A0A077ZHC7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZHC7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 130 aa.

						>A0A077ZHC7_TRITR|A0A077ZHC7
MVTVIIANELGGEGFSDMIEDDIREHIKDCGELFTNEELDEMMQSPKGSDDDYGVIEDREAQTRSEWTLQKLASIFRQAQVLKDMIADYDVFMERDIMVIRGITFSLKPLGNLFDKAKKSNIKIDESVVH
					

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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	51.7	Low	56.4	Low	159 Å²	159	95.8 Å²	95.8	78%	0.783	54%	0.542	S	S	*	.				0	-54.7	0	-158.4	173.9	81.4	0	0	112	T3 I5	M1-T3 PolarHBondContact O-N 3.12Å; M1-I5 HydrophobicContact CG-CD1 3.8Å; M1-I5 WeakPolarHBondContact O-CG1 3.44Å; M1-I5 PolarHBondContact O-N 2.74Å
2	V	53.8	Low	56.6	Low	100 Å²	100	90.1 Å²	90.1	61%	0.606	52%	0.52	S	S	*	.	H	α-helix	trans	-63.3	-39.7	-171.8	-179.1	0	0	0	0	114.6	I6	V2-I6 HydrophobicContact CG1-CD1 3.64Å; V2-I6 HydrophobicContact CG1-CG1 4.32Å; V2-I6 VanDerWaalsContact O-CG1 3.27Å; V2-I6 WeakPolarHBondContact O-CG1 3.45Å; V2-I6 PolarHBondContact O-N 3.25Å; V2-I6 VanDerWaalsContact O-N 3.08Å
3	T	55.1	Low	56.6	Low	110 Å²	110	98.8 Å²	98.8	68%	0.675	55%	0.553	S	S	*	*	H	α-helix	trans	-68.4	-37.8	-174.9	35	0	0	0	0	114.5	M1 A7	M1-T3 PolarHBondContact O-N 3.12Å; T3-A7 WeakPolarHBondContact O-CB 3.41Å; T3-A7 PolarHBondContact O-N 3.44Å
4	V	51.2	Low	57.1	Low	34 Å²	34	96.1 Å²	96.1	21%	0.206	56%	0.558	C	S	.	*	H	α-helix	trans	-75.7	-36.5	178.9	-176.2	0	0	0	0	111.4	I6 A7 N8 M18 I23	V4-I6 VanDerWaalsContact C-N 3.31Å; V4-I6 PolarHBondContact O-N 3.48Å; V4-A7 PolarHBondContact O-N 3.26Å; V4-N8 WeakPolarHBondContact O-CB 3.47Å; V4-N8 PolarHBondContact O-N 2.8Å; V4-M18 HydrophobicContact CG1-CE 3.83Å; V4-M18 HydrophobicContact CG2-CE 4.39Å; V4-I23 HydrophobicContact CB-CD1 4.23Å; V4-I23 HydrophobicContact CG1-CD1 3.6Å; V4-I23 HydrophobicContact CG1-CG1 4.26Å; V4-I23 HydrophobicContact CG2-CG2 4.13Å
5	I	60.8	Low	57.3	Low	85 Å²	85	96.2 Å²	96.2	44%	0.436	55%	0.55	S	S	.	.	H	α-helix	trans	-60.4	-45	173.4	-64.4	171.6	0	0	0	109.8	M1 N8 E9	M1-I5 HydrophobicContact CG-CD1 3.8Å; M1-I5 WeakPolarHBondContact O-CG1 3.44Å; M1-I5 PolarHBondContact O-N 2.74Å; I5-N8 PolarHBondContact O-N 2.75Å; I5-E9 WeakPolarHBondContact O-CB 3.43Å; I5-E9 PolarHBondContact O-N 3.36Å
6	I	63.2	Low	57.8	Low	81 Å²	81	96 Å²	96	42%	0.415	56%	0.556	S	S	.	*	H	α-helix	trans	-63.6	-43.2	175.1	-66.6	171.1	0	0	0	111.1	V2 V4 N8 E9 L10	V2-I6 HydrophobicContact CG1-CD1 3.64Å; V2-I6 HydrophobicContact CG1-CG1 4.32Å; V2-I6 VanDerWaalsContact O-CG1 3.27Å; V2-I6 WeakPolarHBondContact O-CG1 3.45Å; V2-I6 PolarHBondContact O-N 3.25Å; V2-I6 VanDerWaalsContact O-N 3.08Å; V4-I6 VanDerWaalsContact C-N 3.31Å; V4-I6 PolarHBondContact O-N 3.48Å; I6-N8 VanDerWaalsContact C-N 3.31Å; I6-N8 PolarHBondContact O-N 3.34Å; I6-E9 PolarHBondContact O-N 3.44Å; I6-L10 HydrophobicContact CG2-CD1 3.55Å; I6-L10 HydrophobicContact CG2-CG 3.99Å; I6-L10 VanDerWaalsContact O-CB 3.23Å; I6-L10 WeakPolarHBondContact O-CB 3.49Å; I6-L10 WeakPolarHBondContact O-CG 3.42Å; I6-L10 PolarHBondContact O-N 3.3Å
7	A	58.7	Low	58.5	Low	29 Å²	29	98.4 Å²	98.4	24%	0.24	57%	0.566	C	S	.	*	H	α-helix	trans	-63.2	-37	178.4	0	0	0	0	0	112.7	T3 V4 G12 F15	T3-A7 WeakPolarHBondContact O-CB 3.41Å; T3-A7 PolarHBondContact O-N 3.44Å; V4-A7 PolarHBondContact O-N 3.26Å; A7-G12 PolarHBondContact O-N 2.89Å; A7-F15 HydrophobicContact CB-CD2 4.35Å; A7-F15 HydrophobicContact CB-CE2 4.4Å
8	N	53.4	Low	59.1	Low	99 Å²	99	96.5 Å²	96.5	53%	0.529	55%	0.552	S	S	.	*	H	α-helix	trans	-72.5	-43.2	176.7	-163.3	35.8	0	0	0	111.7	V4 I5 I6 L10 G11	V4-N8 WeakPolarHBondContact O-CB 3.47Å; V4-N8 PolarHBondContact O-N 2.8Å; I5-N8 PolarHBondContact O-N 2.75Å; I6-N8 VanDerWaalsContact C-N 3.31Å; I6-N8 PolarHBondContact O-N 3.34Å; N8-L10 VanDerWaalsContact C-N 3.35Å; N8-G11 PolarHBondContact O-N 3.42Å
9	E	55.2	Low	59.7	Low	158 Å²	158	96.6 Å²	96.6	74%	0.738	55%	0.55	S	S	*	*	H	α-helix	trans	-66.4	-33.4	174.3	-83.9	-176.5	150.8	0	0	113	I5 I6 G11	I5-E9 WeakPolarHBondContact O-CB 3.43Å; I5-E9 PolarHBondContact O-N 3.36Å; I6-E9 PolarHBondContact O-N 3.44Å; E9-G11 PolarHBondContact O-N 3.42Å
10	L	62.6	Low	60	Low	142 Å²	142	99.5 Å²	99.5	74%	0.743	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	3.5	175.2	-71.1	177.5	0	0	0	113.3	I6 N8	I6-L10 HydrophobicContact CG2-CD1 3.55Å; I6-L10 HydrophobicContact CG2-CG 3.99Å; I6-L10 VanDerWaalsContact O-CB 3.23Å; I6-L10 WeakPolarHBondContact O-CB 3.49Å; I6-L10 WeakPolarHBondContact O-CG 3.42Å; I6-L10 PolarHBondContact O-N 3.3Å; N8-L10 VanDerWaalsContact C-N 3.35Å
11	G	55.4	Low	60.5	Low	57 Å²	57	98.6 Å²	98.6	59%	0.588	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.3	35.1	177	0	0	0	0	0	113.2	N8 E9 E13	N8-G11 PolarHBondContact O-N 3.42Å; E9-G11 PolarHBondContact O-N 3.42Å; G11-E13 VanDerWaalsContact C-N 3.31Å; G11-E13 PolarHBondContact O-N 3.09Å
12	G	57.9	Low	61.4	Low	27 Å²	27	94.1 Å²	94.1	28%	0.278	53%	0.532	S	S	.	.			trans	-62.3	91.3	169.4	0	0	0	0	0	110.9	A7 G14 F15	A7-G12 PolarHBondContact O-N 2.89Å; G12-G14 PolarHBondContact O-N 3.2Å; G12-F15 PolarHBondContact O-N 3.42Å
13	E	57.6	Low	61.9	Low	203 Å²	203	91 Å²	91	95%	0.949	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	104.9	178.5	-164	151.7	-163.8	0	0	109.2	G11	G11-E13 VanDerWaalsContact C-N 3.31Å; G11-E13 PolarHBondContact O-N 3.09Å
14	G	63.6	Low	62.6	Low	61 Å²	61	92.3 Å²	92.3	63%	0.629	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	137.5	-13.1	-173.9	0	0	0	0	0	115.1	G12	G12-G14 PolarHBondContact O-N 3.2Å
15	F	60.2	Low	63.5	Low	98 Å²	98	97.6 Å²	97.6	43%	0.43	53%	0.526	S	S	.	.			trans	-99.9	-0.4	177.2	-60.2	-68.8	0	0	0	114.3	A7 G12 D17 M18	A7-F15 HydrophobicContact CB-CD2 4.35Å; A7-F15 HydrophobicContact CB-CE2 4.4Å; G12-F15 PolarHBondContact O-N 3.42Å; F15-D17 PolarHBondContact O-N 3.35Å; F15-M18 HydrophobicContact CD1-CE 3.69Å; F15-M18 HydrophobicContact CE1-CE 4.37Å; F15-M18 WeakPolarHBondContact O-CB 3.48Å; F15-M18 PolarHBondContact O-N 3.44Å; F15-M18 VanDerWaalsContact O-N 3.15Å
16	S	64.4	Low	63.6	Low	93 Å²	93	99.6 Å²	99.6	65%	0.65	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.1	-175.6	54.6	0	0	0	0	114
17	D	69.6	Low	63.4	Low	137 Å²	137	99.4 Å²	99.4	73%	0.733	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.1	-174.3	-60.1	-0.6	0	0	0	111.8	F15 I19	F15-D17 PolarHBondContact O-N 3.35Å; D17-I19 PolarHBondContact O-N 3.13Å; D17-I19 VanDerWaalsContact O-N 3.11Å
18	M	69.3	Low	63.5	Low	64 Å²	64	106.8 Å²	106.8	32%	0.315	56%	0.559	S	S	.	*			trans	-78.7	101.1	-176	-160.8	159.3	64.4	0	0	109.3	V4 F15 D22 I23	V4-M18 HydrophobicContact CG1-CE 3.83Å; V4-M18 HydrophobicContact CG2-CE 4.39Å; F15-M18 HydrophobicContact CD1-CE 3.69Å; F15-M18 HydrophobicContact CE1-CE 4.37Å; F15-M18 WeakPolarHBondContact O-CB 3.48Å; F15-M18 PolarHBondContact O-N 3.44Å; F15-M18 VanDerWaalsContact O-N 3.15Å; M18-D22 HydrophobicContact CG-CB 4.09Å; M18-I23 HydrophobicContact CE-CG1 4.09Å; M18-I23 HydrophobicContact CG-CG1 3.93Å; M18-I23 HydrophobicContact SD-CG1 4.45Å
19	I	70.9	Confident	63.8	Low	99 Å²	99	109.2 Å²	109.2	51%	0.508	57%	0.572	S	S	.	*			trans	-71.9	156.3	179.5	59.3	170.3	0	0	0	110.7	D17 D21 D22 I23	D17-I19 PolarHBondContact O-N 3.13Å; D17-I19 VanDerWaalsContact O-N 3.11Å; I19-D21 HydrophobicContact CD1-CB 4.1Å; I19-D21 HydrophobicContact CG1-CB 4.31Å; I19-D21 PolarHBondContact O-N 3.26Å; I19-D22 HydrophobicContact CG1-CB 4.4Å; I19-D22 WeakPolarHBondContact CG1-OD2 2.99Å; I19-D22 PolarHBondContact O-N 3.07Å; I19-D22 VanDerWaalsContact O-N 3.08Å; I19-I23 PolarHBondContact O-N 2.96Å
20	E	66.5	Low	63.9	Low	153 Å²	153	106.6 Å²	106.6	72%	0.715	57%	0.57	S	S	*	*	H	α-helix	trans	-50.8	-31.8	179.7	-173.1	-178.7	167.8	0	0	113.3	R24	E20-R24 WeakPolarHBondContact O-CB 3.47Å; E20-R24 PolarHBondContact O-N 3.47Å
21	D	70.7	Confident	63.2	Low	82 Å²	82	102.8 Å²	102.8	44%	0.439	57%	0.566	S	S	.	*	H	α-helix	trans	-70	-42.5	-180	-77.3	6.9	0	0	0	113.1	I19 I23 R24 E25	I19-D21 HydrophobicContact CD1-CB 4.1Å; I19-D21 HydrophobicContact CG1-CB 4.31Å; I19-D21 PolarHBondContact O-N 3.26Å; D21-I23 VanDerWaalsContact C-N 3.27Å; D21-I23 PolarHBondContact O-N 3.22Å; D21-R24 WeakPolarHBondContact O-CB 3.01Å; D21-R24 PolarHBondContact O-N 3.13Å; D21-R24 VanDerWaalsContact O-N 3.13Å; D21-R24 IonicContact OD1-CZ 2.71Å; D21-R24 IonicContact OD1-NH1 3.3Å; D21-R24 PolarHBondContact OD1-NH1 2.86Å; D21-R24 IonicContact OD1-NH2 2.69Å; D21-R24 PolarHBondContact OD1-NH2 3.04Å; D21-R24 IonicContact OD2-NH2 2.7Å; D21-R24 PolarHBondContact OD2-NH2 3.11Å; D21-E25 PolarHBondContact O-N 3.25Å
22	D	69.7	Low	63.4	Low	65 Å²	65	108.3 Å²	108.3	35%	0.348	58%	0.576	S	S	.	*	H	α-helix	trans	-62.9	-38.9	176.2	-61.6	-18.1	0	0	0	110.4	M18 I19 E25 H26	M18-D22 HydrophobicContact CG-CB 4.09Å; I19-D22 HydrophobicContact CG1-CB 4.4Å; I19-D22 WeakPolarHBondContact CG1-OD2 2.99Å; I19-D22 PolarHBondContact O-N 3.07Å; I19-D22 VanDerWaalsContact O-N 3.08Å; D22-E25 PolarHBondContact O-N 3.12Å; D22-H26 PolarHBondContact O-CD2 3.46Å; D22-H26 PolarHBondContact O-N 3.36Å
23	I	64.4	Low	63.2	Low	33 Å²	33	114.6 Å²	114.6	17%	0.169	60%	0.602	C	S	.	*	H	α-helix	trans	-63.3	-44	175.3	-61	168.7	0	0	0	110.1	V4 M18 I19 D21 E25 H26 I27	V4-I23 HydrophobicContact CB-CD1 4.23Å; V4-I23 HydrophobicContact CG1-CD1 3.6Å; V4-I23 HydrophobicContact CG1-CG1 4.26Å; V4-I23 HydrophobicContact CG2-CG2 4.13Å; M18-I23 HydrophobicContact CE-CG1 4.09Å; M18-I23 HydrophobicContact CG-CG1 3.93Å; M18-I23 HydrophobicContact SD-CG1 4.45Å; I19-I23 PolarHBondContact O-N 2.96Å; D21-I23 VanDerWaalsContact C-N 3.27Å; D21-I23 PolarHBondContact O-N 3.22Å; I23-E25 VanDerWaalsContact C-N 3.33Å; I23-E25 PolarHBondContact O-N 3.17Å; I23-H26 PolarHBondContact O-N 3.41Å; I23-I27 HydrophobicContact CG2-CD1 3.4Å; I23-I27 VanDerWaalsContact CG2-CD1 3.4Å; I23-I27 HydrophobicContact CG2-CG1 4.14Å; I23-I27 WeakPolarHBondContact O-CB 3.28Å; I23-I27 WeakPolarHBondContact O-CG1 3.46Å; I23-I27 PolarHBondContact O-N 3.41Å
24	R	68.9	Low	63.1	Low	139 Å²	139	112.7 Å²	112.7	53%	0.525	59%	0.591	S	S	.	*	H	α-helix	trans	-64.7	-38.1	178.8	-175.1	174.1	62.4	-114.1	-1.1	111.7	E20 D21 K28	E20-R24 WeakPolarHBondContact O-CB 3.47Å; E20-R24 PolarHBondContact O-N 3.47Å; D21-R24 WeakPolarHBondContact O-CB 3.01Å; D21-R24 PolarHBondContact O-N 3.13Å; D21-R24 VanDerWaalsContact O-N 3.13Å; D21-R24 IonicContact OD1-CZ 2.71Å; D21-R24 IonicContact OD1-NH1 3.3Å; D21-R24 PolarHBondContact OD1-NH1 2.86Å; D21-R24 IonicContact OD1-NH2 2.69Å; D21-R24 PolarHBondContact OD1-NH2 3.04Å; D21-R24 IonicContact OD2-NH2 2.7Å; D21-R24 PolarHBondContact OD2-NH2 3.11Å; R24-K28 WeakPolarHBondContact O-CB 3.4Å; R24-K28 PolarHBondContact O-N 3.47Å
25	E	71.4	Confident	63	Low	145 Å²	145	112.8 Å²	112.8	68%	0.678	58%	0.58	S	S	*	*	H	α-helix	trans	-65.4	-48.1	176.1	-173	167.1	-169.8	0	0	111.7	D21 D22 I23 K28	D21-E25 PolarHBondContact O-N 3.25Å; D22-E25 PolarHBondContact O-N 3.12Å; I23-E25 VanDerWaalsContact C-N 3.33Å; I23-E25 PolarHBondContact O-N 3.17Å; E25-K28 WeakPolarHBondContact O-CB 3.44Å; E25-K28 PolarHBondContact O-N 3.34Å
26	H	61.3	Low	63.2	Low	126 Å²	126	114.9 Å²	114.9	58%	0.583	60%	0.596	S	S	*	*	H	α-helix	trans	-71.1	-36.4	-178.6	-74.9	-59.9	0	0	0	114.6	D22 I23 K28 D29 C30	D22-H26 PolarHBondContact O-CD2 3.46Å; D22-H26 PolarHBondContact O-N 3.36Å; I23-H26 PolarHBondContact O-N 3.41Å; H26-K28 VanDerWaalsContact C-N 3.29Å; H26-K28 PolarHBondContact O-N 3.03Å; H26-D29 PolarHBondContact O-N 3.36Å; H26-C30 PolarHBondContact O-N 2.97Å; H26-C30 VanDerWaalsContact O-N 3.13Å
27	I	59.2	Low	63.4	Low	78 Å²	78	118 Å²	118	40%	0.4	60%	0.6	S	S	.	*	H	α-helix	trans	-68	-33.7	176.7	-64.5	169.1	0	0	0	110.8	I23 D29 C30 G31	I23-I27 HydrophobicContact CG2-CD1 3.4Å; I23-I27 VanDerWaalsContact CG2-CD1 3.4Å; I23-I27 HydrophobicContact CG2-CG1 4.14Å; I23-I27 WeakPolarHBondContact O-CB 3.28Å; I23-I27 WeakPolarHBondContact O-CG1 3.46Å; I23-I27 PolarHBondContact O-N 3.41Å; I27-D29 PolarHBondContact O-N 3.49Å; I27-C30 CarbonylContact O-C 3.6Å; I27-C30 PolarHBondContact O-N 3.29Å; I27-C30 VanDerWaalsContact O-N 3.11Å; I27-G31 PolarHBondContact O-N 3.44Å
28	K	60.7	Low	63.3	Low	183 Å²	183	115.7 Å²	115.7	80%	0.796	59%	0.585	S	S	*	*	H	α-helix	trans	-60.1	-31.1	176.3	-168.1	179	178.5	-172.7	0	111.4	R24 E25 H26	R24-K28 WeakPolarHBondContact O-CB 3.4Å; R24-K28 PolarHBondContact O-N 3.47Å; E25-K28 WeakPolarHBondContact O-CB 3.44Å; E25-K28 PolarHBondContact O-N 3.34Å; H26-K28 VanDerWaalsContact C-N 3.29Å; H26-K28 PolarHBondContact O-N 3.03Å
29	D	60.4	Low	62.9	Low	151 Å²	151	116.5 Å²	116.5	81%	0.807	59%	0.59	S	S	*	*	H	α-helix	trans	-80	-32.7	175.3	-145.7	33.8	0	0	0	112.5	H26 I27 G31	H26-D29 PolarHBondContact O-N 3.36Å; I27-D29 PolarHBondContact O-N 3.49Å; D29-G31 PolarHBondContact O-N 2.95Å; D29-G31 VanDerWaalsContact O-N 3.12Å
30	C	57.9	Low	62.5	Low	102 Å²	102	116.8 Å²	116.8	69%	0.689	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	30.8	173.6	-66.3	0	0	0	0	113.9	H26 I27 E32	H26-C30 PolarHBondContact O-N 2.97Å; H26-C30 VanDerWaalsContact O-N 3.13Å; I27-C30 CarbonylContact O-C 3.6Å; I27-C30 PolarHBondContact O-N 3.29Å; I27-C30 VanDerWaalsContact O-N 3.11Å; C30-E32 PolarHBondContact O-N 3.14Å
31	G	48	Very low	62.6	Low	63 Å²	63	116.9 Å²	116.9	65%	0.649	59%	0.593	S	S	*	*			trans	-65.8	0.6	-169.4	0	0	0	0	0	116.9	I27 D29 L33	I27-G31 PolarHBondContact O-N 3.44Å; D29-G31 PolarHBondContact O-N 2.95Å; D29-G31 VanDerWaalsContact O-N 3.12Å; G31-L33 PolarHBondContact O-N 2.7Å
32	E	59.2	Low	61.8	Low	172 Å²	172	118.2 Å²	118.2	80%	0.804	60%	0.598	S	S	*	*			trans	-93	90.7	177.3	-136.8	163.8	-162.3	0	0	109.8	C30	C30-E32 PolarHBondContact O-N 3.14Å
33	L	53.9	Low	61.3	Low	159 Å²	159	121 Å²	121	83%	0.832	61%	0.61	S	S	*	*			trans	-56.7	134.6	157.8	-92.4	138.3	0	0	0	107.9	G31 T35	G31-L33 PolarHBondContact O-N 2.7Å; L33-T35 PolarHBondContact O-N 3.32Å; L33-T35 VanDerWaalsContact O-N 3.12Å
34	F	56	Low	60.7	Low	163 Å²	163	127.2 Å²	127.2	72%	0.715	64%	0.638	S	S	*	*			trans	-45.5	125	172	-75.3	-74.8	0	0	0	109.6	E38	F34-E38 WeakPolarHBondContact CA-OE2 3.35Å; F34-E38 HydrophobicContact CD1-CB 4.25Å
35	T	60.9	Low	59.5	Low	64 Å²	64	124.1 Å²	124.1	39%	0.393	64%	0.638	S	S	.	*			trans	-68.4	151.5	175.8	61.5	0	0	0	0	108.9	L33 E37 E38 L39	L33-T35 PolarHBondContact O-N 3.32Å; L33-T35 VanDerWaalsContact O-N 3.12Å; T35-E37 PolarHBondContact O-N 3.09Å; T35-E38 PolarHBondContact N-OE2 2.87Å; T35-E38 PolarHBondContact O-N 2.9Å; T35-E38 VanDerWaalsContact O-N 3.13Å; T35-E38 WeakPolarHBondContact OG1-CG 3.3Å; T35-E38 PolarHBondContact OG1-N 3.24Å; T35-E38 PolarHBondContact OG1-OE2 2.86Å; T35-L39 PolarHBondContact O-N 3.47Å
36	N	64	Low	58.4	Low	142 Å²	142	123 Å²	123	76%	0.759	64%	0.644	S	S	*	*	H	α-helix	trans	-56.7	-27	177.9	-66.1	-48	0	0	0	112	L39 D40	N36-L39 PolarHBondContact O-N 3.11Å; N36-D40 WeakPolarHBondContact O-CB 3.47Å; N36-D40 PolarHBondContact O-N 2.85Å
37	E	68.5	Low	57.5	Low	159 Å²	159	127.5 Å²	127.5	74%	0.743	66%	0.661	S	S	*	*	H	α-helix	trans	-71.1	-42.8	178.6	-167.1	162.3	-160.8	0	0	112.3	T35 L39 D40 E41	T35-E37 PolarHBondContact O-N 3.09Å; E37-L39 PolarHBondContact O-N 2.83Å; E37-D40 PolarHBondContact O-N 3.3Å; E37-E41 WeakPolarHBondContact O-CB 3.46Å; E37-E41 PolarHBondContact O-N 3.24Å
38	E	67.8	Low	56.3	Low	88 Å²	88	126.9 Å²	126.9	41%	0.411	67%	0.674	S	S	.	*	H	α-helix	trans	-62.1	-34	171.9	-71.9	170.3	118.9	0	0	111.9	F34 T35 M42	F34-E38 WeakPolarHBondContact CA-OE2 3.35Å; F34-E38 HydrophobicContact CD1-CB 4.25Å; T35-E38 PolarHBondContact N-OE2 2.87Å; T35-E38 PolarHBondContact O-N 2.9Å; T35-E38 VanDerWaalsContact O-N 3.13Å; T35-E38 WeakPolarHBondContact OG1-CG 3.3Å; T35-E38 PolarHBondContact OG1-N 3.24Å; T35-E38 PolarHBondContact OG1-OE2 2.86Å; E38-M42 PolarHBondContact O-N 2.85Å
39	L	59.9	Low	55.2	Low	80 Å²	80	122.7 Å²	122.7	42%	0.419	67%	0.668	S	S	.	*	H	α-helix	trans	-71	-41	177	-128.1	157.4	0	0	0	111.6	T35 N36 E37 M42 M43	T35-L39 PolarHBondContact O-N 3.47Å; N36-L39 PolarHBondContact O-N 3.11Å; E37-L39 PolarHBondContact O-N 2.83Å; L39-M42 PolarHBondContact O-N 2.99Å; L39-M43 HydrophobicContact CD2-CE 4.03Å; L39-M43 WeakPolarHBondContact O-CG 3.45Å; L39-M43 PolarHBondContact O-N 3.29Å
40	D	64.1	Low	54.2	Low	105 Å²	105	123.6 Å²	123.6	56%	0.561	67%	0.673	S	S	*	*	H	α-helix	trans	-72	-36.3	178	-117.1	15.1	0	0	0	112.5	N36 E37 M42 M43 Q44	N36-D40 WeakPolarHBondContact O-CB 3.47Å; N36-D40 PolarHBondContact O-N 2.85Å; E37-D40 PolarHBondContact O-N 3.3Å; D40-M42 VanDerWaalsContact C-N 3.27Å; D40-M42 PolarHBondContact O-N 2.96Å; D40-M43 WeakPolarHBondContact O-CB 3.42Å; D40-M43 PolarHBondContact O-N 3.22Å; D40-M43 VanDerWaalsContact O-N 3.09Å; D40-Q44 PolarHBondContact O-N 3.05Å
41	E	67.1	Low	53.6	Low	155 Å²	155	126 Å²	126	72%	0.724	68%	0.679	S	S	*	*	H	α-helix	trans	-61.4	-38.9	173.5	-169.5	177	-175	0	0	110.8	E37 M43 Q44	E37-E41 WeakPolarHBondContact O-CB 3.46Å; E37-E41 PolarHBondContact O-N 3.24Å; E41-M43 VanDerWaalsContact C-N 3.3Å; E41-M43 PolarHBondContact O-N 2.94Å; E41-Q44 PolarHBondContact O-N 3.2Å
42	M	55.5	Low	53.5	Low	110 Å²	110	129.5 Å²	129.5	54%	0.542	68%	0.682	S	S	.	*	H	α-helix	trans	-69	-25.8	174.8	-160.9	-176.7	-146.4	0	0	113.1	E38 L39 D40 Q44 L69	E38-M42 PolarHBondContact O-N 2.85Å; L39-M42 PolarHBondContact O-N 2.99Å; D40-M42 VanDerWaalsContact C-N 3.27Å; D40-M42 PolarHBondContact O-N 2.96Å; M42-Q44 VanDerWaalsContact C-N 3.35Å; M42-L69 HydrophobicContact CE-CD1 3.37Å; M42-L69 HydrophobicContact CE-CG 4.18Å; M42-L69 HydrophobicContact CG-CD1 4.14Å; M42-L69 HydrophobicContact CG-CD2 3.78Å; M42-L69 HydrophobicContact CG-CG 4.21Å
43	M	57.3	Low	52.9	Low	123 Å²	123	132.5 Å²	132.5	61%	0.606	69%	0.688	S	S	*	*	H	α-helix	trans	-77.7	-14.4	176.8	-73	-159.8	-173.5	0	0	114	L39 D40 E41 S45	L39-M43 HydrophobicContact CD2-CE 4.03Å; L39-M43 WeakPolarHBondContact O-CG 3.45Å; L39-M43 PolarHBondContact O-N 3.29Å; D40-M43 WeakPolarHBondContact O-CB 3.42Å; D40-M43 PolarHBondContact O-N 3.22Å; D40-M43 VanDerWaalsContact O-N 3.09Å; E41-M43 VanDerWaalsContact C-N 3.3Å; E41-M43 PolarHBondContact O-N 2.94Å; M43-S45 PolarHBondContact O-N 3.15Å
44	Q	52.2	Low	52	Low	165 Å²	165	127.6 Å²	127.6	77%	0.771	68%	0.676	S	S	*	*			trans	-72.4	61.3	170.7	-62.2	-66.5	-37.2	0	0	110.3	D40 E41 M42	D40-Q44 PolarHBondContact O-N 3.05Å; E41-Q44 PolarHBondContact O-N 3.2Å; M42-Q44 VanDerWaalsContact C-N 3.35Å
45	S	44.9	Very low	51.5	Low	74 Å²	74	126.3 Å²	126.3	52%	0.517	68%	0.681	S	S	.	*			trans	-74.4	142.2	174.8	70	0	0	0	0	110.6	M43 K47	M43-S45 PolarHBondContact O-N 3.15Å; S45-K47 PolarHBondContact O-N 3.02Å
46	P	48.3	Very low	51	Low	122 Å²	122	131.2 Å²	131.2	79%	0.792	70%	0.703	S	S	*	*			trans	-64.5	124.5	177.6	-16.9	29.9	0	0	0	110.9	G48	P46-G48 PolarHBondContact O-N 3.08Å; P46-G48 VanDerWaalsContact O-N 3.14Å
47	K	42	Very low	49.9	Very low	219 Å²	219	133 Å²	133	95%	0.952	71%	0.707	S	S	*	*			trans	-52.9	112.2	166.6	-118.4	170.1	178	153.4	0	109.7	S45	S45-K47 PolarHBondContact O-N 3.02Å
48	G	33.9	Very low	48.8	Very low	65 Å²	65	132 Å²	132	67%	0.67	71%	0.707	S	S	*	*			trans	143	96.1	159.9	0	0	0	0	0	115.5	P46	P46-G48 PolarHBondContact O-N 3.08Å; P46-G48 VanDerWaalsContact O-N 3.14Å
49	S	37	Very low	48.1	Very low	95 Å²	95	136.6 Å²	136.6	66%	0.664	72%	0.72	S	S	*	*				179.4	105.2	121.9	35.4	0	0	0	0	109
50	D	40.5	Very low	47.5	Very low	171 Å²	171	141 Å²	141	91%	0.914	74%	0.739	S	S	*	*			trans	-65.7	124.2	143.4	-74.4	-41.4	0	0	0	106.8
51	D	44.4	Very low	46.8	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	75%	0.747	S	S	*	*			trans	-156.7	151.3	146.4	-152.9	4.3	0	0	0	111.6
52	D	45.5	Very low	45.7	Very low	135 Å²	135	138.7 Å²	138.7	72%	0.722	74%	0.74	S	S	*	*			trans	-75.4	150.7	-151.9	-174.4	24	0	0	0	115.5	G54	D52-G54 PolarHBondContact O-N 2.99Å
53	Y	47.2	Very low	45.6	Very low	235 Å²	235	136.7 Å²	136.7	92%	0.922	73%	0.734	S	S	*	*			trans	-83.8	76.5	-177.1	-56.3	-94	0	0	0	109.7
54	G	35.5	Very low	45.5	Very low	56 Å²	56	142 Å²	142	58%	0.577	75%	0.747	S	S	*	*			trans	-132.9	117.4	-179	0	0	0	0	0	114.2	D52	D52-G54 PolarHBondContact O-N 2.99Å
55	V	43.8	Very low	45.6	Very low	137 Å²	137	138.8 Å²	138.8	83%	0.83	74%	0.743	S	S	*	*			trans	76.8	100.3	163.1	-166.4	0	0	0	0	116.8	E57	V55-E57 PolarHBondContact O-N 3.13Å
56	I	52.3	Low	46.2	Very low	166 Å²	166	138.9 Å²	138.9	85%	0.851	74%	0.735	S	S	*	*			trans	-80.6	94	168.7	-57.9	168.3	0	0	0	108
57	E	39.1	Very low	46.9	Very low	180 Å²	180	140.4 Å²	140.4	84%	0.841	73%	0.725	S	S	*	*			trans	-149.9	130.1	155.4	-138.7	171.7	-176	0	0	107.2	V55	V55-E57 PolarHBondContact O-N 3.13Å
58	D	45.5	Very low	48.6	Very low	139 Å²	139	133.1 Å²	133.1	74%	0.743	70%	0.699	S	S	*	*			trans	86.6	40.4	179.4	-118.1	3.7	0	0	0	119.8	E60	D58-E60 PolarHBondContact O-N 3.11Å
59	R	52.8	Low	50.7	Low	183 Å²	183	134.1 Å²	134.1	69%	0.691	69%	0.689	S	S	*	*	H	α-helix	trans	-71.7	-19.1	177.9	-156.9	178.3	-168.8	-180	5.5	115.3	T63	R59-T63 WeakPolarHBondContact O-CG2 3.18Å
60	E	47.5	Very low	52.9	Low	174 Å²	174	135 Å²	135	81%	0.813	68%	0.682	S	S	*	*	H	α-helix	trans	-72.9	-38.9	-172.6	-71	-173.6	176.4	0	0	113.3	D58 T63	D58-E60 PolarHBondContact O-N 3.11Å; E60-T63 PolarHBondContact O-OG1 2.71Å
61	A	49.4	Very low	55	Low	87 Å²	87	129.5 Å²	129.5	72%	0.719	65%	0.65	S	S	*	*	H	α-helix	trans	-79.5	-26.6	-179.3	0	0	0	0	0	113.8	T63	A61-T63 VanDerWaalsContact C-N 3.29Å; A61-T63 PolarHBondContact O-N 3.3Å
62	Q	45.3	Very low	56.8	Low	124 Å²	124	126.3 Å²	126.3	58%	0.579	63%	0.632	S	S	*	*	H	α-helix	trans	-77	-13	178.8	-158.9	79.8	-4.7	0	0	112.9	R64 E66	Q62-R64 PolarHBondContact O-N 2.69Å; Q62-E66 WeakPolarHBondContact O-CB 3.44Å
63	T	52.7	Low	58.7	Low	67 Å²	67	121.8 Å²	121.8	41%	0.411	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67	-23.5	-169.3	52.7	0	0	0	0	116.1	R59 E60 A61 W67	R59-T63 WeakPolarHBondContact O-CG2 3.18Å; E60-T63 PolarHBondContact O-OG1 2.71Å; A61-T63 VanDerWaalsContact C-N 3.29Å; A61-T63 PolarHBondContact O-N 3.3Å; T63-W67 VanDerWaalsContact O-CD1 3.27Å
64	R	54.9	Low	60.5	Low	234 Å²	234	112.7 Å²	112.7	88%	0.883	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-36.6	-170	-160	174.5	-174.1	164.3	2.3	113.8	Q62	Q62-R64 PolarHBondContact O-N 2.69Å
65	S	53.9	Low	62.9	Low	98 Å²	98	113.7 Å²	113.7	69%	0.685	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-9.2	-179.3	62.9	0	0	0	0	113.9	W67	S65-W67 VanDerWaalsContact C-N 3.31Å; S65-W67 PolarHBondContact O-N 3.32Å
66	E	58.9	Low	65	Low	76 Å²	76	113.2 Å²	113.2	36%	0.355	56%	0.563	S	S	.	*			trans	-83.2	-3.5	-176.6	-154.3	-169.3	-159.4	0	0	113.3	Q62 T68 K71	Q62-E66 WeakPolarHBondContact O-CB 3.44Å; E66-T68 PolarHBondContact O-N 3.13Å; E66-K71 HydrophobicContact CG-CD 4.39Å; E66-K71 WeakPolarHBondContact O-CD 3.23Å; E66-K71 IonicContact OE2-NZ 3.09Å; E66-K71 PolarHBondContact OE2-NZ 3.05Å
67	W	62.7	Low	66.8	Low	155 Å²	155	112.8 Å²	112.8	59%	0.587	55%	0.551	S	S	*	*			trans	-72.6	52.5	168.1	-71.2	98.3	0	0	0	111.6	T63 S65 L72 I75	T63-W67 VanDerWaalsContact O-CD1 3.27Å; S65-W67 VanDerWaalsContact C-N 3.31Å; S65-W67 PolarHBondContact O-N 3.32Å; W67-L72 HydrophobicContact CE3-CD2 3.96Å; W67-L72 HydrophobicContact CE3-CG 4.48Å; W67-L72 HydrophobicContact CZ3-CD2 4.11Å; W67-I75 HydrophobicContact CH2-CD1 4.49Å; W67-I75 HydrophobicContact CZ3-CD1 3.85Å
68	T	78.5	Confident	69.3	Low	66 Å²	66	110.2 Å²	110.2	41%	0.405	54%	0.539	S	S	.	.			trans	-64.9	151.8	173.9	63.2	0	0	0	0	109.5	E66 Q70 K71 L72	E66-T68 PolarHBondContact O-N 3.13Å; T68-Q70 PolarHBondContact O-N 3.31Å; T68-Q70 VanDerWaalsContact O-N 3.11Å; T68-K71 WeakPolarHBondContact O-CA 3.39Å; T68-K71 WeakPolarHBondContact O-CB 3.46Å; T68-K71 PolarHBondContact O-N 3.03Å; T68-K71 PolarHBondContact OG1-N 3.42Å; T68-L72 PolarHBondContact O-N 2.93Å; T68-L72 VanDerWaalsContact O-N 3.09Å
69	L	77.8	Confident	71.2	Confident	86 Å²	86	106.1 Å²	106.1	45%	0.45	52%	0.524	S	S	.	.	H	α-helix	trans	-49.6	-36.6	171.1	-158.9	87.8	0	0	0	111.5	M42 L72 A73	M42-L69 HydrophobicContact CE-CD1 3.37Å; M42-L69 HydrophobicContact CE-CG 4.18Å; M42-L69 HydrophobicContact CG-CD1 4.14Å; M42-L69 HydrophobicContact CG-CD2 3.78Å; M42-L69 HydrophobicContact CG-CG 4.21Å; L69-L72 PolarHBondContact O-N 3.2Å; L69-A73 WeakPolarHBondContact O-CB 3.44Å; L69-A73 PolarHBondContact O-N 3.37Å
70	Q	82.1	Confident	72.9	Confident	113 Å²	113	100.5 Å²	100.5	53%	0.528	51%	0.506	S	S	.	.	H	α-helix	trans	-60.9	-42.8	174.7	-176.4	-177.4	-7.1	0	0	112.4	T68 A73 S74	T68-Q70 PolarHBondContact O-N 3.31Å; T68-Q70 VanDerWaalsContact O-N 3.11Å; Q70-A73 PolarHBondContact O-N 3.49Å; Q70-S74 VanDerWaalsContact O-CB 3.3Å; Q70-S74 WeakPolarHBondContact O-CB 3.49Å; Q70-S74 PolarHBondContact O-N 3.28Å
71	K	84.2	Confident	74.6	Confident	56 Å²	56	96.3 Å²	96.3	24%	0.243	49%	0.492	C	S	.	.	H	α-helix	trans	-66.1	-41.5	176.3	-164.7	171	-176.9	179.6	0	111.1	E66 T68 S74 I75	E66-K71 HydrophobicContact CG-CD 4.39Å; E66-K71 WeakPolarHBondContact O-CD 3.23Å; E66-K71 IonicContact OE2-NZ 3.09Å; E66-K71 PolarHBondContact OE2-NZ 3.05Å; T68-K71 WeakPolarHBondContact O-CA 3.39Å; T68-K71 WeakPolarHBondContact O-CB 3.46Å; T68-K71 PolarHBondContact O-N 3.03Å; T68-K71 PolarHBondContact OG1-N 3.42Å; K71-S74 WeakPolarHBondContact O-CB 3.38Å; K71-S74 PolarHBondContact O-N 2.83Å; K71-I75 HydrophobicContact CG-CD1 4.34Å; K71-I75 VanDerWaalsContact O-CG1 3.28Å; K71-I75 WeakPolarHBondContact O-CG1 3.16Å; K71-I75 PolarHBondContact O-N 3.26Å
72	L	83.5	Confident	76.1	Confident	85 Å²	85	96.5 Å²	96.5	45%	0.445	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-47.3	174.2	-71.8	169.1	0	0	0	112.1	W67 T68 L69 S74 I75 F76	W67-L72 HydrophobicContact CE3-CD2 3.96Å; W67-L72 HydrophobicContact CE3-CG 4.48Å; W67-L72 HydrophobicContact CZ3-CD2 4.11Å; T68-L72 PolarHBondContact O-N 2.93Å; T68-L72 VanDerWaalsContact O-N 3.09Å; L69-L72 PolarHBondContact O-N 3.2Å; L72-S74 VanDerWaalsContact C-N 3.27Å; L72-S74 PolarHBondContact O-N 3.4Å; L72-I75 PolarHBondContact O-N 3.2Å; L72-F76 WeakPolarHBondContact O-CB 3.43Å; L72-F76 PolarHBondContact O-N 2.83Å
73	A	85.6	Confident	77.7	Confident	40 Å²	40	96.1 Å²	96.1	33%	0.331	48%	0.477	S	S	.	.	H	α-helix	trans	-63.6	-33.3	176.2	0	0	0	0	0	112.3	L69 Q70 R77	L69-A73 WeakPolarHBondContact O-CB 3.44Å; L69-A73 PolarHBondContact O-N 3.37Å; Q70-A73 PolarHBondContact O-N 3.49Å; A73-R77 WeakPolarHBondContact O-CB 3.27Å; A73-R77 WeakPolarHBondContact O-CG 3.35Å; A73-R77 PolarHBondContact O-N 3.47Å; A73-R77 PolarHBondContact O-NE 3.42Å
74	S	85	Confident	79	Confident	45 Å²	45	96.9 Å²	96.9	32%	0.315	48%	0.479	S	S	.	.	H	α-helix	trans	-65.9	-48.4	172.5	-175	0	0	0	0	111.4	Q70 K71 L72 F76 R77 Q78	Q70-S74 VanDerWaalsContact O-CB 3.3Å; Q70-S74 WeakPolarHBondContact O-CB 3.49Å; Q70-S74 PolarHBondContact O-N 3.28Å; K71-S74 WeakPolarHBondContact O-CB 3.38Å; K71-S74 PolarHBondContact O-N 2.83Å; L72-S74 VanDerWaalsContact C-N 3.27Å; L72-S74 PolarHBondContact O-N 3.4Å; S74-F76 VanDerWaalsContact C-N 3.31Å; S74-F76 PolarHBondContact O-N 3.22Å; S74-R77 PolarHBondContact O-N 3.42Å; S74-Q78 WeakPolarHBondContact O-CG 3.4Å; S74-Q78 PolarHBondContact O-N 2.87Å; S74-Q78 PolarHBondContact OG-NE2 3.41Å; S74-Q78 VanDerWaalsContact OG-NE2 3.13Å
75	I	84.8	Confident	80	Confident	77 Å²	77	91 Å²	91	40%	0.395	46%	0.462	S	S	.	.	H	α-helix	trans	-59.6	-43.9	176.1	-68	164.5	0	0	0	110.5	W67 K71 L72 R77 Q78 A79	W67-I75 HydrophobicContact CH2-CD1 4.49Å; W67-I75 HydrophobicContact CZ3-CD1 3.85Å; K71-I75 HydrophobicContact CG-CD1 4.34Å; K71-I75 VanDerWaalsContact O-CG1 3.28Å; K71-I75 WeakPolarHBondContact O-CG1 3.16Å; K71-I75 PolarHBondContact O-N 3.26Å; L72-I75 PolarHBondContact O-N 3.2Å; I75-R77 PolarHBondContact O-N 3.48Å; I75-Q78 PolarHBondContact O-N 3.35Å; I75-A79 WeakPolarHBondContact O-CB 3.42Å; I75-A79 PolarHBondContact O-N 2.88Å
76	F	88.6	Confident	80.9	Confident	126 Å²	126	91.4 Å²	91.4	55%	0.553	46%	0.456	S	S	*	.	H	α-helix	trans	-61.2	-46.2	178.1	-176.2	-100	0	0	0	111.9	L72 S74 Q78 A79 Q80	L72-F76 WeakPolarHBondContact O-CB 3.43Å; L72-F76 PolarHBondContact O-N 2.83Å; S74-F76 VanDerWaalsContact C-N 3.31Å; S74-F76 PolarHBondContact O-N 3.22Å; F76-Q78 VanDerWaalsContact C-N 3.35Å; F76-Q78 PolarHBondContact O-N 2.88Å; F76-A79 PolarHBondContact O-N 3.32Å; F76-Q80 HydrophobicContact CD1-CG 4.24Å; F76-Q80 HydrophobicContact CE1-CG 3.9Å; F76-Q80 HydrophobicContact CZ-CG 4.12Å; F76-Q80 WeakPolarHBondContact O-CG 3.33Å; F76-Q80 PolarHBondContact O-N 3.08Å
77	R	91.1	Very high	81.5	Confident	158 Å²	158	91.6 Å²	91.6	60%	0.596	47%	0.47	S	S	*	.	H	α-helix	trans	-59.6	-44.4	174.6	-78.5	-177.1	-81.8	-153.4	-1.4	111.9	A73 S74 I75 A79 Q80 V81	A73-R77 WeakPolarHBondContact O-CB 3.27Å; A73-R77 WeakPolarHBondContact O-CG 3.35Å; A73-R77 PolarHBondContact O-N 3.47Å; A73-R77 PolarHBondContact O-NE 3.42Å; S74-R77 PolarHBondContact O-N 3.42Å; I75-R77 PolarHBondContact O-N 3.48Å; R77-A79 VanDerWaalsContact C-N 3.35Å; R77-A79 PolarHBondContact O-N 2.94Å; R77-Q80 PolarHBondContact O-N 3.48Å; R77-V81 WeakPolarHBondContact O-CG2 3.36Å; R77-V81 PolarHBondContact O-N 3.25Å
78	Q	89.8	Confident	82	Confident	125 Å²	125	91 Å²	91	58%	0.584	48%	0.479	S	S	*	.	H	α-helix	trans	-62.9	-40.3	176.6	-70.6	174.9	43.5	0	0	112.1	S74 I75 F76 V81 L82	S74-Q78 WeakPolarHBondContact O-CG 3.4Å; S74-Q78 PolarHBondContact O-N 2.87Å; S74-Q78 PolarHBondContact OG-NE2 3.41Å; S74-Q78 VanDerWaalsContact OG-NE2 3.13Å; I75-Q78 PolarHBondContact O-N 3.35Å; F76-Q78 VanDerWaalsContact C-N 3.35Å; F76-Q78 PolarHBondContact O-N 2.88Å; Q78-V81 PolarHBondContact O-N 3.46Å; Q78-L82 WeakPolarHBondContact O-CB 3.33Å; Q78-L82 PolarHBondContact O-N 3Å
79	A	86.2	Confident	81.5	Confident	53 Å²	53	92.6 Å²	92.6	44%	0.438	48%	0.478	S	S	.	.	H	α-helix	trans	-65.6	-38.8	176.6	0	0	0	0	0	112.3	I75 F76 R77 L82 K83	I75-A79 WeakPolarHBondContact O-CB 3.42Å; I75-A79 PolarHBondContact O-N 2.88Å; F76-A79 PolarHBondContact O-N 3.32Å; R77-A79 VanDerWaalsContact C-N 3.35Å; R77-A79 PolarHBondContact O-N 2.94Å; A79-L82 PolarHBondContact O-N 2.88Å; A79-K83 WeakPolarHBondContact O-CB 3.36Å; A79-K83 PolarHBondContact O-N 3.41Å
80	Q	87.8	Confident	81.3	Confident	66 Å²	66	92.1 Å²	92.1	31%	0.308	48%	0.476	S	S	.	.	H	α-helix	trans	-64.4	-47.2	173.9	-68.8	-65.2	-17.7	0	0	111.5	F76 R77 L82 K83 D84	F76-Q80 HydrophobicContact CD1-CG 4.24Å; F76-Q80 HydrophobicContact CE1-CG 3.9Å; F76-Q80 HydrophobicContact CZ-CG 4.12Å; F76-Q80 WeakPolarHBondContact O-CG 3.33Å; F76-Q80 PolarHBondContact O-N 3.08Å; R77-Q80 PolarHBondContact O-N 3.48Å; Q80-L82 VanDerWaalsContact C-N 3.28Å; Q80-L82 PolarHBondContact O-N 3.37Å; Q80-K83 WeakPolarHBondContact O-CB 3.31Å; Q80-K83 PolarHBondContact O-N 2.92Å; Q80-D84 PolarHBondContact O-N 3.37Å
81	V	83.5	Confident	80.9	Confident	86 Å²	86	90.7 Å²	90.7	52%	0.521	48%	0.475	S	S	.	.	H	α-helix	trans	-58.7	-42.3	175.7	173.5	0	0	0	0	110.7	R77 Q78 D84 M85	R77-V81 WeakPolarHBondContact O-CG2 3.36Å; R77-V81 PolarHBondContact O-N 3.25Å; Q78-V81 PolarHBondContact O-N 3.46Å; V81-D84 PolarHBondContact O-N 2.93Å; V81-M85 HydrophobicContact CG1-CE 4.16Å; V81-M85 WeakPolarHBondContact O-CG 3.39Å; V81-M85 PolarHBondContact O-N 3.44Å
82	L	81	Confident	80.5	Confident	91 Å²	91	94.3 Å²	94.3	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-44.6	175.8	-179.3	61.5	0	0	0	112.5	Q78 A79 Q80 D84 M85 I86	Q78-L82 WeakPolarHBondContact O-CB 3.33Å; Q78-L82 PolarHBondContact O-N 3Å; A79-L82 PolarHBondContact O-N 2.88Å; Q80-L82 VanDerWaalsContact C-N 3.28Å; Q80-L82 PolarHBondContact O-N 3.37Å; L82-D84 VanDerWaalsContact C-N 3.3Å; L82-D84 PolarHBondContact O-N 2.97Å; L82-M85 HydrophobicContact CB-CE 4.3Å; L82-M85 HydrophobicContact CD1-CE 3.86Å; L82-M85 PolarHBondContact O-N 2.93Å; L82-I86 HydrophobicContact CD1-CD1 4.25Å; L82-I86 HydrophobicContact CD1-CG1 4.46Å; L82-I86 HydrophobicContact CG-CD1 4.03Å; L82-I86 VanDerWaalsContact O-CG1 3.31Å; L82-I86 WeakPolarHBondContact O-CG1 3.44Å; L82-I86 PolarHBondContact O-N 3.17Å
83	K	80.2	Confident	80.4	Confident	115 Å²	115	94.3 Å²	94.3	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-59	-42.9	176.2	-175.4	-152.3	74.9	-166.9	0	111.2	A79 Q80 I86 A87	A79-K83 WeakPolarHBondContact O-CB 3.36Å; A79-K83 PolarHBondContact O-N 3.41Å; Q80-K83 WeakPolarHBondContact O-CB 3.31Å; Q80-K83 PolarHBondContact O-N 2.92Å; K83-I86 PolarHBondContact O-N 3.2Å; K83-A87 PolarHBondContact O-N 3.27Å
84	D	78.4	Confident	80.2	Confident	84 Å²	84	98.3 Å²	98.3	45%	0.449	50%	0.501	S	S	.	.	H	α-helix	trans	-67.9	-40.4	177.9	-64.3	-13.8	0	0	0	111.2	Q80 V81 L82 I86 A87 D88	Q80-D84 PolarHBondContact O-N 3.37Å; V81-D84 PolarHBondContact O-N 2.93Å; L82-D84 VanDerWaalsContact C-N 3.3Å; L82-D84 PolarHBondContact O-N 2.97Å; D84-I86 VanDerWaalsContact C-N 3.27Å; D84-I86 PolarHBondContact O-N 3.08Å; D84-A87 WeakPolarHBondContact O-CB 3.33Å; D84-A87 PolarHBondContact O-N 3.35Å; D84-A87 VanDerWaalsContact O-N 3.08Å; D84-D88 PolarHBondContact O-N 3.27Å
85	M	77.3	Confident	79.9	Confident	111 Å²	111	103.1 Å²	103.1	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-61.2	-34.5	172.1	-72.4	-171.9	-62.5	0	0	112.8	V81 L82 Y89	V81-M85 HydrophobicContact CG1-CE 4.16Å; V81-M85 WeakPolarHBondContact O-CG 3.39Å; V81-M85 PolarHBondContact O-N 3.44Å; L82-M85 HydrophobicContact CB-CE 4.3Å; L82-M85 HydrophobicContact CD1-CE 3.86Å; L82-M85 PolarHBondContact O-N 2.93Å; M85-Y89 PolarHBondContact O-N 3.24Å
86	I	72.4	Confident	79.7	Confident	105 Å²	105	104.1 Å²	104.1	54%	0.538	52%	0.519	S	S	.	.	H	α-helix	trans	-72.7	-32.2	174.7	-68.1	165.2	0	0	0	111	L82 K83 D84 D88 Y89	L82-I86 HydrophobicContact CD1-CD1 4.25Å; L82-I86 HydrophobicContact CD1-CG1 4.46Å; L82-I86 HydrophobicContact CG-CD1 4.03Å; L82-I86 VanDerWaalsContact O-CG1 3.31Å; L82-I86 WeakPolarHBondContact O-CG1 3.44Å; L82-I86 PolarHBondContact O-N 3.17Å; K83-I86 PolarHBondContact O-N 3.2Å; D84-I86 VanDerWaalsContact C-N 3.27Å; D84-I86 PolarHBondContact O-N 3.08Å; I86-D88 VanDerWaalsContact C-N 3.25Å; I86-D88 PolarHBondContact O-N 3.02Å; I86-Y89 WeakPolarHBondContact O-CB 3.16Å; I86-Y89 PolarHBondContact O-N 3.41Å
87	A	72.3	Confident	79.6	Confident	81 Å²	81	101 Å²	101	67%	0.669	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-33.9	174.8	0	0	0	0	0	112	K83 D84 Y89	K83-A87 PolarHBondContact O-N 3.27Å; D84-A87 WeakPolarHBondContact O-CB 3.33Å; D84-A87 PolarHBondContact O-N 3.35Å; D84-A87 VanDerWaalsContact O-N 3.08Å; A87-Y89 VanDerWaalsContact C-N 3.28Å
88	D	71.2	Confident	79.5	Confident	143 Å²	143	99.5 Å²	99.5	77%	0.765	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-10.6	172.3	-68.8	-21.5	0	0	0	113.1	D84 I86 D90	D84-D88 PolarHBondContact O-N 3.27Å; I86-D88 VanDerWaalsContact C-N 3.25Å; I86-D88 PolarHBondContact O-N 3.02Å; D88-D90 PolarHBondContact O-N 2.92Å
89	Y	69.4	Low	79.3	Confident	99 Å²	99	97.5 Å²	97.5	39%	0.388	50%	0.504	S	S	.	.	S	Bend	trans	-72	112.7	179.8	-170.1	-92.3	0	0	0	110.1	M85 I86 A87 V91 M93 E94 I97	M85-Y89 PolarHBondContact O-N 3.24Å; I86-Y89 WeakPolarHBondContact O-CB 3.16Å; I86-Y89 PolarHBondContact O-N 3.41Å; A87-Y89 VanDerWaalsContact C-N 3.28Å; Y89-V91 PolarHBondContact O-N 3.41Å; Y89-M93 HydrophobicContact CD2-CE 3.82Å; Y89-M93 HydrophobicContact CE1-CB 4.3Å; Y89-M93 HydrophobicContact CE2-CE 3.95Å; Y89-M93 HydrophobicContact CG-CE 4.23Å; Y89-E94 HydrophobicContact CE1-CB 4.04Å; Y89-I97 VanDerWaalsContact OH-CD1 3.32Å; Y89-I97 WeakPolarHBondContact OH-CD1 3.44Å
90	D	73	Confident	79.4	Confident	76 Å²	76	99.9 Å²	99.9	41%	0.406	51%	0.509	S	S	.	.			trans	-63.7	121.3	179.7	-171.6	-6.7	0	0	0	111.2	D88 F92 M93	D88-D90 PolarHBondContact O-N 2.92Å; D90-F92 PolarHBondContact O-N 3.36Å; D90-F92 VanDerWaalsContact O-N 3.09Å; D90-F92 WeakPolarHBondContact OD1-CB 3.34Å; D90-F92 WeakPolarHBondContact OD1-CD2 3.38Å; D90-F92 PolarHBondContact OD1-N 3.09Å; D90-M93 HydrophobicContact CB-CE 3.9Å; D90-M93 HydrophobicContact CB-CG 4.2Å; D90-M93 WeakPolarHBondContact O-CA 3.46Å; D90-M93 WeakPolarHBondContact O-CB 3.32Å; D90-M93 PolarHBondContact O-N 2.83Å
91	V	74.1	Confident	79.6	Confident	83 Å²	83	105.5 Å²	105.5	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-53.1	-29.5	172.5	175.9	0	0	0	0	111.4	Y89 M93 E94 R95	Y89-V91 PolarHBondContact O-N 3.41Å; V91-M93 VanDerWaalsContact C-N 3.34Å; V91-E94 PolarHBondContact O-N 3.43Å; V91-R95 WeakPolarHBondContact O-CG 3.33Å; V91-R95 PolarHBondContact O-N 3.2Å
92	F	75.2	Confident	80	Confident	131 Å²	131	103.1 Å²	103.1	58%	0.575	52%	0.52	S	S	*	.	H	α-helix	trans	-66.2	-33.4	173.8	-64.8	-69.1	0	0	0	112.5	D90 R95 D96	D90-F92 PolarHBondContact O-N 3.36Å; D90-F92 VanDerWaalsContact O-N 3.09Å; D90-F92 WeakPolarHBondContact OD1-CB 3.34Å; D90-F92 WeakPolarHBondContact OD1-CD2 3.38Å; D90-F92 PolarHBondContact OD1-N 3.09Å; F92-R95 PolarHBondContact O-N 3.25Å; F92-D96 WeakPolarHBondContact O-CB 3.46Å; F92-D96 VanDerWaalsContact O-CG 3.25Å; F92-D96 PolarHBondContact O-N 2.89Å
93	M	81	Confident	80.4	Confident	85 Å²	85	103.1 Å²	103.1	42%	0.419	52%	0.52	S	S	.	.	H	α-helix	trans	-64.7	-39.6	173.4	-73.9	-169.3	-70.2	0	0	112.1	Y89 D90 V91 R95 D96 I97	Y89-M93 HydrophobicContact CD2-CE 3.82Å; Y89-M93 HydrophobicContact CE1-CB 4.3Å; Y89-M93 HydrophobicContact CE2-CE 3.95Å; Y89-M93 HydrophobicContact CG-CE 4.23Å; D90-M93 HydrophobicContact CB-CE 3.9Å; D90-M93 HydrophobicContact CB-CG 4.2Å; D90-M93 WeakPolarHBondContact O-CA 3.46Å; D90-M93 WeakPolarHBondContact O-CB 3.32Å; D90-M93 PolarHBondContact O-N 2.83Å; V91-M93 VanDerWaalsContact C-N 3.34Å; M93-R95 VanDerWaalsContact C-N 3.33Å; M93-R95 PolarHBondContact O-N 3.19Å; M93-D96 PolarHBondContact O-N 3.4Å; M93-I97 WeakPolarHBondContact O-CB 3.42Å; M93-I97 WeakPolarHBondContact O-CD1 3.4Å; M93-I97 VanDerWaalsContact O-CG1 3.23Å; M93-I97 WeakPolarHBondContact O-CG1 3.46Å; M93-I97 PolarHBondContact O-N 2.97Å
94	E	81.1	Confident	81	Confident	125 Å²	125	101.9 Å²	101.9	58%	0.584	52%	0.522	S	S	*	.	H	α-helix	trans	-60.1	-47	174.9	-164.1	179.4	174.9	0	0	111.2	Y89 V91 I97 M98	Y89-E94 HydrophobicContact CE1-CB 4.04Å; V91-E94 PolarHBondContact O-N 3.43Å; E94-I97 PolarHBondContact O-N 3.38Å; E94-M98 WeakPolarHBondContact O-CB 3.48Å; E94-M98 PolarHBondContact O-N 3.5Å
95	R	80	Confident	81.8	Confident	145 Å²	145	105.7 Å²	105.7	55%	0.547	54%	0.535	S	S	.	.	H	α-helix	trans	-62.2	-45.3	177.7	-69.7	-179.9	-179.9	-164.1	1.4	111.3	V91 F92 M93 M98 V99	V91-R95 WeakPolarHBondContact O-CG 3.33Å; V91-R95 PolarHBondContact O-N 3.2Å; F92-R95 PolarHBondContact O-N 3.25Å; M93-R95 VanDerWaalsContact C-N 3.33Å; M93-R95 PolarHBondContact O-N 3.19Å; R95-M98 PolarHBondContact O-N 3.42Å; R95-V99 WeakPolarHBondContact O-CB 3.46Å; R95-V99 VanDerWaalsContact O-CG2 3.27Å; R95-V99 WeakPolarHBondContact O-CG2 3.23Å; R95-V99 PolarHBondContact O-N 3.4Å
96	D	79.6	Confident	82.6	Confident	98 Å²	98	103.8 Å²	103.8	52%	0.524	53%	0.532	S	S	.	.	H	α-helix	trans	-61.8	-45	178.5	-77	-6.1	0	0	0	111.4	F92 M93 M98 V99 I100	F92-D96 WeakPolarHBondContact O-CB 3.46Å; F92-D96 VanDerWaalsContact O-CG 3.25Å; F92-D96 PolarHBondContact O-N 2.89Å; M93-D96 PolarHBondContact O-N 3.4Å; D96-M98 PolarHBondContact O-N 3.45Å; D96-V99 PolarHBondContact O-N 3.23Å; D96-I100 WeakPolarHBondContact O-CB 3.35Å; D96-I100 WeakPolarHBondContact O-CD1 3.34Å; D96-I100 VanDerWaalsContact O-CG1 3.24Å; D96-I100 WeakPolarHBondContact O-CG1 3.23Å; D96-I100 PolarHBondContact O-N 3Å
97	I	87.3	Confident	83.6	Confident	61 Å²	61	103.3 Å²	103.3	31%	0.313	53%	0.531	S	S	.	.	H	α-helix	trans	-61.6	-44	175.8	-71.4	164.8	0	0	0	110.9	Y89 M93 E94 I100 R101	Y89-I97 VanDerWaalsContact OH-CD1 3.32Å; Y89-I97 WeakPolarHBondContact OH-CD1 3.44Å; M93-I97 WeakPolarHBondContact O-CB 3.42Å; M93-I97 WeakPolarHBondContact O-CD1 3.4Å; M93-I97 VanDerWaalsContact O-CG1 3.23Å; M93-I97 WeakPolarHBondContact O-CG1 3.46Å; M93-I97 PolarHBondContact O-N 2.97Å; E94-I97 PolarHBondContact O-N 3.38Å; I97-I100 PolarHBondContact O-N 2.81Å; I97-R101 VanDerWaalsContact CG2-CZ 3.45Å; I97-R101 WeakPolarHBondContact O-CB 3.1Å; I97-R101 WeakPolarHBondContact O-CG 3.38Å; I97-R101 PolarHBondContact O-N 3.47Å
98	M	89.4	Confident	84.6	Confident	127 Å²	127	106.4 Å²	106.4	63%	0.626	53%	0.529	S	S	*	.	H	α-helix	trans	-62.5	-44.2	177.9	-175.7	176	62	0	0	111.4	E94 R95 D96 R101 G102	E94-M98 WeakPolarHBondContact O-CB 3.48Å; E94-M98 PolarHBondContact O-N 3.5Å; R95-M98 PolarHBondContact O-N 3.42Å; D96-M98 PolarHBondContact O-N 3.45Å; M98-R101 PolarHBondContact O-N 3.26Å; M98-G102 PolarHBondContact O-N 3.38Å
99	V	84.8	Confident	85.7	Confident	82 Å²	82	102.9 Å²	102.9	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-47.6	176.2	169.3	0	0	0	0	110.8	R95 D96 R101 G102 I103	R95-V99 WeakPolarHBondContact O-CB 3.46Å; R95-V99 VanDerWaalsContact O-CG2 3.27Å; R95-V99 WeakPolarHBondContact O-CG2 3.23Å; R95-V99 PolarHBondContact O-N 3.4Å; D96-V99 PolarHBondContact O-N 3.23Å; V99-R101 PolarHBondContact O-N 3.32Å; V99-G102 PolarHBondContact O-N 2.82Å; V99-I103 HydrophobicContact CG1-CD1 3.73Å; V99-I103 HydrophobicContact CG1-CG1 4.41Å; V99-I103 WeakPolarHBondContact O-CG1 3.24Å; V99-I103 PolarHBondContact O-N 2.93Å
100	I	89.1	Confident	86.6	Confident	104 Å²	104	103.2 Å²	103.2	53%	0.533	52%	0.522	S	S	.	.	H	α-helix	trans	-58.1	-48.6	177.3	-71.4	162.3	0	0	0	110.4	D96 I97 G102 I103 T104	D96-I100 WeakPolarHBondContact O-CB 3.35Å; D96-I100 WeakPolarHBondContact O-CD1 3.34Å; D96-I100 VanDerWaalsContact O-CG1 3.24Å; D96-I100 WeakPolarHBondContact O-CG1 3.23Å; D96-I100 PolarHBondContact O-N 3Å; I97-I100 PolarHBondContact O-N 2.81Å; I100-G102 VanDerWaalsContact C-N 3.33Å; I100-G102 PolarHBondContact O-N 3.49Å; I100-I103 PolarHBondContact O-N 3.25Å; I100-T104 WeakPolarHBondContact O-CB 3.34Å; I100-T104 PolarHBondContact O-N 3.42Å; I100-T104 PolarHBondContact O-OG1 2.86Å
101	R	91.9	Very high	87.5	Confident	183 Å²	183	101.2 Å²	101.2	69%	0.691	52%	0.519	S	S	*	.	H	α-helix	trans	-58.9	-43.6	177.8	-75.8	176.1	176.5	147.9	1.1	112	I97 M98 V99 T104 F105	I97-R101 VanDerWaalsContact CG2-CZ 3.45Å; I97-R101 WeakPolarHBondContact O-CB 3.1Å; I97-R101 WeakPolarHBondContact O-CG 3.38Å; I97-R101 PolarHBondContact O-N 3.47Å; M98-R101 PolarHBondContact O-N 3.26Å; V99-R101 PolarHBondContact O-N 3.32Å; R101-T104 PolarHBondContact O-N 2.9Å; R101-F105 WeakPolarHBondContact O-CB 3.27Å; R101-F105 PolarHBondContact O-N 2.79Å
102	G	91.1	Very high	88.4	Confident	36 Å²	36	102 Å²	102	37%	0.371	52%	0.52	S	S	.	.	H	α-helix	trans	-61.6	-44.5	176.5	0	0	0	0	0	112.8	M98 V99 I100 F105 S106	M98-G102 PolarHBondContact O-N 3.38Å; V99-G102 PolarHBondContact O-N 2.82Å; I100-G102 VanDerWaalsContact C-N 3.33Å; I100-G102 PolarHBondContact O-N 3.49Å; G102-F105 PolarHBondContact O-N 2.91Å; G102-S106 WeakPolarHBondContact O-CB 3.39Å; G102-S106 PolarHBondContact O-N 3.49Å; G102-S106 PolarHBondContact O-OG 3.32Å
103	I	89.6	Confident	89	Confident	92 Å²	92	101 Å²	101	47%	0.472	52%	0.52	S	S	.	.	H	α-helix	trans	-64.2	-49	175.7	-68	169.7	0	0	0	110.3	V99 I100 F105 S106 L107	V99-I103 HydrophobicContact CG1-CD1 3.73Å; V99-I103 HydrophobicContact CG1-CG1 4.41Å; V99-I103 WeakPolarHBondContact O-CG1 3.24Å; V99-I103 PolarHBondContact O-N 2.93Å; I100-I103 PolarHBondContact O-N 3.25Å; I103-F105 VanDerWaalsContact C-N 3.32Å; I103-F105 PolarHBondContact O-N 2.87Å; I103-S106 CarbonylContact O-C 3.45Å; I103-S106 PolarHBondContact O-N 2.85Å; I103-S106 VanDerWaalsContact O-N 3.14Å; I103-L107 HydrophobicContact CG2-CD1 3.72Å; I103-L107 HydrophobicContact CG2-CG 4.13Å; I103-L107 WeakPolarHBondContact O-CB 3.31Å; I103-L107 VanDerWaalsContact O-CG 3.32Å; I103-L107 WeakPolarHBondContact O-CG 3.4Å; I103-L107 PolarHBondContact O-N 3.09Å
104	T	93.7	Very high	89.4	Confident	88 Å²	88	103.7 Å²	103.7	54%	0.54	53%	0.53	S	S	.	.	H	α-helix	trans	-57.9	-44.3	178.3	-60.9	0	0	0	0	111.7	I100 R101 S106 L107 K108	I100-T104 WeakPolarHBondContact O-CB 3.34Å; I100-T104 PolarHBondContact O-N 3.42Å; I100-T104 PolarHBondContact O-OG1 2.86Å; R101-T104 PolarHBondContact O-N 2.9Å; T104-S106 VanDerWaalsContact C-N 3.35Å; T104-S106 PolarHBondContact O-N 3Å; T104-L107 PolarHBondContact O-N 2.99Å; T104-K108 PolarHBondContact O-N 3.11Å
105	F	94.4	Very high	90	Very high	164 Å²	164	101.6 Å²	101.6	72%	0.719	52%	0.523	S	S	*	.	H	α-helix	trans	-62.1	-42.9	176.3	-174.2	-94.6	0	0	0	111.7	R101 G102 I103 K108 P109	R101-F105 WeakPolarHBondContact O-CB 3.27Å; R101-F105 PolarHBondContact O-N 2.79Å; G102-F105 PolarHBondContact O-N 2.91Å; I103-F105 VanDerWaalsContact C-N 3.32Å; I103-F105 PolarHBondContact O-N 2.87Å; F105-K108 PolarHBondContact O-N 3.29Å; F105-P109 VanDerWaalsContact O-CD 3.23Å; F105-P109 WeakPolarHBondContact O-CD 3.48Å
106	S	93.5	Very high	90.5	Very high	71 Å²	71	102 Å²	102	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-69.6	-30.4	178.7	-56.6	0	0	0	0	113.3	G102 I103 T104 P109	G102-S106 WeakPolarHBondContact O-CB 3.39Å; G102-S106 PolarHBondContact O-N 3.49Å; G102-S106 PolarHBondContact O-OG 3.32Å; I103-S106 CarbonylContact O-C 3.45Å; I103-S106 PolarHBondContact O-N 2.85Å; I103-S106 VanDerWaalsContact O-N 3.14Å; T104-S106 VanDerWaalsContact C-N 3.35Å; T104-S106 PolarHBondContact O-N 3Å; S106-P109 WeakPolarHBondContact O-CD 3.32Å; S106-P109 WeakPolarHBondContact O-CG 3.44Å
107	L	93.3	Very high	90.7	Very high	96 Å²	96	99.3 Å²	99.3	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-74.4	-28.3	177.4	-76	174.9	0	0	0	112.9	I103 T104 L110 G111	I103-L107 HydrophobicContact CG2-CD1 3.72Å; I103-L107 HydrophobicContact CG2-CG 4.13Å; I103-L107 WeakPolarHBondContact O-CB 3.31Å; I103-L107 VanDerWaalsContact O-CG 3.32Å; I103-L107 WeakPolarHBondContact O-CG 3.4Å; I103-L107 PolarHBondContact O-N 3.09Å; T104-L107 PolarHBondContact O-N 2.99Å; L107-L110 HydrophobicContact CD2-CD1 4.24Å; L107-L110 WeakPolarHBondContact O-CB 3.49Å; L107-L110 PolarHBondContact O-N 2.89Å; L107-L110 VanDerWaalsContact O-N 3.11Å; L107-G111 PolarHBondContact O-N 3.45Å
108	K	94.6	Very high	90.6	Very high	146 Å²	146	102.5 Å²	102.5	64%	0.635	53%	0.531	S	S	*	.	H	α-helix	trans	-54.1	-50.6	-179	-170.9	172.7	-177.1	177.2	0	114.1	T104 F105 L110 G111 N112	T104-K108 PolarHBondContact O-N 3.11Å; F105-K108 PolarHBondContact O-N 3.29Å; K108-L110 VanDerWaalsContact C-N 3.32Å; K108-L110 PolarHBondContact O-N 3.36Å; K108-G111 PolarHBondContact O-N 3.33Å; K108-N112 PolarHBondContact O-N 3.14Å; K108-N112 VanDerWaalsContact O-N 3.09Å
109	P	92.8	Very high	90.5	Very high	69 Å²	69	104 Å²	104	45%	0.448	53%	0.534	S	S	.	.	H	α-helix	trans	-65.1	-33.4	176	24	-33.2	0	0	0	113	F105 S106 N112 L113	F105-P109 VanDerWaalsContact O-CD 3.23Å; F105-P109 WeakPolarHBondContact O-CD 3.48Å; S106-P109 WeakPolarHBondContact O-CD 3.32Å; S106-P109 WeakPolarHBondContact O-CG 3.44Å; P109-N112 WeakPolarHBondContact O-CB 3.44Å; P109-N112 PolarHBondContact O-N 3.3Å; P109-L113 WeakPolarHBondContact O-CG 3.32Å; P109-L113 PolarHBondContact O-N 3.22Å
110	L	90	Very high	90.4	Very high	106 Å²	106	103.2 Å²	103.2	56%	0.555	53%	0.533	S	S	*	.	H	α-helix	trans	-65.4	-41.1	175.4	-64.8	175.1	0	0	0	111.6	L107 K108 N112 L113 F114	L107-L110 HydrophobicContact CD2-CD1 4.24Å; L107-L110 WeakPolarHBondContact O-CB 3.49Å; L107-L110 PolarHBondContact O-N 2.89Å; L107-L110 VanDerWaalsContact O-N 3.11Å; K108-L110 VanDerWaalsContact C-N 3.32Å; K108-L110 PolarHBondContact O-N 3.36Å; L110-N112 PolarHBondContact O-N 2.98Å; L110-L113 PolarHBondContact O-N 3.43Å; L110-F114 PolarHBondContact O-N 3.34Å
111	G	90.8	Very high	89.1	Confident	33 Å²	33	103.7 Å²	103.7	34%	0.34	54%	0.536	S	S	.	.	H	α-helix	trans	-58.4	-45.3	171.4	0	0	0	0	0	112.1	L107 K108 L113 F114 D115	L107-G111 PolarHBondContact O-N 3.45Å; K108-G111 PolarHBondContact O-N 3.33Å; G111-L113 VanDerWaalsContact C-N 3.33Å; G111-L113 PolarHBondContact O-N 2.83Å; G111-F114 WeakPolarHBondContact O-CB 3.48Å; G111-F114 PolarHBondContact O-N 3.49Å; G111-D115 PolarHBondContact O-N 3.02Å
112	N	92	Very high	87.5	Confident	99 Å²	99	101 Å²	101	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-61.4	-39.4	176.6	-67.5	-21.2	0	0	0	112.7	K108 P109 L110 K116	K108-N112 PolarHBondContact O-N 3.14Å; K108-N112 VanDerWaalsContact O-N 3.09Å; P109-N112 WeakPolarHBondContact O-CB 3.44Å; P109-N112 PolarHBondContact O-N 3.3Å; L110-N112 PolarHBondContact O-N 2.98Å; N112-K116 VanDerWaalsContact O-CB 3.31Å; N112-K116 WeakPolarHBondContact O-CB 3.35Å; N112-K116 PolarHBondContact O-N 2.87Å
113	L	89.6	Confident	85.6	Confident	110 Å²	110	107.7 Å²	107.7	58%	0.576	55%	0.553	S	S	*	*	H	α-helix	trans	-66.1	-41.9	175.7	-71.6	174.8	0	0	0	111.5	P109 L110 G111 K116 A117	P109-L113 WeakPolarHBondContact O-CG 3.32Å; P109-L113 PolarHBondContact O-N 3.22Å; L110-L113 PolarHBondContact O-N 3.43Å; G111-L113 VanDerWaalsContact C-N 3.33Å; G111-L113 PolarHBondContact O-N 2.83Å; L113-K116 PolarHBondContact O-N 3.23Å; L113-A117 WeakPolarHBondContact O-CB 3.35Å; L113-A117 PolarHBondContact O-N 3.26Å
114	F	89.6	Confident	83.9	Confident	142 Å²	142	109.9 Å²	109.9	62%	0.623	56%	0.564	S	S	*	*	H	α-helix	trans	-61.8	-46.3	175.9	-178.1	-98.9	0	0	0	111.8	L110 G111 K116 A117 K118	L110-F114 PolarHBondContact O-N 3.34Å; G111-F114 WeakPolarHBondContact O-CB 3.48Å; G111-F114 PolarHBondContact O-N 3.49Å; F114-K116 VanDerWaalsContact C-N 3.33Å; F114-K116 PolarHBondContact O-N 3.2Å; F114-A117 PolarHBondContact O-N 2.97Å; F114-K118 WeakPolarHBondContact O-CB 3.47Å; F114-K118 PolarHBondContact O-N 3.43Å
115	D	91.9	Very high	81.8	Confident	82 Å²	82	110.2 Å²	110.2	44%	0.439	56%	0.563	S	S	.	*	H	α-helix	trans	-62.8	-39.8	176.1	-76.4	-23	0	0	0	112.3	G111 K118 K119	G111-D115 PolarHBondContact O-N 3.02Å; D115-K118 PolarHBondContact O-N 3.44Å; D115-K119 WeakPolarHBondContact O-CG 3.4Å; D115-K119 PolarHBondContact O-N 2.91Å
116	K	90.8	Very high	80	Confident	153 Å²	153	111 Å²	111	67%	0.665	57%	0.569	S	S	*	*	H	α-helix	trans	-62.4	-44.9	174.9	-174.3	179.1	179.3	-178.2	0	111.2	N112 L113 F114 K119 S120	N112-K116 VanDerWaalsContact O-CB 3.31Å; N112-K116 WeakPolarHBondContact O-CB 3.35Å; N112-K116 PolarHBondContact O-N 2.87Å; L113-K116 PolarHBondContact O-N 3.23Å; F114-K116 VanDerWaalsContact C-N 3.33Å; F114-K116 PolarHBondContact O-N 3.2Å; K116-K119 PolarHBondContact O-N 3.38Å; K116-S120 PolarHBondContact O-N 2.9Å; K116-S120 PolarHBondContact O-OG 2.95Å
117	A	83.8	Confident	78.4	Confident	42 Å²	42	111.2 Å²	111.2	35%	0.347	57%	0.57	S	S	.	*	H	α-helix	trans	-65.2	-40	177.8	0	0	0	0	0	112.1	L113 F114 K119 S120 N121	L113-A117 WeakPolarHBondContact O-CB 3.35Å; L113-A117 PolarHBondContact O-N 3.26Å; F114-A117 PolarHBondContact O-N 2.97Å; A117-K119 VanDerWaalsContact C-N 3.33Å; A117-K119 PolarHBondContact O-N 3.44Å; A117-S120 WeakPolarHBondContact CA-OG 3.29Å; A117-S120 PolarHBondContact O-N 3.18Å; A117-S120 PolarHBondContact O-OG 3.19Å; A117-N121 WeakPolarHBondContact O-CB 3.42Å; A117-N121 PolarHBondContact O-N 2.88Å
118	K	85.8	Confident	76.5	Confident	128 Å²	128	112.2 Å²	112.2	56%	0.557	58%	0.58	S	S	*	*	H	α-helix	trans	-59.8	-44.1	173.9	-173.6	176.3	179.2	178.7	0	111.2	F114 D115 I122	F114-K118 WeakPolarHBondContact O-CB 3.47Å; F114-K118 PolarHBondContact O-N 3.43Å; D115-K118 PolarHBondContact O-N 3.44Å; K118-I122 HydrophobicContact CG-CD1 4.12Å; K118-I122 WeakPolarHBondContact O-CD1 3.4Å; K118-I122 VanDerWaalsContact O-CG1 3.29Å; K118-I122 WeakPolarHBondContact O-CG1 3.37Å; K118-I122 PolarHBondContact O-N 3.25Å
119	K	87.7	Confident	74.4	Confident	157 Å²	157	110.9 Å²	110.9	68%	0.683	58%	0.584	S	S	*	*	H	α-helix	trans	-66.5	-34.9	176.3	-71.5	175.5	-175.1	178.5	0	113.2	D115 K116 A117	D115-K119 WeakPolarHBondContact O-CG 3.4Å; D115-K119 PolarHBondContact O-N 2.91Å; K116-K119 PolarHBondContact O-N 3.38Å; A117-K119 VanDerWaalsContact C-N 3.33Å; A117-K119 PolarHBondContact O-N 3.44Å
120	S	82	Confident	72.6	Confident	67 Å²	67	119.6 Å²	119.6	47%	0.469	62%	0.618	S	S	.	*	H	α-helix	trans	-75.3	-36.9	177.1	60.9	0	0	0	0	112.7	K116 A117 K123	K116-S120 PolarHBondContact O-N 2.9Å; K116-S120 PolarHBondContact O-OG 2.95Å; A117-S120 WeakPolarHBondContact CA-OG 3.29Å; A117-S120 PolarHBondContact O-N 3.18Å; A117-S120 PolarHBondContact O-OG 3.19Å; S120-K123 PolarHBondContact O-N 2.94Å
121	N	62.6	Low	71.7	Confident	114 Å²	114	120.3 Å²	120.3	61%	0.61	62%	0.621	S	S	*	*	H	α-helix	trans	-76.9	-18.9	-179.4	-71.3	-15.1	0	0	0	113.7	A117 K123	A117-N121 WeakPolarHBondContact O-CB 3.42Å; A117-N121 PolarHBondContact O-N 2.88Å; N121-K123 PolarHBondContact O-N 3.01Å
122	I	58.1	Low	70.7	Confident	125 Å²	125	124.9 Å²	124.9	64%	0.641	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-13.8	169.3	-68.5	162.9	0	0	0	111.5	K118 I124	K118-I122 HydrophobicContact CG-CD1 4.12Å; K118-I122 WeakPolarHBondContact O-CD1 3.4Å; K118-I122 VanDerWaalsContact O-CG1 3.29Å; K118-I122 WeakPolarHBondContact O-CG1 3.37Å; K118-I122 PolarHBondContact O-N 3.25Å; I122-I124 PolarHBondContact O-N 3.45Å
123	K	51.8	Low	69.5	Low	177 Å²	177	126.3 Å²	126.3	77%	0.77	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	33.9	171	-66.3	-173.4	175.9	-174.6	0	112.9	S120 N121 D125	S120-K123 PolarHBondContact O-N 2.94Å; N121-K123 PolarHBondContact O-N 3.01Å; K123-D125 VanDerWaalsContact C-N 3.31Å; K123-D125 PolarHBondContact O-N 2.92Å; K123-D125 VanDerWaalsContact O-N 3.13Å
124	I	53.9	Low	68.4	Low	138 Å²	138	127.3 Å²	127.3	71%	0.708	65%	0.646	S	S	*	*			trans	-75.3	102.8	155.8	-60.2	-171	0	0	0	105.7	I122 E126	I122-I124 PolarHBondContact O-N 3.45Å; I124-E126 PolarHBondContact O-N 3.13Å
125	D	49.6	Very low	67	Low	96 Å²	96	126.4 Å²	126.4	51%	0.513	65%	0.647	S	S	.	*			trans	-46.3	115.5	177.9	-167.1	-4.8	0	0	0	111.9	K123 S127 V128	K123-D125 VanDerWaalsContact C-N 3.31Å; K123-D125 PolarHBondContact O-N 2.92Å; K123-D125 VanDerWaalsContact O-N 3.13Å; D125-S127 PolarHBondContact O-N 3.27Å; D125-S127 WeakPolarHBondContact OD1-CB 3.09Å; D125-S127 PolarHBondContact OD1-N 3.32Å; D125-S127 PolarHBondContact OD1-OG 3.3Å; D125-S127 PolarHBondContact OD2-OG 3.48Å; D125-V128 PolarHBondContact O-N 3.04Å
126	E	55.4	Low	65.4	Low	181 Å²	181	129.3 Å²	129.3	85%	0.846	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-59.7	-6.7	168.7	-76.6	-178.6	153.8	0	0	112.4	I124 V128 V129	I124-E126 PolarHBondContact O-N 3.13Å; E126-V128 VanDerWaalsContact C-N 3.29Å; E126-V128 PolarHBondContact O-N 3.49Å; E126-V129 PolarHBondContact O-N 3.41Å
127	S	59.7	Low	63.6	Low	75 Å²	75	127.6 Å²	127.6	52%	0.524	66%	0.661	S	S	.	*	G	3₁₀ helix	trans	-71.6	-14.4	173.2	84.6	0	0	0	0	114.9	D125 V129	D125-S127 PolarHBondContact O-N 3.27Å; D125-S127 WeakPolarHBondContact OD1-CB 3.09Å; D125-S127 PolarHBondContact OD1-N 3.32Å; D125-S127 PolarHBondContact OD1-OG 3.3Å; D125-S127 PolarHBondContact OD2-OG 3.48Å; S127-V129 VanDerWaalsContact C-N 3.27Å; S127-V129 PolarHBondContact O-N 2.66Å
128	V	53.4	Low	62	Low	116 Å²	116	134.2 Å²	134.2	70%	0.703	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-85.8	0.2	178.4	-168.3	0	0	0	0	112.5	D125 E126	D125-V128 PolarHBondContact O-N 3.04Å; E126-V128 VanDerWaalsContact C-N 3.29Å; E126-V128 PolarHBondContact O-N 3.49Å
129	V	50.4	Low	60	Low	118 Å²	118	134.8 Å²	134.8	72%	0.715	70%	0.696	S	S	*	*			trans	-115.4	52.1	175.4	-162.1	0	0	0	0	110.9	E126 S127	E126-V129 PolarHBondContact O-N 3.41Å; S127-V129 VanDerWaalsContact C-N 3.27Å; S127-V129 PolarHBondContact O-N 2.66Å
130	H	55.9	Low	57.5	Low	253 Å²	253	132.7 Å²	132.7	100%	1.171	70%	0.697	S	S	*	*			trans	-144.3	0	155.4	-88.3	4.6	0	0	0	108.9

Retrieved 130 of 130 residues in 133.9 ms (Link to these results)

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