G4VJS4_SCHMA Loading...

Putative vesicle transport protein SEC20

AlphaFold DB , UniProt , Accession G4VJS4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 241 aa.

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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	55.9	Low	76	Confident	107 Å²	107	89.4 Å²	89.4	53%	0.527	44%	0.444	S	S	.	.				0	130.1	0	-130.4	175.6	-162.8	0	0	109	V6 K9 F68	M1-V6 HydrophobicContact SD-CG2 4.35Å; M1-K9 HydrophobicContact CE-CD 3.55Å; M1-F68 HydrophobicContact CB-CD2 3.51Å; M1-F68 HydrophobicContact CB-CE1 4.32Å; M1-F68 HydrophobicContact CB-CE2 3.23Å; M1-F68 HydrophobicContact CB-CG 4.17Å; M1-F68 HydrophobicContact CB-CZ 3.67Å; M1-F68 HydrophobicContact CG-CD2 4.33Å; M1-F68 HydrophobicContact CG-CE2 4.43Å; M1-F68 HydrophobicContact SD-CB 3.96Å; M1-F68 HydrophobicContact SD-CD1 4.17Å; M1-F68 HydrophobicContact SD-CD2 3.85Å; M1-F68 HydrophobicContact SD-CE2 4.44Å; M1-F68 HydrophobicContact SD-CG 3.69Å
2	S	67.2	Low	77.1	Confident	72 Å²	72	85.1 Å²	85.1	50%	0.503	43%	0.427	S	S	.	.			trans	-84.6	154.3	176	62.1	0	0	0	0	110.8	L4 S5 V6	S2-L4 PolarHBondContact O-N 3.18Å; S2-L4 VanDerWaalsContact O-N 3.11Å; S2-S5 WeakPolarHBondContact O-CB 3.2Å; S2-S5 PolarHBondContact O-N 3.24Å; S2-S5 PolarHBondContact OG-N 3.39Å; S2-V6 PolarHBondContact O-N 2.78Å
3	R	66.3	Low	77.9	Confident	180 Å²	180	78.8 Å²	78.8	68%	0.679	40%	0.395	S	S	*	.	H	α-helix	trans	-51.3	-34.4	173.4	-87.4	-176	163.5	-177.8	-4.2	112.5	S5 V6 N7 T77	R3-S5 VanDerWaalsContact C-N 3.34Å; R3-S5 PolarHBondContact O-N 3.24Å; R3-V6 PolarHBondContact O-N 3.24Å; R3-N7 PolarHBondContact O-N 3.32Å; R3-T77 PolarHBondContact NH2-OG1 3.17Å
4	L	70.2	Confident	78.6	Confident	142 Å²	142	79.6 Å²	79.6	74%	0.743	41%	0.406	S	S	*	.	H	α-helix	trans	-61.2	-41.7	176.1	-148.6	90.3	0	0	0	112.1	S2 N7 H8	S2-L4 PolarHBondContact O-N 3.18Å; S2-L4 VanDerWaalsContact O-N 3.11Å; L4-N7 PolarHBondContact O-N 3.3Å; L4-H8 WeakPolarHBondContact O-CB 3.32Å; L4-H8 PolarHBondContact O-N 3.05Å
5	S	80.3	Confident	79.3	Confident	39 Å²	39	78.7 Å²	78.7	27%	0.273	41%	0.409	S	S	.	.	H	α-helix	trans	-67.3	-37.7	178.3	178.1	0	0	0	0	112.3	S2 R3 H8 K9	S2-S5 WeakPolarHBondContact O-CB 3.2Å; S2-S5 PolarHBondContact O-N 3.24Å; S2-S5 PolarHBondContact OG-N 3.39Å; R3-S5 VanDerWaalsContact C-N 3.34Å; R3-S5 PolarHBondContact O-N 3.24Å; S5-H8 PolarHBondContact O-N 2.67Å; S5-K9 WeakPolarHBondContact O-CG 3.24Å; S5-K9 PolarHBondContact O-N 3.12Å
6	V	77.2	Confident	80	Confident	12 Å²	12	75.4 Å²	75.4	7%	0.073	39%	0.392	C	S	.	.	H	α-helix	trans	-64.6	-47.1	175.2	175.6	0	0	0	0	110.7	M1 S2 R3 H8 K9 L10 L65 F68 L81	M1-V6 HydrophobicContact SD-CG2 4.35Å; S2-V6 PolarHBondContact O-N 2.78Å; R3-V6 PolarHBondContact O-N 3.24Å; V6-H8 VanDerWaalsContact C-N 3.35Å; V6-H8 PolarHBondContact O-N 2.81Å; V6-K9 PolarHBondContact O-N 3.3Å; V6-L10 HydrophobicContact CG1-CD1 4.11Å; V6-L10 WeakPolarHBondContact O-CG 3.43Å; V6-L10 PolarHBondContact O-N 3.22Å; V6-L65 HydrophobicContact CB-CD2 4.42Å; V6-L65 HydrophobicContact CG1-CD2 3.88Å; V6-L65 HydrophobicContact CG2-CD2 4.41Å; V6-F68 HydrophobicContact CG2-CD1 3.99Å; V6-F68 HydrophobicContact CG2-CE1 3.77Å; V6-L81 HydrophobicContact CG1-CD1 3.63Å
7	N	79.6	Confident	80.5	Confident	102 Å²	102	72.2 Å²	72.2	55%	0.545	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-42.8	178.1	-72.4	-15.9	0	0	0	111.9	R3 L4 K9 L10 E11	R3-N7 PolarHBondContact O-N 3.32Å; L4-N7 PolarHBondContact O-N 3.3Å; N7-K9 VanDerWaalsContact C-N 3.34Å; N7-K9 PolarHBondContact O-N 3.1Å; N7-L10 PolarHBondContact O-N 3.22Å; N7-E11 WeakPolarHBondContact O-CB 3.31Å; N7-E11 PolarHBondContact O-N 3.02Å
8	H	86.3	Confident	81.1	Confident	118 Å²	118	71.3 Å²	71.3	55%	0.546	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-39.7	176.9	-176.9	58.2	0	0	0	112.5	L4 S5 V6 E11 T12	L4-H8 WeakPolarHBondContact O-CB 3.32Å; L4-H8 PolarHBondContact O-N 3.05Å; S5-H8 PolarHBondContact O-N 2.67Å; V6-H8 VanDerWaalsContact C-N 3.35Å; V6-H8 PolarHBondContact O-N 2.81Å; H8-E11 PolarHBondContact O-N 2.81Å; H8-T12 WeakPolarHBondContact O-CB 3.5Å; H8-T12 PolarHBondContact O-N 3.08Å; H8-T12 PolarHBondContact O-OG1 3.04Å
9	K	83.9	Confident	81.6	Confident	39 Å²	39	73.4 Å²	73.4	17%	0.17	39%	0.386	C	S	.	.	H	α-helix	trans	-64.5	-41.6	174.1	-81.6	-179.4	179.2	-79.3	0	112.3	M1 S5 V6 N7 T12 I13 I61 E64 L65	M1-K9 HydrophobicContact CE-CD 3.55Å; S5-K9 WeakPolarHBondContact O-CG 3.24Å; S5-K9 PolarHBondContact O-N 3.12Å; V6-K9 PolarHBondContact O-N 3.3Å; N7-K9 VanDerWaalsContact C-N 3.34Å; N7-K9 PolarHBondContact O-N 3.1Å; K9-T12 WeakPolarHBondContact O-CB 3.16Å; K9-T12 PolarHBondContact O-N 3.24Å; K9-I13 WeakPolarHBondContact O-CG1 3.31Å; K9-I13 PolarHBondContact O-N 3.1Å; K9-I61 HydrophobicContact CB-CG2 3.65Å; K9-I61 HydrophobicContact CD-CG2 4.11Å; K9-I61 HydrophobicContact CG-CG2 3.88Å; K9-E64 WeakPolarHBondContact CE-OE2 3.39Å; K9-E64 IonicContact NZ-OE1 2.58Å; K9-E64 IonicContact NZ-OE2 3.71Å; K9-E64 PolarHBondContact NZ-OE2 3.39Å; K9-L65 HydrophobicContact CB-CD1 4.34Å; K9-L65 HydrophobicContact CB-CD2 4.27Å; K9-L65 HydrophobicContact CB-CG 4.46Å; K9-L65 HydrophobicContact CD-CD2 4.38Å
10	L	83.1	Confident	81.9	Confident	38 Å²	38	69.8 Å²	69.8	20%	0.199	37%	0.367	C	S	.	.	H	α-helix	trans	-64.2	-43.2	175.5	-71	171	0	0	0	111.8	V6 N7 T12 I13 V14 L65 L81	V6-L10 HydrophobicContact CG1-CD1 4.11Å; V6-L10 WeakPolarHBondContact O-CG 3.43Å; V6-L10 PolarHBondContact O-N 3.22Å; N7-L10 PolarHBondContact O-N 3.22Å; L10-T12 VanDerWaalsContact C-N 3.3Å; L10-T12 PolarHBondContact O-N 3.27Å; L10-I13 PolarHBondContact O-N 3.16Å; L10-V14 WeakPolarHBondContact O-CG2 3.29Å; L10-V14 PolarHBondContact O-N 3.42Å; L10-L65 HydrophobicContact CD2-CD1 3.87Å; L10-L65 HydrophobicContact CG-CD1 4.32Å; L10-L81 HydrophobicContact CD1-CD1 4.37Å
11	E	86.3	Confident	82.4	Confident	134 Å²	134	70.7 Å²	70.7	63%	0.626	37%	0.368	S	S	*	.	H	α-helix	trans	-61.1	-41.1	175	-173.8	178.2	-168.6	0	0	111.5	N7 H8 I13 V14 S15	N7-E11 WeakPolarHBondContact O-CB 3.31Å; N7-E11 PolarHBondContact O-N 3.02Å; H8-E11 PolarHBondContact O-N 2.81Å; E11-I13 PolarHBondContact O-N 3.28Å; E11-V14 PolarHBondContact O-N 2.83Å; E11-S15 PolarHBondContact O-N 3.2Å
12	T	88.9	Confident	84.1	Confident	38 Å²	38	71 Å²	71	23%	0.233	37%	0.368	C	S	.	.	H	α-helix	trans	-60.5	-45.9	174.7	-55.5	0	0	0	0	110.9	H8 K9 L10 V14 S15 L16 I61	H8-T12 WeakPolarHBondContact O-CB 3.5Å; H8-T12 PolarHBondContact O-N 3.08Å; H8-T12 PolarHBondContact O-OG1 3.04Å; K9-T12 WeakPolarHBondContact O-CB 3.16Å; K9-T12 PolarHBondContact O-N 3.24Å; L10-T12 VanDerWaalsContact C-N 3.3Å; L10-T12 PolarHBondContact O-N 3.27Å; T12-V14 PolarHBondContact O-N 3.03Å; T12-S15 PolarHBondContact O-N 3.29Å; T12-S15 PolarHBondContact O-OG 2.66Å; T12-L16 HydrophobicContact CG2-CD1 4.01Å; T12-L16 WeakPolarHBondContact O-CD1 3.1Å; T12-L16 PolarHBondContact O-N 2.65Å; T12-I61 HydrophobicContact CG2-CD1 3.81Å
13	I	87	Confident	85.1	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-57.9	-47.5	175.7	-71.6	169.1	0	0	0	110.9	K9 L10 E11 S15 L16 D17 I58 I61 L62 L65 N88	K9-I13 WeakPolarHBondContact O-CG1 3.31Å; K9-I13 PolarHBondContact O-N 3.1Å; L10-I13 PolarHBondContact O-N 3.16Å; E11-I13 PolarHBondContact O-N 3.28Å; I13-S15 VanDerWaalsContact C-N 3.32Å; I13-S15 PolarHBondContact O-N 2.78Å; I13-L16 PolarHBondContact O-N 3.25Å; I13-D17 WeakPolarHBondContact O-CB 3.3Å; I13-D17 PolarHBondContact O-N 3.47Å; I13-I58 HydrophobicContact CG2-CG2 4.23Å; I13-I61 HydrophobicContact CD1-CB 4.14Å; I13-I61 HydrophobicContact CD1-CG2 3.62Å; I13-I61 HydrophobicContact CG1-CB 4.12Å; I13-I61 HydrophobicContact CG1-CD1 4.41Å; I13-I61 HydrophobicContact CG1-CG2 3.81Å; I13-L62 HydrophobicContact CD1-CD1 4.48Å; I13-L65 HydrophobicContact CD1-CD1 3.78Å; I13-N88 WeakPolarHBondContact CG2-OD1 3.39Å
14	V	87.6	Confident	86.2	Confident	90 Å²	90	59.5 Å²	59.5	55%	0.545	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-41.6	180	173.8	0	0	0	0	111.1	L10 E11 T12 D17 A18	L10-V14 WeakPolarHBondContact O-CG2 3.29Å; L10-V14 PolarHBondContact O-N 3.42Å; E11-V14 PolarHBondContact O-N 2.83Å; T12-V14 PolarHBondContact O-N 3.03Å; V14-D17 PolarHBondContact O-N 3.34Å; V14-A18 PolarHBondContact O-N 2.7Å
15	S	90.4	Very high	87.1	Confident	65 Å²	65	56.3 Å²	56.3	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-41	177.5	77.4	0	0	0	0	112.6	E11 T12 I13 A18 K19	E11-S15 PolarHBondContact O-N 3.2Å; T12-S15 PolarHBondContact O-N 3.29Å; T12-S15 PolarHBondContact O-OG 2.66Å; I13-S15 VanDerWaalsContact C-N 3.32Å; I13-S15 PolarHBondContact O-N 2.78Å; S15-A18 PolarHBondContact O-N 3.27Å; S15-K19 WeakPolarHBondContact O-CB 3.37Å; S15-K19 PolarHBondContact O-N 2.88Å
16	L	89.3	Confident	87.5	Confident	26 Å²	26	56.9 Å²	56.9	14%	0.136	30%	0.299	C	S	.	.	H	α-helix	trans	-70.9	-37	178	-95.8	64.6	0	0	0	111.7	T12 I13 K19 T20 T57 I58	T12-L16 HydrophobicContact CG2-CD1 4.01Å; T12-L16 WeakPolarHBondContact O-CD1 3.1Å; T12-L16 PolarHBondContact O-N 2.65Å; I13-L16 PolarHBondContact O-N 3.25Å; L16-K19 PolarHBondContact O-N 3.35Å; L16-T20 VanDerWaalsContact O-CB 3.29Å; L16-T20 WeakPolarHBondContact O-CB 3.29Å; L16-T20 PolarHBondContact O-N 3.42Å; L16-T20 PolarHBondContact O-OG1 3.17Å; L16-T57 HydrophobicContact CD2-CG2 3.56Å; L16-I58 HydrophobicContact CB-CD1 3.93Å; L16-I58 HydrophobicContact CB-CG1 3.81Å; L16-I58 HydrophobicContact CD2-CG1 4.07Å
17	D	89	Confident	88	Confident	22 Å²	22	56.3 Å²	56.3	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-61.8	-46.4	173.5	174.3	72	0	0	0	111	I13 V14 K19 T20 K21 L95	I13-D17 WeakPolarHBondContact O-CB 3.3Å; I13-D17 PolarHBondContact O-N 3.47Å; V14-D17 PolarHBondContact O-N 3.34Å; D17-K19 PolarHBondContact O-N 2.92Å; D17-T20 PolarHBondContact O-N 3.5Å; D17-K21 WeakPolarHBondContact O-CG 3.09Å; D17-K21 PolarHBondContact O-N 2.8Å; D17-K21 IonicContact OD1-NZ 3.88Å; D17-K21 WeakPolarHBondContact OD2-CE 3.44Å; D17-K21 IonicContact OD2-NZ 3.77Å; D17-K21 PolarHBondContact OD2-NZ 3.36Å; D17-L95 WeakPolarHBondContact OD1-CD2 3.5Å
18	A	90.9	Very high	88.4	Confident	56 Å²	56	54 Å²	54	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-59.9	-47.8	175.6	0	0	0	0	0	112.1	V14 S15 T20 K21 E22	V14-A18 PolarHBondContact O-N 2.7Å; S15-A18 PolarHBondContact O-N 3.27Å; A18-T20 VanDerWaalsContact C-N 3.29Å; A18-T20 PolarHBondContact O-N 2.85Å; A18-K21 WeakPolarHBondContact O-CB 3.03Å; A18-K21 PolarHBondContact O-N 2.94Å; A18-E22 PolarHBondContact O-N 3.46Å
19	K	90.7	Very high	88.4	Confident	110 Å²	110	51.7 Å²	51.7	48%	0.478	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-38.6	176.5	-172.2	178.4	-178.1	-175.5	0	112.2	S15 L16 D17 E22 L23	S15-K19 WeakPolarHBondContact O-CB 3.37Å; S15-K19 PolarHBondContact O-N 2.88Å; L16-K19 PolarHBondContact O-N 3.35Å; D17-K19 PolarHBondContact O-N 2.92Å; K19-E22 PolarHBondContact O-N 2.98Å; K19-L23 WeakPolarHBondContact O-CG 3.32Å; K19-L23 PolarHBondContact O-N 3.08Å
20	T	88.8	Confident	88.3	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-68.1	-40.5	178.1	-58	0	0	0	0	111.3	L16 D17 A18 E22 L23 I24 V51 N54 L95	L16-T20 VanDerWaalsContact O-CB 3.29Å; L16-T20 WeakPolarHBondContact O-CB 3.29Å; L16-T20 PolarHBondContact O-N 3.42Å; L16-T20 PolarHBondContact O-OG1 3.17Å; D17-T20 PolarHBondContact O-N 3.5Å; A18-T20 VanDerWaalsContact C-N 3.29Å; A18-T20 PolarHBondContact O-N 2.85Å; T20-E22 VanDerWaalsContact C-N 3.33Å; T20-E22 PolarHBondContact O-N 2.94Å; T20-L23 PolarHBondContact O-N 3.07Å; T20-I24 HydrophobicContact CG2-CD1 4.23Å; T20-I24 VanDerWaalsContact O-CG1 3.29Å; T20-I24 WeakPolarHBondContact O-CG1 3.4Å; T20-I24 PolarHBondContact O-N 3.41Å; T20-V51 HydrophobicContact CG2-CG1 3.85Å; T20-V51 HydrophobicContact CG2-CG2 4.3Å; T20-N54 VanDerWaalsContact OG1-CB 3.25Å; T20-N54 WeakPolarHBondContact OG1-CB 3.43Å; T20-N54 PolarHBondContact OG1-ND2 3.41Å; T20-N54 VanDerWaalsContact OG1-ND2 3.07Å; T20-L95 HydrophobicContact CG2-CD2 3.58Å; T20-L95 HydrophobicContact CG2-CG 4.13Å
21	K	91	Very high	88.1	Confident	89 Å²	89	50.3 Å²	50.3	39%	0.387	28%	0.276	S	S	.	.	H	α-helix	trans	-60	-42.4	172.8	-73.7	168.8	177.7	165.1	0	111.9	D17 A18 I24 V25 L95	D17-K21 WeakPolarHBondContact O-CG 3.09Å; D17-K21 PolarHBondContact O-N 2.8Å; D17-K21 IonicContact OD1-NZ 3.88Å; D17-K21 WeakPolarHBondContact OD2-CE 3.44Å; D17-K21 IonicContact OD2-NZ 3.77Å; D17-K21 PolarHBondContact OD2-NZ 3.36Å; A18-K21 WeakPolarHBondContact O-CB 3.03Å; A18-K21 PolarHBondContact O-N 2.94Å; K21-I24 PolarHBondContact O-N 2.93Å; K21-V25 WeakPolarHBondContact O-CG2 3.46Å; K21-V25 PolarHBondContact O-N 3.38Å; K21-V25 VanDerWaalsContact O-N 3.1Å; K21-L95 HydrophobicContact CB-CD1 4.5Å; K21-L95 HydrophobicContact CD-CD1 4.46Å; K21-L95 HydrophobicContact CG-CD1 3.43Å; K21-L95 VanDerWaalsContact CG-CD1 3.43Å
22	E	92.3	Very high	87.8	Confident	114 Å²	114	52.7 Å²	52.7	53%	0.533	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-46.7	176.4	-167.4	-168.1	158.7	0	0	111.5	A18 K19 T20 I24 V25 Q26	A18-E22 PolarHBondContact O-N 3.46Å; K19-E22 PolarHBondContact O-N 2.98Å; T20-E22 VanDerWaalsContact C-N 3.33Å; T20-E22 PolarHBondContact O-N 2.94Å; E22-I24 VanDerWaalsContact C-N 3.3Å; E22-I24 PolarHBondContact O-N 3.36Å; E22-V25 WeakPolarHBondContact O-CB 3.49Å; E22-V25 PolarHBondContact O-N 2.97Å; E22-V25 VanDerWaalsContact O-N 3.12Å; E22-Q26 WeakPolarHBondContact O-CG 3.33Å; E22-Q26 PolarHBondContact O-N 3.28Å; E22-Q26 PolarHBondContact OE1-NE2 3.34Å
23	L	89.1	Confident	87.2	Confident	11 Å²	11	52.5 Å²	52.5	6%	0.058	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-38.1	177	-70.3	170.5	0	0	0	112.3	K19 T20 V25 Q26 I27 Y47 K50 V51	K19-L23 WeakPolarHBondContact O-CG 3.32Å; K19-L23 PolarHBondContact O-N 3.08Å; T20-L23 PolarHBondContact O-N 3.07Å; L23-V25 VanDerWaalsContact C-N 3.34Å; L23-V25 PolarHBondContact O-N 3.05Å; L23-Q26 PolarHBondContact O-N 3.48Å; L23-I27 WeakPolarHBondContact O-CG1 3.3Å; L23-I27 PolarHBondContact O-N 2.84Å; L23-Y47 HydrophobicContact CD2-CD1 3.82Å; L23-Y47 HydrophobicContact CD2-CE1 4.42Å; L23-Y47 HydrophobicContact CD2-CG 4.36Å; L23-K50 HydrophobicContact CD1-CB 3.65Å; L23-K50 HydrophobicContact CD2-CD 4.38Å; L23-V51 HydrophobicContact CB-CG2 3.58Å; L23-V51 HydrophobicContact CD1-CG2 3.8Å; L23-V51 HydrophobicContact CG-CG2 4.34Å
24	I	87.9	Confident	86.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-42.2	174.8	-68.5	164.8	0	0	0	110.9	T20 K21 E22 Q26 I27 E28 L95 R98 Y99 A102	T20-I24 HydrophobicContact CG2-CD1 4.23Å; T20-I24 VanDerWaalsContact O-CG1 3.29Å; T20-I24 WeakPolarHBondContact O-CG1 3.4Å; T20-I24 PolarHBondContact O-N 3.41Å; K21-I24 PolarHBondContact O-N 2.93Å; E22-I24 VanDerWaalsContact C-N 3.3Å; E22-I24 PolarHBondContact O-N 3.36Å; I24-Q26 VanDerWaalsContact C-N 3.3Å; I24-Q26 PolarHBondContact O-N 3.28Å; I24-I27 WeakPolarHBondContact O-CB 3.43Å; I24-I27 PolarHBondContact O-N 3.35Å; I24-I27 VanDerWaalsContact O-N 3.15Å; I24-E28 HydrophobicContact CG2-CG 4.49Å; I24-E28 WeakPolarHBondContact O-CG 3.42Å; I24-E28 PolarHBondContact O-N 3.08Å; I24-L95 HydrophobicContact CD1-CD1 3.44Å; I24-L95 VanDerWaalsContact CD1-CD1 3.44Å; I24-L95 HydrophobicContact CD1-CG 3.92Å; I24-R98 HydrophobicContact CG2-CG 4.01Å; I24-Y99 HydrophobicContact CG1-CD2 4.07Å; I24-A102 HydrophobicContact CG2-CB 3.92Å
25	V	90.5	Very high	86.1	Confident	74 Å²	74	57.4 Å²	57.4	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-37	175.4	173.6	0	0	0	0	111.3	K21 E22 L23 I27 E28 S29	K21-V25 WeakPolarHBondContact O-CG2 3.46Å; K21-V25 PolarHBondContact O-N 3.38Å; K21-V25 VanDerWaalsContact O-N 3.1Å; E22-V25 WeakPolarHBondContact O-CB 3.49Å; E22-V25 PolarHBondContact O-N 2.97Å; E22-V25 VanDerWaalsContact O-N 3.12Å; L23-V25 VanDerWaalsContact C-N 3.34Å; L23-V25 PolarHBondContact O-N 3.05Å; V25-I27 VanDerWaalsContact C-N 3.33Å; V25-E28 PolarHBondContact O-N 3.35Å; V25-S29 PolarHBondContact O-N 2.72Å
26	Q	88.5	Confident	85.4	Confident	52 Å²	52	58.6 Å²	58.6	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-67.4	-32.4	174.3	-64.9	179.5	27.7	0	0	112.4	E22 L23 I24 S29 I30 Y47	E22-Q26 WeakPolarHBondContact O-CG 3.33Å; E22-Q26 PolarHBondContact O-N 3.28Å; E22-Q26 PolarHBondContact OE1-NE2 3.34Å; L23-Q26 PolarHBondContact O-N 3.48Å; I24-Q26 VanDerWaalsContact C-N 3.3Å; I24-Q26 PolarHBondContact O-N 3.28Å; Q26-S29 PolarHBondContact O-N 3.24Å; Q26-S29 PolarHBondContact O-OG 3.46Å; Q26-I30 WeakPolarHBondContact O-CG1 3.44Å; Q26-I30 PolarHBondContact O-N 2.7Å; Q26-Y47 HydrophobicContact CB-CD2 4.14Å; Q26-Y47 HydrophobicContact CB-CE2 3.72Å; Q26-Y47 VanDerWaalsContact OE1-CE1 3.23Å; Q26-Y47 PolarHBondContact OE1-OH 3.3Å
27	I	87.3	Confident	84.8	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.4	-43.6	172	-67.4	166.9	0	0	0	110.5	L23 I24 V25 S29 I30 S31 L44 Y47 Y99 A102 A106	L23-I27 WeakPolarHBondContact O-CG1 3.3Å; L23-I27 PolarHBondContact O-N 2.84Å; I24-I27 WeakPolarHBondContact O-CB 3.43Å; I24-I27 PolarHBondContact O-N 3.35Å; I24-I27 VanDerWaalsContact O-N 3.15Å; V25-I27 VanDerWaalsContact C-N 3.33Å; I27-S29 PolarHBondContact O-N 2.78Å; I27-I30 PolarHBondContact O-N 3.4Å; I27-S31 PolarHBondContact O-N 3.28Å; I27-L44 HydrophobicContact CB-CD1 4.42Å; I27-L44 HydrophobicContact CG1-CD1 4.04Å; I27-L44 HydrophobicContact CG2-CD1 3.72Å; I27-Y47 HydrophobicContact CG1-CD2 4Å; I27-Y47 HydrophobicContact CG1-CG 4.37Å; I27-Y99 HydrophobicContact CD1-CD2 4.16Å; I27-Y99 HydrophobicContact CD1-CE2 3.85Å; I27-A102 HydrophobicContact CG2-CB 4.03Å; I27-A106 HydrophobicContact CG2-CB 3.8Å
28	E	87.1	Confident	84.3	Confident	54 Å²	54	64.4 Å²	64.4	25%	0.252	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-27.5	175.5	-70.3	171.5	-179.2	0	0	112.3	I24 V25 S31 R98 A102	I24-E28 HydrophobicContact CG2-CG 4.49Å; I24-E28 WeakPolarHBondContact O-CG 3.42Å; I24-E28 PolarHBondContact O-N 3.08Å; V25-E28 PolarHBondContact O-N 3.35Å; E28-S31 PolarHBondContact O-OG 3.49Å; E28-R98 IonicContact OE1-CZ 3.71Å; E28-R98 IonicContact OE1-NE 3.58Å; E28-R98 PolarHBondContact OE1-NE 3Å; E28-R98 IonicContact OE1-NH2 2.8Å; E28-R98 PolarHBondContact OE1-NH2 3.37Å; E28-R98 IonicContact OE2-CZ 3.73Å; E28-R98 IonicContact OE2-NH2 3.6Å; E28-R98 PolarHBondContact OE2-NH2 2.87Å; E28-A102 HydrophobicContact CG-CB 3.73Å
29	S	85.9	Confident	83.8	Confident	68 Å²	68	63.7 Å²	63.7	48%	0.476	32%	0.324	S	S	.	.	H	α-helix	trans	-78.2	-33	176.2	73.5	0	0	0	0	112.6	V25 Q26 I27 S31 K32 G33	V25-S29 PolarHBondContact O-N 2.72Å; Q26-S29 PolarHBondContact O-N 3.24Å; Q26-S29 PolarHBondContact O-OG 3.46Å; I27-S29 PolarHBondContact O-N 2.78Å; S29-S31 PolarHBondContact O-N 2.78Å; S29-K32 PolarHBondContact O-N 2.74Å; S29-K32 VanDerWaalsContact O-N 3.07Å; S29-G33 PolarHBondContact O-N 3.35Å
30	I	82.3	Confident	83.3	Confident	14 Å²	14	59 Å²	59	7%	0.072	31%	0.305	C	S	.	.	H	α-helix	trans	-57.5	-40.7	172.1	-70.1	168.5	0	0	0	110.2	Q26 I27 K32 G33 I34 C40 K43 L44 Y47	Q26-I30 WeakPolarHBondContact O-CG1 3.44Å; Q26-I30 PolarHBondContact O-N 2.7Å; I27-I30 PolarHBondContact O-N 3.4Å; I30-K32 PolarHBondContact O-N 2.65Å; I30-G33 PolarHBondContact O-N 3Å; I30-I34 WeakPolarHBondContact O-CG1 3.29Å; I30-C40 HydrophobicContact CG2-CB 3.98Å; I30-K43 HydrophobicContact CD1-CB 3.98Å; I30-L44 HydrophobicContact CD1-CB 4.43Å; I30-Y47 HydrophobicContact CD1-CD2 3.77Å; I30-Y47 HydrophobicContact CD1-CE2 3.64Å
31	S	79.1	Confident	83	Confident	35 Å²	35	63.1 Å²	63.1	25%	0.245	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-20	179.8	81.4	0	0	0	0	113.7	I27 E28 S29	I27-S31 PolarHBondContact O-N 3.28Å; E28-S31 PolarHBondContact O-OG 3.49Å; S29-S31 PolarHBondContact O-N 2.78Å
32	K	80.2	Confident	82.6	Confident	184 Å²	184	64.1 Å²	64.1	80%	0.8	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-20.6	-178.3	-68	177.9	-178.7	177.1	0	113.7	S29 I30	S29-K32 PolarHBondContact O-N 2.74Å; S29-K32 VanDerWaalsContact O-N 3.07Å; I30-K32 PolarHBondContact O-N 2.65Å
33	G	76.1	Confident	82.3	Confident	33 Å²	33	63.6 Å²	63.6	34%	0.34	32%	0.323	S	S	.	.			trans	-141.8	68.6	-170.5	0	0	0	0	0	112.8	S29 I30 H35	S29-G33 PolarHBondContact O-N 3.35Å; I30-G33 PolarHBondContact O-N 3Å; G33-H35 PolarHBondContact O-N 3.27Å
34	I	75.3	Confident	82.2	Confident	23 Å²	23	63.1 Å²	63.1	12%	0.118	32%	0.32	C	S	.	.			trans	-87.7	107.6	177.5	-55.4	175.3	0	0	0	108.6	I30 T37 A109 L110 F113	I30-I34 WeakPolarHBondContact O-CG1 3.29Å; I34-T37 HydrophobicContact CG2-CG2 4.43Å; I34-A109 VanDerWaalsContact CD1-C 3.42Å; I34-A109 HydrophobicContact CD1-CB 3.77Å; I34-A109 WeakPolarHBondContact CD1-O 3.48Å; I34-L110 HydrophobicContact CD1-CB 4.4Å; I34-L110 HydrophobicContact CD1-CD1 4.33Å; I34-L110 HydrophobicContact CG2-CD1 4.11Å; I34-F113 HydrophobicContact CB-CD2 4.18Å; I34-F113 HydrophobicContact CB-CG 4.28Å; I34-F113 HydrophobicContact CD1-CB 4.3Å; I34-F113 HydrophobicContact CG2-CB 4.18Å; I34-F113 HydrophobicContact CG2-CD1 3.84Å; I34-F113 HydrophobicContact CG2-CD2 4.08Å; I34-F113 HydrophobicContact CG2-CE1 4.2Å; I34-F113 HydrophobicContact CG2-CE2 4.43Å; I34-F113 HydrophobicContact CG2-CG 3.75Å; I34-F113 HydrophobicContact CG2-CZ 4.48Å; I34-F113 WeakPolarHBondContact O-CE2 3.3Å
35	H	75.6	Confident	82	Confident	175 Å²	175	66.9 Å²	66.9	81%	0.81	34%	0.34	S	S	*	.	S	Bend	trans	-108.2	-27.4	174.1	-61	-63.9	0	0	0	112.8	G33	G33-H35 PolarHBondContact O-N 3.27Å
36	N	76.1	Confident	81.8	Confident	89 Å²	89	66 Å²	66	48%	0.476	34%	0.337	S	S	.	.			trans	-144.2	108.5	-178.8	-179	-25.3	0	0	0	108.9	K38 S39 C40	N36-K38 PolarHBondContact O-N 2.84Å; N36-K38 PolarHBondContact OD1-N 3.46Å; N36-K38 VanDerWaalsContact OD1-N 3.16Å; N36-S39 PolarHBondContact O-N 3.04Å; N36-S39 PolarHBondContact OD1-N 2.89Å; N36-C40 WeakPolarHBondContact O-CB 3.36Å; N36-C40 PolarHBondContact O-N 3.46Å; N36-C40 PolarHBondContact O-SG 3.03Å
37	T	76.5	Confident	81.8	Confident	22 Å²	22	65.6 Å²	65.6	14%	0.135	33%	0.333	C	S	.	.	H	α-helix	trans	-54.6	-47.3	-176.9	38.1	0	0	0	0	112.5	I34 C40 R41 L110 F113 E114	I34-T37 HydrophobicContact CG2-CG2 4.43Å; T37-C40 PolarHBondContact O-N 3.46Å; T37-R41 WeakPolarHBondContact O-CB 3.06Å; T37-R41 PolarHBondContact O-N 3.28Å; T37-L110 HydrophobicContact CG2-CD1 4.08Å; T37-F113 HydrophobicContact CG2-CD1 3.34Å; T37-F113 HydrophobicContact CG2-CE1 3.81Å; T37-F113 HydrophobicContact CG2-CG 4.42Å; T37-E114 HydrophobicContact CG2-CG 3.51Å
38	K	79.4	Confident	81.9	Confident	149 Å²	149	66.4 Å²	66.4	65%	0.648	34%	0.337	S	S	*	.	H	α-helix	trans	-63.4	-48.9	-179.2	-169.6	179.5	178.9	-174.5	0	112.4	N36 C40 R41 E42	N36-K38 PolarHBondContact O-N 2.84Å; N36-K38 PolarHBondContact OD1-N 3.46Å; N36-K38 VanDerWaalsContact OD1-N 3.16Å; K38-C40 PolarHBondContact O-N 2.95Å; K38-R41 PolarHBondContact O-N 3.35Å; K38-E42 VanDerWaalsContact CE-OE1 3.31Å; K38-E42 WeakPolarHBondContact CE-OE1 3.22Å; K38-E42 WeakPolarHBondContact O-CG 3.39Å; K38-E42 PolarHBondContact O-N 2.88Å
39	S	79.8	Confident	81.9	Confident	40 Å²	40	67 Å²	67	28%	0.28	35%	0.345	S	S	.	.	H	α-helix	trans	-67.2	-36.6	179.5	-176.7	0	0	0	0	112.3	N36 R41 K43	N36-S39 PolarHBondContact O-N 3.04Å; N36-S39 PolarHBondContact OD1-N 2.89Å; S39-R41 VanDerWaalsContact C-N 3.35Å; S39-K43 WeakPolarHBondContact O-CB 3.22Å; S39-K43 VanDerWaalsContact O-CG 3.3Å; S39-K43 WeakPolarHBondContact O-CG 3.13Å; S39-K43 PolarHBondContact O-N 2.89Å
40	C	80.9	Confident	82	Confident	13 Å²	13	68 Å²	68	9%	0.088	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-41	174.6	-73.8	0	0	0	0	111.5	I30 N36 T37 K38 K43 L44 L110	I30-C40 HydrophobicContact CG2-CB 3.98Å; N36-C40 WeakPolarHBondContact O-CB 3.36Å; N36-C40 PolarHBondContact O-N 3.46Å; N36-C40 PolarHBondContact O-SG 3.03Å; T37-C40 PolarHBondContact O-N 3.46Å; K38-C40 PolarHBondContact O-N 2.95Å; C40-K43 PolarHBondContact O-N 3.02Å; C40-L44 VanDerWaalsContact O-CB 3.27Å; C40-L44 WeakPolarHBondContact O-CB 3.41Å; C40-L44 PolarHBondContact O-N 3.13Å; C40-L110 HydrophobicContact CB-CD1 3.97Å
41	R	81.5	Confident	82.2	Confident	86 Å²	86	67.3 Å²	67.3	33%	0.325	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-47.7	177.2	-168	154.1	-102	160.1	-5.1	112.1	T37 K38 S39 K43 L44 D45 L110 E114	T37-R41 WeakPolarHBondContact O-CB 3.06Å; T37-R41 PolarHBondContact O-N 3.28Å; K38-R41 PolarHBondContact O-N 3.35Å; S39-R41 VanDerWaalsContact C-N 3.35Å; R41-K43 VanDerWaalsContact C-N 3.32Å; R41-K43 PolarHBondContact O-N 3.36Å; R41-L44 WeakPolarHBondContact O-CB 3.32Å; R41-L44 PolarHBondContact O-N 2.9Å; R41-L44 VanDerWaalsContact O-N 3.13Å; R41-D45 VanDerWaalsContact O-CG 3.31Å; R41-D45 PolarHBondContact O-N 2.97Å; R41-L110 HydrophobicContact CB-CD2 3.91Å; R41-L110 HydrophobicContact CG-CD2 4.25Å; R41-E114 IonicContact CZ-OE1 3.97Å; R41-E114 IonicContact CZ-OE2 3.32Å; R41-E114 VanDerWaalsContact NH1-CD 3.27Å; R41-E114 IonicContact NH1-OE1 3.56Å; R41-E114 PolarHBondContact NH1-OE1 2.93Å; R41-E114 IonicContact NH1-OE2 2.67Å; R41-E114 PolarHBondContact NH1-OE2 2.92Å; R41-E114 IonicContact NH2-OE2 3.99Å
42	E	83.7	Confident	82.6	Confident	111 Å²	111	72.2 Å²	72.2	52%	0.519	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-41.7	176.2	-71.1	171.2	-173.4	0	0	112.3	K38 C46	K38-E42 VanDerWaalsContact CE-OE1 3.31Å; K38-E42 WeakPolarHBondContact CE-OE1 3.22Å; K38-E42 WeakPolarHBondContact O-CG 3.39Å; K38-E42 PolarHBondContact O-N 2.88Å; E42-C46 WeakPolarHBondContact O-CB 3.36Å; E42-C46 PolarHBondContact O-N 3.28Å
43	K	85.6	Confident	83	Confident	102 Å²	102	68.8 Å²	68.8	44%	0.443	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-42.8	174.9	-74.4	176.1	-177.5	176.4	0	111.8	I30 S39 C40 R41 C46 Y47	I30-K43 HydrophobicContact CD1-CB 3.98Å; S39-K43 WeakPolarHBondContact O-CB 3.22Å; S39-K43 VanDerWaalsContact O-CG 3.3Å; S39-K43 WeakPolarHBondContact O-CG 3.13Å; S39-K43 PolarHBondContact O-N 2.89Å; C40-K43 PolarHBondContact O-N 3.02Å; R41-K43 VanDerWaalsContact C-N 3.32Å; R41-K43 PolarHBondContact O-N 3.36Å; K43-C46 PolarHBondContact O-N 2.81Å; K43-Y47 HydrophobicContact CB-CE2 4.21Å; K43-Y47 WeakPolarHBondContact O-CB 3.38Å; K43-Y47 WeakPolarHBondContact O-CD2 3.23Å; K43-Y47 PolarHBondContact O-N 3.48Å
44	L	86	Confident	83.6	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-46.3	178	-177.2	60.4	0	0	0	110.9	I27 I30 C40 R41 C46 Y47 Q48 A106 N107	I27-L44 HydrophobicContact CB-CD1 4.42Å; I27-L44 HydrophobicContact CG1-CD1 4.04Å; I27-L44 HydrophobicContact CG2-CD1 3.72Å; I30-L44 HydrophobicContact CD1-CB 4.43Å; C40-L44 VanDerWaalsContact O-CB 3.27Å; C40-L44 WeakPolarHBondContact O-CB 3.41Å; C40-L44 PolarHBondContact O-N 3.13Å; R41-L44 WeakPolarHBondContact O-CB 3.32Å; R41-L44 PolarHBondContact O-N 2.9Å; R41-L44 VanDerWaalsContact O-N 3.13Å; L44-C46 VanDerWaalsContact C-N 3.35Å; L44-C46 PolarHBondContact O-N 2.97Å; L44-Y47 PolarHBondContact O-N 2.75Å; L44-Q48 HydrophobicContact CD1-CG 4.3Å; L44-Q48 HydrophobicContact CG-CG 4.45Å; L44-Q48 WeakPolarHBondContact O-CB 3.49Å; L44-Q48 VanDerWaalsContact O-CG 3.23Å; L44-Q48 WeakPolarHBondContact O-CG 3.47Å; L44-Q48 PolarHBondContact O-N 2.75Å; L44-A106 HydrophobicContact CD1-CB 4.04Å; L44-A106 HydrophobicContact CD2-CB 4.2Å; L44-N107 WeakPolarHBondContact CD2-OD1 3.29Å
45	D	84.4	Confident	84.2	Confident	79 Å²	79	67.6 Å²	67.6	42%	0.422	32%	0.323	S	S	.	.	H	α-helix	trans	-62.9	-41.2	177.9	-67.2	-23.3	0	0	0	111.6	R41 Q48 T49	R41-D45 VanDerWaalsContact O-CG 3.31Å; R41-D45 PolarHBondContact O-N 2.97Å; D45-Q48 PolarHBondContact O-N 3.15Å; D45-T49 WeakPolarHBondContact O-CB 3.47Å; D45-T49 PolarHBondContact O-N 3.37Å; D45-T49 PolarHBondContact O-OG1 2.67Å
46	C	87	Confident	84.7	Confident	55 Å²	55	64.1 Å²	64.1	37%	0.372	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-46.5	174.7	-179.1	0	0	0	0	112.1	E42 K43 L44 T49 K50	E42-C46 WeakPolarHBondContact O-CB 3.36Å; E42-C46 PolarHBondContact O-N 3.28Å; K43-C46 PolarHBondContact O-N 2.81Å; L44-C46 VanDerWaalsContact C-N 3.35Å; L44-C46 PolarHBondContact O-N 2.97Å; C46-T49 PolarHBondContact O-N 3.48Å; C46-K50 WeakPolarHBondContact O-CG 3.42Å; C46-K50 PolarHBondContact O-N 3.32Å; C46-K50 VanDerWaalsContact O-N 3.09Å
47	Y	88.8	Confident	85.3	Confident	44 Å²	44	62.9 Å²	62.9	17%	0.173	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-41	177.6	-62.4	-24.7	0	0	0	112	L23 Q26 I27 I30 K43 L44 T49 K50 V51	L23-Y47 HydrophobicContact CD2-CD1 3.82Å; L23-Y47 HydrophobicContact CD2-CE1 4.42Å; L23-Y47 HydrophobicContact CD2-CG 4.36Å; Q26-Y47 HydrophobicContact CB-CD2 4.14Å; Q26-Y47 HydrophobicContact CB-CE2 3.72Å; Q26-Y47 VanDerWaalsContact OE1-CE1 3.23Å; Q26-Y47 PolarHBondContact OE1-OH 3.3Å; I27-Y47 HydrophobicContact CG1-CD2 4Å; I27-Y47 HydrophobicContact CG1-CG 4.37Å; I30-Y47 HydrophobicContact CD1-CD2 3.77Å; I30-Y47 HydrophobicContact CD1-CE2 3.64Å; K43-Y47 HydrophobicContact CB-CE2 4.21Å; K43-Y47 WeakPolarHBondContact O-CB 3.38Å; K43-Y47 WeakPolarHBondContact O-CD2 3.23Å; K43-Y47 PolarHBondContact O-N 3.48Å; L44-Y47 PolarHBondContact O-N 2.75Å; Y47-T49 VanDerWaalsContact C-N 3.33Å; Y47-T49 PolarHBondContact O-N 3.47Å; Y47-K50 PolarHBondContact O-N 2.9Å; Y47-V51 VanDerWaalsContact O-CG2 3.31Å; Y47-V51 WeakPolarHBondContact O-CG2 3.32Å; Y47-V51 PolarHBondContact O-N 3.44Å
48	Q	88.1	Confident	85.8	Confident	18 Å²	18	62 Å²	62	8%	0.084	30%	0.304	C	S	.	.	H	α-helix	trans	-61	-43.7	175.9	-75.2	-179.3	8.7	0	0	111.7	L44 D45 V51 R52 Y99 I103	L44-Q48 HydrophobicContact CD1-CG 4.3Å; L44-Q48 HydrophobicContact CG-CG 4.45Å; L44-Q48 WeakPolarHBondContact O-CB 3.49Å; L44-Q48 VanDerWaalsContact O-CG 3.23Å; L44-Q48 WeakPolarHBondContact O-CG 3.47Å; L44-Q48 PolarHBondContact O-N 2.75Å; D45-Q48 PolarHBondContact O-N 3.15Å; Q48-V51 PolarHBondContact O-N 3.24Å; Q48-R52 WeakPolarHBondContact O-CB 3.18Å; Q48-R52 VanDerWaalsContact O-CG 3.29Å; Q48-R52 WeakPolarHBondContact O-CG 3.43Å; Q48-R52 PolarHBondContact O-N 2.84Å; Q48-Y99 WeakPolarHBondContact CA-OH 3.37Å; Q48-Y99 PolarHBondContact O-OH 2.68Å; Q48-I103 HydrophobicContact CG-CD1 4.29Å; Q48-I103 HydrophobicContact CG-CG1 4.23Å
49	T	87	Confident	86.2	Confident	67 Å²	67	57.6 Å²	57.6	41%	0.411	29%	0.288	S	S	.	.	H	α-helix	trans	-60.2	-49.4	177.6	-56.8	0	0	0	0	110.8	D45 C46 Y47 V51 R52 E53	D45-T49 WeakPolarHBondContact O-CB 3.47Å; D45-T49 PolarHBondContact O-N 3.37Å; D45-T49 PolarHBondContact O-OG1 2.67Å; C46-T49 PolarHBondContact O-N 3.48Å; Y47-T49 VanDerWaalsContact C-N 3.33Å; Y47-T49 PolarHBondContact O-N 3.47Å; T49-V51 PolarHBondContact O-N 2.71Å; T49-R52 PolarHBondContact O-N 3.16Å; T49-E53 WeakPolarHBondContact O-CG 3.36Å; T49-E53 PolarHBondContact O-N 3.47Å
50	K	88.3	Confident	86.6	Confident	87 Å²	87	58.6 Å²	58.6	38%	0.378	30%	0.295	S	S	.	.	H	α-helix	trans	-61.5	-40.4	177.4	-71.5	175.9	-179	174.7	0	113.3	L23 C46 Y47 E53 N54	L23-K50 HydrophobicContact CD1-CB 3.65Å; L23-K50 HydrophobicContact CD2-CD 4.38Å; C46-K50 WeakPolarHBondContact O-CG 3.42Å; C46-K50 PolarHBondContact O-N 3.32Å; C46-K50 VanDerWaalsContact O-N 3.09Å; Y47-K50 PolarHBondContact O-N 2.9Å; K50-E53 PolarHBondContact O-N 3.37Å; K50-N54 WeakPolarHBondContact O-CB 3.27Å; K50-N54 VanDerWaalsContact O-CG 3.23Å; K50-N54 PolarHBondContact O-N 3.4Å; K50-N54 PolarHBondContact O-OD1 3.26Å
51	V	86.8	Confident	86.9	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.7	-43.3	176.2	170	0	0	0	0	110.4	T20 L23 Y47 Q48 T49 N54 L55 Y99	T20-V51 HydrophobicContact CG2-CG1 3.85Å; T20-V51 HydrophobicContact CG2-CG2 4.3Å; L23-V51 HydrophobicContact CB-CG2 3.58Å; L23-V51 HydrophobicContact CD1-CG2 3.8Å; L23-V51 HydrophobicContact CG-CG2 4.34Å; Y47-V51 VanDerWaalsContact O-CG2 3.31Å; Y47-V51 WeakPolarHBondContact O-CG2 3.32Å; Y47-V51 PolarHBondContact O-N 3.44Å; Q48-V51 PolarHBondContact O-N 3.24Å; T49-V51 PolarHBondContact O-N 2.71Å; V51-N54 PolarHBondContact O-N 2.95Å; V51-L55 HydrophobicContact CG1-CD1 3.82Å; V51-L55 HydrophobicContact CG1-CG 4.16Å; V51-L55 WeakPolarHBondContact O-CB 3.38Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.39Å; V51-L55 PolarHBondContact O-N 2.82Å; V51-Y99 HydrophobicContact CB-CD2 4.23Å; V51-Y99 HydrophobicContact CB-CE2 3.67Å; V51-Y99 HydrophobicContact CG1-CD1 4.07Å; V51-Y99 HydrophobicContact CG1-CD2 3.59Å; V51-Y99 HydrophobicContact CG1-CE1 3.92Å; V51-Y99 HydrophobicContact CG1-CE2 3.41Å; V51-Y99 VanDerWaalsContact CG1-CE2 3.41Å; V51-Y99 HydrophobicContact CG1-CG 3.89Å; V51-Y99 HydrophobicContact CG2-CD2 4.27Å; V51-Y99 HydrophobicContact CG2-CE2 3.95Å
52	R	87.8	Confident	87.1	Confident	138 Å²	138	54.7 Å²	54.7	52%	0.521	28%	0.279	S	S	.	.	H	α-helix	trans	-60.7	-46.3	176.8	-73	174.4	-173.5	162.7	4.8	111.6	Q48 T49 N54 L55 V56	Q48-R52 WeakPolarHBondContact O-CB 3.18Å; Q48-R52 VanDerWaalsContact O-CG 3.29Å; Q48-R52 WeakPolarHBondContact O-CG 3.43Å; Q48-R52 PolarHBondContact O-N 2.84Å; T49-R52 PolarHBondContact O-N 3.16Å; R52-N54 PolarHBondContact O-N 3.18Å; R52-L55 PolarHBondContact O-N 2.84Å; R52-V56 VanDerWaalsContact O-CG2 3.32Å; R52-V56 WeakPolarHBondContact O-CG2 3.28Å; R52-V56 PolarHBondContact O-N 2.93Å
53	E	88.5	Confident	87.1	Confident	112 Å²	112	53 Å²	53	52%	0.523	27%	0.273	S	S	.	.	H	α-helix	trans	-58.5	-46.4	176.3	-72.4	171.5	-178.8	0	0	112.2	T49 K50 L55 V56 T57	T49-E53 WeakPolarHBondContact O-CG 3.36Å; T49-E53 PolarHBondContact O-N 3.47Å; K50-E53 PolarHBondContact O-N 3.37Å; E53-L55 PolarHBondContact O-N 3.09Å; E53-V56 PolarHBondContact O-N 3.37Å; E53-T57 WeakPolarHBondContact O-CB 3.22Å; E53-T57 PolarHBondContact O-N 3.18Å; E53-T57 PolarHBondContact O-OG1 3.29Å
54	N	88.6	Confident	87	Confident	14 Å²	14	51.7 Å²	51.7	8%	0.075	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-44.8	176.8	-70.9	-10.4	0	0	0	111.4	T20 K50 V51 R52 T57 I58	T20-N54 VanDerWaalsContact OG1-CB 3.25Å; T20-N54 WeakPolarHBondContact OG1-CB 3.43Å; T20-N54 PolarHBondContact OG1-ND2 3.41Å; T20-N54 VanDerWaalsContact OG1-ND2 3.07Å; K50-N54 WeakPolarHBondContact O-CB 3.27Å; K50-N54 VanDerWaalsContact O-CG 3.23Å; K50-N54 PolarHBondContact O-N 3.4Å; K50-N54 PolarHBondContact O-OD1 3.26Å; V51-N54 PolarHBondContact O-N 2.95Å; R52-N54 PolarHBondContact O-N 3.18Å; N54-T57 PolarHBondContact O-N 3.36Å; N54-I58 VanDerWaalsContact O-CG1 3.25Å; N54-I58 WeakPolarHBondContact O-CG1 3.32Å; N54-I58 PolarHBondContact O-N 2.91Å
55	L	87.1	Confident	86.8	Confident	17 Å²	17	51.7 Å²	51.7	9%	0.089	27%	0.269	C	S	.	.	H	α-helix	trans	-63.8	-41.8	179.6	-72.2	175.4	0	0	0	111.7	V51 R52 E53 T57 I58 N59 L92 L95 Q96 Y99	V51-L55 HydrophobicContact CG1-CD1 3.82Å; V51-L55 HydrophobicContact CG1-CG 4.16Å; V51-L55 WeakPolarHBondContact O-CB 3.38Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.39Å; V51-L55 PolarHBondContact O-N 2.82Å; R52-L55 PolarHBondContact O-N 2.84Å; E53-L55 PolarHBondContact O-N 3.09Å; L55-T57 VanDerWaalsContact C-N 3.34Å; L55-I58 PolarHBondContact O-N 3.41Å; L55-N59 WeakPolarHBondContact O-CB 3.4Å; L55-N59 PolarHBondContact O-N 3.46Å; L55-N59 PolarHBondContact O-ND2 3.15Å; L55-L92 HydrophobicContact CD2-CD1 3.46Å; L55-L92 VanDerWaalsContact CD2-CD1 3.46Å; L55-L95 HydrophobicContact CD2-CD2 4.49Å; L55-Q96 HydrophobicContact CD1-CG 4.15Å; L55-Q96 HydrophobicContact CD2-CG 4.05Å; L55-Y99 HydrophobicContact CD1-CD1 4.47Å
56	V	87.9	Confident	86.6	Confident	103 Å²	103	50.9 Å²	50.9	62%	0.624	26%	0.262	S	S	*	.	H	α-helix	trans	-62	-45.2	175.4	170.9	0	0	0	0	110.3	R52 E53 N59 S60	R52-V56 VanDerWaalsContact O-CG2 3.32Å; R52-V56 WeakPolarHBondContact O-CG2 3.28Å; R52-V56 PolarHBondContact O-N 2.93Å; E53-V56 PolarHBondContact O-N 3.37Å; V56-N59 PolarHBondContact O-N 2.93Å; V56-S60 PolarHBondContact O-N 2.93Å
57	T	88.2	Confident	86.2	Confident	63 Å²	63	52 Å²	52	39%	0.387	27%	0.268	S	S	.	.	H	α-helix	trans	-63	-44.8	179	-53.4	0	0	0	0	111.7	L16 E53 N54 L55 N59 S60 I61	L16-T57 HydrophobicContact CD2-CG2 3.56Å; E53-T57 WeakPolarHBondContact O-CB 3.22Å; E53-T57 PolarHBondContact O-N 3.18Å; E53-T57 PolarHBondContact O-OG1 3.29Å; N54-T57 PolarHBondContact O-N 3.36Å; L55-T57 VanDerWaalsContact C-N 3.34Å; T57-N59 PolarHBondContact O-N 2.82Å; T57-S60 PolarHBondContact O-N 2.89Å; T57-I61 HydrophobicContact CG2-CD1 4Å; T57-I61 VanDerWaalsContact O-CG1 3.31Å; T57-I61 WeakPolarHBondContact O-CG1 3.16Å; T57-I61 PolarHBondContact O-N 2.91Å
58	I	87.5	Confident	85.4	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-46.9	175.9	-68.7	163.3	0	0	0	110.4	I13 L16 N54 L55 S60 I61 L62 L92	I13-I58 HydrophobicContact CG2-CG2 4.23Å; L16-I58 HydrophobicContact CB-CD1 3.93Å; L16-I58 HydrophobicContact CB-CG1 3.81Å; L16-I58 HydrophobicContact CD2-CG1 4.07Å; N54-I58 VanDerWaalsContact O-CG1 3.25Å; N54-I58 WeakPolarHBondContact O-CG1 3.32Å; N54-I58 PolarHBondContact O-N 2.91Å; L55-I58 PolarHBondContact O-N 3.41Å; I58-S60 PolarHBondContact O-N 3.27Å; I58-I61 PolarHBondContact O-N 3.49Å; I58-L62 WeakPolarHBondContact O-CB 3.37Å; I58-L62 PolarHBondContact O-N 3.35Å; I58-L92 HydrophobicContact CB-CD1 4.47Å; I58-L92 HydrophobicContact CD1-CD1 4.23Å; I58-L92 HydrophobicContact CG2-CD1 3.93Å; I58-L92 HydrophobicContact CG2-CD2 3.94Å
59	N	87.4	Confident	84.6	Confident	56 Å²	56	52 Å²	52	30%	0.299	28%	0.275	S	S	.	.	H	α-helix	trans	-62	-42.7	179.5	-78.4	-64.4	0	0	0	111.8	L55 V56 T57 I61 L62 D63 L92	L55-N59 WeakPolarHBondContact O-CB 3.4Å; L55-N59 PolarHBondContact O-N 3.46Å; L55-N59 PolarHBondContact O-ND2 3.15Å; V56-N59 PolarHBondContact O-N 2.93Å; T57-N59 PolarHBondContact O-N 2.82Å; N59-I61 PolarHBondContact O-N 3.25Å; N59-L62 PolarHBondContact O-N 3.33Å; N59-D63 WeakPolarHBondContact O-CB 3.18Å; N59-D63 PolarHBondContact O-N 3.21Å; N59-L92 WeakPolarHBondContact OD1-CD2 3.27Å
60	S	87.6	Confident	83.8	Confident	61 Å²	61	54.1 Å²	54.1	43%	0.427	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-48.1	176.1	-170.1	0	0	0	0	111.9	V56 T57 I58 L62 D63 E64	V56-S60 PolarHBondContact O-N 2.93Å; T57-S60 PolarHBondContact O-N 2.89Å; I58-S60 PolarHBondContact O-N 3.27Å; S60-L62 VanDerWaalsContact C-N 3.28Å; S60-L62 PolarHBondContact O-N 3.39Å; S60-D63 PolarHBondContact O-N 3.29Å; S60-E64 WeakPolarHBondContact O-CG 3.37Å; S60-E64 PolarHBondContact O-N 3.19Å
61	I	86.8	Confident	82.9	Confident	15 Å²	15	57.1 Å²	57.1	8%	0.077	29%	0.291	C	S	.	.	H	α-helix	trans	-64	-38.7	179.4	-62	168.3	0	0	0	110.6	K9 T12 I13 T57 I58 N59 E64 L65	K9-I61 HydrophobicContact CB-CG2 3.65Å; K9-I61 HydrophobicContact CD-CG2 4.11Å; K9-I61 HydrophobicContact CG-CG2 3.88Å; T12-I61 HydrophobicContact CG2-CD1 3.81Å; I13-I61 HydrophobicContact CD1-CB 4.14Å; I13-I61 HydrophobicContact CD1-CG2 3.62Å; I13-I61 HydrophobicContact CG1-CB 4.12Å; I13-I61 HydrophobicContact CG1-CD1 4.41Å; I13-I61 HydrophobicContact CG1-CG2 3.81Å; T57-I61 HydrophobicContact CG2-CD1 4Å; T57-I61 VanDerWaalsContact O-CG1 3.31Å; T57-I61 WeakPolarHBondContact O-CG1 3.16Å; T57-I61 PolarHBondContact O-N 2.91Å; I58-I61 PolarHBondContact O-N 3.49Å; N59-I61 PolarHBondContact O-N 3.25Å; I61-E64 PolarHBondContact O-N 2.76Å; I61-L65 HydrophobicContact CG2-CD1 4.1Å; I61-L65 HydrophobicContact CG2-CG 4.42Å; I61-L65 WeakPolarHBondContact O-CB 3.33Å; I61-L65 VanDerWaalsContact O-CG 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.32Å; I61-L65 PolarHBondContact O-N 2.94Å
62	L	85.6	Confident	81.8	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-69.7	-37.2	-178.8	-166.1	59.4	0	0	0	112.3	I13 I58 N59 S60 L65 Q66 I85 N88 K89 L92	I13-L62 HydrophobicContact CD1-CD1 4.48Å; I58-L62 WeakPolarHBondContact O-CB 3.37Å; I58-L62 PolarHBondContact O-N 3.35Å; N59-L62 PolarHBondContact O-N 3.33Å; S60-L62 VanDerWaalsContact C-N 3.28Å; S60-L62 PolarHBondContact O-N 3.39Å; L62-L65 PolarHBondContact O-N 2.7Å; L62-Q66 WeakPolarHBondContact O-CB 3.39Å; L62-Q66 PolarHBondContact O-N 2.75Å; L62-I85 HydrophobicContact CD1-CB 4.24Å; L62-I85 HydrophobicContact CD1-CG1 4.25Å; L62-I85 HydrophobicContact CD1-CG2 3.77Å; L62-I85 HydrophobicContact CG-CG2 4.36Å; L62-N88 HydrophobicContact CD1-CB 4.21Å; L62-K89 HydrophobicContact CD2-CB 4.41Å; L62-K89 HydrophobicContact CD2-CD 4.17Å; L62-K89 HydrophobicContact CD2-CG 3.31Å; L62-K89 HydrophobicContact CG-CG 4.09Å; L62-L92 HydrophobicContact CD2-CD2 4.42Å
63	D	84.6	Confident	80.2	Confident	76 Å²	76	59.5 Å²	59.5	41%	0.406	32%	0.316	S	S	.	.	H	α-helix	trans	-67.4	-43.2	173.7	-75.6	-15.6	0	0	0	110.9	N59 S60 L65 Q66 T67 K89	N59-D63 WeakPolarHBondContact O-CB 3.18Å; N59-D63 PolarHBondContact O-N 3.21Å; S60-D63 PolarHBondContact O-N 3.29Å; D63-L65 PolarHBondContact O-N 3.07Å; D63-Q66 PolarHBondContact O-N 2.93Å; D63-T67 WeakPolarHBondContact O-CG2 3.36Å; D63-T67 PolarHBondContact O-N 3.45Å; D63-T67 PolarHBondContact O-OG1 2.92Å; D63-K89 IonicContact OD1-NZ 2.81Å
64	E	83.7	Confident	78.5	Confident	75 Å²	75	60.3 Å²	60.3	35%	0.35	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-46.1	172.8	-72.8	174.3	-135.8	0	0	112	K9 S60 I61 Q66 T67 F68	K9-E64 WeakPolarHBondContact CE-OE2 3.39Å; K9-E64 IonicContact NZ-OE1 2.58Å; K9-E64 IonicContact NZ-OE2 3.71Å; K9-E64 PolarHBondContact NZ-OE2 3.39Å; S60-E64 WeakPolarHBondContact O-CG 3.37Å; S60-E64 PolarHBondContact O-N 3.19Å; I61-E64 PolarHBondContact O-N 2.76Å; E64-Q66 VanDerWaalsContact C-N 3.28Å; E64-Q66 PolarHBondContact O-N 3.42Å; E64-T67 PolarHBondContact O-N 2.75Å; E64-T67 PolarHBondContact O-OG1 3.26Å; E64-F68 PolarHBondContact O-N 3.47Å
65	L	81	Confident	76.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-36.5	176.4	-75.9	172.7	0	0	0	112.2	V6 K9 L10 I13 I61 L62 D63 G69 I85	V6-L65 HydrophobicContact CB-CD2 4.42Å; V6-L65 HydrophobicContact CG1-CD2 3.88Å; V6-L65 HydrophobicContact CG2-CD2 4.41Å; K9-L65 HydrophobicContact CB-CD1 4.34Å; K9-L65 HydrophobicContact CB-CD2 4.27Å; K9-L65 HydrophobicContact CB-CG 4.46Å; K9-L65 HydrophobicContact CD-CD2 4.38Å; L10-L65 HydrophobicContact CD2-CD1 3.87Å; L10-L65 HydrophobicContact CG-CD1 4.32Å; I13-L65 HydrophobicContact CD1-CD1 3.78Å; I61-L65 HydrophobicContact CG2-CD1 4.1Å; I61-L65 HydrophobicContact CG2-CG 4.42Å; I61-L65 WeakPolarHBondContact O-CB 3.33Å; I61-L65 VanDerWaalsContact O-CG 3.3Å; I61-L65 WeakPolarHBondContact O-CG 3.32Å; I61-L65 PolarHBondContact O-N 2.94Å; L62-L65 PolarHBondContact O-N 2.7Å; D63-L65 PolarHBondContact O-N 3.07Å; L65-G69 PolarHBondContact O-N 3.34Å; L65-I85 HydrophobicContact CB-CD1 3.93Å; L65-I85 HydrophobicContact CB-CG1 4.28Å
66	Q	79.9	Confident	75.6	Confident	62 Å²	62	68.2 Å²	68.2	29%	0.29	38%	0.38	S	S	.	.	H	α-helix	trans	-68.9	-42	177	-176	175.9	-23.4	0	0	112	L62 D63 E64 G69 R70	L62-Q66 WeakPolarHBondContact O-CB 3.39Å; L62-Q66 PolarHBondContact O-N 2.75Å; D63-Q66 PolarHBondContact O-N 2.93Å; E64-Q66 VanDerWaalsContact C-N 3.28Å; E64-Q66 PolarHBondContact O-N 3.42Å; Q66-G69 PolarHBondContact O-N 2.79Å; Q66-R70 PolarHBondContact O-N 3.39Å; Q66-R70 VanDerWaalsContact O-N 3.14Å
67	T	78.4	Confident	74.4	Confident	80 Å²	80	66.1 Å²	66.1	49%	0.491	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-44.3	174.8	58.4	0	0	0	0	111.4	D63 E64 G69 R70 E71	D63-T67 WeakPolarHBondContact O-CG2 3.36Å; D63-T67 PolarHBondContact O-N 3.45Å; D63-T67 PolarHBondContact O-OG1 2.92Å; E64-T67 PolarHBondContact O-N 2.75Å; E64-T67 PolarHBondContact O-OG1 3.26Å; T67-G69 PolarHBondContact O-N 2.72Å; T67-R70 PolarHBondContact O-N 3.45Å; T67-R70 VanDerWaalsContact O-N 3.13Å; T67-E71 PolarHBondContact O-N 3.44Å; T67-E71 VanDerWaalsContact O-N 3.08Å
68	F	73.4	Confident	73.4	Confident	36 Å²	36	64.5 Å²	64.5	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-61.9	-41	176.6	-179.4	-106	0	0	0	113.2	M1 V6 E64 R70 E71 T72 L81	M1-F68 HydrophobicContact CB-CD2 3.51Å; M1-F68 HydrophobicContact CB-CE1 4.32Å; M1-F68 HydrophobicContact CB-CE2 3.23Å; M1-F68 HydrophobicContact CB-CG 4.17Å; M1-F68 HydrophobicContact CB-CZ 3.67Å; M1-F68 HydrophobicContact CG-CD2 4.33Å; M1-F68 HydrophobicContact CG-CE2 4.43Å; M1-F68 HydrophobicContact SD-CB 3.96Å; M1-F68 HydrophobicContact SD-CD1 4.17Å; M1-F68 HydrophobicContact SD-CD2 3.85Å; M1-F68 HydrophobicContact SD-CE2 4.44Å; M1-F68 HydrophobicContact SD-CG 3.69Å; V6-F68 HydrophobicContact CG2-CD1 3.99Å; V6-F68 HydrophobicContact CG2-CE1 3.77Å; E64-F68 PolarHBondContact O-N 3.47Å; F68-R70 VanDerWaalsContact C-N 3.27Å; F68-R70 PolarHBondContact O-N 2.99Å; F68-E71 PolarHBondContact O-N 2.97Å; F68-T72 HydrophobicContact CD2-CG2 4.42Å; F68-T72 HydrophobicContact CE1-CG2 4.44Å; F68-T72 HydrophobicContact CE2-CG2 3.82Å; F68-T72 HydrophobicContact CZ-CG2 3.85Å; F68-T72 PolarHBondContact O-N 3.41Å; F68-T72 PolarHBondContact O-OG1 2.8Å; F68-L81 HydrophobicContact CD1-CD2 4.36Å
69	G	71.6	Confident	72.6	Confident	24 Å²	24	73 Å²	73	25%	0.247	39%	0.389	C	S	.	.	H	α-helix	trans	-64.3	-29.5	175.9	0	0	0	0	0	113.5	L65 Q66 T67	L65-G69 PolarHBondContact O-N 3.34Å; Q66-G69 PolarHBondContact O-N 2.79Å; T67-G69 PolarHBondContact O-N 2.72Å
70	R	69.5	Low	72.1	Confident	113 Å²	113	74.6 Å²	74.6	43%	0.426	40%	0.4	S	S	.	.	H	α-helix	trans	-76.8	-41.6	176.4	-174.5	-173.9	-75.8	-152.1	-5.8	112.2	Q66 T67 F68 T72 N179 E182	Q66-R70 PolarHBondContact O-N 3.39Å; Q66-R70 VanDerWaalsContact O-N 3.14Å; T67-R70 PolarHBondContact O-N 3.45Å; T67-R70 VanDerWaalsContact O-N 3.13Å; F68-R70 VanDerWaalsContact C-N 3.27Å; F68-R70 PolarHBondContact O-N 2.99Å; R70-T72 VanDerWaalsContact C-N 3.34Å; R70-T72 PolarHBondContact O-N 3.42Å; R70-N179 PolarHBondContact NH2-OD1 3.36Å; R70-E182 IonicContact CZ-OE2 3.91Å; R70-E182 IonicContact NH1-OE1 3.97Å; R70-E182 PolarHBondContact NH1-OE1 3.42Å; R70-E182 IonicContact NH1-OE2 3.23Å; R70-E182 PolarHBondContact NH1-OE2 2.77Å; R70-E182 IonicContact NH2-OE2 3.14Å
71	E	68.4	Low	71.4	Confident	150 Å²	150	72.4 Å²	72.4	70%	0.701	38%	0.384	S	S	*	.	H	α-helix	trans	-67.2	-35.4	-179	-71.8	174.9	-177.6	0	0	112.5	T67 F68 N73	T67-E71 PolarHBondContact O-N 3.44Å; T67-E71 VanDerWaalsContact O-N 3.08Å; F68-E71 PolarHBondContact O-N 2.97Å; E71-N73 PolarHBondContact O-N 2.97Å
72	T	64	Low	71	Confident	44 Å²	44	78.8 Å²	78.8	27%	0.27	41%	0.408	S	S	.	.			trans	-85.9	86.7	179.8	51.4	0	0	0	0	110.1	F68 R70 I74 N78	F68-T72 HydrophobicContact CD2-CG2 4.42Å; F68-T72 HydrophobicContact CE1-CG2 4.44Å; F68-T72 HydrophobicContact CE2-CG2 3.82Å; F68-T72 HydrophobicContact CZ-CG2 3.85Å; F68-T72 PolarHBondContact O-N 3.41Å; F68-T72 PolarHBondContact O-OG1 2.8Å; R70-T72 VanDerWaalsContact C-N 3.34Å; R70-T72 PolarHBondContact O-N 3.42Å; T72-I74 PolarHBondContact O-N 3.49Å; T72-N78 WeakPolarHBondContact CB-ND2 3.16Å; T72-N78 PolarHBondContact O-ND2 3.22Å; T72-N78 PolarHBondContact OG1-ND2 3.35Å; T72-N78 PolarHBondContact OG1-OD1 3.01Å
73	N	54.9	Low	70.7	Confident	143 Å²	143	83.4 Å²	83.4	77%	0.765	43%	0.43	S	S	*	.			trans	-70.8	24.7	180	-94.3	-65	0	0	0	115.6	E71 S75	E71-N73 PolarHBondContact O-N 2.97Å; N73-S75 PolarHBondContact O-N 3.41Å
74	I	52.4	Low	70.6	Confident	129 Å²	129	81.1 Å²	81.1	66%	0.662	42%	0.422	S	S	*	.			trans	-105.4	87.3	-166.8	-55.7	174.2	0	0	0	113.2	T72 S76	T72-I74 PolarHBondContact O-N 3.49Å; I74-S76 PolarHBondContact O-N 3.49Å
75	S	55.5	Low	70.4	Confident	116 Å²	116	77.8 Å²	77.8	81%	0.811	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	-32.7	132.7	-41.1	0	0	0	0	123.2	N73	N73-S75 PolarHBondContact O-N 3.41Å
76	S	58.9	Low	70.5	Confident	81 Å²	81	80.2 Å²	80.2	57%	0.566	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-161.4	-43.8	179.1	61	0	0	0	0	115.6	I74 N78 R79	I74-S76 PolarHBondContact O-N 3.49Å; S76-N78 PolarHBondContact O-N 3.28Å; S76-R79 WeakPolarHBondContact O-CB 3.41Å; S76-R79 PolarHBondContact O-N 3.07Å
77	T	62.8	Low	70.7	Confident	60 Å²	60	82.8 Å²	82.8	37%	0.368	43%	0.433	S	S	.	.	H	α-helix	trans	-61.4	-30.6	177	-61	0	0	0	0	111.3	R3 R79 T80 L81	R3-T77 PolarHBondContact NH2-OG1 3.17Å; T77-R79 VanDerWaalsContact C-N 3.31Å; T77-R79 PolarHBondContact O-N 2.9Å; T77-T80 PolarHBondContact O-OG1 3.49Å; T77-L81 PolarHBondContact O-N 2.92Å; T77-L81 VanDerWaalsContact O-N 3.15Å
78	N	67.6	Low	70.9	Confident	29 Å²	29	80.3 Å²	80.3	16%	0.155	42%	0.417	C	S	.	.	H	α-helix	trans	-74.8	-20.5	177.2	-76.7	-35.5	0	0	0	114.3	T72 S76 Y82	T72-N78 WeakPolarHBondContact CB-ND2 3.16Å; T72-N78 PolarHBondContact O-ND2 3.22Å; T72-N78 PolarHBondContact OG1-ND2 3.35Å; T72-N78 PolarHBondContact OG1-OD1 3.01Å; S76-N78 PolarHBondContact O-N 3.28Å; N78-Y82 WeakPolarHBondContact O-CB 3.25Å; N78-Y82 PolarHBondContact O-N 3.21Å
79	R	71.3	Confident	71.5	Confident	182 Å²	182	81.5 Å²	81.5	69%	0.687	42%	0.422	S	S	*	.	H	α-helix	trans	-67.9	-46.7	173.9	-172.5	173.9	178.6	132.9	-1.4	110.7	S76 T77 Y82 E83	S76-R79 WeakPolarHBondContact O-CB 3.41Å; S76-R79 PolarHBondContact O-N 3.07Å; T77-R79 VanDerWaalsContact C-N 3.31Å; T77-R79 PolarHBondContact O-N 2.9Å; R79-Y82 PolarHBondContact O-N 3.49Å; R79-E83 WeakPolarHBondContact CG-OE1 3.31Å; R79-E83 IonicContact NE-OE1 3.47Å; R79-E83 PolarHBondContact NE-OE1 2.88Å; R79-E83 VanDerWaalsContact NE-OE1 3.14Å; R79-E83 IonicContact NH2-OE1 3.46Å; R79-E83 WeakPolarHBondContact O-CB 3.44Å; R79-E83 VanDerWaalsContact O-CG 3.31Å; R79-E83 WeakPolarHBondContact O-CG 3.23Å; R79-E83 PolarHBondContact O-N 3.23Å
80	T	75.5	Confident	72.2	Confident	89 Å²	89	87.5 Å²	87.5	55%	0.546	44%	0.441	S	S	.	.	H	α-helix	trans	-66.6	-38.7	177.5	58.8	0	0	0	0	111.7	T77 E83 A84	T77-T80 PolarHBondContact O-OG1 3.49Å; T80-E83 PolarHBondContact O-N 3.38Å; T80-A84 WeakPolarHBondContact O-CB 3.34Å; T80-A84 PolarHBondContact O-N 3Å
81	L	74.2	Confident	72.9	Confident	15 Å²	15	86.1 Å²	86.1	8%	0.079	44%	0.439	C	S	.	.	H	α-helix	trans	-62.9	-45.6	174	-176.2	66.4	0	0	0	111.7	V6 L10 F68 T77 A84 I85	V6-L81 HydrophobicContact CG1-CD1 3.63Å; L10-L81 HydrophobicContact CD1-CD1 4.37Å; F68-L81 HydrophobicContact CD1-CD2 4.36Å; T77-L81 PolarHBondContact O-N 2.92Å; T77-L81 VanDerWaalsContact O-N 3.15Å; L81-A84 WeakPolarHBondContact O-CB 3.35Å; L81-A84 PolarHBondContact O-N 3.31Å; L81-I85 HydrophobicContact CD1-CD1 4.49Å; L81-I85 HydrophobicContact CG-CD1 4Å; L81-I85 VanDerWaalsContact O-CG1 3.3Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 3.37Å
82	Y	77.6	Confident	73.7	Confident	149 Å²	149	79.5 Å²	79.5	58%	0.584	41%	0.409	S	S	*	.	H	α-helix	trans	-63	-44.4	178	-178.4	-97.3	0	0	0	111.6	N78 R79 A84 I85 V86	N78-Y82 WeakPolarHBondContact O-CB 3.25Å; N78-Y82 PolarHBondContact O-N 3.21Å; R79-Y82 PolarHBondContact O-N 3.49Å; Y82-A84 VanDerWaalsContact C-N 3.31Å; Y82-A84 PolarHBondContact O-N 3.32Å; Y82-I85 PolarHBondContact O-N 3.06Å; Y82-V86 HydrophobicContact CD1-CG2 4.07Å; Y82-V86 HydrophobicContact CE1-CG2 3.67Å; Y82-V86 HydrophobicContact CE2-CG2 4.26Å; Y82-V86 VanDerWaalsContact O-CG2 3.32Å; Y82-V86 WeakPolarHBondContact O-CG2 3.19Å; Y82-V86 PolarHBondContact O-N 3.1Å
83	E	80.1	Confident	74.7	Confident	98 Å²	98	83.9 Å²	83.9	46%	0.458	42%	0.424	S	S	.	.	H	α-helix	trans	-58.8	-42.7	174.1	-74.1	171.3	-170.7	0	0	111.2	R79 T80 V86 Q87	R79-E83 WeakPolarHBondContact CG-OE1 3.31Å; R79-E83 IonicContact NE-OE1 3.47Å; R79-E83 PolarHBondContact NE-OE1 2.88Å; R79-E83 VanDerWaalsContact NE-OE1 3.14Å; R79-E83 IonicContact NH2-OE1 3.46Å; R79-E83 WeakPolarHBondContact O-CB 3.44Å; R79-E83 VanDerWaalsContact O-CG 3.31Å; R79-E83 WeakPolarHBondContact O-CG 3.23Å; R79-E83 PolarHBondContact O-N 3.23Å; T80-E83 PolarHBondContact O-N 3.38Å; E83-V86 PolarHBondContact O-N 3.12Å; E83-Q87 WeakPolarHBondContact O-CB 3.48Å; E83-Q87 PolarHBondContact O-N 3.44Å
84	A	81.1	Confident	76.3	Confident	29 Å²	29	80.1 Å²	80.1	24%	0.24	41%	0.413	C	S	.	.	H	α-helix	trans	-64.2	-41.1	175.1	0	0	0	0	0	112.8	T80 L81 Y82 Q87 N88	T80-A84 WeakPolarHBondContact O-CB 3.34Å; T80-A84 PolarHBondContact O-N 3Å; L81-A84 WeakPolarHBondContact O-CB 3.35Å; L81-A84 PolarHBondContact O-N 3.31Å; Y82-A84 VanDerWaalsContact C-N 3.31Å; Y82-A84 PolarHBondContact O-N 3.32Å; A84-Q87 PolarHBondContact O-N 3.38Å; A84-N88 WeakPolarHBondContact O-CB 3.28Å; A84-N88 PolarHBondContact O-N 2.98Å; A84-N88 PolarHBondContact O-ND2 3.02Å
85	I	81	Confident	77.8	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.021	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-46.7	175.7	-71.6	166.6	0	0	0	110.3	L62 L65 L81 Y82 Q87 N88 K89	L62-I85 HydrophobicContact CD1-CB 4.24Å; L62-I85 HydrophobicContact CD1-CG1 4.25Å; L62-I85 HydrophobicContact CD1-CG2 3.77Å; L62-I85 HydrophobicContact CG-CG2 4.36Å; L65-I85 HydrophobicContact CB-CD1 3.93Å; L65-I85 HydrophobicContact CB-CG1 4.28Å; L81-I85 HydrophobicContact CD1-CD1 4.49Å; L81-I85 HydrophobicContact CG-CD1 4Å; L81-I85 VanDerWaalsContact O-CG1 3.3Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 3.37Å; Y82-I85 PolarHBondContact O-N 3.06Å; I85-Q87 VanDerWaalsContact C-N 3.34Å; I85-Q87 PolarHBondContact O-N 3.47Å; I85-N88 PolarHBondContact O-N 2.89Å; I85-K89 PolarHBondContact O-N 3.33Å
86	V	82	Confident	79.3	Confident	52 Å²	52	70.8 Å²	70.8	32%	0.315	35%	0.354	S	S	.	.	H	α-helix	trans	-63.4	-41.3	178.9	171.3	0	0	0	0	111.1	Y82 E83 K89 K90	Y82-V86 HydrophobicContact CD1-CG2 4.07Å; Y82-V86 HydrophobicContact CE1-CG2 3.67Å; Y82-V86 HydrophobicContact CE2-CG2 4.26Å; Y82-V86 VanDerWaalsContact O-CG2 3.32Å; Y82-V86 WeakPolarHBondContact O-CG2 3.19Å; Y82-V86 PolarHBondContact O-N 3.1Å; E83-V86 PolarHBondContact O-N 3.12Å; V86-K89 PolarHBondContact O-N 2.71Å; V86-K90 PolarHBondContact O-N 2.8Å
87	Q	84.5	Confident	80.6	Confident	115 Å²	115	70.4 Å²	70.4	54%	0.537	35%	0.346	S	S	.	.	H	α-helix	trans	-64.8	-44.6	175.7	-176.1	177.2	-12.2	0	0	111.7	E83 A84 I85 K89 K90 Q91	E83-Q87 WeakPolarHBondContact O-CB 3.48Å; E83-Q87 PolarHBondContact O-N 3.44Å; A84-Q87 PolarHBondContact O-N 3.38Å; I85-Q87 VanDerWaalsContact C-N 3.34Å; I85-Q87 PolarHBondContact O-N 3.47Å; Q87-K89 VanDerWaalsContact C-N 3.34Å; Q87-K89 PolarHBondContact O-N 3.21Å; Q87-K90 PolarHBondContact O-N 3.21Å; Q87-Q91 WeakPolarHBondContact O-CG 3.2Å; Q87-Q91 PolarHBondContact O-N 3.48Å
88	N	83.3	Confident	81.7	Confident	29 Å²	29	72.6 Å²	72.6	16%	0.155	35%	0.347	C	S	.	.	H	α-helix	trans	-60.6	-41.6	175.1	-87	-82.1	0	0	0	111.5	I13 L62 A84 I85 K90 Q91 L92	I13-N88 WeakPolarHBondContact CG2-OD1 3.39Å; L62-N88 HydrophobicContact CD1-CB 4.21Å; A84-N88 WeakPolarHBondContact O-CB 3.28Å; A84-N88 PolarHBondContact O-N 2.98Å; A84-N88 PolarHBondContact O-ND2 3.02Å; I85-N88 PolarHBondContact O-N 2.89Å; N88-K90 PolarHBondContact O-N 2.69Å; N88-Q91 PolarHBondContact O-N 3.29Å; N88-L92 VanDerWaalsContact O-CB 3.32Å; N88-L92 WeakPolarHBondContact O-CB 3.26Å; N88-L92 PolarHBondContact O-N 2.78Å
89	K	84.9	Confident	82.5	Confident	60 Å²	60	72.1 Å²	72.1	26%	0.261	34%	0.343	S	S	.	.	H	α-helix	trans	-57.7	-47.5	173.3	-78.4	-166.9	171.1	-172.4	0	111.7	L62 D63 I85 V86 Q87 Q91 L92 F93	L62-K89 HydrophobicContact CD2-CB 4.41Å; L62-K89 HydrophobicContact CD2-CD 4.17Å; L62-K89 HydrophobicContact CD2-CG 3.31Å; L62-K89 HydrophobicContact CG-CG 4.09Å; D63-K89 IonicContact OD1-NZ 2.81Å; I85-K89 PolarHBondContact O-N 3.33Å; V86-K89 PolarHBondContact O-N 2.71Å; Q87-K89 VanDerWaalsContact C-N 3.34Å; Q87-K89 PolarHBondContact O-N 3.21Å; K89-Q91 PolarHBondContact O-N 2.69Å; K89-L92 WeakPolarHBondContact O-CB 3.14Å; K89-L92 PolarHBondContact O-N 2.76Å; K89-F93 HydrophobicContact CB-CE2 4.47Å; K89-F93 WeakPolarHBondContact O-CD2 3.1Å; K89-F93 PolarHBondContact O-N 3.32Å
90	K	86.5	Confident	83.2	Confident	151 Å²	151	70 Å²	70	66%	0.657	34%	0.335	S	S	*	.	H	α-helix	trans	-60.3	-44.1	177.2	-77.1	-178.7	176.2	-179.9	0	112.4	V86 Q87 N88 L92 F93 A94	V86-K90 PolarHBondContact O-N 2.8Å; Q87-K90 PolarHBondContact O-N 3.21Å; N88-K90 PolarHBondContact O-N 2.69Å; K90-L92 VanDerWaalsContact C-N 3.34Å; K90-F93 PolarHBondContact O-N 3.29Å; K90-A94 PolarHBondContact O-N 2.78Å; K90-A94 VanDerWaalsContact O-N 3.11Å
91	Q	85.1	Confident	83.7	Confident	83 Å²	83	72 Å²	72	39%	0.388	34%	0.336	S	S	.	.	H	α-helix	trans	-64.6	-40	177.5	-71.6	179.1	-9	0	0	111.7	Q87 N88 K89 A94 L95	Q87-Q91 WeakPolarHBondContact O-CG 3.2Å; Q87-Q91 PolarHBondContact O-N 3.48Å; N88-Q91 PolarHBondContact O-N 3.29Å; K89-Q91 PolarHBondContact O-N 2.69Å; Q91-A94 PolarHBondContact O-N 3.37Å; Q91-L95 WeakPolarHBondContact O-CB 3.13Å; Q91-L95 PolarHBondContact O-N 3.29Å
92	L	85.7	Confident	84.2	Confident	11 Å²	11	71.4 Å²	71.4	6%	0.058	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-43.1	175.8	-173.2	64.3	0	0	0	111.9	L55 I58 N59 L62 N88 K89 K90 L95 Q96	L55-L92 HydrophobicContact CD2-CD1 3.46Å; L55-L92 VanDerWaalsContact CD2-CD1 3.46Å; I58-L92 HydrophobicContact CB-CD1 4.47Å; I58-L92 HydrophobicContact CD1-CD1 4.23Å; I58-L92 HydrophobicContact CG2-CD1 3.93Å; I58-L92 HydrophobicContact CG2-CD2 3.94Å; N59-L92 WeakPolarHBondContact OD1-CD2 3.27Å; L62-L92 HydrophobicContact CD2-CD2 4.42Å; N88-L92 VanDerWaalsContact O-CB 3.32Å; N88-L92 WeakPolarHBondContact O-CB 3.26Å; N88-L92 PolarHBondContact O-N 2.78Å; K89-L92 WeakPolarHBondContact O-CB 3.14Å; K89-L92 PolarHBondContact O-N 2.76Å; K90-L92 VanDerWaalsContact C-N 3.34Å; L92-L95 WeakPolarHBondContact O-CB 3.49Å; L92-L95 PolarHBondContact O-N 2.94Å; L92-Q96 WeakPolarHBondContact O-CG 3.29Å; L92-Q96 PolarHBondContact O-N 3.47Å
93	F	84.3	Confident	84.6	Confident	136 Å²	136	65.6 Å²	65.6	60%	0.596	31%	0.312	S	S	*	.	H	α-helix	trans	-61.7	-43.5	174.8	-76.6	-61.6	0	0	0	112.1	K89 K90 L95 Q96 D97	K89-F93 HydrophobicContact CB-CE2 4.47Å; K89-F93 WeakPolarHBondContact O-CD2 3.1Å; K89-F93 PolarHBondContact O-N 3.32Å; K90-F93 PolarHBondContact O-N 3.29Å; F93-L95 VanDerWaalsContact C-N 3.29Å; F93-L95 PolarHBondContact O-N 3.06Å; F93-Q96 PolarHBondContact O-N 3.3Å; F93-D97 PolarHBondContact O-N 3.47Å
94	A	87.1	Confident	84.9	Confident	64 Å²	64	68 Å²	68	53%	0.529	32%	0.322	S	S	.	.	H	α-helix	trans	-62.9	-38	175.6	0	0	0	0	0	112	K90 Q91 D97 R98	K90-A94 PolarHBondContact O-N 2.78Å; K90-A94 VanDerWaalsContact O-N 3.11Å; Q91-A94 PolarHBondContact O-N 3.37Å; A94-D97 PolarHBondContact O-N 2.86Å; A94-R98 PolarHBondContact O-N 2.93Å
95	L	85.4	Confident	85	Confident	8 Å²	8	68.7 Å²	68.7	4%	0.042	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-42.7	176	-171.4	68.6	0	0	0	112	D17 T20 K21 I24 L55 Q91 L92 F93 R98 Y99	D17-L95 WeakPolarHBondContact OD1-CD2 3.5Å; T20-L95 HydrophobicContact CG2-CD2 3.58Å; T20-L95 HydrophobicContact CG2-CG 4.13Å; K21-L95 HydrophobicContact CB-CD1 4.5Å; K21-L95 HydrophobicContact CD-CD1 4.46Å; K21-L95 HydrophobicContact CG-CD1 3.43Å; K21-L95 VanDerWaalsContact CG-CD1 3.43Å; I24-L95 HydrophobicContact CD1-CD1 3.44Å; I24-L95 VanDerWaalsContact CD1-CD1 3.44Å; I24-L95 HydrophobicContact CD1-CG 3.92Å; L55-L95 HydrophobicContact CD2-CD2 4.49Å; Q91-L95 WeakPolarHBondContact O-CB 3.13Å; Q91-L95 PolarHBondContact O-N 3.29Å; L92-L95 WeakPolarHBondContact O-CB 3.49Å; L92-L95 PolarHBondContact O-N 2.94Å; F93-L95 VanDerWaalsContact C-N 3.29Å; F93-L95 PolarHBondContact O-N 3.06Å; L95-R98 PolarHBondContact O-N 3.47Å; L95-Y99 WeakPolarHBondContact O-CB 3.44Å; L95-Y99 PolarHBondContact O-N 3.46Å
96	Q	87	Confident	85.1	Confident	42 Å²	42	68.5 Å²	68.5	20%	0.196	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-41.8	175.6	-74.6	176.7	-12.7	0	0	111.9	L55 L92 F93 Y99 R100	L55-Q96 HydrophobicContact CD1-CG 4.15Å; L55-Q96 HydrophobicContact CD2-CG 4.05Å; L92-Q96 WeakPolarHBondContact O-CG 3.29Å; L92-Q96 PolarHBondContact O-N 3.47Å; F93-Q96 PolarHBondContact O-N 3.3Å; Q96-Y99 PolarHBondContact O-N 3.02Å; Q96-R100 VanDerWaalsContact O-CG 3.3Å; Q96-R100 WeakPolarHBondContact O-CG 3.32Å; Q96-R100 PolarHBondContact O-N 3.47Å
97	D	85.5	Confident	85.2	Confident	73 Å²	73	68.3 Å²	68.3	39%	0.39	32%	0.324	S	S	.	.	H	α-helix	trans	-62.8	-44.5	175.5	-176.5	58.9	0	0	0	111.6	F93 A94 Y99 R100 K101	F93-D97 PolarHBondContact O-N 3.47Å; A94-D97 PolarHBondContact O-N 2.86Å; D97-Y99 PolarHBondContact O-N 2.91Å; D97-R100 PolarHBondContact O-N 3.49Å; D97-K101 WeakPolarHBondContact O-CG 3.49Å; D97-K101 PolarHBondContact O-N 3.46Å; D97-K101 IonicContact OD1-NZ 2.69Å; D97-K101 VanDerWaalsContact OD2-CE 3.28Å; D97-K101 WeakPolarHBondContact OD2-CE 3.41Å; D97-K101 IonicContact OD2-NZ 2.63Å; D97-K101 PolarHBondContact OD2-NZ 3.29Å
98	R	85.1	Confident	85	Confident	106 Å²	106	65.3 Å²	65.3	40%	0.4	32%	0.316	S	S	.	.	H	α-helix	trans	-61.8	-44.3	174.8	-170	-176.9	174.2	174.2	-2	112	I24 E28 A94 L95 R100 K101 A102	I24-R98 HydrophobicContact CG2-CG 4.01Å; E28-R98 IonicContact OE1-CZ 3.71Å; E28-R98 IonicContact OE1-NE 3.58Å; E28-R98 PolarHBondContact OE1-NE 3Å; E28-R98 IonicContact OE1-NH2 2.8Å; E28-R98 PolarHBondContact OE1-NH2 3.37Å; E28-R98 IonicContact OE2-CZ 3.73Å; E28-R98 IonicContact OE2-NH2 3.6Å; E28-R98 PolarHBondContact OE2-NH2 2.87Å; A94-R98 PolarHBondContact O-N 2.93Å; L95-R98 PolarHBondContact O-N 3.47Å; R98-R100 VanDerWaalsContact C-N 3.35Å; R98-R100 PolarHBondContact O-N 2.91Å; R98-K101 PolarHBondContact O-N 3.24Å; R98-A102 WeakPolarHBondContact O-CB 3.44Å; R98-A102 PolarHBondContact O-N 2.97Å
99	Y	86.1	Confident	85	Confident	18 Å²	18	65 Å²	65	7%	0.071	32%	0.316	C	S	.	.	H	α-helix	trans	-58.9	-44.4	176.2	170.6	-116.7	0	0	0	112	I24 I27 Q48 V51 L55 L95 Q96 D97 K101 A102 I103	I24-Y99 HydrophobicContact CG1-CD2 4.07Å; I27-Y99 HydrophobicContact CD1-CD2 4.16Å; I27-Y99 HydrophobicContact CD1-CE2 3.85Å; Q48-Y99 WeakPolarHBondContact CA-OH 3.37Å; Q48-Y99 PolarHBondContact O-OH 2.68Å; V51-Y99 HydrophobicContact CB-CD2 4.23Å; V51-Y99 HydrophobicContact CB-CE2 3.67Å; V51-Y99 HydrophobicContact CG1-CD1 4.07Å; V51-Y99 HydrophobicContact CG1-CD2 3.59Å; V51-Y99 HydrophobicContact CG1-CE1 3.92Å; V51-Y99 HydrophobicContact CG1-CE2 3.41Å; V51-Y99 VanDerWaalsContact CG1-CE2 3.41Å; V51-Y99 HydrophobicContact CG1-CG 3.89Å; V51-Y99 HydrophobicContact CG2-CD2 4.27Å; V51-Y99 HydrophobicContact CG2-CE2 3.95Å; L55-Y99 HydrophobicContact CD1-CD1 4.47Å; L95-Y99 WeakPolarHBondContact O-CB 3.44Å; L95-Y99 PolarHBondContact O-N 3.46Å; Q96-Y99 PolarHBondContact O-N 3.02Å; D97-Y99 PolarHBondContact O-N 2.91Å; Y99-K101 PolarHBondContact O-N 3.25Å; Y99-A102 PolarHBondContact O-N 3.48Å; Y99-I103 HydrophobicContact CD1-CD1 3.78Å; Y99-I103 HydrophobicContact CD2-CD1 3.78Å; Y99-I103 HydrophobicContact CD2-CG1 4.01Å; Y99-I103 HydrophobicContact CE1-CD1 3.3Å; Y99-I103 HydrophobicContact CE1-CG1 4.49Å; Y99-I103 HydrophobicContact CE2-CD1 3.3Å; Y99-I103 HydrophobicContact CE2-CG1 3.69Å; Y99-I103 HydrophobicContact CG-CD1 4.02Å; Y99-I103 WeakPolarHBondContact O-CG1 3.25Å; Y99-I103 PolarHBondContact O-N 2.97Å; Y99-I103 WeakPolarHBondContact OH-CD1 3.44Å
100	R	86.1	Confident	84.9	Confident	138 Å²	138	62.2 Å²	62.2	52%	0.521	30%	0.304	S	S	.	.	H	α-helix	trans	-59.1	-46.8	176.1	-74.3	172	178.5	-173.3	-1.8	111.7	Q96 D97 R98 I103 F104	Q96-R100 VanDerWaalsContact O-CG 3.3Å; Q96-R100 WeakPolarHBondContact O-CG 3.32Å; Q96-R100 PolarHBondContact O-N 3.47Å; D97-R100 PolarHBondContact O-N 3.49Å; R98-R100 VanDerWaalsContact C-N 3.35Å; R98-R100 PolarHBondContact O-N 2.91Å; R100-I103 PolarHBondContact O-N 2.86Å; R100-F104 WeakPolarHBondContact O-CB 3.42Å; R100-F104 PolarHBondContact O-N 3.45Å
101	K	85.9	Confident	84.7	Confident	130 Å²	130	58.5 Å²	58.5	57%	0.565	29%	0.289	S	S	*	.	H	α-helix	trans	-61.1	-44	176.7	-71.8	169.6	177.1	164.8	0	111.9	D97 R98 Y99 F104 A105	D97-K101 WeakPolarHBondContact O-CG 3.49Å; D97-K101 PolarHBondContact O-N 3.46Å; D97-K101 IonicContact OD1-NZ 2.69Å; D97-K101 VanDerWaalsContact OD2-CE 3.28Å; D97-K101 WeakPolarHBondContact OD2-CE 3.41Å; D97-K101 IonicContact OD2-NZ 2.63Å; D97-K101 PolarHBondContact OD2-NZ 3.29Å; R98-K101 PolarHBondContact O-N 3.24Å; Y99-K101 PolarHBondContact O-N 3.25Å; K101-F104 PolarHBondContact O-N 2.96Å; K101-A105 WeakPolarHBondContact O-CB 3.5Å; K101-A105 PolarHBondContact O-N 2.76Å
102	A	83.8	Confident	84.6	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.025	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-44.6	178.7	0	0	0	0	0	112.4	I24 I27 E28 R98 Y99 A105 A106	I24-A102 HydrophobicContact CG2-CB 3.92Å; I27-A102 HydrophobicContact CG2-CB 4.03Å; E28-A102 HydrophobicContact CG-CB 3.73Å; R98-A102 WeakPolarHBondContact O-CB 3.44Å; R98-A102 PolarHBondContact O-N 2.97Å; Y99-A102 PolarHBondContact O-N 3.48Å; A102-A105 PolarHBondContact O-N 3.03Å; A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.27Å
103	I	87	Confident	84.4	Confident	27 Å²	27	62 Å²	62	14%	0.138	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-46.8	175.6	-68.9	164.6	0	0	0	111.1	Q48 Y99 R100 A105 A106 N107	Q48-I103 HydrophobicContact CG-CD1 4.29Å; Q48-I103 HydrophobicContact CG-CG1 4.23Å; Y99-I103 HydrophobicContact CD1-CD1 3.78Å; Y99-I103 HydrophobicContact CD2-CD1 3.78Å; Y99-I103 HydrophobicContact CD2-CG1 4.01Å; Y99-I103 HydrophobicContact CE1-CD1 3.3Å; Y99-I103 HydrophobicContact CE1-CG1 4.49Å; Y99-I103 HydrophobicContact CE2-CD1 3.3Å; Y99-I103 HydrophobicContact CE2-CG1 3.69Å; Y99-I103 HydrophobicContact CG-CD1 4.02Å; Y99-I103 WeakPolarHBondContact O-CG1 3.25Å; Y99-I103 PolarHBondContact O-N 2.97Å; Y99-I103 WeakPolarHBondContact OH-CD1 3.44Å; R100-I103 PolarHBondContact O-N 2.86Å; I103-A105 VanDerWaalsContact C-N 3.3Å; I103-A105 PolarHBondContact O-N 3.47Å; I103-A106 PolarHBondContact O-N 2.78Å; I103-N107 WeakPolarHBondContact CG2-ND2 3.37Å; I103-N107 WeakPolarHBondContact O-CB 3.25Å; I103-N107 PolarHBondContact O-N 2.92Å
104	F	84.5	Confident	84.2	Confident	149 Å²	149	57.9 Å²	57.9	65%	0.654	29%	0.293	S	S	*	.	H	α-helix	trans	-59.8	-44.7	-179.4	-178.8	-96	0	0	0	111	R100 K101 S108	R100-F104 WeakPolarHBondContact O-CB 3.42Å; R100-F104 PolarHBondContact O-N 3.45Å; K101-F104 PolarHBondContact O-N 2.96Å; F104-S108 WeakPolarHBondContact O-CB 3.38Å; F104-S108 PolarHBondContact O-N 3.44Å
105	A	83.8	Confident	83.7	Confident	43 Å²	43	59.9 Å²	59.9	36%	0.355	29%	0.29	S	S	.	.	H	α-helix	trans	-62.2	-43.9	175.4	0	0	0	0	0	112.3	K101 A102 I103 A109	K101-A105 WeakPolarHBondContact O-CB 3.5Å; K101-A105 PolarHBondContact O-N 2.76Å; A102-A105 PolarHBondContact O-N 3.03Å; I103-A105 VanDerWaalsContact C-N 3.3Å; I103-A105 PolarHBondContact O-N 3.47Å; A105-A109 VanDerWaalsContact O-CB 3.25Å; A105-A109 WeakPolarHBondContact O-CB 3.43Å; A105-A109 PolarHBondContact O-N 2.62Å
106	A	83.5	Confident	83.5	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66	-45.1	178.9	0	0	0	0	0	112.6	I27 L44 A102 I103 L110	I27-A106 HydrophobicContact CG2-CB 3.8Å; L44-A106 HydrophobicContact CD1-CB 4.04Å; L44-A106 HydrophobicContact CD2-CB 4.2Å; A102-A106 WeakPolarHBondContact O-CB 3.4Å; A102-A106 PolarHBondContact O-N 3.27Å; I103-A106 PolarHBondContact O-N 2.78Å; A106-L110 VanDerWaalsContact O-CB 3.32Å; A106-L110 WeakPolarHBondContact O-CB 3.47Å; A106-L110 PolarHBondContact O-N 2.7Å
107	N	84.5	Confident	83	Confident	49 Å²	49	64.8 Å²	64.8	26%	0.262	32%	0.322	S	S	.	.	H	α-helix	trans	-64.8	-45	176.6	-81.6	-24.4	0	0	0	111.5	L44 I103 L110 E111	L44-N107 WeakPolarHBondContact CD2-OD1 3.29Å; I103-N107 WeakPolarHBondContact CG2-ND2 3.37Å; I103-N107 WeakPolarHBondContact O-CB 3.25Å; I103-N107 PolarHBondContact O-N 2.92Å; N107-L110 PolarHBondContact O-N 3.01Å; N107-E111 WeakPolarHBondContact O-CB 3.14Å; N107-E111 WeakPolarHBondContact O-CG 3.28Å; N107-E111 PolarHBondContact O-N 3.14Å
108	S	80.5	Confident	82.6	Confident	52 Å²	52	66.3 Å²	66.3	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-61.2	-46.9	177.6	-176.2	0	0	0	0	111.3	F104 L110 E111 T112	F104-S108 WeakPolarHBondContact O-CB 3.38Å; F104-S108 PolarHBondContact O-N 3.44Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 3.47Å; S108-E111 PolarHBondContact O-N 2.72Å; S108-T112 WeakPolarHBondContact O-CG2 3.48Å; S108-T112 PolarHBondContact O-N 2.66Å; S108-T112 PolarHBondContact O-OG1 2.67Å
109	A	82	Confident	82.2	Confident	21 Å²	21	65.8 Å²	65.8	17%	0.174	34%	0.338	C	S	.	.	H	α-helix	trans	-60.9	-39.6	176.8	0	0	0	0	0	112.2	I34 A105 T112 F113	I34-A109 VanDerWaalsContact CD1-C 3.42Å; I34-A109 HydrophobicContact CD1-CB 3.77Å; I34-A109 WeakPolarHBondContact CD1-O 3.48Å; A105-A109 VanDerWaalsContact O-CB 3.25Å; A105-A109 WeakPolarHBondContact O-CB 3.43Å; A105-A109 PolarHBondContact O-N 2.62Å; A109-T112 WeakPolarHBondContact CA-OG1 3.29Å; A109-T112 PolarHBondContact O-OG1 3.43Å; A109-F113 WeakPolarHBondContact O-CB 3.48Å; A109-F113 PolarHBondContact O-N 2.89Å
110	L	82.8	Confident	81.3	Confident	2 Å²	2	68.1 Å²	68.1	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-66.9	-45.3	176.7	-167.7	68.2	0	0	0	111.8	I34 T37 C40 R41 A106 N107 S108 T112 F113 E114	I34-L110 HydrophobicContact CD1-CB 4.4Å; I34-L110 HydrophobicContact CD1-CD1 4.33Å; I34-L110 HydrophobicContact CG2-CD1 4.11Å; T37-L110 HydrophobicContact CG2-CD1 4.08Å; C40-L110 HydrophobicContact CB-CD1 3.97Å; R41-L110 HydrophobicContact CB-CD2 3.91Å; R41-L110 HydrophobicContact CG-CD2 4.25Å; A106-L110 VanDerWaalsContact O-CB 3.32Å; A106-L110 WeakPolarHBondContact O-CB 3.47Å; A106-L110 PolarHBondContact O-N 2.7Å; N107-L110 PolarHBondContact O-N 3.01Å; S108-L110 VanDerWaalsContact C-N 3.3Å; S108-L110 PolarHBondContact O-N 3.47Å; L110-T112 PolarHBondContact O-N 2.77Å; L110-F113 PolarHBondContact O-N 3.37Å; L110-E114 WeakPolarHBondContact O-CB 3.35Å; L110-E114 WeakPolarHBondContact O-CG 3.21Å; L110-E114 PolarHBondContact O-N 3.44Å
111	E	83.2	Confident	80.1	Confident	73 Å²	73	69.9 Å²	69.9	34%	0.341	36%	0.364	S	S	.	.	H	α-helix	trans	-61.2	-42.3	175.5	-76.5	179.9	-159.6	0	0	111.9	N107 S108 F113 E114 K115 R150	N107-E111 WeakPolarHBondContact O-CB 3.14Å; N107-E111 WeakPolarHBondContact O-CG 3.28Å; N107-E111 PolarHBondContact O-N 3.14Å; S108-E111 PolarHBondContact O-N 2.72Å; E111-F113 VanDerWaalsContact C-N 3.32Å; E111-F113 PolarHBondContact O-N 3.25Å; E111-E114 PolarHBondContact O-N 3Å; E111-K115 WeakPolarHBondContact O-CB 3.18Å; E111-K115 VanDerWaalsContact O-CG 3.23Å; E111-K115 WeakPolarHBondContact O-CG 3.3Å; E111-K115 PolarHBondContact O-N 3.35Å; E111-R150 IonicContact OE2-NH2 2.92Å; E111-R150 PolarHBondContact OE2-NH2 3.4Å
112	T	82.1	Confident	78.7	Confident	88 Å²	88	67.9 Å²	67.9	54%	0.54	37%	0.366	S	S	.	.	H	α-helix	trans	-65.5	-38	178	53.8	0	0	0	0	111.8	S108 A109 L110 A116	S108-T112 WeakPolarHBondContact O-CG2 3.48Å; S108-T112 PolarHBondContact O-N 2.66Å; S108-T112 PolarHBondContact O-OG1 2.67Å; A109-T112 WeakPolarHBondContact CA-OG1 3.29Å; A109-T112 PolarHBondContact O-OG1 3.43Å; L110-T112 PolarHBondContact O-N 2.77Å; T112-A116 PolarHBondContact O-N 2.87Å; T112-A116 VanDerWaalsContact O-N 3.08Å
113	F	81.5	Confident	77.1	Confident	81 Å²	81	72.6 Å²	72.6	36%	0.355	40%	0.399	S	S	.	.	H	α-helix	trans	-70.6	-44.9	177.4	-170.3	-81.2	0	0	0	111.6	I34 T37 A109 L110 E111 K115 A116 E117	I34-F113 HydrophobicContact CB-CD2 4.18Å; I34-F113 HydrophobicContact CB-CG 4.28Å; I34-F113 HydrophobicContact CD1-CB 4.3Å; I34-F113 HydrophobicContact CG2-CB 4.18Å; I34-F113 HydrophobicContact CG2-CD1 3.84Å; I34-F113 HydrophobicContact CG2-CD2 4.08Å; I34-F113 HydrophobicContact CG2-CE1 4.2Å; I34-F113 HydrophobicContact CG2-CE2 4.43Å; I34-F113 HydrophobicContact CG2-CG 3.75Å; I34-F113 HydrophobicContact CG2-CZ 4.48Å; I34-F113 WeakPolarHBondContact O-CE2 3.3Å; T37-F113 HydrophobicContact CG2-CD1 3.34Å; T37-F113 HydrophobicContact CG2-CE1 3.81Å; T37-F113 HydrophobicContact CG2-CG 4.42Å; A109-F113 WeakPolarHBondContact O-CB 3.48Å; A109-F113 PolarHBondContact O-N 2.89Å; L110-F113 PolarHBondContact O-N 3.37Å; E111-F113 VanDerWaalsContact C-N 3.32Å; E111-F113 PolarHBondContact O-N 3.25Å; F113-K115 VanDerWaalsContact C-N 3.28Å; F113-K115 PolarHBondContact O-N 2.98Å; F113-A116 PolarHBondContact O-N 3.49Å; F113-E117 PolarHBondContact O-N 2.58Å
114	E	80.6	Confident	75.4	Confident	48 Å²	48	81.8 Å²	81.8	22%	0.224	43%	0.432	C	S	.	.	H	α-helix	trans	-57.8	-41.6	175.3	-75.8	177.6	167.4	0	0	111.3	T37 R41 L110 E111 E117 L118	T37-E114 HydrophobicContact CG2-CG 3.51Å; R41-E114 IonicContact CZ-OE1 3.97Å; R41-E114 IonicContact CZ-OE2 3.32Å; R41-E114 VanDerWaalsContact NH1-CD 3.27Å; R41-E114 IonicContact NH1-OE1 3.56Å; R41-E114 PolarHBondContact NH1-OE1 2.93Å; R41-E114 IonicContact NH1-OE2 2.67Å; R41-E114 PolarHBondContact NH1-OE2 2.92Å; R41-E114 IonicContact NH2-OE2 3.99Å; L110-E114 WeakPolarHBondContact O-CB 3.35Å; L110-E114 WeakPolarHBondContact O-CG 3.21Å; L110-E114 PolarHBondContact O-N 3.44Å; E111-E114 PolarHBondContact O-N 3Å; E114-E117 PolarHBondContact O-N 3.39Å; E114-L118 VanDerWaalsContact O-CG 3.31Å; E114-L118 WeakPolarHBondContact O-CG 3.31Å; E114-L118 PolarHBondContact O-N 2.85Å
115	K	76.8	Confident	73.8	Confident	106 Å²	106	79.1 Å²	79.1	46%	0.461	43%	0.428	S	S	.	.	H	α-helix	trans	-63.7	-44.8	175.2	-74.1	174.9	-178.3	-171.1	0	112.4	E111 F113 E117 L118 T119	E111-K115 WeakPolarHBondContact O-CB 3.18Å; E111-K115 VanDerWaalsContact O-CG 3.23Å; E111-K115 WeakPolarHBondContact O-CG 3.3Å; E111-K115 PolarHBondContact O-N 3.35Å; F113-K115 VanDerWaalsContact C-N 3.28Å; F113-K115 PolarHBondContact O-N 2.98Å; K115-E117 VanDerWaalsContact C-N 3.31Å; K115-E117 PolarHBondContact O-N 3.28Å; K115-L118 PolarHBondContact O-N 3.46Å; K115-T119 WeakPolarHBondContact O-CG2 3.25Å; K115-T119 PolarHBondContact O-N 3.43Å; K115-T119 PolarHBondContact O-OG1 3.38Å; K115-T119 VanDerWaalsContact O-OG1 3.07Å
116	A	80.8	Confident	72.1	Confident	53 Å²	53	86.3 Å²	86.3	44%	0.438	45%	0.454	S	S	.	.	H	α-helix	trans	-63.6	-36.7	177.9	0	0	0	0	0	112.5	T112 F113 T119 S120	T112-A116 PolarHBondContact O-N 2.87Å; T112-A116 VanDerWaalsContact O-N 3.08Å; F113-A116 PolarHBondContact O-N 3.49Å; A116-T119 PolarHBondContact O-OG1 3.23Å; A116-S120 VanDerWaalsContact O-CB 3.3Å; A116-S120 WeakPolarHBondContact O-CB 3.36Å; A116-S120 PolarHBondContact O-N 2.89Å; A116-S120 VanDerWaalsContact O-N 3.1Å; A116-S120 PolarHBondContact O-OG 3.03Å
117	E	77.4	Confident	70.5	Confident	101 Å²	101	92.2 Å²	92.2	47%	0.472	49%	0.485	S	S	.	.	H	α-helix	trans	-65.8	-41.8	174.7	-168.6	179.2	176.5	0	0	111.5	F113 E114 K115 S120 R121	F113-E117 PolarHBondContact O-N 2.58Å; E114-E117 PolarHBondContact O-N 3.39Å; K115-E117 VanDerWaalsContact C-N 3.31Å; K115-E117 PolarHBondContact O-N 3.28Å; E117-S120 PolarHBondContact O-OG 3.27Å; E117-R121 PolarHBondContact O-N 3.11Å
118	L	76	Confident	68.8	Low	105 Å²	105	91.7 Å²	91.7	55%	0.55	49%	0.491	S	S	.	.	H	α-helix	trans	-69.8	-43.7	178.4	-70.2	171.9	0	0	0	113	E114 K115 R121 S122	E114-L118 VanDerWaalsContact O-CG 3.31Å; E114-L118 WeakPolarHBondContact O-CG 3.31Å; E114-L118 PolarHBondContact O-N 2.85Å; K115-L118 PolarHBondContact O-N 3.46Å; L118-R121 PolarHBondContact O-N 2.97Å; L118-S122 PolarHBondContact O-N 3.31Å; L118-S122 VanDerWaalsContact O-N 3.1Å
119	T	76.5	Confident	67.3	Low	94 Å²	94	96.8 Å²	96.8	58%	0.577	51%	0.514	S	S	*	.	H	α-helix	trans	-68.6	-38.3	-179.6	54.1	0	0	0	0	112.1	K115 A116 R121 S122 S123	K115-T119 WeakPolarHBondContact O-CG2 3.25Å; K115-T119 PolarHBondContact O-N 3.43Å; K115-T119 PolarHBondContact O-OG1 3.38Å; K115-T119 VanDerWaalsContact O-OG1 3.07Å; A116-T119 PolarHBondContact O-OG1 3.23Å; T119-R121 VanDerWaalsContact C-N 3.29Å; T119-R121 PolarHBondContact O-N 2.69Å; T119-S122 WeakPolarHBondContact O-CB 3.44Å; T119-S122 PolarHBondContact O-N 2.98Å; T119-S123 PolarHBondContact O-N 3.22Å
120	S	68.9	Low	65.7	Low	68 Å²	68	107 Å²	107	48%	0.476	55%	0.548	S	S	.	.	H	α-helix	trans	-67.3	-27.8	174.5	61.4	0	0	0	0	113.2	A116 E117 S123	A116-S120 VanDerWaalsContact O-CB 3.3Å; A116-S120 WeakPolarHBondContact O-CB 3.36Å; A116-S120 PolarHBondContact O-N 2.89Å; A116-S120 VanDerWaalsContact O-N 3.1Å; A116-S120 PolarHBondContact O-OG 3.03Å; E117-S120 PolarHBondContact O-OG 3.27Å; S120-S123 PolarHBondContact O-OG 3.34Å
121	R	59.9	Low	64.3	Low	175 Å²	175	111.3 Å²	111.3	66%	0.66	57%	0.57	S	S	*	*	H	α-helix	trans	-74.1	-34.8	172.2	-164.7	171.1	70	170.2	2.2	112.2	E117 L118 T119 R124 T125	E117-R121 PolarHBondContact O-N 3.11Å; L118-R121 PolarHBondContact O-N 2.97Å; T119-R121 VanDerWaalsContact C-N 3.29Å; T119-R121 PolarHBondContact O-N 2.69Å; R121-R124 PolarHBondContact O-N 3.28Å; R121-T125 PolarHBondContact O-OG1 3.03Å
122	S	56	Low	62.9	Low	88 Å²	88	110.2 Å²	110.2	62%	0.615	57%	0.571	S	S	*	*	H	α-helix	trans	-65	-40.8	178.4	-165.4	0	0	0	0	112.3	L118 T119 R124 T125	L118-S122 PolarHBondContact O-N 3.31Å; L118-S122 VanDerWaalsContact O-N 3.1Å; T119-S122 WeakPolarHBondContact O-CB 3.44Å; T119-S122 PolarHBondContact O-N 2.98Å; S122-R124 PolarHBondContact O-N 3.48Å; S122-T125 PolarHBondContact O-N 3.43Å
123	S	51.9	Low	61.4	Low	102 Å²	102	110.3 Å²	110.3	71%	0.713	58%	0.575	S	S	*	*	H	α-helix	trans	-67.1	-19.6	178.8	58.4	0	0	0	0	113.7	T119 S120 T125	T119-S123 PolarHBondContact O-N 3.22Å; S120-S123 PolarHBondContact O-OG 3.34Å; S123-T125 VanDerWaalsContact C-N 3.34Å
124	R	51.2	Low	60	Low	219 Å²	219	113 Å²	113	83%	0.826	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-4.9	178.2	-131.1	176.7	102.2	176.5	7	114.4	R121 S122	R121-R124 PolarHBondContact O-N 3.28Å; S122-R124 PolarHBondContact O-N 3.48Å
125	T	49.9	Very low	58.8	Low	93 Å²	93	113.9 Å²	113.9	57%	0.571	60%	0.596	S	S	*	*	S	Bend	trans	-101	99.3	-179.5	-40.3	0	0	0	0	108.9	R121 S122 S123 I127	R121-T125 PolarHBondContact O-OG1 3.03Å; S122-T125 PolarHBondContact O-N 3.43Å; S123-T125 VanDerWaalsContact C-N 3.34Å; T125-I127 PolarHBondContact O-N 3.25Å
126	E	47.2	Very low	57.7	Low	195 Å²	195	115.2 Å²	115.2	91%	0.911	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	27.4	-166.2	-69.5	-177.6	144.6	0	0	118.8
127	I	51	Low	56.3	Low	124 Å²	124	120.1 Å²	120.1	64%	0.636	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-0.4	179.4	-50.5	176.5	0	0	0	111.8	T125 N129 I131	T125-I127 PolarHBondContact O-N 3.25Å; I127-N129 PolarHBondContact O-N 3.45Å; I127-I131 HydrophobicContact CG2-CD1 3.97Å
128	G	48.4	Very low	55.1	Low	38 Å²	38	121.6 Å²	121.6	39%	0.392	62%	0.62	S	S	.	*	H	α-helix	trans	-65.3	-24.1	-166.1	0	0	0	0	0	117.9	R130 S132	G128-R130 PolarHBondContact O-N 2.92Å; G128-S132 WeakPolarHBondContact O-CB 3.41Å; G128-S132 PolarHBondContact O-N 2.99Å; G128-S132 PolarHBondContact O-OG 3.43Å
129	N	49.6	Very low	54.1	Low	159 Å²	159	120.3 Å²	120.3	85%	0.85	61%	0.611	S	S	*	*	H	α-helix	trans	-79.8	-11.2	-168.1	-78.4	3.6	0	0	0	115.8	I127	I127-N129 PolarHBondContact O-N 3.45Å
130	R	47.7	Very low	53.4	Low	236 Å²	236	120.6 Å²	120.6	89%	0.891	61%	0.609	S	S	*	*	H	α-helix	trans	-113.9	-17.2	176.8	-78.6	-176.6	171.3	-178.7	-2.4	114.3	G128	G128-R130 PolarHBondContact O-N 2.92Å
131	I	53.7	Low	52.6	Low	91 Å²	91	120.1 Å²	120.1	47%	0.467	61%	0.606	S	S	.	*	H	α-helix	trans	-91.3	-27	176.1	-67.6	175.2	0	0	0	110.6	I127 S133 L134 E135	I127-I131 HydrophobicContact CG2-CD1 3.97Å; I131-S133 VanDerWaalsContact C-N 3.33Å; I131-S133 PolarHBondContact O-N 3.5Å; I131-S133 VanDerWaalsContact O-N 3.12Å; I131-L134 PolarHBondContact O-N 3.45Å; I131-L134 VanDerWaalsContact O-N 3.08Å; I131-E135 HydrophobicContact CG2-CB 3.63Å; I131-E135 HydrophobicContact CG2-CG 4.18Å; I131-E135 WeakPolarHBondContact O-CB 3.37Å; I131-E135 PolarHBondContact O-N 3.44Å
132	S	53.1	Low	52.4	Low	51 Å²	51	113.9 Å²	113.9	36%	0.357	59%	0.586	S	S	.	*	H	α-helix	trans	-52.6	-37.8	-173.4	54.2	0	0	0	0	115.7	G128 E136	G128-S132 WeakPolarHBondContact O-CB 3.41Å; G128-S132 PolarHBondContact O-N 2.99Å; G128-S132 PolarHBondContact O-OG 3.43Å; S132-E136 VanDerWaalsContact O-CB 3.24Å; S132-E136 WeakPolarHBondContact O-CB 3.38Å; S132-E136 VanDerWaalsContact O-CG 3.29Å; S132-E136 WeakPolarHBondContact O-CG 3.29Å; S132-E136 PolarHBondContact O-N 3.26Å
133	S	51.6	Low	52.7	Low	90 Å²	90	114.9 Å²	114.9	63%	0.629	58%	0.58	S	S	*	*	H	α-helix	trans	-75.3	-29.4	-178.5	75.9	0	0	0	0	113.6	I131	I131-S133 VanDerWaalsContact C-N 3.33Å; I131-S133 PolarHBondContact O-N 3.5Å; I131-S133 VanDerWaalsContact O-N 3.12Å
134	L	52.6	Low	52.9	Low	137 Å²	137	116.7 Å²	116.7	72%	0.717	58%	0.581	S	S	*	*	H	α-helix	trans	-89.2	-32.4	178.8	-141	145	0	0	0	110.3	I131 Y138	I131-L134 PolarHBondContact O-N 3.45Å; I131-L134 VanDerWaalsContact O-N 3.08Å; L134-Y138 WeakPolarHBondContact O-CB 2.97Å; L134-Y138 PolarHBondContact O-N 3.43Å
135	E	54.3	Low	53.8	Low	67 Å²	67	110.5 Å²	110.5	31%	0.313	57%	0.568	S	S	.	*	H	α-helix	trans	-73.7	-36	174.3	-168.4	63.2	-166.8	0	0	112.3	I131 Q137 Y138 Q139	I131-E135 HydrophobicContact CG2-CB 3.63Å; I131-E135 HydrophobicContact CG2-CG 4.18Å; I131-E135 WeakPolarHBondContact O-CB 3.37Å; I131-E135 PolarHBondContact O-N 3.44Å; E135-Q137 VanDerWaalsContact C-N 3.27Å; E135-Q137 PolarHBondContact O-N 3.24Å; E135-Y138 PolarHBondContact O-N 2.63Å; E135-Q139 HydrophobicContact CG-CG 3.67Å; E135-Q139 WeakPolarHBondContact O-CA 3.05Å; E135-Q139 WeakPolarHBondContact O-CB 3.42Å; E135-Q139 WeakPolarHBondContact O-CG 3.48Å; E135-Q139 PolarHBondContact O-N 2.64Å; E135-Q139 VanDerWaalsContact OE1-CG 3.32Å; E135-Q139 WeakPolarHBondContact OE1-CG 3.46Å; E135-Q139 PolarHBondContact OE1-NE2 3.45Å
136	E	54.2	Low	54.4	Low	134 Å²	134	111.4 Å²	111.4	63%	0.626	57%	0.566	S	S	*	*	H	α-helix	trans	-61.1	-39.1	173.7	-87.1	179.8	176.4	0	0	111.4	S132 N140	S132-E136 VanDerWaalsContact O-CB 3.24Å; S132-E136 WeakPolarHBondContact O-CB 3.38Å; S132-E136 VanDerWaalsContact O-CG 3.29Å; S132-E136 WeakPolarHBondContact O-CG 3.29Å; S132-E136 PolarHBondContact O-N 3.26Å; E136-N140 VanDerWaalsContact O-CB 3.29Å; E136-N140 WeakPolarHBondContact O-CB 3.47Å; E136-N140 PolarHBondContact O-N 2.89Å; E136-N140 PolarHBondContact O-ND2 2.89Å; E136-N140 PolarHBondContact O-OD1 3Å
137	Q	50.6	Low	55.5	Low	155 Å²	155	105.3 Å²	105.3	72%	0.724	54%	0.539	S	S	*	.	H	α-helix	trans	-73.4	-37.7	178	-164.1	175.2	-16.9	0	0	112	E135 S141	E135-Q137 VanDerWaalsContact C-N 3.27Å; E135-Q137 PolarHBondContact O-N 3.24Å; Q137-S141 PolarHBondContact O-N 2.96Å
138	Y	53.5	Low	55.9	Low	132 Å²	132	106.3 Å²	106.3	52%	0.518	54%	0.543	S	S	.	.	H	α-helix	trans	-71.6	-40.4	175	-172.3	-116.9	0	0	0	112.2	L134 E135 S141 L142	L134-Y138 WeakPolarHBondContact O-CB 2.97Å; L134-Y138 PolarHBondContact O-N 3.43Å; E135-Y138 PolarHBondContact O-N 2.63Å; Y138-S141 CarbonylContact O-C 3.59Å; Y138-S141 PolarHBondContact O-N 3.33Å; Y138-S141 PolarHBondContact O-OG 2.58Å; Y138-L142 HydrophobicContact CD1-CD1 3.57Å; Y138-L142 HydrophobicContact CD1-CG 4.24Å; Y138-L142 HydrophobicContact CE1-CD1 3.21Å; Y138-L142 HydrophobicContact CE1-CG 3.92Å; Y138-L142 HydrophobicContact CE2-CG 4.42Å; Y138-L142 HydrophobicContact CG-CD1 4.38Å; Y138-L142 WeakPolarHBondContact O-CB 3.33Å; Y138-L142 PolarHBondContact O-N 2.74Å
139	Q	55.1	Low	56.8	Low	79 Å²	79	107.6 Å²	107.6	37%	0.369	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-40.6	175.1	-74.2	-70.1	-9.1	0	0	111.2	E135 S141 L142 E143	E135-Q139 HydrophobicContact CG-CG 3.67Å; E135-Q139 WeakPolarHBondContact O-CA 3.05Å; E135-Q139 WeakPolarHBondContact O-CB 3.42Å; E135-Q139 WeakPolarHBondContact O-CG 3.48Å; E135-Q139 PolarHBondContact O-N 2.64Å; E135-Q139 VanDerWaalsContact OE1-CG 3.32Å; E135-Q139 WeakPolarHBondContact OE1-CG 3.46Å; E135-Q139 PolarHBondContact OE1-NE2 3.45Å; Q139-S141 VanDerWaalsContact C-N 3.26Å; Q139-S141 PolarHBondContact O-N 3.42Å; Q139-L142 CarbonylContact O-C 3.55Å; Q139-L142 PolarHBondContact O-N 3.44Å; Q139-E143 WeakPolarHBondContact O-CA 3.16Å; Q139-E143 WeakPolarHBondContact O-CB 3.08Å; Q139-E143 PolarHBondContact O-N 3.4Å
140	N	60.9	Low	57.7	Low	99 Å²	99	105 Å²	105	53%	0.529	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-38.1	173.2	-74	-12.9	0	0	0	111.3	E136 L144	E136-N140 VanDerWaalsContact O-CB 3.29Å; E136-N140 WeakPolarHBondContact O-CB 3.47Å; E136-N140 PolarHBondContact O-N 2.89Å; E136-N140 PolarHBondContact O-ND2 2.89Å; E136-N140 PolarHBondContact O-OD1 3Å; N140-L144 WeakPolarHBondContact O-CB 3.42Å; N140-L144 PolarHBondContact O-N 3.47Å
141	S	52	Low	58.5	Low	58 Å²	58	101.1 Å²	101.1	41%	0.406	51%	0.508	S	S	.	.	H	α-helix	trans	-71.4	-37	176.5	78.9	0	0	0	0	112.9	Q137 Y138 Q139 T145	Q137-S141 PolarHBondContact O-N 2.96Å; Y138-S141 CarbonylContact O-C 3.59Å; Y138-S141 PolarHBondContact O-N 3.33Å; Y138-S141 PolarHBondContact O-OG 2.58Å; Q139-S141 VanDerWaalsContact C-N 3.26Å; Q139-S141 PolarHBondContact O-N 3.42Å; S141-T145 WeakPolarHBondContact O-CB 3.45Å; S141-T145 PolarHBondContact O-N 2.92Å; S141-T145 VanDerWaalsContact O-N 3.08Å; S141-T145 PolarHBondContact O-OG1 3Å
142	L	56.8	Low	59.1	Low	45 Å²	45	99.4 Å²	99.4	24%	0.236	51%	0.507	C	S	.	.	H	α-helix	trans	-70.8	-40.5	174.6	-85	176.5	0	0	0	111.2	Y138 Q139 T145 Q146	Y138-L142 HydrophobicContact CD1-CD1 3.57Å; Y138-L142 HydrophobicContact CD1-CG 4.24Å; Y138-L142 HydrophobicContact CE1-CD1 3.21Å; Y138-L142 HydrophobicContact CE1-CG 3.92Å; Y138-L142 HydrophobicContact CE2-CG 4.42Å; Y138-L142 HydrophobicContact CG-CD1 4.38Å; Y138-L142 WeakPolarHBondContact O-CB 3.33Å; Y138-L142 PolarHBondContact O-N 2.74Å; Q139-L142 CarbonylContact O-C 3.55Å; Q139-L142 PolarHBondContact O-N 3.44Å; L142-T145 CarbonylContact O-C 3.53Å; L142-T145 PolarHBondContact O-N 3.3Å; L142-Q146 WeakPolarHBondContact O-CA 3.37Å; L142-Q146 WeakPolarHBondContact O-CB 3.5Å; L142-Q146 WeakPolarHBondContact O-CG 3.38Å; L142-Q146 PolarHBondContact O-N 3.49Å
143	E	61.8	Low	59.9	Low	108 Å²	108	105.6 Å²	105.6	51%	0.505	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-45.4	177.5	-175.9	175.1	-168.8	0	0	109.4	Q139 T145 Q146 D147	Q139-E143 WeakPolarHBondContact O-CA 3.16Å; Q139-E143 WeakPolarHBondContact O-CB 3.08Å; Q139-E143 PolarHBondContact O-N 3.4Å; E143-T145 VanDerWaalsContact C-N 3.33Å; E143-T145 PolarHBondContact O-N 3.46Å; E143-Q146 PolarHBondContact O-N 3.38Å; E143-D147 VanDerWaalsContact O-CB 3.22Å; E143-D147 WeakPolarHBondContact O-CB 3.18Å; E143-D147 PolarHBondContact O-N 3.47Å
144	L	56.5	Low	61	Low	140 Å²	140	104.9 Å²	104.9	73%	0.733	51%	0.512	S	S	*	.	H	α-helix	trans	-62.6	-41.3	175.2	-147.3	104.6	0	0	0	111.7	N140 M148	N140-L144 WeakPolarHBondContact O-CB 3.42Å; N140-L144 PolarHBondContact O-N 3.47Å; L144-M148 WeakPolarHBondContact O-CB 3.44Å; L144-M148 PolarHBondContact O-N 2.75Å
145	T	69.9	Low	61.7	Low	89 Å²	89	103.8 Å²	103.8	55%	0.546	51%	0.506	S	S	.	.	H	α-helix	trans	-72.7	-37	179	-56.3	0	0	0	0	112.1	S141 L142 E143 M148 T149	S141-T145 WeakPolarHBondContact O-CB 3.45Å; S141-T145 PolarHBondContact O-N 2.92Å; S141-T145 VanDerWaalsContact O-N 3.08Å; S141-T145 PolarHBondContact O-OG1 3Å; L142-T145 CarbonylContact O-C 3.53Å; L142-T145 PolarHBondContact O-N 3.3Å; E143-T145 VanDerWaalsContact C-N 3.33Å; E143-T145 PolarHBondContact O-N 3.46Å; T145-M148 PolarHBondContact O-N 3.19Å; T145-T149 PolarHBondContact O-N 3.02Å; T145-T149 PolarHBondContact O-OG1 2.95Å
146	Q	61.8	Low	62.5	Low	112 Å²	112	103.3 Å²	103.3	52%	0.523	51%	0.514	S	S	.	.	H	α-helix	trans	-73.4	-39.7	178.7	-79.4	180	1.8	0	0	111	L142 E143 M148 T149 R150	L142-Q146 WeakPolarHBondContact O-CA 3.37Å; L142-Q146 WeakPolarHBondContact O-CB 3.5Å; L142-Q146 WeakPolarHBondContact O-CG 3.38Å; L142-Q146 PolarHBondContact O-N 3.49Å; E143-Q146 PolarHBondContact O-N 3.38Å; Q146-M148 VanDerWaalsContact C-N 3.31Å; Q146-T149 VanDerWaalsContact CA-OG1 3.29Å; Q146-T149 WeakPolarHBondContact CA-OG1 3.3Å; Q146-T149 CarbonylContact O-C 3.55Å; Q146-T149 PolarHBondContact O-N 2.88Å; Q146-T149 PolarHBondContact O-OG1 3.46Å; Q146-R150 VanDerWaalsContact O-CB 3.22Å; Q146-R150 WeakPolarHBondContact O-CB 3.33Å; Q146-R150 PolarHBondContact O-N 2.96Å
147	D	70.9	Confident	63.5	Low	67 Å²	67	100.8 Å²	100.8	36%	0.358	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-44	168.5	-89.5	-6.9	0	0	0	109.5	E143 T149 R150 Y151	E143-D147 VanDerWaalsContact O-CB 3.22Å; E143-D147 WeakPolarHBondContact O-CB 3.18Å; E143-D147 PolarHBondContact O-N 3.47Å; D147-T149 VanDerWaalsContact C-N 3.32Å; D147-T149 PolarHBondContact O-N 3.46Å; D147-R150 CarbonylContact O-C 3.6Å; D147-R150 PolarHBondContact O-N 3.05Å; D147-R150 VanDerWaalsContact O-N 3.16Å; D147-Y151 HydrophobicContact CB-CD2 4.31Å; D147-Y151 HydrophobicContact CB-CE2 4.47Å; D147-Y151 VanDerWaalsContact O-CB 3.32Å; D147-Y151 WeakPolarHBondContact O-CB 3.38Å; D147-Y151 WeakPolarHBondContact O-CD2 3.22Å; D147-Y151 PolarHBondContact O-N 3.46Å
148	M	58.6	Low	64.4	Low	146 Å²	146	99.4 Å²	99.4	72%	0.719	50%	0.495	S	S	*	.	H	α-helix	trans	-61.6	-39.7	175.4	-154.1	-175.7	-167.9	0	0	112.1	L144 T145 Q146 A152	L144-M148 WeakPolarHBondContact O-CB 3.44Å; L144-M148 PolarHBondContact O-N 2.75Å; T145-M148 PolarHBondContact O-N 3.19Å; Q146-M148 VanDerWaalsContact C-N 3.31Å; M148-A152 VanDerWaalsContact O-CB 3.22Å; M148-A152 WeakPolarHBondContact O-CB 3.32Å; M148-A152 PolarHBondContact O-N 3.31Å
149	T	68.5	Low	65.2	Low	64 Å²	64	97.7 Å²	97.7	39%	0.393	50%	0.498	S	S	.	.	H	α-helix	trans	-71.7	-32.5	174.9	14.1	0	0	0	0	112.7	T145 Q146 D147 A152 R153	T145-T149 PolarHBondContact O-N 3.02Å; T145-T149 PolarHBondContact O-OG1 2.95Å; Q146-T149 VanDerWaalsContact CA-OG1 3.29Å; Q146-T149 WeakPolarHBondContact CA-OG1 3.3Å; Q146-T149 CarbonylContact O-C 3.55Å; Q146-T149 PolarHBondContact O-N 2.88Å; Q146-T149 PolarHBondContact O-OG1 3.46Å; D147-T149 VanDerWaalsContact C-N 3.32Å; D147-T149 PolarHBondContact O-N 3.46Å; T149-A152 PolarHBondContact O-N 3.28Å; T149-R153 WeakPolarHBondContact O-CB 3.43Å; T149-R153 VanDerWaalsContact O-CG 3.32Å; T149-R153 WeakPolarHBondContact O-CG 3.37Å; T149-R153 PolarHBondContact O-N 2.83Å
150	R	67	Low	65.9	Low	104 Å²	104	100.2 Å²	100.2	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-69.5	-46.1	174.1	-173.6	-177	-177.6	-159.6	-1	110.1	E111 Q146 D147 A152 R153 L154	E111-R150 IonicContact OE2-NH2 2.92Å; E111-R150 PolarHBondContact OE2-NH2 3.4Å; Q146-R150 VanDerWaalsContact O-CB 3.22Å; Q146-R150 WeakPolarHBondContact O-CB 3.33Å; Q146-R150 PolarHBondContact O-N 2.96Å; D147-R150 CarbonylContact O-C 3.6Å; D147-R150 PolarHBondContact O-N 3.05Å; D147-R150 VanDerWaalsContact O-N 3.16Å; R150-A152 VanDerWaalsContact C-N 3.31Å; R150-A152 PolarHBondContact O-N 3.21Å; R150-R153 PolarHBondContact O-N 2.89Å; R150-L154 HydrophobicContact CG-CD1 4.15Å; R150-L154 HydrophobicContact CG-CG 4.48Å; R150-L154 WeakPolarHBondContact O-CB 3.44Å; R150-L154 VanDerWaalsContact O-CG 3.27Å; R150-L154 WeakPolarHBondContact O-CG 3.48Å; R150-L154 PolarHBondContact O-N 3.48Å
151	Y	65.6	Low	65.7	Low	156 Å²	156	101.6 Å²	101.6	61%	0.612	51%	0.508	S	S	*	.	H	α-helix	trans	-61.1	-39.8	172.2	-85.2	-69	0	0	0	111	D147 L154 L155	D147-Y151 HydrophobicContact CB-CD2 4.31Å; D147-Y151 HydrophobicContact CB-CE2 4.47Å; D147-Y151 VanDerWaalsContact O-CB 3.32Å; D147-Y151 WeakPolarHBondContact O-CB 3.38Å; D147-Y151 WeakPolarHBondContact O-CD2 3.22Å; D147-Y151 PolarHBondContact O-N 3.46Å; Y151-L154 PolarHBondContact O-N 3.11Å; Y151-L155 VanDerWaalsContact O-CB 3.26Å; Y151-L155 WeakPolarHBondContact O-CB 3.47Å; Y151-L155 PolarHBondContact O-N 3.26Å
152	A	66.2	Low	66.2	Low	54 Å²	54	100.5 Å²	100.5	45%	0.446	51%	0.506	S	S	.	.	H	α-helix	trans	-66.3	-40.4	174.3	0	0	0	0	0	112.4	M148 T149 R150 L155 A156	M148-A152 VanDerWaalsContact O-CB 3.22Å; M148-A152 WeakPolarHBondContact O-CB 3.32Å; M148-A152 PolarHBondContact O-N 3.31Å; T149-A152 PolarHBondContact O-N 3.28Å; R150-A152 VanDerWaalsContact C-N 3.31Å; R150-A152 PolarHBondContact O-N 3.21Å; A152-L155 PolarHBondContact O-N 3.06Å; A152-A156 VanDerWaalsContact O-CB 3.28Å; A152-A156 WeakPolarHBondContact O-CB 3.35Å; A152-A156 PolarHBondContact O-N 2.81Å
153	R	69.5	Low	66.5	Low	182 Å²	182	101 Å²	101	69%	0.687	52%	0.516	S	S	*	.	H	α-helix	trans	-67.4	-41.3	173.9	-78	178.9	-176.3	140.1	1.6	112	T149 R150 A156 E157	T149-R153 WeakPolarHBondContact O-CB 3.43Å; T149-R153 VanDerWaalsContact O-CG 3.32Å; T149-R153 WeakPolarHBondContact O-CG 3.37Å; T149-R153 PolarHBondContact O-N 2.83Å; R150-R153 PolarHBondContact O-N 2.89Å; R153-A156 CarbonylContact O-C 3.57Å; R153-A156 PolarHBondContact O-N 3.45Å; R153-E157 VanDerWaalsContact O-CB 3.28Å; R153-E157 WeakPolarHBondContact O-CB 3.28Å; R153-E157 PolarHBondContact O-N 2.92Å
154	L	74.7	Confident	66.4	Low	75 Å²	75	99.7 Å²	99.7	39%	0.393	52%	0.516	S	S	.	.	H	α-helix	trans	-65.4	-40.7	174.5	-74	172.8	0	0	0	110.6	R150 Y151 E157 E158	R150-L154 HydrophobicContact CG-CD1 4.15Å; R150-L154 HydrophobicContact CG-CG 4.48Å; R150-L154 WeakPolarHBondContact O-CB 3.44Å; R150-L154 VanDerWaalsContact O-CG 3.27Å; R150-L154 WeakPolarHBondContact O-CG 3.48Å; R150-L154 PolarHBondContact O-N 3.48Å; Y151-L154 PolarHBondContact O-N 3.11Å; L154-E157 CarbonylContact O-C 3.6Å; L154-E157 PolarHBondContact O-N 2.85Å; L154-E158 WeakPolarHBondContact O-CA 3.48Å; L154-E158 WeakPolarHBondContact O-CB 3.42Å; L154-E158 PolarHBondContact O-N 2.94Å
155	L	66.5	Low	66.6	Low	113 Å²	113	96.4 Å²	96.4	59%	0.592	50%	0.499	S	S	*	.	H	α-helix	trans	-63.6	-42.6	171.9	-105.4	158.7	0	0	0	111.3	Y151 A152 E157 E158 V159	Y151-L155 VanDerWaalsContact O-CB 3.26Å; Y151-L155 WeakPolarHBondContact O-CB 3.47Å; Y151-L155 PolarHBondContact O-N 3.26Å; A152-L155 PolarHBondContact O-N 3.06Å; L155-E157 VanDerWaalsContact C-N 3.33Å; L155-E158 PolarHBondContact O-N 2.61Å; L155-V159 WeakPolarHBondContact O-CB 3.47Å; L155-V159 WeakPolarHBondContact O-CG2 3.39Å; L155-V159 PolarHBondContact O-N 3.34Å
156	A	72.4	Confident	65.9	Low	58 Å²	58	94.7 Å²	94.7	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-38.8	176.1	0	0	0	0	0	111.4	A152 R153 Q160	A152-A156 VanDerWaalsContact O-CB 3.28Å; A152-A156 WeakPolarHBondContact O-CB 3.35Å; A152-A156 PolarHBondContact O-N 2.81Å; R153-A156 CarbonylContact O-C 3.57Å; R153-A156 PolarHBondContact O-N 3.45Å; A156-Q160 WeakPolarHBondContact O-CB 3.14Å; A156-Q160 PolarHBondContact O-N 3.23Å
157	E	73.9	Confident	65.8	Low	80 Å²	80	94.8 Å²	94.8	37%	0.374	49%	0.494	S	S	.	.	H	α-helix	trans	-72.8	-37.2	176.2	-158.4	-174.3	177.7	0	0	111.3	R153 L154 L155 Q160 R161	R153-E157 VanDerWaalsContact O-CB 3.28Å; R153-E157 WeakPolarHBondContact O-CB 3.28Å; R153-E157 PolarHBondContact O-N 2.92Å; L154-E157 CarbonylContact O-C 3.6Å; L154-E157 PolarHBondContact O-N 2.85Å; L155-E157 VanDerWaalsContact C-N 3.33Å; E157-Q160 PolarHBondContact O-N 2.77Å; E157-R161 WeakPolarHBondContact O-CA 3.43Å; E157-R161 WeakPolarHBondContact O-CB 3.46Å; E157-R161 WeakPolarHBondContact O-CG 3.37Å; E157-R161 PolarHBondContact O-N 3.27Å; E157-R161 IonicContact OE1-CZ 2.97Å; E157-R161 IonicContact OE1-NE 2.97Å; E157-R161 PolarHBondContact OE1-NE 3.3Å; E157-R161 IonicContact OE1-NH2 3.92Å; E157-R161 PolarHBondContact OE1-NH2 2.72Å; E157-R161 IonicContact OE2-NH2 3.25Å
158	E	69.8	Low	65.4	Low	126 Å²	126	96.5 Å²	96.5	59%	0.589	50%	0.503	S	S	*	.	H	α-helix	trans	-68.3	-37.4	174	-162.8	79.2	-153.6	0	0	110.4	L154 L155 G162	L154-E158 WeakPolarHBondContact O-CA 3.48Å; L154-E158 WeakPolarHBondContact O-CB 3.42Å; L154-E158 PolarHBondContact O-N 2.94Å; L155-E158 PolarHBondContact O-N 2.61Å; E158-G162 VanDerWaalsContact O-CA 3.3Å; E158-G162 WeakPolarHBondContact O-CA 3.14Å; E158-G162 PolarHBondContact O-N 2.67Å
159	V	70.7	Confident	65.3	Low	96 Å²	96	95.3 Å²	95.3	58%	0.582	50%	0.499	S	S	*	.	H	α-helix	trans	-72.3	-38.8	173.3	167.8	0	0	0	0	110.7	L155 G162 A163	L155-V159 WeakPolarHBondContact O-CB 3.47Å; L155-V159 WeakPolarHBondContact O-CG2 3.39Å; L155-V159 PolarHBondContact O-N 3.34Å; V159-G162 CarbonylContact O-C 3.53Å; V159-G162 WeakPolarHBondContact O-CA 3.13Å; V159-G162 PolarHBondContact O-N 3.05Å; V159-A163 VanDerWaalsContact O-CB 3.29Å; V159-A163 WeakPolarHBondContact O-CB 3.2Å; V159-A163 PolarHBondContact O-N 3.08Å
160	Q	68.9	Low	64.7	Low	132 Å²	132	97.7 Å²	97.7	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-42.4	175.2	-173.7	176.6	9.5	0	0	110.9	A156 E157 G162 A163 V164	A156-Q160 WeakPolarHBondContact O-CB 3.14Å; A156-Q160 PolarHBondContact O-N 3.23Å; E157-Q160 PolarHBondContact O-N 2.77Å; Q160-G162 VanDerWaalsContact C-N 3.26Å; Q160-G162 PolarHBondContact O-N 3.44Å; Q160-A163 PolarHBondContact O-N 3.13Å; Q160-V164 WeakPolarHBondContact O-CG2 3.32Å; Q160-V164 PolarHBondContact O-N 3.42Å
161	R	58.5	Low	64.6	Low	128 Å²	128	96.7 Å²	96.7	48%	0.483	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-36.5	170.1	-74.6	171.5	-176.5	175.8	4.2	110.7	E157 N165	E157-R161 WeakPolarHBondContact O-CA 3.43Å; E157-R161 WeakPolarHBondContact O-CB 3.46Å; E157-R161 WeakPolarHBondContact O-CG 3.37Å; E157-R161 PolarHBondContact O-N 3.27Å; E157-R161 IonicContact OE1-CZ 2.97Å; E157-R161 IonicContact OE1-NE 2.97Å; E157-R161 PolarHBondContact OE1-NE 3.3Å; E157-R161 IonicContact OE1-NH2 3.92Å; E157-R161 PolarHBondContact OE1-NH2 2.72Å; E157-R161 IonicContact OE2-NH2 3.25Å; R161-N165 WeakPolarHBondContact O-CB 3.03Å; R161-N165 PolarHBondContact O-N 2.82Å
162	G	61.7	Low	64.1	Low	36 Å²	36	92 Å²	92	37%	0.371	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-37.7	173.4	0	0	0	0	0	111.7	E158 V159 Q160 A166	E158-G162 VanDerWaalsContact O-CA 3.3Å; E158-G162 WeakPolarHBondContact O-CA 3.14Å; E158-G162 PolarHBondContact O-N 2.67Å; V159-G162 CarbonylContact O-C 3.53Å; V159-G162 WeakPolarHBondContact O-CA 3.13Å; V159-G162 PolarHBondContact O-N 3.05Å; Q160-G162 VanDerWaalsContact C-N 3.26Å; Q160-G162 PolarHBondContact O-N 3.44Å; G162-A166 WeakPolarHBondContact O-CA 3.43Å; G162-A166 WeakPolarHBondContact O-CB 3.37Å; G162-A166 PolarHBondContact O-N 2.85Å
163	A	62.8	Low	63.4	Low	54 Å²	54	91.7 Å²	91.7	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-73.3	-43.2	175.8	0	0	0	0	0	111.3	V159 Q160 A166 E167	V159-A163 VanDerWaalsContact O-CB 3.29Å; V159-A163 WeakPolarHBondContact O-CB 3.2Å; V159-A163 PolarHBondContact O-N 3.08Å; Q160-A163 PolarHBondContact O-N 3.13Å; A163-A166 CarbonylContact O-C 3.57Å; A163-A166 PolarHBondContact O-N 3.14Å; A163-E167 VanDerWaalsContact O-CB 3.28Å; A163-E167 WeakPolarHBondContact O-CB 3.38Å; A163-E167 PolarHBondContact O-N 3.4Å
164	V	60.2	Low	63	Low	82 Å²	82	86.9 Å²	86.9	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-39.1	173.4	173	0	0	0	0	110.7	Q160 E167 L168	Q160-V164 WeakPolarHBondContact O-CG2 3.32Å; Q160-V164 PolarHBondContact O-N 3.42Å; V164-E167 PolarHBondContact O-N 3.21Å; V164-L168 WeakPolarHBondContact O-CB 3.15Å; V164-L168 PolarHBondContact O-N 3.38Å
165	N	60.7	Low	62.4	Low	70 Å²	70	89.8 Å²	89.8	37%	0.374	49%	0.49	S	S	.	.	H	α-helix	trans	-68.3	-37.1	171.7	-94.3	-5	0	0	0	111.1	R161 E167 L168 L169	R161-N165 WeakPolarHBondContact O-CB 3.03Å; R161-N165 PolarHBondContact O-N 2.82Å; N165-E167 VanDerWaalsContact C-N 3.35Å; N165-L168 CarbonylContact O-C 3.58Å; N165-L168 PolarHBondContact O-N 2.89Å; N165-L169 WeakPolarHBondContact O-CA 3.48Å; N165-L169 WeakPolarHBondContact O-CB 2.81Å; N165-L169 PolarHBondContact O-N 3.43Å
166	A	55	Low	62	Low	54 Å²	54	90.1 Å²	90.1	45%	0.446	49%	0.492	S	S	.	.	H	α-helix	trans	-69.5	-34.7	176.5	0	0	0	0	0	110.7	G162 A163 L169 E170	G162-A166 WeakPolarHBondContact O-CA 3.43Å; G162-A166 WeakPolarHBondContact O-CB 3.37Å; G162-A166 PolarHBondContact O-N 2.85Å; A163-A166 CarbonylContact O-C 3.57Å; A163-A166 PolarHBondContact O-N 3.14Å; A166-L169 CarbonylContact O-C 3.58Å; A166-E170 WeakPolarHBondContact O-CA 3.04Å; A166-E170 WeakPolarHBondContact O-CB 3.5Å; A166-E170 PolarHBondContact O-N 3.41Å
167	E	60.2	Low	61.6	Low	114 Å²	114	92 Å²	92	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-72.6	-38.3	173	-173	-174.9	175.6	0	0	110.7	A163 V164 N165 E170 N171	A163-E167 VanDerWaalsContact O-CB 3.28Å; A163-E167 WeakPolarHBondContact O-CB 3.38Å; A163-E167 PolarHBondContact O-N 3.4Å; V164-E167 PolarHBondContact O-N 3.21Å; N165-E167 VanDerWaalsContact C-N 3.35Å; E167-E170 PolarHBondContact O-N 3.35Å; E167-N171 WeakPolarHBondContact O-CB 3.15Å; E167-N171 VanDerWaalsContact O-CG 3.28Å; E167-N171 PolarHBondContact O-N 2.87Å; E167-N171 PolarHBondContact O-ND2 3.25Å; E167-N171 VanDerWaalsContact O-ND2 3.14Å
168	L	61.6	Low	61	Low	103 Å²	103	91 Å²	91	54%	0.539	49%	0.494	S	S	.	.	H	α-helix	trans	-69.3	-39.5	172.8	-168.5	82.4	0	0	0	110.7	V164 N165 S172	V164-L168 WeakPolarHBondContact O-CB 3.15Å; V164-L168 PolarHBondContact O-N 3.38Å; N165-L168 CarbonylContact O-C 3.58Å; N165-L168 PolarHBondContact O-N 2.89Å; L168-S172 WeakPolarHBondContact O-CA 3.43Å; L168-S172 WeakPolarHBondContact O-CB 3.4Å; L168-S172 PolarHBondContact O-N 3.4Å; L168-S172 PolarHBondContact O-OG 3.23Å
169	L	56.1	Low	60.7	Low	120 Å²	120	87.1 Å²	87.1	63%	0.628	48%	0.478	S	S	*	.	H	α-helix	trans	-70.5	-36.3	173.6	-116.3	95.9	0	0	0	110.2	N165 A166 S172 S173	N165-L169 WeakPolarHBondContact O-CA 3.48Å; N165-L169 WeakPolarHBondContact O-CB 2.81Å; N165-L169 PolarHBondContact O-N 3.43Å; A166-L169 CarbonylContact O-C 3.58Å; L169-S172 CarbonylContact O-C 3.51Å; L169-S172 PolarHBondContact O-N 3.48Å; L169-S173 WeakPolarHBondContact O-CA 3.39Å; L169-S173 WeakPolarHBondContact O-CB 3.12Å; L169-S173 PolarHBondContact O-N 3.45Å
170	E	57.2	Low	60.4	Low	114 Å²	114	90.2 Å²	90.2	53%	0.533	48%	0.48	S	S	.	.	H	α-helix	trans	-73.2	-40	177.8	178	176.7	-171.1	0	0	108.9	A166 E167 S173 N174	A166-E170 WeakPolarHBondContact O-CA 3.04Å; A166-E170 WeakPolarHBondContact O-CB 3.5Å; A166-E170 PolarHBondContact O-N 3.41Å; E167-E170 PolarHBondContact O-N 3.35Å; E170-S173 PolarHBondContact O-N 2.84Å; E170-N174 VanDerWaalsContact CG-ND2 3.32Å; E170-N174 WeakPolarHBondContact CG-ND2 3.42Å; E170-N174 WeakPolarHBondContact O-CA 3.44Å; E170-N174 WeakPolarHBondContact O-CB 3.07Å; E170-N174 PolarHBondContact O-N 2.91Å; E170-N174 PolarHBondContact O-ND2 3.13Å
171	N	63.8	Low	60.1	Low	84 Å²	84	86.9 Å²	86.9	45%	0.449	47%	0.471	S	S	.	.	H	α-helix	trans	-66.3	-40.3	170.9	-80.4	-40.2	0	0	0	111.1	E167 K175	E167-N171 WeakPolarHBondContact O-CB 3.15Å; E167-N171 VanDerWaalsContact O-CG 3.28Å; E167-N171 PolarHBondContact O-N 2.87Å; E167-N171 PolarHBondContact O-ND2 3.25Å; E167-N171 VanDerWaalsContact O-ND2 3.14Å; N171-K175 WeakPolarHBondContact O-CB 3.49Å; N171-K175 WeakPolarHBondContact O-CG 3.3Å; N171-K175 PolarHBondContact O-N 2.8Å
172	S	55.3	Low	60.1	Low	57 Å²	57	84.2 Å²	84.2	40%	0.399	46%	0.464	S	S	.	.	H	α-helix	trans	-72.2	-32.7	176.3	-61.3	0	0	0	0	112	L168 L169 K175 L176	L168-S172 WeakPolarHBondContact O-CA 3.43Å; L168-S172 WeakPolarHBondContact O-CB 3.4Å; L168-S172 PolarHBondContact O-N 3.4Å; L168-S172 PolarHBondContact O-OG 3.23Å; L169-S172 CarbonylContact O-C 3.51Å; L169-S172 PolarHBondContact O-N 3.48Å; S172-K175 CarbonylContact O-C 3.51Å; S172-L176 WeakPolarHBondContact O-CA 3.19Å; S172-L176 WeakPolarHBondContact O-CB 3.06Å; S172-L176 PolarHBondContact O-N 2.95Å
173	S	51.9	Low	59.9	Low	48 Å²	48	87.3 Å²	87.3	34%	0.336	47%	0.472	S	S	.	.	H	α-helix	trans	-81.1	-43.7	-179.3	-173.8	0	0	0	0	109.6	L169 E170 K175 L176 I177	L169-S173 WeakPolarHBondContact O-CA 3.39Å; L169-S173 WeakPolarHBondContact O-CB 3.12Å; L169-S173 PolarHBondContact O-N 3.45Å; E170-S173 PolarHBondContact O-N 2.84Å; S173-K175 VanDerWaalsContact C-N 3.28Å; S173-K175 PolarHBondContact O-N 2.68Å; S173-L176 CarbonylContact O-C 3.54Å; S173-L176 WeakPolarHBondContact O-CA 3.32Å; S173-L176 PolarHBondContact O-N 2.75Å; S173-I177 WeakPolarHBondContact O-CA 3.36Å; S173-I177 WeakPolarHBondContact O-CB 3.36Å; S173-I177 WeakPolarHBondContact O-CG1 3.15Å; S173-I177 PolarHBondContact O-N 2.73Å; S173-I177 WeakPolarHBondContact OG-CD1 3.47Å
174	N	61	Low	60.1	Low	81 Å²	81	91.5 Å²	91.5	43%	0.433	48%	0.48	S	S	.	.	H	α-helix	trans	-60.9	-38.8	167.7	-72.3	-21.4	0	0	0	110.1	E170 S178	E170-N174 VanDerWaalsContact CG-ND2 3.32Å; E170-N174 WeakPolarHBondContact CG-ND2 3.42Å; E170-N174 WeakPolarHBondContact O-CA 3.44Å; E170-N174 WeakPolarHBondContact O-CB 3.07Å; E170-N174 PolarHBondContact O-N 2.91Å; E170-N174 PolarHBondContact O-ND2 3.13Å; N174-S178 WeakPolarHBondContact O-CA 3.26Å; N174-S178 WeakPolarHBondContact O-CB 3.24Å; N174-S178 PolarHBondContact O-N 3.32Å; N174-S178 PolarHBondContact O-OG 2.69Å
175	K	63	Low	60.3	Low	136 Å²	136	93.9 Å²	93.9	59%	0.591	49%	0.486	S	S	*	.	H	α-helix	trans	-71	-29	170.8	-76.6	179.4	-178.8	-174.7	0	113.4	N171 S172 S173 S178 N179	N171-K175 WeakPolarHBondContact O-CB 3.49Å; N171-K175 WeakPolarHBondContact O-CG 3.3Å; N171-K175 PolarHBondContact O-N 2.8Å; S172-K175 CarbonylContact O-C 3.51Å; S173-K175 VanDerWaalsContact C-N 3.28Å; S173-K175 PolarHBondContact O-N 2.68Å; K175-S178 PolarHBondContact O-OG 3.25Å; K175-N179 WeakPolarHBondContact O-CB 3.41Å; K175-N179 PolarHBondContact O-N 2.74Å; K175-N179 PolarHBondContact O-ND2 3.27Å
176	L	57.6	Low	60.2	Low	119 Å²	119	96.1 Å²	96.1	62%	0.623	50%	0.495	S	S	*	.	H	α-helix	trans	-79.6	-37.6	176.4	-102.8	163	0	0	0	111.9	S172 S173 N179 Y180	S172-L176 WeakPolarHBondContact O-CA 3.19Å; S172-L176 WeakPolarHBondContact O-CB 3.06Å; S172-L176 PolarHBondContact O-N 2.95Å; S173-L176 CarbonylContact O-C 3.54Å; S173-L176 WeakPolarHBondContact O-CA 3.32Å; S173-L176 PolarHBondContact O-N 2.75Å; L176-N179 CarbonylContact O-C 3.44Å; L176-Y180 WeakPolarHBondContact O-CA 3.49Å; L176-Y180 WeakPolarHBondContact O-CB 3.4Å; L176-Y180 PolarHBondContact O-N 3.4Å
177	I	63.8	Low	60.4	Low	99 Å²	99	95.9 Å²	95.9	51%	0.508	49%	0.493	S	S	.	.	H	α-helix	trans	-73.6	-42.2	174.6	-68.2	166	0	0	0	107.8	S173 Y180 S181	S173-I177 WeakPolarHBondContact O-CA 3.36Å; S173-I177 WeakPolarHBondContact O-CB 3.36Å; S173-I177 WeakPolarHBondContact O-CG1 3.15Å; S173-I177 PolarHBondContact O-N 2.73Å; S173-I177 WeakPolarHBondContact OG-CD1 3.47Å; I177-Y180 CarbonylContact O-C 3.53Å; I177-Y180 PolarHBondContact O-N 3.48Å; I177-S181 WeakPolarHBondContact O-CA 3.12Å; I177-S181 WeakPolarHBondContact O-CB 3.12Å; I177-S181 PolarHBondContact O-N 2.74Å; I177-S181 PolarHBondContact O-OG 2.94Å; I177-S181 VanDerWaalsContact O-OG 3.13Å
178	S	61.2	Low	60.4	Low	57 Å²	57	92.2 Å²	92.2	40%	0.399	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-46.8	170.6	87.7	0	0	0	0	109.5	N174 K175 Y180 S181 E182	N174-S178 WeakPolarHBondContact O-CA 3.26Å; N174-S178 WeakPolarHBondContact O-CB 3.24Å; N174-S178 PolarHBondContact O-N 3.32Å; N174-S178 PolarHBondContact O-OG 2.69Å; K175-S178 PolarHBondContact O-OG 3.25Å; S178-Y180 VanDerWaalsContact C-N 3.31Å; S178-Y180 PolarHBondContact O-N 3.5Å; S178-S181 WeakPolarHBondContact CA-OG 3.31Å; S178-S181 CarbonylContact O-C 3.58Å; S178-S181 PolarHBondContact O-N 3.18Å; S178-S181 PolarHBondContact O-OG 3.15Å; S178-E182 WeakPolarHBondContact O-CB 3.44Å; S178-E182 PolarHBondContact O-N 3.47Å
179	N	63.6	Low	60.2	Low	46 Å²	46	93.1 Å²	93.1	25%	0.246	49%	0.487	C	S	.	.	H	α-helix	trans	-59.3	-41.1	173.1	-102.9	-82.5	0	0	0	112.1	R70 K175 L176 E182 L183	R70-N179 PolarHBondContact NH2-OD1 3.36Å; K175-N179 WeakPolarHBondContact O-CB 3.41Å; K175-N179 PolarHBondContact O-N 2.74Å; K175-N179 PolarHBondContact O-ND2 3.27Å; L176-N179 CarbonylContact O-C 3.44Å; N179-E182 PolarHBondContact O-N 2.91Å; N179-L183 WeakPolarHBondContact O-CA 3.17Å; N179-L183 WeakPolarHBondContact O-CB 3.15Å; N179-L183 WeakPolarHBondContact O-CG 3.01Å; N179-L183 PolarHBondContact O-N 2.76Å
180	Y	64.1	Low	60	Low	161 Å²	161	93.1 Å²	93.1	63%	0.631	49%	0.486	S	S	*	.	H	α-helix	trans	-72.5	-35.9	-178.4	-171.5	-93.4	0	0	0	110.4	L176 I177 S178 K184	L176-Y180 WeakPolarHBondContact O-CA 3.49Å; L176-Y180 WeakPolarHBondContact O-CB 3.4Å; L176-Y180 PolarHBondContact O-N 3.4Å; I177-Y180 CarbonylContact O-C 3.53Å; I177-Y180 PolarHBondContact O-N 3.48Å; S178-Y180 VanDerWaalsContact C-N 3.31Å; S178-Y180 PolarHBondContact O-N 3.5Å; Y180-K184 HydrophobicContact CE1-CD 4.42Å; Y180-K184 WeakPolarHBondContact O-CA 3.46Å; Y180-K184 WeakPolarHBondContact O-CB 3.49Å; Y180-K184 PolarHBondContact O-N 2.86Å
181	S	62.3	Low	59.8	Low	62 Å²	62	92.7 Å²	92.7	43%	0.434	49%	0.487	S	S	.	.	H	α-helix	trans	-69.3	-39.6	173.7	73.5	0	0	0	0	111	I177 S178 K184 E185	I177-S181 WeakPolarHBondContact O-CA 3.12Å; I177-S181 WeakPolarHBondContact O-CB 3.12Å; I177-S181 PolarHBondContact O-N 2.74Å; I177-S181 PolarHBondContact O-OG 2.94Å; I177-S181 VanDerWaalsContact O-OG 3.13Å; S178-S181 WeakPolarHBondContact CA-OG 3.31Å; S178-S181 CarbonylContact O-C 3.58Å; S178-S181 PolarHBondContact O-N 3.18Å; S178-S181 PolarHBondContact O-OG 3.15Å; S181-K184 CarbonylContact O-C 3.59Å; S181-K184 PolarHBondContact O-N 2.58Å; S181-E185 WeakPolarHBondContact O-CB 3.11Å; S181-E185 PolarHBondContact O-N 3.25Å
182	E	59.9	Low	59.3	Low	72 Å²	72	94.7 Å²	94.7	34%	0.336	49%	0.494	S	S	.	.	H	α-helix	trans	-70.7	-41	176.2	-168.2	-173.7	-172.1	0	0	110	R70 S178 N179 E185 M186	R70-E182 IonicContact CZ-OE2 3.91Å; R70-E182 IonicContact NH1-OE1 3.97Å; R70-E182 PolarHBondContact NH1-OE1 3.42Å; R70-E182 IonicContact NH1-OE2 3.23Å; R70-E182 PolarHBondContact NH1-OE2 2.77Å; R70-E182 IonicContact NH2-OE2 3.14Å; S178-E182 WeakPolarHBondContact O-CB 3.44Å; S178-E182 PolarHBondContact O-N 3.47Å; N179-E182 PolarHBondContact O-N 2.91Å; E182-E185 PolarHBondContact O-N 3.05Å; E182-M186 VanDerWaalsContact O-CB 3.24Å; E182-M186 WeakPolarHBondContact O-CB 3.46Å; E182-M186 VanDerWaalsContact O-CG 3.26Å; E182-M186 WeakPolarHBondContact O-CG 3.48Å; E182-M186 PolarHBondContact O-N 2.98Å
183	L	57.6	Low	59.1	Low	101 Å²	101	94.9 Å²	94.9	53%	0.529	50%	0.495	S	S	.	.	H	α-helix	trans	-66.2	-36.4	171.3	-77	169.7	0	0	0	111.7	N179 A187	N179-L183 WeakPolarHBondContact O-CA 3.17Å; N179-L183 WeakPolarHBondContact O-CB 3.15Å; N179-L183 WeakPolarHBondContact O-CG 3.01Å; N179-L183 PolarHBondContact O-N 2.76Å; L183-A187 WeakPolarHBondContact O-CB 3.47Å; L183-A187 PolarHBondContact O-N 2.99Å
184	K	66.9	Low	59	Low	142 Å²	142	98.5 Å²	98.5	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-73.9	-34.7	175.9	-178	174.1	179.4	-179.1	0	111.4	Y180 S181 A187 G188	Y180-K184 HydrophobicContact CE1-CD 4.42Å; Y180-K184 WeakPolarHBondContact O-CA 3.46Å; Y180-K184 WeakPolarHBondContact O-CB 3.49Å; Y180-K184 PolarHBondContact O-N 2.86Å; S181-K184 CarbonylContact O-C 3.59Å; S181-K184 PolarHBondContact O-N 2.58Å; K184-A187 CarbonylContact O-C 3.52Å; K184-A187 PolarHBondContact O-N 3.14Å; K184-G188 WeakPolarHBondContact O-CA 3.22Å; K184-G188 PolarHBondContact O-N 3.19Å
185	E	62.9	Low	58.5	Low	132 Å²	132	100.1 Å²	100.1	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-70.5	-41	173.2	-170.7	174.3	-163.3	0	0	110	S181 E182 G188 H189	S181-E185 WeakPolarHBondContact O-CB 3.11Å; S181-E185 PolarHBondContact O-N 3.25Å; E182-E185 PolarHBondContact O-N 3.05Å; E185-G188 CarbonylContact O-C 3.54Å; E185-G188 WeakPolarHBondContact O-CA 3.46Å; E185-G188 PolarHBondContact O-N 2.72Å; E185-H189 WeakPolarHBondContact O-CB 3.49Å; E185-H189 PolarHBondContact O-N 3.47Å
186	M	58.4	Low	58	Low	116 Å²	116	100.2 Å²	100.2	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-61.8	-43	168.7	-80.6	-176.6	141.9	0	0	111.9	E182 G188 H189 M190	E182-M186 VanDerWaalsContact O-CB 3.24Å; E182-M186 WeakPolarHBondContact O-CB 3.46Å; E182-M186 VanDerWaalsContact O-CG 3.26Å; E182-M186 WeakPolarHBondContact O-CG 3.48Å; E182-M186 PolarHBondContact O-N 2.98Å; M186-G188 VanDerWaalsContact C-N 3.3Å; M186-H189 PolarHBondContact O-N 3.32Å; M186-M190 WeakPolarHBondContact O-CB 3.49Å; M186-M190 PolarHBondContact O-N 3.44Å
187	A	61.1	Low	58	Low	49 Å²	49	98.3 Å²	98.3	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-33.4	174.3	0	0	0	0	0	111.6	L183 K184 M190 N191	L183-A187 WeakPolarHBondContact O-CB 3.47Å; L183-A187 PolarHBondContact O-N 2.99Å; K184-A187 CarbonylContact O-C 3.52Å; K184-A187 PolarHBondContact O-N 3.14Å; A187-M190 PolarHBondContact O-N 3.35Å; A187-N191 PolarHBondContact O-N 2.78Å
188	G	59.4	Low	57.6	Low	38 Å²	38	96.2 Å²	96.2	39%	0.392	50%	0.504	S	S	.	.	H	α-helix	trans	-64.7	-46.7	172.6	0	0	0	0	0	111.6	K184 E185 M186 M190 N191 Q192	K184-G188 WeakPolarHBondContact O-CA 3.22Å; K184-G188 PolarHBondContact O-N 3.19Å; E185-G188 CarbonylContact O-C 3.54Å; E185-G188 WeakPolarHBondContact O-CA 3.46Å; E185-G188 PolarHBondContact O-N 2.72Å; M186-G188 VanDerWaalsContact C-N 3.3Å; G188-M190 VanDerWaalsContact C-N 3.29Å; G188-M190 PolarHBondContact O-N 2.85Å; G188-N191 CarbonylContact O-C 3.56Å; G188-N191 WeakPolarHBondContact O-CA 3.4Å; G188-N191 PolarHBondContact O-N 3.38Å; G188-N191 VanDerWaalsContact O-N 3.08Å; G188-Q192 PolarHBondContact O-N 2.91Å
189	H	57.1	Low	57.4	Low	121 Å²	121	98.8 Å²	98.8	56%	0.56	51%	0.512	S	S	*	.	H	α-helix	trans	-62.7	-36.5	172.1	-106.8	-80.6	0	0	0	111.8	E185 M186 N191 Q192 S193	E185-H189 WeakPolarHBondContact O-CB 3.49Å; E185-H189 PolarHBondContact O-N 3.47Å; M186-H189 PolarHBondContact O-N 3.32Å; H189-N191 VanDerWaalsContact C-N 3.32Å; H189-N191 PolarHBondContact O-N 3.49Å; H189-Q192 PolarHBondContact O-N 3.08Å; H189-S193 PolarHBondContact O-N 2.87Å
190	M	52.4	Low	57.4	Low	120 Å²	120	98.8 Å²	98.8	59%	0.591	52%	0.518	S	S	*	.	H	α-helix	trans	-66.4	-36.1	173.1	-166.1	170	61.6	0	0	111.4	M186 A187 G188 S193 K194	M186-M190 WeakPolarHBondContact O-CB 3.49Å; M186-M190 PolarHBondContact O-N 3.44Å; A187-M190 PolarHBondContact O-N 3.35Å; G188-M190 VanDerWaalsContact C-N 3.29Å; G188-M190 PolarHBondContact O-N 2.85Å; M190-S193 WeakPolarHBondContact O-CB 3.32Å; M190-S193 PolarHBondContact O-N 3.47Å; M190-S193 PolarHBondContact O-OG 3.4Å; M190-K194 PolarHBondContact O-N 3.07Å
191	N	53.3	Low	57.4	Low	106 Å²	106	99.8 Å²	99.8	57%	0.567	52%	0.521	S	S	*	.	H	α-helix	trans	-74.7	-31.2	174.2	-156.4	51.4	0	0	0	112.7	A187 G188 H189 S193 K194 H195	A187-N191 PolarHBondContact O-N 2.78Å; G188-N191 CarbonylContact O-C 3.56Å; G188-N191 WeakPolarHBondContact O-CA 3.4Å; G188-N191 PolarHBondContact O-N 3.38Å; G188-N191 VanDerWaalsContact O-N 3.08Å; H189-N191 VanDerWaalsContact C-N 3.32Å; H189-N191 PolarHBondContact O-N 3.49Å; N191-S193 VanDerWaalsContact C-N 3.3Å; N191-K194 WeakPolarHBondContact O-CA 3.49Å; N191-K194 VanDerWaalsContact O-CB 3.3Å; N191-K194 WeakPolarHBondContact O-CB 3.49Å; N191-K194 PolarHBondContact O-N 3.22Å; N191-H195 PolarHBondContact O-N 3.05Å
192	Q	52	Low	57.8	Low	126 Å²	126	106.7 Å²	106.7	59%	0.589	54%	0.538	S	S	*	.	H	α-helix	trans	-67.8	-33.5	171.2	-154.8	173.9	17.9	0	0	111	G188 H189 K194 H195 L196	G188-Q192 PolarHBondContact O-N 2.91Å; H189-Q192 PolarHBondContact O-N 3.08Å; Q192-K194 VanDerWaalsContact C-N 3.25Å; Q192-K194 PolarHBondContact O-N 2.77Å; Q192-H195 PolarHBondContact O-N 3.19Å; Q192-L196 PolarHBondContact O-N 3.11Å
193	S	51.5	Low	58.6	Low	61 Å²	61	111.9 Å²	111.9	43%	0.427	55%	0.554	S	S	.	*	H	α-helix	trans	-64.3	-29.8	168.5	95.3	0	0	0	0	112.5	H189 M190 N191 H195 T197	H189-S193 PolarHBondContact O-N 2.87Å; M190-S193 WeakPolarHBondContact O-CB 3.32Å; M190-S193 PolarHBondContact O-N 3.47Å; M190-S193 PolarHBondContact O-OG 3.4Å; N191-S193 VanDerWaalsContact C-N 3.3Å; S193-H195 VanDerWaalsContact C-N 3.3Å; S193-H195 PolarHBondContact O-N 2.93Å; S193-T197 WeakPolarHBondContact O-CG2 3.43Å; S193-T197 PolarHBondContact O-N 3.4Å; S193-T197 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-OG1 3.42Å
194	K	49.2	Very low	59.6	Low	123 Å²	123	114.9 Å²	114.9	54%	0.535	56%	0.559	S	S	.	*	H	α-helix	trans	-67.6	-29.6	171.9	-68.9	-175.4	-177.5	176.1	0	112.1	M190 N191 Q192 T197 S198	M190-K194 PolarHBondContact O-N 3.07Å; N191-K194 WeakPolarHBondContact O-CA 3.49Å; N191-K194 VanDerWaalsContact O-CB 3.3Å; N191-K194 WeakPolarHBondContact O-CB 3.49Å; N191-K194 PolarHBondContact O-N 3.22Å; Q192-K194 VanDerWaalsContact C-N 3.25Å; Q192-K194 PolarHBondContact O-N 2.77Å; K194-T197 VanDerWaalsContact CA-OG1 3.32Å; K194-T197 WeakPolarHBondContact CA-OG1 3.3Å; K194-T197 PolarHBondContact O-OG1 3.32Å; K194-S198 WeakPolarHBondContact O-CB 3.13Å; K194-S198 PolarHBondContact O-N 3.43Å; K194-S198 PolarHBondContact O-OG 3.21Å
195	H	51.9	Low	60.4	Low	116 Å²	116	114.6 Å²	114.6	54%	0.537	56%	0.558	S	S	.	*	H	α-helix	trans	-71.9	-38.4	178.5	-160.7	-19.1	0	0	0	112.5	N191 Q192 S193 S198 L199	N191-H195 PolarHBondContact O-N 3.05Å; Q192-H195 PolarHBondContact O-N 3.19Å; S193-H195 VanDerWaalsContact C-N 3.3Å; S193-H195 PolarHBondContact O-N 2.93Å; H195-S198 PolarHBondContact O-N 2.77Å; H195-S198 PolarHBondContact O-OG 3.23Å; H195-S198 VanDerWaalsContact O-OG 3.07Å; H195-L199 WeakPolarHBondContact CE1-CD1 3.46Å; H195-L199 WeakPolarHBondContact ND1-CD1 3.16Å; H195-L199 PolarHBondContact O-N 3.07Å; H195-L199 VanDerWaalsContact O-N 3.09Å
196	L	52.3	Low	61.5	Low	138 Å²	138	110.7 Å²	110.7	72%	0.723	55%	0.547	S	S	*	.	H	α-helix	trans	-71.3	-35.7	174.9	-66.3	177.8	0	0	0	111.8	Q192 A200	Q192-L196 PolarHBondContact O-N 3.11Å; L196-A200 PolarHBondContact O-N 3.32Å
197	T	56.6	Low	62.9	Low	79 Å²	79	109.4 Å²	109.4	49%	0.485	54%	0.54	S	S	.	.	H	α-helix	trans	-75.3	-26.9	173.8	54.9	0	0	0	0	113.1	S193 K194 R201	S193-T197 WeakPolarHBondContact O-CG2 3.43Å; S193-T197 PolarHBondContact O-N 3.4Å; S193-T197 VanDerWaalsContact O-N 3.11Å; S193-T197 PolarHBondContact O-OG1 3.42Å; K194-T197 VanDerWaalsContact CA-OG1 3.32Å; K194-T197 WeakPolarHBondContact CA-OG1 3.3Å; K194-T197 PolarHBondContact O-OG1 3.32Å; T197-R201 VanDerWaalsContact O-CB 3.32Å; T197-R201 WeakPolarHBondContact O-CB 3.32Å; T197-R201 PolarHBondContact O-N 2.97Å
198	S	56	Low	64.2	Low	55 Å²	55	115.1 Å²	115.1	39%	0.385	55%	0.551	S	S	.	*	H	α-helix	trans	-74.3	-37.6	175.7	77.2	0	0	0	0	112.2	K194 H195 R201 R202	K194-S198 WeakPolarHBondContact O-CB 3.13Å; K194-S198 PolarHBondContact O-N 3.43Å; K194-S198 PolarHBondContact O-OG 3.21Å; H195-S198 PolarHBondContact O-N 2.77Å; H195-S198 PolarHBondContact O-OG 3.23Å; H195-S198 VanDerWaalsContact O-OG 3.07Å; S198-R201 WeakPolarHBondContact O-CB 3.17Å; S198-R201 PolarHBondContact O-N 3.09Å; S198-R202 PolarHBondContact O-N 3.12Å
199	L	57.1	Low	65.8	Low	110 Å²	110	116.6 Å²	116.6	58%	0.576	55%	0.553	S	S	*	*	H	α-helix	trans	-63.5	-44.6	173.1	-105.1	87.2	0	0	0	111.5	H195 R201 R202 R203	H195-L199 WeakPolarHBondContact CE1-CD1 3.46Å; H195-L199 WeakPolarHBondContact ND1-CD1 3.16Å; H195-L199 PolarHBondContact O-N 3.07Å; H195-L199 VanDerWaalsContact O-N 3.09Å; L199-R201 VanDerWaalsContact C-N 3.28Å; L199-R201 PolarHBondContact O-N 3.39Å; L199-R202 PolarHBondContact O-N 3.24Å; L199-R203 PolarHBondContact O-N 2.93Å
200	A	62.4	Low	67.3	Low	46 Å²	46	116.3 Å²	116.3	38%	0.38	56%	0.555	S	S	.	*	H	α-helix	trans	-62.2	-37.1	174.9	0	0	0	0	0	111.8	L196 R204	L196-A200 PolarHBondContact O-N 3.32Å; A200-R204 WeakPolarHBondContact O-CG 3.43Å; A200-R204 PolarHBondContact O-N 3.23Å; A200-R204 VanDerWaalsContact O-N 3.12Å
201	R	64.5	Low	69.2	Low	183 Å²	183	118.2 Å²	118.2	69%	0.691	56%	0.56	S	S	*	*	H	α-helix	trans	-64.9	-40.8	176	-172.8	-175.5	-60	-113.4	-0.5	111.9	T197 S198 L199 R203 R204 F205	T197-R201 VanDerWaalsContact O-CB 3.32Å; T197-R201 WeakPolarHBondContact O-CB 3.32Å; T197-R201 PolarHBondContact O-N 2.97Å; S198-R201 WeakPolarHBondContact O-CB 3.17Å; S198-R201 PolarHBondContact O-N 3.09Å; L199-R201 VanDerWaalsContact C-N 3.28Å; L199-R201 PolarHBondContact O-N 3.39Å; R201-R203 VanDerWaalsContact C-N 3.35Å; R201-R203 PolarHBondContact O-N 3.26Å; R201-R204 PolarHBondContact O-N 2.82Å; R201-F205 VanDerWaalsContact O-CB 3.25Å; R201-F205 WeakPolarHBondContact O-CB 3.25Å; R201-F205 PolarHBondContact O-N 3.38Å
202	R	71.4	Confident	71.1	Confident	206 Å²	206	120.9 Å²	120.9	78%	0.777	57%	0.567	S	S	*	*	H	α-helix	trans	-65.1	-39.7	-179.4	-155.9	175.4	-175.7	-176.1	0.7	111.4	S198 L199 F205 A206	S198-R202 PolarHBondContact O-N 3.12Å; L199-R202 PolarHBondContact O-N 3.24Å; R202-F205 PolarHBondContact O-N 3.46Å; R202-A206 WeakPolarHBondContact O-CB 3.44Å; R202-A206 PolarHBondContact O-N 2.96Å
203	R	76.4	Confident	73.1	Confident	182 Å²	182	119.3 Å²	119.3	69%	0.687	56%	0.562	S	S	*	*	H	α-helix	trans	-64.1	-48.8	174.2	-172.8	173.6	175.3	164.3	2.7	112.1	L199 R201 F205 A206 E207	L199-R203 PolarHBondContact O-N 2.93Å; R201-R203 VanDerWaalsContact C-N 3.35Å; R201-R203 PolarHBondContact O-N 3.26Å; R203-F205 VanDerWaalsContact C-N 3.28Å; R203-F205 PolarHBondContact O-N 3.35Å; R203-A206 PolarHBondContact O-N 3.48Å; R203-E207 IonicContact NE-OE1 3.35Å; R203-E207 PolarHBondContact NE-OE1 3.41Å; R203-E207 WeakPolarHBondContact O-CG 3.36Å; R203-E207 PolarHBondContact O-N 2.89Å
204	R	79.8	Confident	75	Confident	164 Å²	164	119.3 Å²	119.3	62%	0.619	57%	0.565	S	S	*	*	H	α-helix	trans	-64.1	-33.1	177	-65.1	-167.6	-148.8	-139.6	9.3	112.8	A200 R201 R208	A200-R204 WeakPolarHBondContact O-CG 3.43Å; A200-R204 PolarHBondContact O-N 3.23Å; A200-R204 VanDerWaalsContact O-N 3.12Å; R201-R204 PolarHBondContact O-N 2.82Å; R204-R208 VanDerWaalsContact O-CG 3.31Å; R204-R208 WeakPolarHBondContact O-CG 3.31Å; R204-R208 PolarHBondContact O-N 3.1Å; R204-R208 VanDerWaalsContact O-N 3.1Å
205	F	82.2	Confident	77.2	Confident	136 Å²	136	119.2 Å²	119.2	60%	0.596	57%	0.565	S	S	*	*	H	α-helix	trans	-70.2	-44.2	175.7	-174.2	-98.1	0	0	0	111.1	R201 R202 R203 E207 R208 V209	R201-F205 VanDerWaalsContact O-CB 3.25Å; R201-F205 WeakPolarHBondContact O-CB 3.25Å; R201-F205 PolarHBondContact O-N 3.38Å; R202-F205 PolarHBondContact O-N 3.46Å; R203-F205 VanDerWaalsContact C-N 3.28Å; R203-F205 PolarHBondContact O-N 3.35Å; F205-E207 VanDerWaalsContact C-N 3.32Å; F205-E207 PolarHBondContact O-N 3.31Å; F205-R208 PolarHBondContact O-N 3.18Å; F205-V209 HydrophobicContact CD1-CG2 3.86Å; F205-V209 HydrophobicContact CE1-CG2 3.48Å; F205-V209 VanDerWaalsContact CE1-CG2 3.48Å; F205-V209 HydrophobicContact CE2-CG2 4.39Å; F205-V209 HydrophobicContact CG-CG2 4.47Å; F205-V209 HydrophobicContact CZ-CG2 3.78Å; F205-V209 WeakPolarHBondContact O-CG2 3.4Å; F205-V209 PolarHBondContact O-N 2.96Å
206	A	86.4	Confident	79.1	Confident	49 Å²	49	116.8 Å²	116.8	41%	0.405	56%	0.561	S	S	.	*	H	α-helix	trans	-59.2	-42.5	174.9	0	0	0	0	0	111.8	R202 R203 V209 L210	R202-A206 WeakPolarHBondContact O-CB 3.44Å; R202-A206 PolarHBondContact O-N 2.96Å; R203-A206 PolarHBondContact O-N 3.48Å; A206-V209 PolarHBondContact O-N 3.42Å; A206-L210 WeakPolarHBondContact O-CB 3.44Å; A206-L210 PolarHBondContact O-N 2.86Å
207	E	88.2	Confident	81.1	Confident	90 Å²	90	116.1 Å²	116.1	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-60.5	-45.9	174.2	-73.6	167.9	-170.4	0	0	111.6	R203 F205 V209 L210 F211	R203-E207 IonicContact NE-OE1 3.35Å; R203-E207 PolarHBondContact NE-OE1 3.41Å; R203-E207 WeakPolarHBondContact O-CG 3.36Å; R203-E207 PolarHBondContact O-N 2.89Å; F205-E207 VanDerWaalsContact C-N 3.32Å; F205-E207 PolarHBondContact O-N 3.31Å; E207-V209 PolarHBondContact O-N 3.29Å; E207-L210 WeakPolarHBondContact O-CB 3.47Å; E207-L210 PolarHBondContact O-N 3.46Å; E207-F211 VanDerWaalsContact O-CD2 3.27Å; E207-F211 WeakPolarHBondContact O-CD2 3.27Å; E207-F211 PolarHBondContact O-N 2.85Å
208	R	88.8	Confident	82.8	Confident	168 Å²	168	118.7 Å²	118.7	63%	0.634	56%	0.557	S	S	*	*	H	α-helix	trans	-63.4	-39.9	176	-70.9	178	-153.7	-163.8	2.4	112.8	R204 F205 F211 F212	R204-R208 VanDerWaalsContact O-CG 3.31Å; R204-R208 WeakPolarHBondContact O-CG 3.31Å; R204-R208 PolarHBondContact O-N 3.1Å; R204-R208 VanDerWaalsContact O-N 3.1Å; F205-R208 PolarHBondContact O-N 3.18Å; R208-F211 PolarHBondContact O-N 2.91Å; R208-F212 WeakPolarHBondContact O-CB 3.34Å; R208-F212 WeakPolarHBondContact O-CD2 3.49Å; R208-F212 PolarHBondContact O-N 3.34Å
209	V	91.8	Very high	84.5	Confident	70 Å²	70	121.8 Å²	121.8	42%	0.424	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-40.5	176.5	170.7	0	0	0	0	110.6	F205 A206 E207 F212 L213	F205-V209 HydrophobicContact CD1-CG2 3.86Å; F205-V209 HydrophobicContact CE1-CG2 3.48Å; F205-V209 VanDerWaalsContact CE1-CG2 3.48Å; F205-V209 HydrophobicContact CE2-CG2 4.39Å; F205-V209 HydrophobicContact CG-CG2 4.47Å; F205-V209 HydrophobicContact CZ-CG2 3.78Å; F205-V209 WeakPolarHBondContact O-CG2 3.4Å; F205-V209 PolarHBondContact O-N 2.96Å; A206-V209 PolarHBondContact O-N 3.42Å; E207-V209 PolarHBondContact O-N 3.29Å; V209-F212 PolarHBondContact O-N 2.77Å; V209-L213 VanDerWaalsContact O-CB 3.28Å; V209-L213 WeakPolarHBondContact O-CB 3.42Å; V209-L213 PolarHBondContact O-N 3.27Å
210	L	90.2	Very high	86.1	Confident	115 Å²	115	121.7 Å²	121.7	60%	0.602	56%	0.564	S	S	*	*	H	α-helix	trans	-60.6	-45.3	173.7	-94.9	160.6	0	0	0	111.8	A206 E207 L213 A214	A206-L210 WeakPolarHBondContact O-CB 3.44Å; A206-L210 PolarHBondContact O-N 2.86Å; E207-L210 WeakPolarHBondContact O-CB 3.47Å; E207-L210 PolarHBondContact O-N 3.46Å; L210-L213 PolarHBondContact O-N 2.88Å; L210-A214 WeakPolarHBondContact O-CB 3.46Å; L210-A214 PolarHBondContact O-N 3.38Å
211	F	91.8	Very high	87.5	Confident	160 Å²	160	122.4 Å²	122.4	70%	0.702	57%	0.566	S	S	*	*	H	α-helix	trans	-60.5	-46	173.5	-87.7	-72.2	0	0	0	111.8	E207 R208 L213 A214 F215	E207-F211 VanDerWaalsContact O-CD2 3.27Å; E207-F211 WeakPolarHBondContact O-CD2 3.27Å; E207-F211 PolarHBondContact O-N 2.85Å; R208-F211 PolarHBondContact O-N 2.91Å; F211-L213 VanDerWaalsContact C-N 3.35Å; F211-L213 PolarHBondContact O-N 3.22Å; F211-A214 PolarHBondContact O-N 3.44Å; F211-F215 WeakPolarHBondContact O-CB 3.28Å; F211-F215 PolarHBondContact O-N 2.92Å
212	F	93	Very high	88.6	Confident	161 Å²	161	115.8 Å²	115.8	71%	0.706	55%	0.547	S	S	*	.	H	α-helix	trans	-61.9	-40.5	176.5	-102.5	-80.9	0	0	0	112.8	R208 V209 F215 S216	R208-F212 WeakPolarHBondContact O-CB 3.34Å; R208-F212 WeakPolarHBondContact O-CD2 3.49Å; R208-F212 PolarHBondContact O-N 3.34Å; V209-F212 PolarHBondContact O-N 2.77Å; F212-F215 PolarHBondContact O-N 3.42Å; F212-S216 VanDerWaalsContact O-CB 3.23Å; F212-S216 WeakPolarHBondContact O-CB 3.29Å; F212-S216 PolarHBondContact O-N 2.84Å
213	L	93.3	Very high	89.4	Confident	94 Å²	94	107.8 Å²	107.8	49%	0.492	53%	0.529	S	S	.	.	H	α-helix	trans	-65.2	-46.7	178.1	-168	91.7	0	0	0	110.4	V209 L210 F211 F215 S216 F217	V209-L213 VanDerWaalsContact O-CB 3.28Å; V209-L213 WeakPolarHBondContact O-CB 3.42Å; V209-L213 PolarHBondContact O-N 3.27Å; L210-L213 PolarHBondContact O-N 2.88Å; F211-L213 VanDerWaalsContact C-N 3.35Å; F211-L213 PolarHBondContact O-N 3.22Å; L213-F215 VanDerWaalsContact C-N 3.31Å; L213-F215 PolarHBondContact O-N 3.39Å; L213-S216 PolarHBondContact O-N 3.46Å; L213-F217 HydrophobicContact CD1-CE2 4.28Å; L213-F217 HydrophobicContact CD2-CD2 4.27Å; L213-F217 HydrophobicContact CD2-CE2 3.9Å; L213-F217 HydrophobicContact CG-CD2 3.93Å; L213-F217 HydrophobicContact CG-CE2 3.8Å; L213-F217 VanDerWaalsContact O-CD2 3.29Å; L213-F217 WeakPolarHBondContact O-CD2 3.49Å; L213-F217 PolarHBondContact O-N 2.78Å
214	A	92.5	Very high	89.8	Confident	60 Å²	60	103.2 Å²	103.2	50%	0.496	52%	0.521	S	S	.	.	H	α-helix	trans	-60.3	-42.9	175.6	0	0	0	0	0	111.4	L210 F211 F217 F218	L210-A214 WeakPolarHBondContact O-CB 3.46Å; L210-A214 PolarHBondContact O-N 3.38Å; F211-A214 PolarHBondContact O-N 3.44Å; A214-F217 PolarHBondContact O-N 2.91Å; A214-F218 WeakPolarHBondContact O-CB 3.34Å; A214-F218 PolarHBondContact O-N 3.39Å
215	F	94.1	Very high	90.1	Very high	122 Å²	122	100.7 Å²	100.7	54%	0.535	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-39.4	176.4	-145.7	-116.9	0	0	0	111.8	F211 F212 L213 F218 F219	F211-F215 WeakPolarHBondContact O-CB 3.28Å; F211-F215 PolarHBondContact O-N 2.92Å; F212-F215 PolarHBondContact O-N 3.42Å; L213-F215 VanDerWaalsContact C-N 3.31Å; L213-F215 PolarHBondContact O-N 3.39Å; F215-F218 WeakPolarHBondContact O-CB 3.21Å; F215-F218 PolarHBondContact O-N 3.32Å; F215-F219 AromaticContact CD1-CD2 3.72Å; F215-F219 HydrophobicContact CD1-CD2 3.72Å; F215-F219 AromaticContact CD1-CE2 3.15Å; F215-F219 HydrophobicContact CD1-CE2 3.15Å; F215-F219 HydrophobicContact CD1-CZ 4.03Å; F215-F219 HydrophobicContact CE1-CD2 4.02Å; F215-F219 AromaticContact CE1-CE2 3.03Å; F215-F219 HydrophobicContact CE1-CE2 3.03Å; F215-F219 AromaticContact CE1-CZ 3.44Å; F215-F219 HydrophobicContact CE1-CZ 3.44Å; F215-F219 VanDerWaalsContact CE1-CZ 3.44Å; F215-F219 HydrophobicContact CG-CD2 4.4Å; F215-F219 HydrophobicContact CG-CE2 4.14Å; F215-F219 AromaticContact CZ-CE2 3.93Å; F215-F219 HydrophobicContact CZ-CE2 3.93Å; F215-F219 AromaticContact CZ-CZ 3.97Å; F215-F219 HydrophobicContact CZ-CZ 3.97Å; F215-F219 WeakPolarHBondContact O-CD2 3.23Å; F215-F219 PolarHBondContact O-N 2.91Å
216	S	92.8	Very high	90.2	Very high	64 Å²	64	100.3 Å²	100.3	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-43.6	176	-175.7	0	0	0	0	111.7	F212 L213 F218 F219 L220	F212-S216 VanDerWaalsContact O-CB 3.23Å; F212-S216 WeakPolarHBondContact O-CB 3.29Å; F212-S216 PolarHBondContact O-N 2.84Å; L213-S216 PolarHBondContact O-N 3.46Å; S216-F218 VanDerWaalsContact C-N 3.34Å; S216-F219 PolarHBondContact O-N 3.34Å; S216-L220 WeakPolarHBondContact O-CB 3.43Å; S216-L220 PolarHBondContact O-N 3.22Å
217	F	93.8	Very high	89.9	Confident	125 Å²	125	104.2 Å²	104.2	55%	0.548	53%	0.53	S	S	.	.	H	α-helix	trans	-61.7	-42.5	172.8	-88.1	-67.8	0	0	0	111.7	L213 A214 F219 L220 S221	L213-F217 HydrophobicContact CD1-CE2 4.28Å; L213-F217 HydrophobicContact CD2-CD2 4.27Å; L213-F217 HydrophobicContact CD2-CE2 3.9Å; L213-F217 HydrophobicContact CG-CD2 3.93Å; L213-F217 HydrophobicContact CG-CE2 3.8Å; L213-F217 VanDerWaalsContact O-CD2 3.29Å; L213-F217 WeakPolarHBondContact O-CD2 3.49Å; L213-F217 PolarHBondContact O-N 2.78Å; A214-F217 PolarHBondContact O-N 2.91Å; F217-F219 PolarHBondContact O-N 2.84Å; F217-L220 PolarHBondContact O-N 3.47Å; F217-S221 WeakPolarHBondContact O-CB 3.41Å; F217-S221 PolarHBondContact O-N 3.26Å; F217-S221 PolarHBondContact O-OG 2.79Å
218	F	92.8	Very high	89.2	Confident	132 Å²	132	108 Å²	108	58%	0.579	55%	0.548	S	S	*	.	H	α-helix	trans	-59.5	-46.4	175.6	-178.9	-99.4	0	0	0	111.6	A214 F215 S216 S221 C222	A214-F218 WeakPolarHBondContact O-CB 3.34Å; A214-F218 PolarHBondContact O-N 3.39Å; F215-F218 WeakPolarHBondContact O-CB 3.21Å; F215-F218 PolarHBondContact O-N 3.32Å; S216-F218 VanDerWaalsContact C-N 3.34Å; F218-S221 PolarHBondContact O-N 3.49Å; F218-C222 VanDerWaalsContact O-CB 3.23Å; F218-C222 WeakPolarHBondContact O-CB 3.5Å; F218-C222 PolarHBondContact O-N 3.44Å
219	F	91.5	Very high	88.3	Confident	120 Å²	120	109.6 Å²	109.6	53%	0.526	55%	0.554	S	S	.	*	H	α-helix	trans	-67.6	-36.3	175.4	-78.3	-57.1	0	0	0	113.5	F215 S216 F217 C222 G223	F215-F219 AromaticContact CD1-CD2 3.72Å; F215-F219 HydrophobicContact CD1-CD2 3.72Å; F215-F219 AromaticContact CD1-CE2 3.15Å; F215-F219 HydrophobicContact CD1-CE2 3.15Å; F215-F219 HydrophobicContact CD1-CZ 4.03Å; F215-F219 HydrophobicContact CE1-CD2 4.02Å; F215-F219 AromaticContact CE1-CE2 3.03Å; F215-F219 HydrophobicContact CE1-CE2 3.03Å; F215-F219 AromaticContact CE1-CZ 3.44Å; F215-F219 HydrophobicContact CE1-CZ 3.44Å; F215-F219 VanDerWaalsContact CE1-CZ 3.44Å; F215-F219 HydrophobicContact CG-CD2 4.4Å; F215-F219 HydrophobicContact CG-CE2 4.14Å; F215-F219 AromaticContact CZ-CE2 3.93Å; F215-F219 HydrophobicContact CZ-CE2 3.93Å; F215-F219 AromaticContact CZ-CZ 3.97Å; F215-F219 HydrophobicContact CZ-CZ 3.97Å; F215-F219 WeakPolarHBondContact O-CD2 3.23Å; F215-F219 PolarHBondContact O-N 2.91Å; S216-F219 PolarHBondContact O-N 3.34Å; F217-F219 PolarHBondContact O-N 2.84Å; F219-C222 PolarHBondContact O-N 2.75Å; F219-G223 WeakPolarHBondContact O-CA 3.46Å; F219-G223 PolarHBondContact O-N 2.99Å
220	L	91.2	Very high	86.9	Confident	108 Å²	108	111 Å²	111	57%	0.565	56%	0.558	S	S	*	*	H	α-helix	trans	-63.1	-48.6	174.7	-119.6	77.8	0	0	0	110.2	S216 F217 C222 G223 T224	S216-L220 WeakPolarHBondContact O-CB 3.43Å; S216-L220 PolarHBondContact O-N 3.22Å; F217-L220 PolarHBondContact O-N 3.47Å; L220-C222 VanDerWaalsContact C-N 3.34Å; L220-C222 PolarHBondContact O-N 3.46Å; L220-G223 CarbonylContact O-C 3.45Å; L220-G223 PolarHBondContact O-N 2.75Å; L220-T224 VanDerWaalsContact O-CG2 3.26Å; L220-T224 WeakPolarHBondContact O-CG2 3.47Å; L220-T224 PolarHBondContact O-N 3.22Å; L220-T224 PolarHBondContact O-OG1 3.41Å
221	S	90.1	Very high	85.4	Confident	62 Å²	62	110.7 Å²	110.7	43%	0.434	56%	0.563	S	S	.	*	H	α-helix	trans	-63.1	-40.6	176.7	-67.4	0	0	0	0	112	F217 F218 G223 T224 I225	F217-S221 WeakPolarHBondContact O-CB 3.41Å; F217-S221 PolarHBondContact O-N 3.26Å; F217-S221 PolarHBondContact O-OG 2.79Å; F218-S221 PolarHBondContact O-N 3.49Å; S221-G223 VanDerWaalsContact C-N 3.35Å; S221-T224 WeakPolarHBondContact CA-OG1 3.26Å; S221-T224 PolarHBondContact O-N 2.84Å; S221-T224 PolarHBondContact O-OG1 2.96Å; S221-I225 WeakPolarHBondContact O-CB 3.23Å; S221-I225 WeakPolarHBondContact O-CD1 3.44Å; S221-I225 WeakPolarHBondContact O-CG1 3.28Å; S221-I225 PolarHBondContact O-N 3.46Å
222	C	89.6	Confident	83.5	Confident	44 Å²	44	111.3 Å²	111.3	30%	0.297	57%	0.57	S	S	.	*	H	α-helix	trans	-63	-45.4	174.3	-160.6	0	0	0	0	110.2	F218 F219 L220 I225 F226	F218-C222 VanDerWaalsContact O-CB 3.23Å; F218-C222 WeakPolarHBondContact O-CB 3.5Å; F218-C222 PolarHBondContact O-N 3.44Å; F219-C222 PolarHBondContact O-N 2.75Å; L220-C222 VanDerWaalsContact C-N 3.34Å; L220-C222 PolarHBondContact O-N 3.46Å; C222-I225 PolarHBondContact O-N 2.86Å; C222-F226 WeakPolarHBondContact O-CB 3.37Å; C222-F226 VanDerWaalsContact O-CD2 3.28Å; C222-F226 WeakPolarHBondContact O-CD2 3.19Å; C222-F226 PolarHBondContact O-N 3.42Å; C222-F226 VanDerWaalsContact SG-CE2 3.58Å
223	G	87.6	Confident	81.6	Confident	38 Å²	38	106.1 Å²	106.1	39%	0.392	56%	0.562	S	S	.	*	H	α-helix	trans	-62.9	-40.5	176.6	0	0	0	0	0	113.2	F219 L220 S221 F226 L227	F219-G223 WeakPolarHBondContact O-CA 3.46Å; F219-G223 PolarHBondContact O-N 2.99Å; L220-G223 CarbonylContact O-C 3.45Å; L220-G223 PolarHBondContact O-N 2.75Å; S221-G223 VanDerWaalsContact C-N 3.35Å; G223-F226 PolarHBondContact O-N 2.77Å; G223-L227 WeakPolarHBondContact O-CB 3.43Å; G223-L227 PolarHBondContact O-N 3.5Å
224	T	84.9	Confident	79.5	Confident	85 Å²	85	112.3 Å²	112.3	52%	0.521	58%	0.58	S	S	.	*	H	α-helix	trans	-67.4	-39.5	175.5	60.8	0	0	0	0	111.2	L220 S221 H228	L220-T224 VanDerWaalsContact O-CG2 3.26Å; L220-T224 WeakPolarHBondContact O-CG2 3.47Å; L220-T224 PolarHBondContact O-N 3.22Å; L220-T224 PolarHBondContact O-OG1 3.41Å; S221-T224 WeakPolarHBondContact CA-OG1 3.26Å; S221-T224 PolarHBondContact O-N 2.84Å; S221-T224 PolarHBondContact O-OG1 2.96Å; T224-H228 WeakPolarHBondContact O-CB 3.09Å; T224-H228 PolarHBondContact O-N 3.29Å
225	I	86.3	Confident	77.6	Confident	111 Å²	111	119.7 Å²	119.7	57%	0.569	60%	0.595	S	S	*	*	H	α-helix	trans	-65.2	-47.5	174.2	-66.6	162.9	0	0	0	110	S221 C222 L227 H228 R229	S221-I225 WeakPolarHBondContact O-CB 3.23Å; S221-I225 WeakPolarHBondContact O-CD1 3.44Å; S221-I225 WeakPolarHBondContact O-CG1 3.28Å; S221-I225 PolarHBondContact O-N 3.46Å; C222-I225 PolarHBondContact O-N 2.86Å; I225-L227 PolarHBondContact O-N 2.72Å; I225-H228 CarbonylContact O-C 3.59Å; I225-H228 PolarHBondContact O-N 2.8Å; I225-R229 WeakPolarHBondContact O-CA 3.24Å; I225-R229 WeakPolarHBondContact O-CB 3.4Å; I225-R229 PolarHBondContact O-N 3.27Å
226	F	83.4	Confident	75.8	Confident	128 Å²	128	121.6 Å²	121.6	56%	0.561	60%	0.604	S	S	*	*	H	α-helix	trans	-63.7	-41.1	177.8	-91.5	-77.5	0	0	0	112.2	C222 G223 H228 R229 I230	C222-F226 WeakPolarHBondContact O-CB 3.37Å; C222-F226 VanDerWaalsContact O-CD2 3.28Å; C222-F226 WeakPolarHBondContact O-CD2 3.19Å; C222-F226 PolarHBondContact O-N 3.42Å; C222-F226 VanDerWaalsContact SG-CE2 3.58Å; G223-F226 PolarHBondContact O-N 2.77Å; F226-H228 VanDerWaalsContact C-N 3.34Å; F226-R229 PolarHBondContact O-N 3.33Å; F226-I230 WeakPolarHBondContact O-CB 3.1Å; F226-I230 VanDerWaalsContact O-CG1 3.24Å; F226-I230 WeakPolarHBondContact O-CG1 2.98Å; F226-I230 PolarHBondContact O-N 2.78Å
227	L	79.7	Confident	73.6	Confident	131 Å²	131	126.6 Å²	126.6	69%	0.686	63%	0.625	S	S	*	*	H	α-helix	trans	-68.8	-34.8	177.8	-168.3	71.1	0	0	0	111.7	G223 I225 I230	G223-L227 WeakPolarHBondContact O-CB 3.43Å; G223-L227 PolarHBondContact O-N 3.5Å; I225-L227 PolarHBondContact O-N 2.72Å; L227-I230 VanDerWaalsContact O-O 3.13Å
228	H	74.9	Confident	71.6	Confident	169 Å²	169	126 Å²	126	78%	0.782	63%	0.633	S	S	*	*	H	α-helix	trans	-77.9	-27.1	173.9	-170.7	-76.3	0	0	0	112.2	T224 I225 F226	T224-H228 WeakPolarHBondContact O-CB 3.09Å; T224-H228 PolarHBondContact O-N 3.29Å; I225-H228 CarbonylContact O-C 3.59Å; I225-H228 PolarHBondContact O-N 2.8Å; F226-H228 VanDerWaalsContact C-N 3.34Å
229	R	69.4	Low	69.9	Low	202 Å²	202	125.5 Å²	125.5	76%	0.762	65%	0.646	S	S	*	*	H	α-helix	trans	-87.1	-30	-177.8	-170.8	74.6	179.9	-169.2	3.5	112.2	I225 F226 P231	I225-R229 WeakPolarHBondContact O-CA 3.24Å; I225-R229 WeakPolarHBondContact O-CB 3.4Å; I225-R229 PolarHBondContact O-N 3.27Å; F226-R229 PolarHBondContact O-N 3.33Å; R229-P231 WeakPolarHBondContact O-CD 3.05Å
230	I	62.4	Low	67.6	Low	101 Å²	101	124.6 Å²	124.6	52%	0.518	66%	0.655	S	S	.	*	S	Bend	trans	-74.3	99.8	165.1	-64.6	164.7	0	0	0	104.6	F226 L227 M232	F226-I230 WeakPolarHBondContact O-CB 3.1Å; F226-I230 VanDerWaalsContact O-CG1 3.24Å; F226-I230 WeakPolarHBondContact O-CG1 2.98Å; F226-I230 PolarHBondContact O-N 2.78Å; L227-I230 VanDerWaalsContact O-O 3.13Å; I230-M232 VanDerWaalsContact C-N 3.33Å; I230-M232 PolarHBondContact O-N 2.7Å
231	P	57.9	Low	65.6	Low	108 Å²	108	133.7 Å²	133.7	70%	0.701	68%	0.684	S	S	*	*			trans	-67.2	106.6	174.1	7.5	11.7	0	0	0	103.9	R229 G233	R229-P231 WeakPolarHBondContact O-CD 3.05Å; P231-G233 PolarHBondContact O-N 2.87Å
232	M	52.5	Low	64.4	Low	173 Å²	173	137.3 Å²	137.3	85%	0.852	70%	0.696	S	S	*	*			trans	-63.7	63.7	157.5	-74.9	-79	-79.9	0	0	107.1	I230	I230-M232 VanDerWaalsContact C-N 3.33Å; I230-M232 PolarHBondContact O-N 2.7Å
233	G	53.2	Low	63.1	Low	52 Å²	52	142.2 Å²	142.2	54%	0.536	72%	0.717	S	S	.	*			trans	-110.8	36	-172.6	0	0	0	0	0	110.5	P231	P231-G233 PolarHBondContact O-N 2.87Å
234	Y	48.1	Very low	61.7	Low	224 Å²	224	147.9 Å²	147.9	88%	0.878	74%	0.735	S	S	*	*	S	Bend	trans	-143.3	93.6	160.1	-82	-83.2	0	0	0	106.1
235	W	52.9	Low	60.4	Low	214 Å²	214	151.6 Å²	151.6	81%	0.811	75%	0.748	S	S	*	*	S	Bend		-170.2	-15.6	124.7	-138.2	54.1	0	0	0	117.7
236	F	56	Low	58.7	Low	162 Å²	162	154.2 Å²	154.2	71%	0.711	76%	0.759	S	S	*	*			trans	-140.8	95.8	-170.5	-90.6	-74	0	0	0	112.3
237	L	48.4	Very low	57.1	Low	170 Å²	170	155.9 Å²	155.9	89%	0.89	77%	0.772	S	S	*	*			trans	-163.9	105.8	130.3	-93.1	139.2	0	0	0	107.3	S239	L237-S239 PolarHBondContact O-N 2.92Å
238	P	51.7	Low	55.5	Low	111 Å²	111	157.7 Å²	157.7	72%	0.721	78%	0.778	S	S	*	*			trans	-66.2	124.1	166.7	10.1	1.4	0	0	0	107.6	S240	P238-S240 VanDerWaalsContact C-N 3.29Å; P238-S240 PolarHBondContact O-N 3.37Å
239	S	55.9	Low	54	Low	122 Å²	122	156.8 Å²	156.8	85%	0.853	78%	0.778	S	S	*	*			trans	-67.5	90.3	167.6	176.5	0	0	0	0	108.4	L237	L237-S239 PolarHBondContact O-N 2.92Å
240	S	43.2	Very low	52.7	Low	101 Å²	101	153.1 Å²	153.1	71%	0.706	78%	0.779	S	S	*	*			trans	-84.2	107.7	157.7	66.6	0	0	0	0	108	P238	P238-S240 VanDerWaalsContact C-N 3.29Å; P238-S240 PolarHBondContact O-N 3.37Å
241	Y	50.1	Low	51.8	Low	299 Å²	299	157.8 Å²	157.8	100%	1.173	80%	0.803	S	S	*	*			trans	-170.3	0	134.6	-111.1	-75.8	0	0	0	108.8

Retrieved 241 of 241 residues in 50.6 ms (Link to these results)

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