondContact O-N 3.22Å
123	P	52.6	Low	47.2	Very low	109 Å²	109	130.2 Å²	130.2	71%	0.708	79%	0.788	S	S	*	*			trans	-61.4	128.5	-155.9	27.3	-35.5	0	0	0	111.2	V125	P123-V125 PolarHBondContact O-N 3.05Å
124	A	46.8	Very low	46.8	Very low	95 Å²	95	132.3 Å²	132.3	79%	0.785	80%	0.797	S	S	*	*			trans	-38.7	117.5	145.5	0	0	0	0	0	107	C122 A126	C122-A124 PolarHBondContact O-N 3.22Å; A124-A126 PolarHBondContact O-N 3.27Å
125	V	47	Very low	46.5	Very low	134 Å²	134	130.9 Å²	130.9	81%	0.812	80%	0.798	S	S	*	*			trans	-40.3	109.2	177.5	174.1	0	0	0	0	107.3	P123 L127	P123-V125 PolarHBondContact O-N 3.05Å; V125-L127 PolarHBondContact O-N 3.46Å
126	A	48.5	Very low	46.4	Very low	85 Å²	85	127.9 Å²	127.9	70%	0.702	80%	0.798	S	S	*	*			trans	-54.8	106.8	176.2	0	0	0	0	0	106.2	A124 I128	A124-A126 PolarHBondContact O-N 3.27Å; A126-I128 PolarHBondContact O-N 3.15Å; A126-I128 VanDerWaalsContact O-N 3.08Å
127	L	42.6	Very low	46.4	Very low	165 Å²	165	125.3 Å²	125.3	86%	0.864	80%	0.801	S	S	*	*			trans	-50.5	116.7	168.2	-90.8	153.5	0	0	0	106.3	V125 Q129	V125-L127 PolarHBondContact O-N 3.46Å; L127-Q129 PolarHBondContact O-N 2.97Å; L127-Q129 VanDerWaalsContact O-N 3.11Å
128	I	40.6	Very low	46.3	Very low	167 Å²	167	125.3 Å²	125.3	86%	0.856	80%	0.804	S	S	*	*			trans	-55.2	113.2	168.4	-61.5	161	0	0	0	106	A126	A126-I128 PolarHBondContact O-N 3.15Å; A126-I128 VanDerWaalsContact O-N 3.08Å
129	Q	45.9	Very low	46.6	Very low	260 Å²	260	129 Å²	129	100%	1.215	80%	0.797	S	S	*	*			trans	-103.2	0	153.5	-84.3	-168.3	-25.3	0	0	107.7	L127	L127-Q129 PolarHBondContact O-N 2.97Å; L127-Q129 VanDerWaalsContact O-N 3.11Å

Retrieved 129 of 129 residues in 31.2 ms (Link to these results)

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