A0A077Z222_TRITR Loading...

DnaJ protein subfamily C

AlphaFold DB , UniProt , Accession A0A077Z222, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 439 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	58	Low	61.5	Low	229 Å²	229	140.5 Å²	140.5	100%	1.128	67%	0.67	S	S	*	*				0	-33.4	0	-129	169.3	169.9	0	0	114.1	I3	M1-I3 PolarHBondContact O-N 3.03Å
2	Y	53.7	Low	62.1	Low	223 Å²	223	138.3 Å²	138.3	88%	0.875	66%	0.658	S	S	*	*	H	α-helix	trans	-66.1	-33.5	-178.6	-117.4	-95.7	0	0	0	115.7	R6	Y2-R6 PolarHBondContact O-N 3.3Å
3	I	57.7	Low	62.2	Low	150 Å²	150	136.5 Å²	136.5	77%	0.769	65%	0.654	S	S	*	*	H	α-helix	trans	-70.8	-39.6	-177.1	-59.6	175.1	0	0	0	111.7	M1 G5 R6 F7	M1-I3 PolarHBondContact O-N 3.03Å; I3-G5 PolarHBondContact O-N 2.71Å; I3-R6 PolarHBondContact O-N 3.04Å; I3-F7 PolarHBondContact O-N 3.01Å; I3-F7 VanDerWaalsContact O-N 3.1Å
4	A	56	Low	62.5	Low	72 Å²	72	135.4 Å²	135.4	60%	0.595	65%	0.652	S	S	*	*	H	α-helix	trans	-64.7	-38.6	179	0	0	0	0	0	112.6	R6 F7 N8	A4-R6 PolarHBondContact O-N 2.94Å; A4-F7 PolarHBondContact O-N 3.49Å; A4-N8 PolarHBondContact O-N 2.97Å; A4-N8 VanDerWaalsContact O-N 3.08Å
5	G	59.1	Low	62.9	Low	42 Å²	42	131.3 Å²	131.3	43%	0.433	63%	0.634	S	S	.	*	H	α-helix	trans	-66.9	-34.7	176.8	0	0	0	0	0	113.5	I3 R9	I3-G5 PolarHBondContact O-N 2.71Å; G5-R9 PolarHBondContact O-N 3.37Å
6	R	62.2	Low	63.2	Low	193 Å²	193	126.8 Å²	126.8	73%	0.728	63%	0.625	S	S	*	*	H	α-helix	trans	-73.8	-37.9	178.1	-141.5	178.7	-168.7	-174.3	3	111.9	Y2 I3 A4 R9 L10	Y2-R6 PolarHBondContact O-N 3.3Å; I3-R6 PolarHBondContact O-N 3.04Å; A4-R6 PolarHBondContact O-N 2.94Å; R6-R9 PolarHBondContact O-N 3.34Å; R6-L10 WeakPolarHBondContact O-CG 3.4Å; R6-L10 PolarHBondContact O-N 3.37Å
7	F	61.1	Low	63.6	Low	150 Å²	150	123.9 Å²	123.9	66%	0.658	62%	0.62	S	S	*	*	H	α-helix	trans	-65	-43.1	174.9	-162.5	-93.9	0	0	0	111.6	I3 A4 R9 L10 F11	I3-F7 PolarHBondContact O-N 3.01Å; I3-F7 VanDerWaalsContact O-N 3.1Å; A4-F7 PolarHBondContact O-N 3.49Å; F7-R9 PolarHBondContact O-N 3.13Å; F7-L10 PolarHBondContact O-N 3.33Å; F7-F11 VanDerWaalsContact O-CB 3.32Å; F7-F11 WeakPolarHBondContact O-CB 3.37Å; F7-F11 PolarHBondContact O-N 3.47Å
8	N	66.9	Low	64	Low	87 Å²	87	120.6 Å²	120.6	47%	0.465	62%	0.615	S	S	.	*	H	α-helix	trans	-65.8	-38.4	178.9	-156.5	20.4	0	0	0	112.3	A4 F11 H12	A4-N8 PolarHBondContact O-N 2.97Å; A4-N8 VanDerWaalsContact O-N 3.08Å; N8-F11 PolarHBondContact O-N 3.39Å; N8-H12 WeakPolarHBondContact O-CB 3.41Å; N8-H12 PolarHBondContact O-CD2 2.84Å; N8-H12 PolarHBondContact O-N 2.98Å; N8-H12 PolarHBondContact OD1-CD2 3.18Å; N8-H12 PolarHBondContact OD1-NE2 3.44Å
9	R	67.1	Low	64.6	Low	194 Å²	194	118.6 Å²	118.6	73%	0.732	61%	0.609	S	S	*	*	H	α-helix	trans	-65.4	-42.9	173.7	-76.8	-173.3	-178.6	-168.8	1.2	112.8	G5 R6 F7 H12 L13	G5-R9 PolarHBondContact O-N 3.37Å; R6-R9 PolarHBondContact O-N 3.34Å; F7-R9 PolarHBondContact O-N 3.13Å; R9-H12 PolarHBondContact O-N 3.08Å; R9-L13 WeakPolarHBondContact O-CB 3.5Å; R9-L13 WeakPolarHBondContact O-CD1 3.49Å; R9-L13 WeakPolarHBondContact O-CG 3.3Å; R9-L13 PolarHBondContact O-N 3.18Å
10	L	66.5	Low	65.1	Low	99 Å²	99	116.8 Å²	116.8	52%	0.518	60%	0.601	S	S	.	*	H	α-helix	trans	-65.3	-40	176.6	-76.4	165.9	0	0	0	111.6	R6 F7 L13 L14	R6-L10 WeakPolarHBondContact O-CG 3.4Å; R6-L10 PolarHBondContact O-N 3.37Å; F7-L10 PolarHBondContact O-N 3.33Å; L10-L13 PolarHBondContact O-N 3.26Å; L10-L14 WeakPolarHBondContact O-CB 3.41Å; L10-L14 VanDerWaalsContact O-CG 3.31Å; L10-L14 WeakPolarHBondContact O-CG 3.42Å; L10-L14 PolarHBondContact O-N 2.93Å
11	F	68	Low	65.7	Low	107 Å²	107	112.9 Å²	112.9	47%	0.469	59%	0.589	S	S	.	*	H	α-helix	trans	-63.9	-46.3	175.8	-175.1	-107.4	0	0	0	112.1	F7 N8 L13 L14 I15	F7-F11 VanDerWaalsContact O-CB 3.32Å; F7-F11 WeakPolarHBondContact O-CB 3.37Å; F7-F11 PolarHBondContact O-N 3.47Å; N8-F11 PolarHBondContact O-N 3.39Å; F11-L13 VanDerWaalsContact C-N 3.35Å; F11-L13 PolarHBondContact O-N 3.05Å; F11-L14 PolarHBondContact O-N 3.34Å; F11-I15 HydrophobicContact CD1-CD1 3.68Å; F11-I15 HydrophobicContact CE1-CD1 3.21Å; F11-I15 HydrophobicContact CE1-CG1 4.35Å; F11-I15 HydrophobicContact CE2-CD1 4.13Å; F11-I15 HydrophobicContact CG-CD1 4.33Å; F11-I15 HydrophobicContact CZ-CD1 3.47Å; F11-I15 VanDerWaalsContact CZ-CD1 3.47Å; F11-I15 HydrophobicContact CZ-CG1 4.35Å; F11-I15 WeakPolarHBondContact O-CG1 3.41Å; F11-I15 PolarHBondContact O-N 3.21Å
12	H	68.8	Low	66.9	Low	114 Å²	114	104.1 Å²	104.1	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-62.8	-38.3	174.1	-80	-61.7	0	0	0	112.9	N8 R9 A16	N8-H12 WeakPolarHBondContact O-CB 3.41Å; N8-H12 PolarHBondContact O-CD2 2.84Å; N8-H12 PolarHBondContact O-N 2.98Å; N8-H12 PolarHBondContact OD1-CD2 3.18Å; N8-H12 PolarHBondContact OD1-NE2 3.44Å; R9-H12 PolarHBondContact O-N 3.08Å; H12-A16 VanDerWaalsContact O-CB 3.24Å; H12-A16 WeakPolarHBondContact O-CB 3.21Å; H12-A16 PolarHBondContact O-N 3.23Å
13	L	63.1	Low	68.6	Low	115 Å²	115	97.8 Å²	97.8	60%	0.602	53%	0.531	S	S	*	.	H	α-helix	trans	-65.4	-40.9	175	-81.6	160.1	0	0	0	112.1	R9 L10 F11 A16 S17	R9-L13 WeakPolarHBondContact O-CB 3.5Å; R9-L13 WeakPolarHBondContact O-CD1 3.49Å; R9-L13 WeakPolarHBondContact O-CG 3.3Å; R9-L13 PolarHBondContact O-N 3.18Å; L10-L13 PolarHBondContact O-N 3.26Å; F11-L13 VanDerWaalsContact C-N 3.35Å; F11-L13 PolarHBondContact O-N 3.05Å; L13-A16 PolarHBondContact O-N 3.25Å; L13-S17 VanDerWaalsContact O-CB 3.3Å; L13-S17 WeakPolarHBondContact O-CB 3.45Å; L13-S17 PolarHBondContact O-N 3.06Å
14	L	66.4	Low	70.2	Confident	120 Å²	120	95.9 Å²	95.9	63%	0.628	52%	0.519	S	S	*	.	H	α-helix	trans	-66.6	-42.6	176.3	-75.7	167.9	0	0	0	111.9	L10 F11 S17 A18	L10-L14 WeakPolarHBondContact O-CB 3.41Å; L10-L14 VanDerWaalsContact O-CG 3.31Å; L10-L14 WeakPolarHBondContact O-CG 3.42Å; L10-L14 PolarHBondContact O-N 2.93Å; F11-L14 PolarHBondContact O-N 3.34Å; L14-S17 PolarHBondContact O-N 3.41Å; L14-A18 WeakPolarHBondContact O-CB 3.46Å; L14-A18 PolarHBondContact O-N 2.85Å
15	I	69.7	Low	72	Confident	75 Å²	75	96.7 Å²	96.7	39%	0.385	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-46.5	174.3	-69.3	173	0	0	0	110.4	F11 S17 A18 V19	F11-I15 HydrophobicContact CD1-CD1 3.68Å; F11-I15 HydrophobicContact CE1-CD1 3.21Å; F11-I15 HydrophobicContact CE1-CG1 4.35Å; F11-I15 HydrophobicContact CE2-CD1 4.13Å; F11-I15 HydrophobicContact CG-CD1 4.33Å; F11-I15 HydrophobicContact CZ-CD1 3.47Å; F11-I15 VanDerWaalsContact CZ-CD1 3.47Å; F11-I15 HydrophobicContact CZ-CG1 4.35Å; F11-I15 WeakPolarHBondContact O-CG1 3.41Å; F11-I15 PolarHBondContact O-N 3.21Å; I15-S17 VanDerWaalsContact C-N 3.31Å; I15-S17 PolarHBondContact O-N 2.78Å; I15-A18 PolarHBondContact O-N 2.81Å; I15-V19 HydrophobicContact CG2-CG2 4.1Å; I15-V19 WeakPolarHBondContact O-CB 3.49Å; I15-V19 VanDerWaalsContact O-CG2 3.26Å; I15-V19 WeakPolarHBondContact O-CG2 3.44Å; I15-V19 PolarHBondContact O-N 3.18Å
16	A	67.1	Low	73.6	Confident	59 Å²	59	95.7 Å²	95.7	49%	0.488	50%	0.495	S	S	.	.	H	α-helix	trans	-60	-42.8	178.8	0	0	0	0	0	111.5	H12 L13 V19 D20	H12-A16 VanDerWaalsContact O-CB 3.24Å; H12-A16 WeakPolarHBondContact O-CB 3.21Å; H12-A16 PolarHBondContact O-N 3.23Å; L13-A16 PolarHBondContact O-N 3.25Å; A16-V19 PolarHBondContact O-N 3.42Å; A16-D20 VanDerWaalsContact O-CB 3.27Å; A16-D20 WeakPolarHBondContact O-CB 3.35Å; A16-D20 PolarHBondContact O-N 3.01Å
17	S	70.1	Confident	75.1	Confident	78 Å²	78	92 Å²	92	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-41.8	174.5	162.6	0	0	0	0	112.9	L13 L14 I15 G21	L13-S17 VanDerWaalsContact O-CB 3.3Å; L13-S17 WeakPolarHBondContact O-CB 3.45Å; L13-S17 PolarHBondContact O-N 3.06Å; L14-S17 PolarHBondContact O-N 3.41Å; I15-S17 VanDerWaalsContact C-N 3.31Å; I15-S17 PolarHBondContact O-N 2.78Å; S17-G21 PolarHBondContact O-N 2.87Å
18	A	70.8	Confident	76.8	Confident	64 Å²	64	91.4 Å²	91.4	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-68.2	-41.1	178.6	0	0	0	0	0	111.8	L14 I15 G21 S22	L14-A18 WeakPolarHBondContact O-CB 3.46Å; L14-A18 PolarHBondContact O-N 2.85Å; I15-A18 PolarHBondContact O-N 2.81Å; A18-G21 PolarHBondContact O-N 3.39Å; A18-S22 PolarHBondContact O-N 3.11Å
19	V	75	Confident	78.2	Confident	83 Å²	83	88.2 Å²	88.2	50%	0.503	46%	0.462	S	S	.	.	H	α-helix	trans	-65.2	-43.9	175.9	173.5	0	0	0	0	110.6	I15 A16 G21 S22 L23	I15-V19 HydrophobicContact CG2-CG2 4.1Å; I15-V19 WeakPolarHBondContact O-CB 3.49Å; I15-V19 VanDerWaalsContact O-CG2 3.26Å; I15-V19 WeakPolarHBondContact O-CG2 3.44Å; I15-V19 PolarHBondContact O-N 3.18Å; A16-V19 PolarHBondContact O-N 3.42Å; V19-G21 PolarHBondContact O-N 3.27Å; V19-S22 PolarHBondContact O-N 3.09Å; V19-S22 PolarHBondContact O-OG 3.09Å; V19-L23 PolarHBondContact O-N 3.44Å
20	D	74.8	Confident	79.6	Confident	82 Å²	82	80.3 Å²	80.3	44%	0.439	43%	0.434	S	S	.	.	H	α-helix	trans	-62	-43.3	176.6	-172.5	24.5	0	0	0	111.7	A16 S22 L23 Q24	A16-D20 VanDerWaalsContact O-CB 3.27Å; A16-D20 WeakPolarHBondContact O-CB 3.35Å; A16-D20 PolarHBondContact O-N 3.01Å; D20-S22 VanDerWaalsContact C-N 3.35Å; D20-S22 PolarHBondContact O-N 3.22Å; D20-L23 PolarHBondContact O-N 3.46Å; D20-Q24 WeakPolarHBondContact O-CG 3.18Å; D20-Q24 PolarHBondContact O-N 2.78Å; D20-Q24 PolarHBondContact OD1-NE2 3.5Å; D20-Q24 PolarHBondContact OD2-NE2 3.13Å
21	G	77.5	Confident	81.1	Confident	35 Å²	35	79.7 Å²	79.7	36%	0.361	43%	0.429	S	S	.	.	H	α-helix	trans	-57.9	-44.1	173.1	0	0	0	0	0	113.1	S17 A18 V19 E25	S17-G21 PolarHBondContact O-N 2.87Å; A18-G21 PolarHBondContact O-N 3.39Å; V19-G21 PolarHBondContact O-N 3.27Å; G21-E25 WeakPolarHBondContact O-CB 3.43Å; G21-E25 PolarHBondContact O-N 3.03Å; G21-E25 VanDerWaalsContact O-N 3.08Å
22	S	84	Confident	82.4	Confident	45 Å²	45	78 Å²	78	32%	0.315	42%	0.423	S	S	.	.	H	α-helix	trans	-66.5	-36.8	177.2	70.9	0	0	0	0	113	A18 V19 D20 E25 I26	A18-S22 PolarHBondContact O-N 3.11Å; V19-S22 PolarHBondContact O-N 3.09Å; V19-S22 PolarHBondContact O-OG 3.09Å; D20-S22 VanDerWaalsContact C-N 3.35Å; D20-S22 PolarHBondContact O-N 3.22Å; S22-E25 PolarHBondContact O-N 3.24Å; S22-I26 WeakPolarHBondContact O-CD1 3.32Å; S22-I26 VanDerWaalsContact O-CG1 3.24Å; S22-I26 WeakPolarHBondContact O-CG1 3.43Å; S22-I26 PolarHBondContact O-N 3.43Å
23	L	89	Confident	83.8	Confident	89 Å²	89	72.5 Å²	72.5	47%	0.466	40%	0.398	S	S	.	.	H	α-helix	trans	-67	-45.1	178.5	-170.1	110.9	0	0	0	111.1	V19 D20 E25 I26 E27	V19-L23 PolarHBondContact O-N 3.44Å; D20-L23 PolarHBondContact O-N 3.46Å; L23-E25 VanDerWaalsContact C-N 3.28Å; L23-E25 PolarHBondContact O-N 3.1Å; L23-I26 PolarHBondContact O-N 2.84Å; L23-E27 WeakPolarHBondContact O-CG 3.48Å; L23-E27 PolarHBondContact O-N 3.05Å
24	Q	91	Very high	85.4	Confident	111 Å²	111	72.2 Å²	72.2	52%	0.519	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-38.1	175.9	-69.6	174.3	26	0	0	111.7	D20 R28	D20-Q24 WeakPolarHBondContact O-CG 3.18Å; D20-Q24 PolarHBondContact O-N 2.78Å; D20-Q24 PolarHBondContact OD1-NE2 3.5Å; D20-Q24 PolarHBondContact OD2-NE2 3.13Å; Q24-R28 WeakPolarHBondContact O-CB 3.24Å; Q24-R28 PolarHBondContact O-N 3.49Å
25	E	93.1	Very high	86.8	Confident	88 Å²	88	70.2 Å²	70.2	41%	0.411	38%	0.379	S	S	.	.	H	α-helix	trans	-66	-45.6	176	-170.8	167	-160.9	0	0	111.9	G21 S22 L23 E27 R28 H29 L55	G21-E25 WeakPolarHBondContact O-CB 3.43Å; G21-E25 PolarHBondContact O-N 3.03Å; G21-E25 VanDerWaalsContact O-N 3.08Å; S22-E25 PolarHBondContact O-N 3.24Å; L23-E25 VanDerWaalsContact C-N 3.28Å; L23-E25 PolarHBondContact O-N 3.1Å; E25-E27 PolarHBondContact O-N 3.04Å; E25-R28 WeakPolarHBondContact O-CB 3.5Å; E25-R28 PolarHBondContact O-N 2.55Å; E25-H29 PolarHBondContact O-CD2 3.12Å; E25-H29 PolarHBondContact O-N 3.19Å; E25-L55 HydrophobicContact CB-CD1 4.05Å; E25-L55 HydrophobicContact CG-CD1 3.73Å
26	I	94	Very high	88.1	Confident	22 Å²	22	69.7 Å²	69.7	11%	0.113	37%	0.372	C	S	.	.	H	α-helix	trans	-55.5	-52.2	173.5	-68.9	160.3	0	0	0	110.3	S22 L23 R28 H29 L30 L55 D56	S22-I26 WeakPolarHBondContact O-CD1 3.32Å; S22-I26 VanDerWaalsContact O-CG1 3.24Å; S22-I26 WeakPolarHBondContact O-CG1 3.43Å; S22-I26 PolarHBondContact O-N 3.43Å; L23-I26 PolarHBondContact O-N 2.84Å; I26-R28 VanDerWaalsContact C-N 3.31Å; I26-R28 PolarHBondContact O-N 3.11Å; I26-H29 PolarHBondContact O-N 3.46Å; I26-H29 VanDerWaalsContact O-N 3.15Å; I26-L30 HydrophobicContact CG2-CD1 3.82Å; I26-L30 HydrophobicContact CG2-CG 4.19Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.49Å; I26-L30 PolarHBondContact O-N 3.13Å; I26-L55 HydrophobicContact CD1-CB 3.84Å; I26-L55 HydrophobicContact CG1-CB 3.46Å; I26-L55 VanDerWaalsContact CG1-CB 3.46Å; I26-L55 HydrophobicContact CG1-CD1 3.74Å; I26-L55 HydrophobicContact CG1-CG 4.25Å; I26-D56 HydrophobicContact CD1-CB 3.94Å
27	E	94.4	Very high	89.4	Confident	116 Å²	116	69.2 Å²	69.2	54%	0.542	36%	0.361	S	S	.	.	H	α-helix	trans	-59.7	-41.1	-179	-74.2	-175.7	172.3	0	0	112.2	L23 E25 H29 L30 E31	L23-E27 WeakPolarHBondContact O-CG 3.48Å; L23-E27 PolarHBondContact O-N 3.05Å; E25-E27 PolarHBondContact O-N 3.04Å; E27-H29 PolarHBondContact O-N 2.97Å; E27-L30 PolarHBondContact O-N 3.01Å; E27-E31 WeakPolarHBondContact O-CB 3.13Å; E27-E31 PolarHBondContact O-N 3.44Å
28	R	95.8	Very high	90.6	Very high	136 Å²	136	70.1 Å²	70.1	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-58.9	-46.8	174.9	-172.1	-171.5	74.2	117.3	0.1	111.5	Q24 E25 I26 E31 M32	Q24-R28 WeakPolarHBondContact O-CB 3.24Å; Q24-R28 PolarHBondContact O-N 3.49Å; E25-R28 WeakPolarHBondContact O-CB 3.5Å; E25-R28 PolarHBondContact O-N 2.55Å; I26-R28 VanDerWaalsContact C-N 3.31Å; I26-R28 PolarHBondContact O-N 3.11Å; R28-E31 PolarHBondContact O-N 3.49Å; R28-M32 WeakPolarHBondContact O-CB 3.2Å; R28-M32 VanDerWaalsContact O-CG 3.28Å; R28-M32 WeakPolarHBondContact O-CG 3.47Å; R28-M32 PolarHBondContact O-N 3.13Å
29	H	97.1	Very high	91.9	Very high	21 Å²	21	73.5 Å²	73.5	10%	0.097	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-41.7	176.9	-82.9	-78.1	0	0	0	111.9	E25 I26 E27 E31 M32 G33 H48 A51 A52	E25-H29 PolarHBondContact O-CD2 3.12Å; E25-H29 PolarHBondContact O-N 3.19Å; I26-H29 PolarHBondContact O-N 3.46Å; I26-H29 VanDerWaalsContact O-N 3.15Å; E27-H29 PolarHBondContact O-N 2.97Å; H29-E31 PolarHBondContact O-N 3.33Å; H29-M32 PolarHBondContact O-N 3.32Å; H29-G33 PolarHBondContact O-N 3.49Å; H29-H48 WeakPolarHBondContact CB-O 3.35Å; H29-H48 AromaticContact CE1-ND1 3.89Å; H29-H48 AromaticContact ND1-ND1 3.23Å; H29-H48 PolarHBondContact ND1-ND1 3.33Å; H29-H48 WeakPolarHBondContact O-CB 3.37Å; H29-A51 VanDerWaalsContact CE1-CB 3.43Å; H29-A51 WeakPolarHBondContact CE1-CB 3.3Å; H29-A51 WeakPolarHBondContact ND1-CB 3.25Å; H29-A52 HydrophobicContact CB-CB 3.95Å
30	L	96.3	Very high	92.8	Very high	28 Å²	28	71.4 Å²	71.4	15%	0.147	37%	0.365	C	S	.	.	H	α-helix	trans	-63.1	-40.1	177.5	-69	178.3	0	0	0	113.3	I26 E27 K34 Y49 A52 T62	I26-L30 HydrophobicContact CG2-CD1 3.82Å; I26-L30 HydrophobicContact CG2-CG 4.19Å; I26-L30 VanDerWaalsContact O-CG 3.31Å; I26-L30 WeakPolarHBondContact O-CG 3.49Å; I26-L30 PolarHBondContact O-N 3.13Å; E27-L30 PolarHBondContact O-N 3.01Å; L30-K34 WeakPolarHBondContact O-CB 3.03Å; L30-K34 PolarHBondContact O-N 2.66Å; L30-Y49 HydrophobicContact CD2-CD1 4.14Å; L30-Y49 HydrophobicContact CD2-CE1 4.34Å; L30-A52 HydrophobicContact CD2-CB 3.87Å; L30-A52 HydrophobicContact CG-CB 4.21Å; L30-T62 HydrophobicContact CD2-CG2 3.6Å; L30-T62 WeakPolarHBondContact CD2-OG1 3.46Å
31	E	96.7	Very high	93.8	Very high	86 Å²	86	71.1 Å²	71.1	40%	0.402	36%	0.362	S	S	.	.	H	α-helix	trans	-71.6	-42.5	178.9	-172.3	54.3	-148.8	0	0	111.3	E27 R28 H29 G33 K34 Q35	E27-E31 WeakPolarHBondContact O-CB 3.13Å; E27-E31 PolarHBondContact O-N 3.44Å; R28-E31 PolarHBondContact O-N 3.49Å; H29-E31 PolarHBondContact O-N 3.33Å; E31-G33 PolarHBondContact O-N 3.13Å; E31-K34 PolarHBondContact O-N 3.35Å; E31-K34 IonicContact OE2-NZ 3.61Å; E31-Q35 WeakPolarHBondContact O-CG 3.48Å; E31-Q35 PolarHBondContact O-N 3.2Å
32	M	97	Very high	94.8	Very high	70 Å²	70	72.3 Å²	72.3	35%	0.345	36%	0.357	S	S	.	.	H	α-helix	trans	-59.4	-47.3	172.4	-71.5	-65.6	-179.8	0	0	111.5	R28 H29 K34 Q35 Y36 H48	R28-M32 WeakPolarHBondContact O-CB 3.2Å; R28-M32 VanDerWaalsContact O-CG 3.28Å; R28-M32 WeakPolarHBondContact O-CG 3.47Å; R28-M32 PolarHBondContact O-N 3.13Å; H29-M32 PolarHBondContact O-N 3.32Å; M32-K34 VanDerWaalsContact C-N 3.28Å; M32-K34 PolarHBondContact O-N 3.29Å; M32-Q35 PolarHBondContact O-N 3.49Å; M32-Q35 VanDerWaalsContact O-N 3.13Å; M32-Y36 HydrophobicContact CB-CD2 4.43Å; M32-Y36 HydrophobicContact CB-CE2 4.44Å; M32-Y36 WeakPolarHBondContact O-CD2 3.32Å; M32-Y36 PolarHBondContact O-N 3.17Å; M32-H48 HydrophobicContact CB-CB 4.4Å
33	G	96.9	Very high	95.4	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-40.9	177.4	0	0	0	0	0	112.6	H29 E31 L37 A45 Y49	H29-G33 PolarHBondContact O-N 3.49Å; E31-G33 PolarHBondContact O-N 3.13Å; G33-L37 VanDerWaalsContact O-CB 3.28Å; G33-L37 WeakPolarHBondContact O-CB 3.32Å; G33-L37 PolarHBondContact O-N 3.08Å; G33-A45 WeakPolarHBondContact O-CB 3.49Å; G33-Y49 VanDerWaalsContact C-OH 3.28Å; G33-Y49 PolarHBondContact O-OH 3.08Å
34	K	95.9	Very high	95.7	Very high	109 Å²	109	71.9 Å²	71.9	47%	0.474	36%	0.357	S	S	.	.	H	α-helix	trans	-66	-42.4	175.6	-178.4	-175	169.9	-161.1	0	112.1	L30 E31 M32 L37 S38 Y49	L30-K34 WeakPolarHBondContact O-CB 3.03Å; L30-K34 PolarHBondContact O-N 2.66Å; E31-K34 PolarHBondContact O-N 3.35Å; E31-K34 IonicContact OE2-NZ 3.61Å; M32-K34 VanDerWaalsContact C-N 3.28Å; M32-K34 PolarHBondContact O-N 3.29Å; K34-L37 PolarHBondContact O-N 3.42Å; K34-S38 PolarHBondContact O-N 2.77Å; K34-Y49 PolarHBondContact N-OH 2.91Å
35	Q	97.2	Very high	96	Very high	77 Å²	77	66.6 Å²	66.6	36%	0.36	33%	0.332	S	S	.	.	H	α-helix	trans	-63.4	-48.7	177	-72	179.2	17.5	0	0	111.7	E31 M32 L37 S38 K39	E31-Q35 WeakPolarHBondContact O-CG 3.48Å; E31-Q35 PolarHBondContact O-N 3.2Å; M32-Q35 PolarHBondContact O-N 3.49Å; M32-Q35 VanDerWaalsContact O-N 3.13Å; Q35-L37 VanDerWaalsContact C-N 3.31Å; Q35-L37 PolarHBondContact O-N 3.41Å; Q35-S38 PolarHBondContact O-N 3.41Å; Q35-S38 PolarHBondContact O-OG 2.62Å; Q35-K39 WeakPolarHBondContact O-CG 3.35Å; Q35-K39 PolarHBondContact O-N 3.15Å; Q35-K39 VanDerWaalsContact O-N 3.12Å
36	Y	97.5	Very high	96.3	Very high	65 Å²	65	62.9 Å²	62.9	26%	0.255	32%	0.315	S	S	.	.	H	α-helix	trans	-61.2	-40.2	176.5	-78.1	-66.4	0	0	0	112.1	M32 S38 K39 G40 Q41 D44 H48	M32-Y36 HydrophobicContact CB-CD2 4.43Å; M32-Y36 HydrophobicContact CB-CE2 4.44Å; M32-Y36 WeakPolarHBondContact O-CD2 3.32Å; M32-Y36 PolarHBondContact O-N 3.17Å; Y36-S38 VanDerWaalsContact C-N 3.33Å; Y36-S38 PolarHBondContact O-N 3.05Å; Y36-K39 PolarHBondContact O-N 3.47Å; Y36-K39 VanDerWaalsContact O-N 3.16Å; Y36-G40 PolarHBondContact O-N 2.78Å; Y36-Q41 HydrophobicContact CD1-CB 3.79Å; Y36-Q41 HydrophobicContact CD1-CG 4.35Å; Y36-Q41 VanDerWaalsContact CD1-OE1 3.25Å; Y36-Q41 HydrophobicContact CG-CB 4.48Å; Y36-Q41 PolarHBondContact O-N 3.32Å; Y36-D44 HydrophobicContact CD1-CB 3.52Å; Y36-D44 HydrophobicContact CD2-CB 4.07Å; Y36-D44 HydrophobicContact CE1-CB 3.86Å; Y36-D44 HydrophobicContact CE2-CB 4.39Å; Y36-D44 HydrophobicContact CG-CB 3.63Å; Y36-H48 AromaticContact CD2-CD2 3.5Å; Y36-H48 VanDerWaalsContact CD2-CD2 3.5Å; Y36-H48 WeakPolarHBondContact CD2-CD2 3.5Å; Y36-H48 AromaticContact CD2-NE2 3.84Å; Y36-H48 AromaticContact CE2-CD2 3.52Å; Y36-H48 AromaticContact CE2-NE2 3.33Å; Y36-H48 VanDerWaalsContact CE2-NE2 3.33Å; Y36-H48 WeakPolarHBondContact CE2-NE2 3.38Å
37	L	94.3	Very high	96.4	Very high	48 Å²	48	66.9 Å²	66.9	25%	0.251	33%	0.334	S	S	.	.	H	α-helix	trans	-59.4	-44.1	175.2	-170	75.1	0	0	0	111.5	G33 K34 Q35 K39 G40 F42 A45 A69	G33-L37 VanDerWaalsContact O-CB 3.28Å; G33-L37 WeakPolarHBondContact O-CB 3.32Å; G33-L37 PolarHBondContact O-N 3.08Å; K34-L37 PolarHBondContact O-N 3.42Å; Q35-L37 VanDerWaalsContact C-N 3.31Å; Q35-L37 PolarHBondContact O-N 3.41Å; L37-K39 VanDerWaalsContact C-N 3.26Å; L37-K39 PolarHBondContact O-N 3.15Å; L37-G40 PolarHBondContact O-N 2.93Å; L37-G40 VanDerWaalsContact O-N 3.13Å; L37-F42 HydrophobicContact CD1-CD1 4.04Å; L37-F42 HydrophobicContact CD1-CE1 4.49Å; L37-A45 HydrophobicContact CB-CB 4.07Å; L37-A45 HydrophobicContact CD1-CB 4.39Å; L37-A69 HydrophobicContact CD1-CB 3.74Å
38	S	95.1	Very high	96.6	Very high	98 Å²	98	62.5 Å²	62.5	69%	0.685	31%	0.314	S	S	*	.	H	α-helix	trans	-65.7	-27.3	178.2	75.4	0	0	0	0	113.6	K34 Q35 Y36 G40	K34-S38 PolarHBondContact O-N 2.77Å; Q35-S38 PolarHBondContact O-N 3.41Å; Q35-S38 PolarHBondContact O-OG 2.62Å; Y36-S38 VanDerWaalsContact C-N 3.33Å; Y36-S38 PolarHBondContact O-N 3.05Å; S38-G40 VanDerWaalsContact C-N 3.29Å
39	K	96.7	Very high	96.7	Very high	135 Å²	135	56.1 Å²	56.1	59%	0.587	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-0.5	176	-67.8	175.9	-176.9	175.1	0	113.2	Q35 Y36 L37 Q41	Q35-K39 WeakPolarHBondContact O-CG 3.35Å; Q35-K39 PolarHBondContact O-N 3.15Å; Q35-K39 VanDerWaalsContact O-N 3.12Å; Y36-K39 PolarHBondContact O-N 3.47Å; Y36-K39 VanDerWaalsContact O-N 3.16Å; L37-K39 VanDerWaalsContact C-N 3.26Å; L37-K39 PolarHBondContact O-N 3.15Å; K39-Q41 HydrophobicContact CB-CG 4.12Å; K39-Q41 PolarHBondContact O-N 3.1Å
40	G	94.6	Very high	96.7	Very high	38 Å²	38	57.3 Å²	57.3	39%	0.392	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	9.4	-173.6	0	0	0	0	0	114	Y36 L37 S38 F42	Y36-G40 PolarHBondContact O-N 2.78Å; L37-G40 PolarHBondContact O-N 2.93Å; L37-G40 VanDerWaalsContact O-N 3.13Å; S38-G40 VanDerWaalsContact C-N 3.29Å; G40-F42 VanDerWaalsContact C-N 3.28Å; G40-F42 WeakPolarHBondContact O-CD2 3.48Å; G40-F42 PolarHBondContact O-N 3.36Å
41	Q	96.8	Very high	96.7	Very high	77 Å²	77	57 Å²	57	36%	0.36	30%	0.298	S	S	.	.			trans	-85.4	69.6	178.6	-66.5	-178	-77.3	0	0	109.7	Y36 K39 S43 D44 A45	Y36-Q41 HydrophobicContact CD1-CB 3.79Å; Y36-Q41 HydrophobicContact CD1-CG 4.35Å; Y36-Q41 VanDerWaalsContact CD1-OE1 3.25Å; Y36-Q41 HydrophobicContact CG-CB 4.48Å; Y36-Q41 PolarHBondContact O-N 3.32Å; K39-Q41 HydrophobicContact CB-CG 4.12Å; K39-Q41 PolarHBondContact O-N 3.1Å; Q41-S43 PolarHBondContact O-N 2.91Å; Q41-D44 HydrophobicContact CB-CB 4.37Å; Q41-D44 PolarHBondContact O-N 3.49Å; Q41-A45 PolarHBondContact O-N 2.95Å
42	F	96.8	Very high	96.7	Very high	59 Å²	59	52.9 Å²	52.9	26%	0.259	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-36.3	-168.8	-50.5	-54	0	0	0	113.9	L37 G40 A45 I46 A72 N73	L37-F42 HydrophobicContact CD1-CD1 4.04Å; L37-F42 HydrophobicContact CD1-CE1 4.49Å; G40-F42 VanDerWaalsContact C-N 3.28Å; G40-F42 WeakPolarHBondContact O-CD2 3.48Å; G40-F42 PolarHBondContact O-N 3.36Å; F42-A45 PolarHBondContact O-N 3.02Å; F42-I46 WeakPolarHBondContact O-CD1 3.46Å; F42-I46 VanDerWaalsContact O-CG1 3.22Å; F42-I46 WeakPolarHBondContact O-CG1 3.49Å; F42-I46 PolarHBondContact O-N 3.16Å; F42-A72 HydrophobicContact CD1-CB 3.63Å; F42-A72 HydrophobicContact CD2-CB 4.45Å; F42-A72 HydrophobicContact CE1-CB 3.47Å; F42-A72 VanDerWaalsContact CE1-CB 3.47Å; F42-A72 HydrophobicContact CE2-CB 4.3Å; F42-A72 WeakPolarHBondContact CE2-O 3.45Å; F42-A72 HydrophobicContact CG-CB 4.14Å; F42-A72 HydrophobicContact CZ-CB 3.83Å; F42-N73 HydrophobicContact CB-CB 3.72Å; F42-N73 HydrophobicContact CD2-CB 4.3Å; F42-N73 HydrophobicContact CG-CB 4.27Å
43	S	96.4	Very high	96.7	Very high	66 Å²	66	50.2 Å²	50.2	46%	0.462	27%	0.266	S	S	.	.	H	α-helix	trans	-65.1	-43.4	178.7	-60.4	0	0	0	0	112	Q41 A45 I46 M47	Q41-S43 PolarHBondContact O-N 2.91Å; S43-A45 VanDerWaalsContact C-N 3.34Å; S43-I46 PolarHBondContact O-N 3.21Å; S43-M47 PolarHBondContact O-N 2.88Å; S43-M47 VanDerWaalsContact O-N 3.09Å
44	D	96.7	Very high	96.7	Very high	60 Å²	60	57.8 Å²	57.8	32%	0.321	30%	0.301	S	S	.	.	H	α-helix	trans	-66.7	-39.3	177.1	-57.8	-48.9	0	0	0	110.7	Y36 Q41 I46 M47 H48	Y36-D44 HydrophobicContact CD1-CB 3.52Å; Y36-D44 HydrophobicContact CD2-CB 4.07Å; Y36-D44 HydrophobicContact CE1-CB 3.86Å; Y36-D44 HydrophobicContact CE2-CB 4.39Å; Y36-D44 HydrophobicContact CG-CB 3.63Å; Q41-D44 HydrophobicContact CB-CB 4.37Å; Q41-D44 PolarHBondContact O-N 3.49Å; D44-I46 PolarHBondContact O-N 2.92Å; D44-M47 PolarHBondContact O-N 3.43Å; D44-H48 PolarHBondContact O-CD2 3.21Å; D44-H48 VanDerWaalsContact O-CD2 3.27Å; D44-H48 PolarHBondContact O-N 3.06Å; D44-H48 VanDerWaalsContact O-N 3.12Å
45	A	97.8	Very high	96.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-45.5	174.2	0	0	0	0	0	112.2	G33 L37 Q41 F42 S43 H48 Y49	G33-A45 WeakPolarHBondContact O-CB 3.49Å; L37-A45 HydrophobicContact CB-CB 4.07Å; L37-A45 HydrophobicContact CD1-CB 4.39Å; Q41-A45 PolarHBondContact O-N 2.95Å; F42-A45 PolarHBondContact O-N 3.02Å; S43-A45 VanDerWaalsContact C-N 3.34Å; A45-H48 PolarHBondContact O-N 3.49Å; A45-Y49 HydrophobicContact CB-CE2 4.23Å; A45-Y49 WeakPolarHBondContact O-CD2 3.47Å; A45-Y49 PolarHBondContact O-N 3.06Å
46	I	97.8	Very high	96.4	Very high	10 Å²	10	55.1 Å²	55.1	5%	0.051	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-47.1	177.2	-69.6	159	0	0	0	110.4	F42 S43 D44 H48 Y49 D50 R66 A69 Y70 N73	F42-I46 WeakPolarHBondContact O-CD1 3.46Å; F42-I46 VanDerWaalsContact O-CG1 3.22Å; F42-I46 WeakPolarHBondContact O-CG1 3.49Å; F42-I46 PolarHBondContact O-N 3.16Å; S43-I46 PolarHBondContact O-N 3.21Å; D44-I46 PolarHBondContact O-N 2.92Å; I46-H48 VanDerWaalsContact C-N 3.31Å; I46-H48 PolarHBondContact O-N 3.33Å; I46-Y49 CarbonylContact O-C 3.59Å; I46-Y49 PolarHBondContact O-N 2.92Å; I46-Y49 VanDerWaalsContact O-N 3.08Å; I46-D50 PolarHBondContact O-N 2.92Å; I46-R66 HydrophobicContact CG2-CG 4.4Å; I46-A69 HydrophobicContact CD1-CB 4.44Å; I46-A69 HydrophobicContact CG1-CB 3.7Å; I46-Y70 HydrophobicContact CD1-CD1 3.58Å; I46-Y70 HydrophobicContact CD1-CE1 3.75Å; I46-Y70 HydrophobicContact CD1-CG 4.35Å; I46-Y70 HydrophobicContact CG1-CD1 4.23Å; I46-Y70 HydrophobicContact CG1-CE1 4.21Å; I46-Y70 HydrophobicContact CG2-CE1 3.85Å; I46-N73 HydrophobicContact CD1-CB 4.4Å
47	M	97.6	Very high	96.3	Very high	105 Å²	105	55.9 Å²	55.9	52%	0.517	31%	0.307	S	S	.	.	H	α-helix	trans	-57	-43	178.7	-179.8	-172	67	0	0	112.3	S43 D44 D50 A51	S43-M47 PolarHBondContact O-N 2.88Å; S43-M47 VanDerWaalsContact O-N 3.09Å; D44-M47 PolarHBondContact O-N 3.43Å; M47-D50 PolarHBondContact O-N 2.94Å; M47-A51 PolarHBondContact O-N 2.93Å; M47-A51 VanDerWaalsContact O-N 3.11Å
48	H	98	Very high	96.3	Very high	24 Å²	24	58 Å²	58	11%	0.111	32%	0.319	C	S	.	.	H	α-helix	trans	-69.1	-36	176.7	-79.5	-72.2	0	0	0	112.8	H29 M32 Y36 D44 A45 I46 A52	H29-H48 WeakPolarHBondContact CB-O 3.35Å; H29-H48 AromaticContact CE1-ND1 3.89Å; H29-H48 AromaticContact ND1-ND1 3.23Å; H29-H48 PolarHBondContact ND1-ND1 3.33Å; H29-H48 WeakPolarHBondContact O-CB 3.37Å; M32-H48 HydrophobicContact CB-CB 4.4Å; Y36-H48 AromaticContact CD2-CD2 3.5Å; Y36-H48 VanDerWaalsContact CD2-CD2 3.5Å; Y36-H48 WeakPolarHBondContact CD2-CD2 3.5Å; Y36-H48 AromaticContact CD2-NE2 3.84Å; Y36-H48 AromaticContact CE2-CD2 3.52Å; Y36-H48 AromaticContact CE2-NE2 3.33Å; Y36-H48 VanDerWaalsContact CE2-NE2 3.33Å; Y36-H48 WeakPolarHBondContact CE2-NE2 3.38Å; D44-H48 PolarHBondContact O-CD2 3.21Å; D44-H48 VanDerWaalsContact O-CD2 3.27Å; D44-H48 PolarHBondContact O-N 3.06Å; D44-H48 VanDerWaalsContact O-N 3.12Å; A45-H48 PolarHBondContact O-N 3.49Å; I46-H48 VanDerWaalsContact C-N 3.31Å; I46-H48 PolarHBondContact O-N 3.33Å; H48-A52 PolarHBondContact O-N 3.5Å
49	Y	97.8	Very high	96.3	Very high	2 Å²	2	55 Å²	55	1%	0.008	30%	0.295	C	S	.	.	H	α-helix	trans	-69.5	-33.9	173.3	-64.1	-44.4	0	0	0	112.9	L30 G33 K34 A45 I46 A52 L53 T62 R65 R66 A69	L30-Y49 HydrophobicContact CD2-CD1 4.14Å; L30-Y49 HydrophobicContact CD2-CE1 4.34Å; G33-Y49 VanDerWaalsContact C-OH 3.28Å; G33-Y49 PolarHBondContact O-OH 3.08Å; K34-Y49 PolarHBondContact N-OH 2.91Å; A45-Y49 HydrophobicContact CB-CE2 4.23Å; A45-Y49 WeakPolarHBondContact O-CD2 3.47Å; A45-Y49 PolarHBondContact O-N 3.06Å; I46-Y49 CarbonylContact O-C 3.59Å; I46-Y49 PolarHBondContact O-N 2.92Å; I46-Y49 VanDerWaalsContact O-N 3.08Å; Y49-A52 PolarHBondContact O-N 2.93Å; Y49-L53 WeakPolarHBondContact O-CB 3.47Å; Y49-L53 VanDerWaalsContact O-CG 3.29Å; Y49-L53 WeakPolarHBondContact O-CG 3.43Å; Y49-L53 PolarHBondContact O-N 3.43Å; Y49-T62 HydrophobicContact CD1-CG2 4.24Å; Y49-R65 HydrophobicContact CD1-CB 4.24Å; Y49-R65 HydrophobicContact CD2-CB 4.34Å; Y49-R65 HydrophobicContact CE1-CB 3.81Å; Y49-R65 HydrophobicContact CE1-CG 4.44Å; Y49-R65 HydrophobicContact CE2-CB 3.9Å; Y49-R65 HydrophobicContact CG-CB 4.5Å; Y49-R66 HydrophobicContact CD2-CB 4.32Å; Y49-R66 HydrophobicContact CG-CB 4.41Å; Y49-A69 HydrophobicContact CD2-CB 4.33Å; Y49-A69 HydrophobicContact CE2-CB 4.21Å
50	D	97.4	Very high	96.3	Very high	47 Å²	47	52.3 Å²	52.3	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-60	-50.7	172.8	-71.8	-27.7	0	0	0	110.4	I46 M47 A52 L53 E54 R66	I46-D50 PolarHBondContact O-N 2.92Å; M47-D50 PolarHBondContact O-N 2.94Å; D50-A52 VanDerWaalsContact C-N 3.31Å; D50-A52 PolarHBondContact O-N 3.35Å; D50-L53 CarbonylContact O-C 3.4Å; D50-L53 PolarHBondContact O-N 3.36Å; D50-E54 PolarHBondContact O-N 2.87Å; D50-R66 WeakPolarHBondContact OD1-CD 3.2Å; D50-R66 IonicContact OD1-CZ 3.57Å; D50-R66 IonicContact OD1-NE 4Å; D50-R66 IonicContact OD1-NH1 2.68Å; D50-R66 PolarHBondContact OD1-NH1 3.47Å
51	A	96.7	Very high	96.3	Very high	20 Å²	20	53.7 Å²	53.7	17%	0.165	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-37.2	176.3	0	0	0	0	0	113	H29 M47 L53 E54	H29-A51 VanDerWaalsContact CE1-CB 3.43Å; H29-A51 WeakPolarHBondContact CE1-CB 3.3Å; H29-A51 WeakPolarHBondContact ND1-CB 3.25Å; M47-A51 PolarHBondContact O-N 2.93Å; M47-A51 VanDerWaalsContact O-N 3.11Å; A51-L53 VanDerWaalsContact C-N 3.34Å; A51-E54 PolarHBondContact O-N 3.03Å
52	A	96.8	Very high	96.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-35.3	173.7	0	0	0	0	0	112.5	H29 L30 H48 Y49 D50 L55 D56 T62	H29-A52 HydrophobicContact CB-CB 3.95Å; L30-A52 HydrophobicContact CD2-CB 3.87Å; L30-A52 HydrophobicContact CG-CB 4.21Å; H48-A52 PolarHBondContact O-N 3.5Å; Y49-A52 PolarHBondContact O-N 2.93Å; D50-A52 VanDerWaalsContact C-N 3.31Å; D50-A52 PolarHBondContact O-N 3.35Å; A52-L55 PolarHBondContact O-N 2.71Å; A52-D56 PolarHBondContact O-N 2.99Å; A52-T62 HydrophobicContact CB-CG2 3.86Å
53	L	96.4	Very high	96.4	Very high	14 Å²	14	47.7 Å²	47.7	7%	0.073	25%	0.252	C	S	.	.	H	α-helix	trans	-77.2	-21.8	177.8	-72.6	166.9	0	0	0	113.4	Y49 D50 A51 L55 D56 P57 T62 L63 R66	Y49-L53 WeakPolarHBondContact O-CB 3.47Å; Y49-L53 VanDerWaalsContact O-CG 3.29Å; Y49-L53 WeakPolarHBondContact O-CG 3.43Å; Y49-L53 PolarHBondContact O-N 3.43Å; D50-L53 CarbonylContact O-C 3.4Å; D50-L53 PolarHBondContact O-N 3.36Å; A51-L53 VanDerWaalsContact C-N 3.34Å; L53-L55 VanDerWaalsContact C-N 3.25Å; L53-D56 CarbonylContact O-C 3.5Å; L53-P57 VanDerWaalsContact O-CA 3.22Å; L53-P57 WeakPolarHBondContact O-CA 3.49Å; L53-P57 WeakPolarHBondContact O-CG 3.28Å; L53-T62 HydrophobicContact CD1-CG2 4.23Å; L53-T62 HydrophobicContact CD2-CG2 3.82Å; L53-T62 HydrophobicContact CG-CG2 3.62Å; L53-L63 HydrophobicContact CD1-CD2 3.83Å; L53-L63 HydrophobicContact CD1-CG 4.45Å; L53-L63 HydrophobicContact CD2-CD2 3.8Å; L53-L63 HydrophobicContact CD2-CG 3.72Å; L53-L63 HydrophobicContact CG-CD2 4.48Å; L53-R66 HydrophobicContact CD1-CB 4.45Å
54	E	95.8	Very high	96.5	Very high	159 Å²	159	46.6 Å²	46.6	74%	0.743	24%	0.238	S	C	*	.	H	α-helix	trans	-65.8	-32.7	169.6	-73	177.7	176.8	0	0	111.6	D50 A51	D50-E54 PolarHBondContact O-N 2.87Å; A51-E54 PolarHBondContact O-N 3.03Å
55	L	94.2	Very high	96.5	Very high	74 Å²	74	47.4 Å²	47.4	39%	0.387	24%	0.237	S	C	.	.	H	α-helix	trans	-88	-35.7	179.5	-61	174.3	0	0	0	112.8	E25 I26 A52 L53	E25-L55 HydrophobicContact CB-CD1 4.05Å; E25-L55 HydrophobicContact CG-CD1 3.73Å; I26-L55 HydrophobicContact CD1-CB 3.84Å; I26-L55 HydrophobicContact CG1-CB 3.46Å; I26-L55 VanDerWaalsContact CG1-CB 3.46Å; I26-L55 HydrophobicContact CG1-CD1 3.74Å; I26-L55 HydrophobicContact CG1-CG 4.25Å; A52-L55 PolarHBondContact O-N 2.71Å; L53-L55 VanDerWaalsContact C-N 3.25Å
56	D	93.6	Very high	96.4	Very high	56 Å²	56	49.6 Å²	49.6	30%	0.299	25%	0.245	S	C	.	.			trans	-136.1	84	176.4	-177.6	11.4	0	0	0	111.6	I26 A52 L53 D58 N59	I26-D56 HydrophobicContact CD1-CB 3.94Å; A52-D56 PolarHBondContact O-N 2.99Å; L53-D56 CarbonylContact O-C 3.5Å; D56-D58 VanDerWaalsContact C-N 3.28Å; D56-D58 PolarHBondContact O-N 3.48Å; D56-N59 HydrophobicContact CB-CB 4.34Å; D56-N59 WeakPolarHBondContact O-CB 3.27Å; D56-N59 PolarHBondContact O-N 2.89Å; D56-N59 VanDerWaalsContact OD2-CB 3.28Å; D56-N59 WeakPolarHBondContact OD2-CB 3.33Å; D56-N59 PolarHBondContact OD2-ND2 3.42Å
57	P	94.7	Very high	96.4	Very high	82 Å²	82	49.1 Å²	49.1	53%	0.532	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-24.9	-174	-23	33	0	0	0	115.2	L53	L53-P57 VanDerWaalsContact O-CA 3.22Å; L53-P57 WeakPolarHBondContact O-CA 3.49Å; L53-P57 WeakPolarHBondContact O-CG 3.28Å
58	D	94	Very high	96.3	Very high	91 Å²	91	45.8 Å²	45.8	49%	0.487	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	10.1	-175.7	-74.3	-34.4	0	0	0	112.7	D56 Y60 R85 L89	D56-D58 VanDerWaalsContact C-N 3.28Å; D56-D58 PolarHBondContact O-N 3.48Å; D58-Y60 PolarHBondContact O-N 3.18Å; D58-R85 IonicContact OD1-CZ 2.65Å; D58-R85 IonicContact OD1-NE 2.67Å; D58-R85 IonicContact OD1-NH2 3.66Å; D58-R85 PolarHBondContact OD1-NH2 2.93Å; D58-L89 HydrophobicContact CB-CD2 4.46Å; D58-L89 WeakPolarHBondContact O-CD1 3.1Å
59	N	95.1	Very high	96.3	Very high	37 Å²	37	44.7 Å²	44.7	20%	0.198	22%	0.223	C	C	.	.			trans	-71.3	94.8	174.2	-158.2	-48.7	0	0	0	111.9	D56 M61 T62 L63	D56-N59 HydrophobicContact CB-CB 4.34Å; D56-N59 WeakPolarHBondContact O-CB 3.27Å; D56-N59 PolarHBondContact O-N 2.89Å; D56-N59 VanDerWaalsContact OD2-CB 3.28Å; D56-N59 WeakPolarHBondContact OD2-CB 3.33Å; D56-N59 PolarHBondContact OD2-ND2 3.42Å; N59-M61 PolarHBondContact O-N 3.25Å; N59-M61 VanDerWaalsContact O-N 3.15Å; N59-M61 WeakPolarHBondContact OD1-CB 3.38Å; N59-M61 PolarHBondContact OD1-N 3.25Å; N59-M61 VanDerWaalsContact OD1-N 3.16Å; N59-T62 PolarHBondContact O-N 3.37Å; N59-T62 VanDerWaalsContact O-N 3.11Å; N59-T62 PolarHBondContact OD1-N 3.27Å; N59-T62 PolarHBondContact OD1-OG1 2.85Å; N59-L63 PolarHBondContact O-N 2.83Å
60	Y	96.5	Very high	96.3	Very high	77 Å²	77	46.1 Å²	46.1	30%	0.302	23%	0.229	S	C	.	.	H	α-helix	trans	-59.4	-29.6	-179.7	84.2	-89	0	0	0	113.1	D58 Y64 V86 K90 F93	D58-Y60 PolarHBondContact O-N 3.18Å; Y60-Y64 WeakPolarHBondContact O-CB 3.4Å; Y60-Y64 PolarHBondContact O-N 3.1Å; Y60-V86 HydrophobicContact CD2-CG1 4.24Å; Y60-V86 WeakPolarHBondContact O-CG2 3.38Å; Y60-K90 HydrophobicContact CD2-CB 4.09Å; Y60-K90 HydrophobicContact CD2-CG 4.43Å; Y60-K90 HydrophobicContact CE2-CB 4.4Å; Y60-K90 HydrophobicContact CE2-CG 4.25Å; Y60-K90 HydrophobicContact CG-CB 4.19Å; Y60-F93 HydrophobicContact CE2-CD2 4.28Å; Y60-F93 HydrophobicContact CE2-CE2 4.42Å; Y60-F93 HydrophobicContact CE2-CG 4.39Å
61	M	96.4	Very high	96.1	Very high	67 Å²	67	45.9 Å²	45.9	33%	0.33	23%	0.227	S	C	.	.	H	α-helix	trans	-72.5	-39.6	178.1	-74.2	-63.7	-70.4	0	0	111.4	N59 Y64 R65 F93	N59-M61 PolarHBondContact O-N 3.25Å; N59-M61 VanDerWaalsContact O-N 3.15Å; N59-M61 WeakPolarHBondContact OD1-CB 3.38Å; N59-M61 PolarHBondContact OD1-N 3.25Å; N59-M61 VanDerWaalsContact OD1-N 3.16Å; M61-Y64 PolarHBondContact O-N 2.97Å; M61-R65 VanDerWaalsContact O-CG 3.27Å; M61-R65 WeakPolarHBondContact O-CG 3.4Å; M61-R65 PolarHBondContact O-N 3.37Å; M61-F93 HydrophobicContact SD-CZ 4.32Å
62	T	96.7	Very high	96	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.012	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-44.1	175.2	-50.3	0	0	0	0	111.2	L30 Y49 A52 L53 N59 Y64 R65 R66	L30-T62 HydrophobicContact CD2-CG2 3.6Å; L30-T62 WeakPolarHBondContact CD2-OG1 3.46Å; Y49-T62 HydrophobicContact CD1-CG2 4.24Å; A52-T62 HydrophobicContact CB-CG2 3.86Å; L53-T62 HydrophobicContact CD1-CG2 4.23Å; L53-T62 HydrophobicContact CD2-CG2 3.82Å; L53-T62 HydrophobicContact CG-CG2 3.62Å; N59-T62 PolarHBondContact O-N 3.37Å; N59-T62 VanDerWaalsContact O-N 3.11Å; N59-T62 PolarHBondContact OD1-N 3.27Å; N59-T62 PolarHBondContact OD1-OG1 2.85Å; T62-Y64 VanDerWaalsContact C-N 3.32Å; T62-Y64 PolarHBondContact O-N 3.27Å; T62-R65 PolarHBondContact O-N 3.18Å; T62-R66 PolarHBondContact O-N 3.21Å
63	L	98	Very high	95.8	Very high	9 Å²	9	49.5 Å²	49.5	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-45.9	172.8	-71.8	167.4	0	0	0	111.5	L53 N59 R65 R66 A67 R85 V86 L89	L53-L63 HydrophobicContact CD1-CD2 3.83Å; L53-L63 HydrophobicContact CD1-CG 4.45Å; L53-L63 HydrophobicContact CD2-CD2 3.8Å; L53-L63 HydrophobicContact CD2-CG 3.72Å; L53-L63 HydrophobicContact CG-CD2 4.48Å; N59-L63 PolarHBondContact O-N 2.83Å; L63-R65 PolarHBondContact O-N 3.47Å; L63-R66 PolarHBondContact O-N 2.98Å; L63-A67 WeakPolarHBondContact O-CB 3.4Å; L63-A67 PolarHBondContact O-N 3.26Å; L63-R85 HydrophobicContact CD1-CB 3.98Å; L63-R85 HydrophobicContact CD1-CG 3.42Å; L63-R85 VanDerWaalsContact CD1-CG 3.42Å; L63-V86 HydrophobicContact CB-CG2 3.51Å; L63-V86 HydrophobicContact CD1-CG2 4.46Å; L63-L89 HydrophobicContact CD1-CD1 3.78Å
64	Y	97.8	Very high	95.5	Very high	43 Å²	43	51.7 Å²	51.7	17%	0.169	28%	0.277	C	S	.	.	H	α-helix	trans	-63.4	-41.1	177.5	-178.9	-114.4	0	0	0	112.3	Y60 M61 T62 A67 T68 L83 F93 A95 A96 Q99	Y60-Y64 WeakPolarHBondContact O-CB 3.4Å; Y60-Y64 PolarHBondContact O-N 3.1Å; M61-Y64 PolarHBondContact O-N 2.97Å; T62-Y64 VanDerWaalsContact C-N 3.32Å; T62-Y64 PolarHBondContact O-N 3.27Å; Y64-A67 WeakPolarHBondContact O-CB 3.19Å; Y64-A67 PolarHBondContact O-N 3.48Å; Y64-T68 HydrophobicContact CD1-CG2 4.46Å; Y64-T68 HydrophobicContact CD2-CG2 4.45Å; Y64-T68 HydrophobicContact CE1-CG2 4.04Å; Y64-T68 HydrophobicContact CE2-CG2 4.04Å; Y64-T68 WeakPolarHBondContact O-CG2 3.5Å; Y64-T68 PolarHBondContact O-N 3.36Å; Y64-T68 PolarHBondContact O-OG1 2.97Å; Y64-L83 HydrophobicContact CD2-CD2 4.12Å; Y64-L83 HydrophobicContact CE2-CD2 4.34Å; Y64-F93 AromaticContact CD1-CE1 3.77Å; Y64-F93 HydrophobicContact CD1-CE1 3.77Å; Y64-F93 AromaticContact CD1-CZ 3.84Å; Y64-F93 HydrophobicContact CD1-CZ 3.84Å; Y64-F93 AromaticContact CD2-CE1 3.69Å; Y64-F93 HydrophobicContact CD2-CE1 3.69Å; Y64-F93 HydrophobicContact CE1-CE1 4.06Å; Y64-F93 AromaticContact CE1-CZ 3.97Å; Y64-F93 HydrophobicContact CE1-CZ 3.97Å; Y64-F93 AromaticContact CE2-CE1 3.98Å; Y64-F93 HydrophobicContact CE2-CE1 3.98Å; Y64-F93 AromaticContact CG-CE1 3.57Å; Y64-F93 HydrophobicContact CG-CE1 3.57Å; Y64-F93 HydrophobicContact CG-CZ 4.13Å; Y64-A95 HydrophobicContact CE2-CB 4.45Å; Y64-A96 HydrophobicContact CD2-CB 3.87Å; Y64-A96 HydrophobicContact CE2-CB 4.08Å; Y64-Q99 HydrophobicContact CE2-CG 4.37Å
65	R	96.7	Very high	95.3	Very high	77 Å²	77	50.2 Å²	50.2	29%	0.291	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-38	175.9	-73.2	176.3	-175.3	-168.8	6	112.4	Y49 M61 T62 L63 T68 A69	Y49-R65 HydrophobicContact CD1-CB 4.24Å; Y49-R65 HydrophobicContact CD2-CB 4.34Å; Y49-R65 HydrophobicContact CE1-CB 3.81Å; Y49-R65 HydrophobicContact CE1-CG 4.44Å; Y49-R65 HydrophobicContact CE2-CB 3.9Å; Y49-R65 HydrophobicContact CG-CB 4.5Å; M61-R65 VanDerWaalsContact O-CG 3.27Å; M61-R65 WeakPolarHBondContact O-CG 3.4Å; M61-R65 PolarHBondContact O-N 3.37Å; T62-R65 PolarHBondContact O-N 3.18Å; L63-R65 PolarHBondContact O-N 3.47Å; R65-T68 WeakPolarHBondContact CA-OG1 3.32Å; R65-T68 PolarHBondContact O-N 3.39Å; R65-T68 PolarHBondContact O-OG1 3.32Å; R65-A69 WeakPolarHBondContact O-CB 3.39Å; R65-A69 PolarHBondContact O-N 3.24Å
66	R	97.6	Very high	95.2	Very high	45 Å²	45	47 Å²	47	17%	0.17	25%	0.249	C	C	.	.	H	α-helix	trans	-66.7	-43.2	173.9	-166.2	177.1	65.1	-174.5	-3.8	111.2	I46 Y49 D50 L53 T62 L63 T68 A69 Y70 D82	I46-R66 HydrophobicContact CG2-CG 4.4Å; Y49-R66 HydrophobicContact CD2-CB 4.32Å; Y49-R66 HydrophobicContact CG-CB 4.41Å; D50-R66 WeakPolarHBondContact OD1-CD 3.2Å; D50-R66 IonicContact OD1-CZ 3.57Å; D50-R66 IonicContact OD1-NE 4Å; D50-R66 IonicContact OD1-NH1 2.68Å; D50-R66 PolarHBondContact OD1-NH1 3.47Å; L53-R66 HydrophobicContact CD1-CB 4.45Å; T62-R66 PolarHBondContact O-N 3.21Å; L63-R66 PolarHBondContact O-N 2.98Å; R66-T68 PolarHBondContact O-N 3.28Å; R66-A69 WeakPolarHBondContact O-CB 3.49Å; R66-A69 PolarHBondContact O-N 2.81Å; R66-Y70 HydrophobicContact CG-CD2 4Å; R66-Y70 HydrophobicContact CG-CE2 3.56Å; R66-Y70 VanDerWaalsContact O-CD2 3.29Å; R66-Y70 WeakPolarHBondContact O-CD2 3.21Å; R66-Y70 PolarHBondContact O-N 3.39Å; R66-D82 IonicContact CZ-OD1 3.36Å; R66-D82 IonicContact CZ-OD2 2.72Å; R66-D82 IonicContact NE-OD1 2.71Å; R66-D82 IonicContact NE-OD2 3.3Å; R66-D82 PolarHBondContact NE-OD2 2.93Å; R66-D82 IonicContact NH2-OD1 3.18Å; R66-D82 PolarHBondContact NH2-OD1 2.82Å; R66-D82 IonicContact NH2-OD2 3.73Å; R66-D82 PolarHBondContact NH2-OD2 3.41Å
67	A	97.5	Very high	95	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.6	-43.7	174.5	0	0	0	0	0	112.7	L63 Y64 Y70 L71 A79 D82 L83	L63-A67 WeakPolarHBondContact O-CB 3.4Å; L63-A67 PolarHBondContact O-N 3.26Å; Y64-A67 WeakPolarHBondContact O-CB 3.19Å; Y64-A67 PolarHBondContact O-N 3.48Å; A67-Y70 WeakPolarHBondContact O-CB 3.48Å; A67-Y70 PolarHBondContact O-N 3.44Å; A67-L71 WeakPolarHBondContact O-CG 3.39Å; A67-L71 PolarHBondContact O-N 2.91Å; A67-A79 HydrophobicContact CB-CB 4.26Å; A67-D82 HydrophobicContact CB-CB 3.81Å; A67-L83 HydrophobicContact CB-CD2 3.86Å; A67-L83 HydrophobicContact CB-CG 3.88Å
68	T	95.7	Very high	95	Very high	36 Å²	36	48.4 Å²	48.4	22%	0.221	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-37	176.8	56.6	0	0	0	0	111.9	Y64 R65 R66 L71 A72	Y64-T68 HydrophobicContact CD1-CG2 4.46Å; Y64-T68 HydrophobicContact CD2-CG2 4.45Å; Y64-T68 HydrophobicContact CE1-CG2 4.04Å; Y64-T68 HydrophobicContact CE2-CG2 4.04Å; Y64-T68 WeakPolarHBondContact O-CG2 3.5Å; Y64-T68 PolarHBondContact O-N 3.36Å; Y64-T68 PolarHBondContact O-OG1 2.97Å; R65-T68 WeakPolarHBondContact CA-OG1 3.32Å; R65-T68 PolarHBondContact O-N 3.39Å; R65-T68 PolarHBondContact O-OG1 3.32Å; R66-T68 PolarHBondContact O-N 3.28Å; T68-L71 PolarHBondContact O-N 3.3Å; T68-A72 WeakPolarHBondContact O-CB 3.34Å; T68-A72 PolarHBondContact O-N 3.49Å
69	A	96.6	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.3	-42.7	172	0	0	0	0	0	111.9	L37 I46 Y49 R65 R66 L71 A72 N73	L37-A69 HydrophobicContact CD1-CB 3.74Å; I46-A69 HydrophobicContact CD1-CB 4.44Å; I46-A69 HydrophobicContact CG1-CB 3.7Å; Y49-A69 HydrophobicContact CD2-CB 4.33Å; Y49-A69 HydrophobicContact CE2-CB 4.21Å; R65-A69 WeakPolarHBondContact O-CB 3.39Å; R65-A69 PolarHBondContact O-N 3.24Å; R66-A69 WeakPolarHBondContact O-CB 3.49Å; R66-A69 PolarHBondContact O-N 2.81Å; A69-L71 VanDerWaalsContact C-N 3.34Å; A69-L71 PolarHBondContact O-N 3.01Å; A69-A72 PolarHBondContact O-N 3.18Å; A69-N73 WeakPolarHBondContact O-CB 3.47Å; A69-N73 PolarHBondContact O-N 3.13Å
70	Y	97.4	Very high	95.1	Very high	33 Å²	33	43.8 Å²	43.8	13%	0.129	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-43.1	172.8	-79.1	-51.4	0	0	0	112.3	I46 R66 A67 N73 G74 R75	I46-Y70 HydrophobicContact CD1-CD1 3.58Å; I46-Y70 HydrophobicContact CD1-CE1 3.75Å; I46-Y70 HydrophobicContact CD1-CG 4.35Å; I46-Y70 HydrophobicContact CG1-CD1 4.23Å; I46-Y70 HydrophobicContact CG1-CE1 4.21Å; I46-Y70 HydrophobicContact CG2-CE1 3.85Å; R66-Y70 HydrophobicContact CG-CD2 4Å; R66-Y70 HydrophobicContact CG-CE2 3.56Å; R66-Y70 VanDerWaalsContact O-CD2 3.29Å; R66-Y70 WeakPolarHBondContact O-CD2 3.21Å; R66-Y70 PolarHBondContact O-N 3.39Å; A67-Y70 WeakPolarHBondContact O-CB 3.48Å; A67-Y70 PolarHBondContact O-N 3.44Å; Y70-N73 CarbonylContact O-C 3.45Å; Y70-N73 PolarHBondContact O-N 3.02Å; Y70-G74 PolarHBondContact O-N 3.44Å; Y70-R75 HydrophobicContact CD1-CB 4.13Å; Y70-R75 WeakPolarHBondContact O-CA 3.46Å; Y70-R75 PolarHBondContact O-N 3.09Å
71	L	94.3	Very high	95.1	Very high	42 Å²	42	43.9 Å²	43.9	22%	0.22	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-42.2	178.2	-70.1	168.3	0	0	0	112.3	A67 T68 A69 N73 G74 A76 A79 Q99 I103	A67-L71 WeakPolarHBondContact O-CG 3.39Å; A67-L71 PolarHBondContact O-N 2.91Å; T68-L71 PolarHBondContact O-N 3.3Å; A69-L71 VanDerWaalsContact C-N 3.34Å; A69-L71 PolarHBondContact O-N 3.01Å; L71-N73 VanDerWaalsContact C-N 3.26Å; L71-N73 PolarHBondContact O-N 3.15Å; L71-G74 PolarHBondContact O-N 3.27Å; L71-A76 HydrophobicContact CD2-CB 3.91Å; L71-A79 HydrophobicContact CD1-CB 4.46Å; L71-A79 HydrophobicContact CD2-CB 4.02Å; L71-A79 HydrophobicContact CG-CB 3.84Å; L71-Q99 HydrophobicContact CD1-CB 4.32Å; L71-Q99 HydrophobicContact CD1-CG 4.47Å; L71-I103 HydrophobicContact CD1-CD1 4.23Å; L71-I103 HydrophobicContact CD2-CD1 3.57Å; L71-I103 HydrophobicContact CD2-CG1 3.88Å; L71-I103 HydrophobicContact CG-CD1 4.41Å
72	A	93.8	Very high	95.2	Very high	50 Å²	50	41.1 Å²	41.1	41%	0.413	22%	0.222	S	C	.	.	H	α-helix	trans	-63.7	-34.1	175	0	0	0	0	0	111.9	F42 T68 A69 G74	F42-A72 HydrophobicContact CD1-CB 3.63Å; F42-A72 HydrophobicContact CD2-CB 4.45Å; F42-A72 HydrophobicContact CE1-CB 3.47Å; F42-A72 VanDerWaalsContact CE1-CB 3.47Å; F42-A72 HydrophobicContact CE2-CB 4.3Å; F42-A72 WeakPolarHBondContact CE2-O 3.45Å; F42-A72 HydrophobicContact CG-CB 4.14Å; F42-A72 HydrophobicContact CZ-CB 3.83Å; T68-A72 WeakPolarHBondContact O-CB 3.34Å; T68-A72 PolarHBondContact O-N 3.49Å; A69-A72 PolarHBondContact O-N 3.18Å; A72-G74 PolarHBondContact O-N 3.5Å
73	N	93.8	Very high	95.2	Very high	45 Å²	45	41 Å²	41	24%	0.241	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	6.5	173.5	-153.8	10.1	0	0	0	114	F42 I46 A69 Y70 L71 R75	F42-N73 HydrophobicContact CB-CB 3.72Å; F42-N73 HydrophobicContact CD2-CB 4.3Å; F42-N73 HydrophobicContact CG-CB 4.27Å; I46-N73 HydrophobicContact CD1-CB 4.4Å; A69-N73 WeakPolarHBondContact O-CB 3.47Å; A69-N73 PolarHBondContact O-N 3.13Å; Y70-N73 CarbonylContact O-C 3.45Å; Y70-N73 PolarHBondContact O-N 3.02Å; L71-N73 VanDerWaalsContact C-N 3.26Å; L71-N73 PolarHBondContact O-N 3.15Å; N73-R75 HydrophobicContact CB-CG 4.4Å; N73-R75 PolarHBondContact ND2-NE 2.96Å; N73-R75 PolarHBondContact O-N 3.42Å
74	G	90.3	Very high	95.2	Very high	61 Å²	61	43.1 Å²	43.1	63%	0.629	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	6.5	-178.3	0	0	0	0	0	115.3	Y70 L71 A72 A76	Y70-G74 PolarHBondContact O-N 3.44Å; L71-G74 PolarHBondContact O-N 3.27Å; A72-G74 PolarHBondContact O-N 3.5Å; G74-A76 VanDerWaalsContact C-N 3.35Å; G74-A76 PolarHBondContact O-N 3.22Å
75	R	91.3	Very high	95.2	Very high	128 Å²	128	45.6 Å²	45.6	48%	0.483	24%	0.242	S	C	.	.			trans	-92.3	56.3	-177.4	-60.3	-175.6	-175.1	-176	1.6	111.8	Y70 N73 K77 S78 A79	Y70-R75 HydrophobicContact CD1-CB 4.13Å; Y70-R75 WeakPolarHBondContact O-CA 3.46Å; Y70-R75 PolarHBondContact O-N 3.09Å; N73-R75 HydrophobicContact CB-CG 4.4Å; N73-R75 PolarHBondContact ND2-NE 2.96Å; N73-R75 PolarHBondContact O-N 3.42Å; R75-K77 VanDerWaalsContact C-N 3.26Å; R75-K77 PolarHBondContact O-N 3.35Å; R75-K77 VanDerWaalsContact O-N 3.16Å; R75-S78 WeakPolarHBondContact O-CB 3.32Å; R75-S78 PolarHBondContact O-N 2.84Å; R75-A79 PolarHBondContact O-N 3.04Å
76	A	91.1	Very high	95.2	Very high	7 Å²	7	42 Å²	42	6%	0.058	23%	0.228	C	C	.	.	H	α-helix	trans	-58.7	-32.2	-174.2	0	0	0	0	0	114.6	L71 G74 S78 A79 I103 W157	L71-A76 HydrophobicContact CD2-CB 3.91Å; G74-A76 VanDerWaalsContact C-N 3.35Å; G74-A76 PolarHBondContact O-N 3.22Å; A76-S78 VanDerWaalsContact C-N 3.34Å; A76-S78 PolarHBondContact O-N 3.37Å; A76-A79 PolarHBondContact O-N 2.92Å; A76-I103 HydrophobicContact CB-CG2 4.34Å; A76-W157 HydrophobicContact CB-CE3 4.07Å; A76-W157 HydrophobicContact CB-CH2 3.34Å; A76-W157 HydrophobicContact CB-CZ2 4.15Å; A76-W157 HydrophobicContact CB-CZ3 3.3Å
77	K	90.3	Very high	95.2	Very high	114 Å²	114	40.4 Å²	40.4	50%	0.496	22%	0.224	S	C	.	.	H	α-helix	trans	-62.2	-39.6	174.4	-74.2	-175.4	168.2	-164.6	0	112.8	R75 A79 I80 P81 L188	R75-K77 VanDerWaalsContact C-N 3.26Å; R75-K77 PolarHBondContact O-N 3.35Å; R75-K77 VanDerWaalsContact O-N 3.16Å; K77-A79 VanDerWaalsContact C-N 3.26Å; K77-A79 PolarHBondContact O-N 2.94Å; K77-I80 PolarHBondContact O-N 2.91Å; K77-P81 WeakPolarHBondContact O-CD 3.27Å; K77-L188 WeakPolarHBondContact CE-O 3.48Å; K77-L188 PolarHBondContact NZ-O 3.46Å
78	S	93.6	Very high	95.1	Very high	53 Å²	53	46.3 Å²	46.3	37%	0.371	25%	0.251	S	S	.	.	H	α-helix	trans	-71	-22.4	179.4	-56.4	0	0	0	0	112.5	R75 A76 P81	R75-S78 WeakPolarHBondContact O-CB 3.32Å; R75-S78 PolarHBondContact O-N 2.84Å; A76-S78 VanDerWaalsContact C-N 3.34Å; A76-S78 PolarHBondContact O-N 3.37Å; S78-P81 WeakPolarHBondContact O-CD 3.44Å
79	A	96.3	Very high	95.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-77.2	-25.7	177.8	0	0	0	0	0	113.6	A67 L71 R75 A76 K77 D82 L83 I103	A67-A79 HydrophobicContact CB-CB 4.26Å; L71-A79 HydrophobicContact CD1-CB 4.46Å; L71-A79 HydrophobicContact CD2-CB 4.02Å; L71-A79 HydrophobicContact CG-CB 3.84Å; R75-A79 PolarHBondContact O-N 3.04Å; A76-A79 PolarHBondContact O-N 2.92Å; K77-A79 VanDerWaalsContact C-N 3.26Å; K77-A79 PolarHBondContact O-N 2.94Å; A79-D82 PolarHBondContact O-N 3.31Å; A79-L83 HydrophobicContact CB-CD1 4.37Å; A79-L83 VanDerWaalsContact O-CG 3.28Å; A79-L83 WeakPolarHBondContact O-CG 3.47Å; A79-L83 PolarHBondContact O-N 3.37Å; A79-I103 HydrophobicContact CB-CD1 4.44Å
80	I	96	Very high	95.1	Very high	30 Å²	30	50.9 Å²	50.9	15%	0.154	27%	0.271	C	S	.	.	H	α-helix	trans	-61	-47.1	-174.2	-68.7	170	0	0	0	113	K77 D82 L83 N84 I103	K77-I80 PolarHBondContact O-N 2.91Å; I80-D82 VanDerWaalsContact C-N 3.31Å; I80-D82 PolarHBondContact O-N 3.3Å; I80-L83 PolarHBondContact O-N 3.26Å; I80-N84 WeakPolarHBondContact O-CB 3.38Å; I80-N84 VanDerWaalsContact O-CG 3.3Å; I80-N84 PolarHBondContact O-N 3.26Å; I80-I103 HydrophobicContact CD1-CG2 3.73Å; I80-I103 HydrophobicContact CG1-CD1 4.49Å; I80-I103 HydrophobicContact CG1-CG2 3.87Å
81	P	96.6	Very high	94.9	Very high	79 Å²	79	52.9 Å²	52.9	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-57.5	-43.4	178.3	-25.8	35.4	0	0	0	112.7	K77 S78 N84 R85	K77-P81 WeakPolarHBondContact O-CD 3.27Å; S78-P81 WeakPolarHBondContact O-CD 3.44Å; P81-N84 WeakPolarHBondContact O-CB 3.38Å; P81-N84 PolarHBondContact O-N 3.44Å; P81-R85 PolarHBondContact O-N 2.91Å
82	D	97.3	Very high	94.8	Very high	9 Å²	9	54.3 Å²	54.3	5%	0.048	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-46.5	177.2	-69.8	-2.3	0	0	0	111.2	R66 A67 A79 I80 N84 R85 V86	R66-D82 IonicContact CZ-OD1 3.36Å; R66-D82 IonicContact CZ-OD2 2.72Å; R66-D82 IonicContact NE-OD1 2.71Å; R66-D82 IonicContact NE-OD2 3.3Å; R66-D82 PolarHBondContact NE-OD2 2.93Å; R66-D82 IonicContact NH2-OD1 3.18Å; R66-D82 PolarHBondContact NH2-OD1 2.82Å; R66-D82 IonicContact NH2-OD2 3.73Å; R66-D82 PolarHBondContact NH2-OD2 3.41Å; A67-D82 HydrophobicContact CB-CB 3.81Å; A79-D82 PolarHBondContact O-N 3.31Å; I80-D82 VanDerWaalsContact C-N 3.31Å; I80-D82 PolarHBondContact O-N 3.3Å; D82-N84 VanDerWaalsContact C-N 3.31Å; D82-N84 PolarHBondContact O-N 3Å; D82-R85 PolarHBondContact O-N 3.31Å; D82-V86 VanDerWaalsContact O-CG2 3.26Å; D82-V86 WeakPolarHBondContact O-CG2 3.39Å; D82-V86 PolarHBondContact O-N 3.36Å
83	L	97.8	Very high	94.7	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-37	178	-67.9	169.9	0	0	0	112.2	Y64 A67 A79 I80 V86 V87 A96 Q99 R100 I103	Y64-L83 HydrophobicContact CD2-CD2 4.12Å; Y64-L83 HydrophobicContact CE2-CD2 4.34Å; A67-L83 HydrophobicContact CB-CD2 3.86Å; A67-L83 HydrophobicContact CB-CG 3.88Å; A79-L83 HydrophobicContact CB-CD1 4.37Å; A79-L83 VanDerWaalsContact O-CG 3.28Å; A79-L83 WeakPolarHBondContact O-CG 3.47Å; A79-L83 PolarHBondContact O-N 3.37Å; I80-L83 PolarHBondContact O-N 3.26Å; L83-V86 PolarHBondContact O-N 2.82Å; L83-V87 WeakPolarHBondContact O-CB 3.49Å; L83-V87 VanDerWaalsContact O-CG2 3.26Å; L83-V87 WeakPolarHBondContact O-CG2 3.46Å; L83-V87 PolarHBondContact O-N 3.34Å; L83-A96 HydrophobicContact CD2-CB 3.91Å; L83-Q99 HydrophobicContact CD1-CB 4.04Å; L83-Q99 HydrophobicContact CD2-CB 4.07Å; L83-R100 HydrophobicContact CB-CB 4.21Å; L83-R100 HydrophobicContact CD1-CB 4.23Å; L83-I103 HydrophobicContact CD1-CD1 3.47Å; L83-I103 VanDerWaalsContact CD1-CD1 3.47Å
84	N	97.5	Very high	94.7	Very high	54 Å²	54	53.2 Å²	53.2	29%	0.289	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-49.8	172.9	-74.2	-17.9	0	0	0	110.6	I80 P81 D82 V86 V87 E88 R100	I80-N84 WeakPolarHBondContact O-CB 3.38Å; I80-N84 VanDerWaalsContact O-CG 3.3Å; I80-N84 PolarHBondContact O-N 3.26Å; P81-N84 WeakPolarHBondContact O-CB 3.38Å; P81-N84 PolarHBondContact O-N 3.44Å; D82-N84 VanDerWaalsContact C-N 3.31Å; D82-N84 PolarHBondContact O-N 3Å; N84-V86 VanDerWaalsContact C-N 3.34Å; N84-V86 PolarHBondContact O-N 2.65Å; N84-V87 PolarHBondContact O-N 3.1Å; N84-V87 VanDerWaalsContact O-N 3.16Å; N84-E88 WeakPolarHBondContact O-CG 3.21Å; N84-E88 PolarHBondContact O-N 2.9Å; N84-R100 WeakPolarHBondContact OD1-CD 3.14Å; N84-R100 PolarHBondContact OD1-NH1 3.29Å
85	R	97.4	Very high	94.8	Very high	95 Å²	95	52 Å²	52	36%	0.358	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-40.5	179.5	-171.9	61.3	179.1	165.7	-0.6	112.2	D58 L63 P81 D82 V87 E88 L89	D58-R85 IonicContact OD1-CZ 2.65Å; D58-R85 IonicContact OD1-NE 2.67Å; D58-R85 IonicContact OD1-NH2 3.66Å; D58-R85 PolarHBondContact OD1-NH2 2.93Å; L63-R85 HydrophobicContact CD1-CB 3.98Å; L63-R85 HydrophobicContact CD1-CG 3.42Å; L63-R85 VanDerWaalsContact CD1-CG 3.42Å; P81-R85 PolarHBondContact O-N 2.91Å; D82-R85 PolarHBondContact O-N 3.31Å; R85-V87 PolarHBondContact O-N 3.49Å; R85-E88 IonicContact NH1-OE2 3.73Å; R85-E88 PolarHBondContact NH1-OE2 3.23Å; R85-E88 WeakPolarHBondContact O-CB 3.4Å; R85-E88 PolarHBondContact O-N 3.28Å; R85-L89 HydrophobicContact CG-CD1 3.93Å; R85-L89 HydrophobicContact CG-CG 4.4Å; R85-L89 WeakPolarHBondContact O-CB 3.23Å; R85-L89 VanDerWaalsContact O-CG 3.3Å; R85-L89 WeakPolarHBondContact O-CG 3.42Å; R85-L89 PolarHBondContact O-N 3.46Å
86	V	98	Very high	94.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-43.1	175	174.9	0	0	0	0	111.6	Y60 L63 D82 L83 N84 E88 L89 K90 F93 A96	Y60-V86 HydrophobicContact CD2-CG1 4.24Å; Y60-V86 WeakPolarHBondContact O-CG2 3.38Å; L63-V86 HydrophobicContact CB-CG2 3.51Å; L63-V86 HydrophobicContact CD1-CG2 4.46Å; D82-V86 VanDerWaalsContact O-CG2 3.26Å; D82-V86 WeakPolarHBondContact O-CG2 3.39Å; D82-V86 PolarHBondContact O-N 3.36Å; L83-V86 PolarHBondContact O-N 2.82Å; N84-V86 VanDerWaalsContact C-N 3.34Å; N84-V86 PolarHBondContact O-N 2.65Å; V86-E88 VanDerWaalsContact C-N 3.3Å; V86-E88 PolarHBondContact O-N 3.06Å; V86-L89 PolarHBondContact O-N 3.16Å; V86-K90 PolarHBondContact O-N 3.25Å; V86-F93 HydrophobicContact CG1-CD1 3.52Å; V86-F93 HydrophobicContact CG1-CE1 4.11Å; V86-F93 HydrophobicContact CG1-CG 4.44Å; V86-A96 HydrophobicContact CB-CB 4.04Å; V86-A96 HydrophobicContact CG1-CB 3.46Å; V86-A96 VanDerWaalsContact CG1-CB 3.46Å
87	V	96.2	Very high	95.1	Very high	12 Å²	12	46.8 Å²	46.8	7%	0.073	24%	0.244	C	C	.	.	H	α-helix	trans	-68.5	-30.2	178.7	170.3	0	0	0	0	111.9	L83 N84 R85 P91 A96 R97	L83-V87 WeakPolarHBondContact O-CB 3.49Å; L83-V87 VanDerWaalsContact O-CG2 3.26Å; L83-V87 WeakPolarHBondContact O-CG2 3.46Å; L83-V87 PolarHBondContact O-N 3.34Å; N84-V87 PolarHBondContact O-N 3.1Å; N84-V87 VanDerWaalsContact O-N 3.16Å; R85-V87 PolarHBondContact O-N 3.49Å; V87-P91 VanDerWaalsContact O-CA 3.31Å; V87-P91 WeakPolarHBondContact O-CA 3.49Å; V87-A96 HydrophobicContact CG2-CB 4.28Å; V87-R97 VanDerWaalsContact CG1-NH2 3.31Å; V87-R97 HydrophobicContact CG2-CB 4.16Å
88	E	96.6	Very high	95.1	Very high	124 Å²	124	43.5 Å²	43.5	58%	0.579	23%	0.232	S	C	*	.	H	α-helix	trans	-69.7	-49.7	171.7	-72	167.4	-167.9	0	0	112	N84 R85 V86	N84-E88 WeakPolarHBondContact O-CG 3.21Å; N84-E88 PolarHBondContact O-N 2.9Å; R85-E88 IonicContact NH1-OE2 3.73Å; R85-E88 PolarHBondContact NH1-OE2 3.23Å; R85-E88 WeakPolarHBondContact O-CB 3.4Å; R85-E88 PolarHBondContact O-N 3.28Å; V86-E88 VanDerWaalsContact C-N 3.3Å; V86-E88 PolarHBondContact O-N 3.06Å
89	L	97.2	Very high	95.2	Very high	61 Å²	61	44.1 Å²	44.1	32%	0.319	23%	0.229	S	C	.	.	H	α-helix	trans	-69.3	-36.7	-178.4	-69	170.3	0	0	0	112.6	D58 L63 R85 V86	D58-L89 HydrophobicContact CB-CD2 4.46Å; D58-L89 WeakPolarHBondContact O-CD1 3.1Å; L63-L89 HydrophobicContact CD1-CD1 3.78Å; R85-L89 HydrophobicContact CG-CD1 3.93Å; R85-L89 HydrophobicContact CG-CG 4.4Å; R85-L89 WeakPolarHBondContact O-CB 3.23Å; R85-L89 VanDerWaalsContact O-CG 3.3Å; R85-L89 WeakPolarHBondContact O-CG 3.42Å; R85-L89 PolarHBondContact O-N 3.46Å; V86-L89 PolarHBondContact O-N 3.16Å
90	K	95.1	Very high	95.1	Very high	72 Å²	72	46 Å²	46	31%	0.313	24%	0.236	S	C	.	.			trans	-137.3	81.7	-176.9	-163.4	69.8	177.5	111.6	0	111.3	Y60 V86 D92 F93	Y60-K90 HydrophobicContact CD2-CB 4.09Å; Y60-K90 HydrophobicContact CD2-CG 4.43Å; Y60-K90 HydrophobicContact CE2-CB 4.4Å; Y60-K90 HydrophobicContact CE2-CG 4.25Å; Y60-K90 HydrophobicContact CG-CB 4.19Å; V86-K90 PolarHBondContact O-N 3.25Å; K90-D92 VanDerWaalsContact C-N 3.27Å; K90-D92 WeakPolarHBondContact CD-OD1 3.48Å; K90-D92 WeakPolarHBondContact CE-OD1 3.23Å; K90-D92 VanDerWaalsContact CG-OD1 3.28Å; K90-D92 WeakPolarHBondContact CG-OD1 3.33Å; K90-D92 IonicContact NZ-OD1 2.69Å; K90-D92 PolarHBondContact NZ-OD1 3.18Å; K90-D92 IonicContact NZ-OD2 3.02Å; K90-D92 PolarHBondContact NZ-OD2 3.13Å; K90-D92 PolarHBondContact O-N 2.94Å; K90-F93 HydrophobicContact CB-CB 4.02Å; K90-F93 HydrophobicContact CG-CB 3.81Å; K90-F93 VanDerWaalsContact O-CB 3.25Å; K90-F93 WeakPolarHBondContact O-CB 3.32Å; K90-F93 PolarHBondContact O-N 3.06Å
91	P	93.6	Very high	94.9	Very high	74 Å²	74	44.6 Å²	44.6	48%	0.481	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-25.9	-173	-27.4	36.1	0	0	0	116.4	V87 F93 R97	V87-P91 VanDerWaalsContact O-CA 3.31Å; V87-P91 WeakPolarHBondContact O-CA 3.49Å; P91-F93 VanDerWaalsContact C-N 3.33Å; P91-R97 PolarHBondContact O-NH2 3Å
92	D	91.1	Very high	94.6	Very high	73 Å²	73	43.2 Å²	43.2	39%	0.39	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-0.2	177.1	64.2	-32.2	0	0	0	113.3	K90 V94 L123	K90-D92 VanDerWaalsContact C-N 3.27Å; K90-D92 WeakPolarHBondContact CD-OD1 3.48Å; K90-D92 WeakPolarHBondContact CE-OD1 3.23Å; K90-D92 VanDerWaalsContact CG-OD1 3.28Å; K90-D92 WeakPolarHBondContact CG-OD1 3.33Å; K90-D92 IonicContact NZ-OD1 2.69Å; K90-D92 PolarHBondContact NZ-OD1 3.18Å; K90-D92 IonicContact NZ-OD2 3.02Å; K90-D92 PolarHBondContact NZ-OD2 3.13Å; K90-D92 PolarHBondContact O-N 2.94Å; D92-V94 VanDerWaalsContact C-N 3.29Å; D92-V94 PolarHBondContact O-N 2.67Å; D92-L123 HydrophobicContact CB-CD2 4.43Å
93	F	92.7	Very high	94.4	Very high	45 Å²	45	43 Å²	43	20%	0.197	22%	0.216	C	C	.	.			trans	-77.3	80.2	177	-165.3	-120.3	0	0	0	111.6	Y60 M61 Y64 V86 K90 P91 A95 A96 R97	Y60-F93 HydrophobicContact CE2-CD2 4.28Å; Y60-F93 HydrophobicContact CE2-CE2 4.42Å; Y60-F93 HydrophobicContact CE2-CG 4.39Å; M61-F93 HydrophobicContact SD-CZ 4.32Å; Y64-F93 AromaticContact CD1-CE1 3.77Å; Y64-F93 HydrophobicContact CD1-CE1 3.77Å; Y64-F93 AromaticContact CD1-CZ 3.84Å; Y64-F93 HydrophobicContact CD1-CZ 3.84Å; Y64-F93 AromaticContact CD2-CE1 3.69Å; Y64-F93 HydrophobicContact CD2-CE1 3.69Å; Y64-F93 HydrophobicContact CE1-CE1 4.06Å; Y64-F93 AromaticContact CE1-CZ 3.97Å; Y64-F93 HydrophobicContact CE1-CZ 3.97Å; Y64-F93 AromaticContact CE2-CE1 3.98Å; Y64-F93 HydrophobicContact CE2-CE1 3.98Å; Y64-F93 AromaticContact CG-CE1 3.57Å; Y64-F93 HydrophobicContact CG-CE1 3.57Å; Y64-F93 HydrophobicContact CG-CZ 4.13Å; V86-F93 HydrophobicContact CG1-CD1 3.52Å; V86-F93 HydrophobicContact CG1-CE1 4.11Å; V86-F93 HydrophobicContact CG1-CG 4.44Å; K90-F93 HydrophobicContact CB-CB 4.02Å; K90-F93 HydrophobicContact CG-CB 3.81Å; K90-F93 VanDerWaalsContact O-CB 3.25Å; K90-F93 WeakPolarHBondContact O-CB 3.32Å; K90-F93 PolarHBondContact O-N 3.06Å; P91-F93 VanDerWaalsContact C-N 3.33Å; F93-A95 HydrophobicContact CE1-CB 4.17Å; F93-A95 HydrophobicContact CE2-CB 4.41Å; F93-A95 HydrophobicContact CZ-CB 4.03Å; F93-A95 PolarHBondContact O-N 3.08Å; F93-A95 VanDerWaalsContact O-N 3.12Å; F93-A96 HydrophobicContact CD1-CB 3.51Å; F93-A96 HydrophobicContact CE1-CB 3.93Å; F93-A96 PolarHBondContact O-N 3.16Å; F93-R97 PolarHBondContact O-N 3.09Å
94	V	92.2	Very high	94.1	Very high	26 Å²	26	43.9 Å²	43.9	16%	0.158	22%	0.221	C	C	.	.	H	α-helix	trans	-51.5	-37.7	-176.3	173.5	0	0	0	0	112.9	D92 A96 R97 L98 I120 L123 I132	D92-V94 VanDerWaalsContact C-N 3.29Å; D92-V94 PolarHBondContact O-N 2.67Å; V94-A96 PolarHBondContact O-N 3.34Å; V94-R97 PolarHBondContact O-N 2.95Å; V94-L98 WeakPolarHBondContact O-CB 3.36Å; V94-L98 PolarHBondContact O-N 2.9Å; V94-I120 HydrophobicContact CG1-CG1 4.27Å; V94-I120 HydrophobicContact CG1-CG2 3.83Å; V94-L123 HydrophobicContact CG2-CB 4.2Å; V94-L123 HydrophobicContact CG2-CD1 4.11Å; V94-I132 HydrophobicContact CG1-CD1 3.93Å
95	A	92	Very high	93.6	Very high	35 Å²	35	43.5 Å²	43.5	29%	0.289	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-42.1	-175.7	0	0	0	0	0	112.8	Y64 F93 Q99	Y64-A95 HydrophobicContact CE2-CB 4.45Å; F93-A95 HydrophobicContact CE1-CB 4.17Å; F93-A95 HydrophobicContact CE2-CB 4.41Å; F93-A95 HydrophobicContact CZ-CB 4.03Å; F93-A95 PolarHBondContact O-N 3.08Å; F93-A95 VanDerWaalsContact O-N 3.12Å; A95-Q99 VanDerWaalsContact O-CG 3.31Å; A95-Q99 WeakPolarHBondContact O-CG 3.38Å; A95-Q99 PolarHBondContact O-N 3.35Å; A95-Q99 VanDerWaalsContact O-N 3.16Å
96	A	94.7	Very high	93.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-42.7	175.9	0	0	0	0	0	111.8	Y64 L83 V86 V87 F93 V94 L98 Q99 R100	Y64-A96 HydrophobicContact CD2-CB 3.87Å; Y64-A96 HydrophobicContact CE2-CB 4.08Å; L83-A96 HydrophobicContact CD2-CB 3.91Å; V86-A96 HydrophobicContact CB-CB 4.04Å; V86-A96 HydrophobicContact CG1-CB 3.46Å; V86-A96 VanDerWaalsContact CG1-CB 3.46Å; V87-A96 HydrophobicContact CG2-CB 4.28Å; F93-A96 HydrophobicContact CD1-CB 3.51Å; F93-A96 HydrophobicContact CE1-CB 3.93Å; F93-A96 PolarHBondContact O-N 3.16Å; V94-A96 PolarHBondContact O-N 3.34Å; A96-L98 VanDerWaalsContact C-N 3.31Å; A96-L98 PolarHBondContact O-N 3.18Å; A96-Q99 PolarHBondContact O-N 2.66Å; A96-R100 PolarHBondContact O-N 3.47Å
97	R	94.5	Very high	92.9	Very high	27 Å²	27	45.8 Å²	45.8	10%	0.102	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-39.7	178	-164.6	178.5	-69.8	-91.7	9.6	112	V87 P91 F93 V94 R100 G101 D116 I120	V87-R97 VanDerWaalsContact CG1-NH2 3.31Å; V87-R97 HydrophobicContact CG2-CB 4.16Å; P91-R97 PolarHBondContact O-NH2 3Å; F93-R97 PolarHBondContact O-N 3.09Å; V94-R97 PolarHBondContact O-N 2.95Å; R97-R100 PolarHBondContact O-N 3.44Å; R97-G101 PolarHBondContact O-N 3.4Å; R97-D116 HydrophobicContact CG-CB 3.87Å; R97-D116 VanDerWaalsContact CG-OD1 3.26Å; R97-D116 WeakPolarHBondContact CG-OD1 3.38Å; R97-D116 IonicContact CZ-OD1 3.24Å; R97-D116 IonicContact NH1-OD1 3.04Å; R97-D116 PolarHBondContact NH1-OD1 2.86Å; R97-I120 HydrophobicContact CB-CD1 4.19Å; R97-I120 HydrophobicContact CB-CG1 4.12Å; R97-I120 HydrophobicContact CG-CD1 4.1Å; R97-I120 HydrophobicContact CG-CG1 3.98Å
98	L	91.6	Very high	92.4	Very high	45 Å²	45	45.6 Å²	45.6	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-63.9	-44.8	176.2	-177.2	65.8	0	0	0	111.4	V94 A96 R100 G101 N102 F117 I120 V134	V94-L98 WeakPolarHBondContact O-CB 3.36Å; V94-L98 PolarHBondContact O-N 2.9Å; A96-L98 VanDerWaalsContact C-N 3.31Å; A96-L98 PolarHBondContact O-N 3.18Å; L98-R100 VanDerWaalsContact C-N 3.34Å; L98-R100 PolarHBondContact O-N 2.96Å; L98-G101 PolarHBondContact O-N 3.22Å; L98-N102 WeakPolarHBondContact O-CB 3.4Å; L98-N102 PolarHBondContact O-N 2.97Å; L98-N102 PolarHBondContact O-ND2 3.27Å; L98-F117 HydrophobicContact CD1-CD1 4.45Å; L98-F117 HydrophobicContact CD1-CE1 4.12Å; L98-I120 HydrophobicContact CB-CD1 3.87Å; L98-I120 HydrophobicContact CD1-CD1 4.06Å; L98-V134 HydrophobicContact CD1-CG1 4.38Å
99	Q	93.9	Very high	92	Very high	65 Å²	65	43.1 Å²	43.1	30%	0.304	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-43.8	175.8	-68.2	-62.6	-13.6	0	0	111.2	Y64 L71 L83 A95 A96 N102 I103	Y64-Q99 HydrophobicContact CE2-CG 4.37Å; L71-Q99 HydrophobicContact CD1-CB 4.32Å; L71-Q99 HydrophobicContact CD1-CG 4.47Å; L83-Q99 HydrophobicContact CD1-CB 4.04Å; L83-Q99 HydrophobicContact CD2-CB 4.07Å; A95-Q99 VanDerWaalsContact O-CG 3.31Å; A95-Q99 WeakPolarHBondContact O-CG 3.38Å; A95-Q99 PolarHBondContact O-N 3.35Å; A95-Q99 VanDerWaalsContact O-N 3.16Å; A96-Q99 PolarHBondContact O-N 2.66Å; Q99-N102 PolarHBondContact O-N 3Å; Q99-I103 WeakPolarHBondContact O-CD1 3.44Å; Q99-I103 VanDerWaalsContact O-CG1 3.25Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 3.07Å; Q99-I103 VanDerWaalsContact O-N 3.07Å
100	R	95	Very high	91.4	Very high	40 Å²	40	43.1 Å²	43.1	15%	0.151	22%	0.223	C	C	.	.	H	α-helix	trans	-61.9	-50.1	176.9	-168.5	176.9	69.2	179.5	1.9	111.7	L83 N84 A96 R97 L98 N102 I103 L104 D116	L83-R100 HydrophobicContact CB-CB 4.21Å; L83-R100 HydrophobicContact CD1-CB 4.23Å; N84-R100 WeakPolarHBondContact OD1-CD 3.14Å; N84-R100 PolarHBondContact OD1-NH1 3.29Å; A96-R100 PolarHBondContact O-N 3.47Å; R97-R100 PolarHBondContact O-N 3.44Å; L98-R100 VanDerWaalsContact C-N 3.34Å; L98-R100 PolarHBondContact O-N 2.96Å; R100-N102 VanDerWaalsContact C-N 3.28Å; R100-N102 PolarHBondContact O-N 3.22Å; R100-I103 PolarHBondContact O-N 3.46Å; R100-I103 VanDerWaalsContact O-N 3.08Å; R100-L104 HydrophobicContact CG-CD1 3.89Å; R100-L104 HydrophobicContact CG-CG 4.29Å; R100-L104 VanDerWaalsContact O-CG 3.32Å; R100-L104 WeakPolarHBondContact O-CG 3.47Å; R100-L104 PolarHBondContact O-N 3.43Å; R100-D116 IonicContact CZ-OD1 3.13Å; R100-D116 IonicContact CZ-OD2 3.95Å; R100-D116 IonicContact NE-OD1 3.87Å; R100-D116 IonicContact NE-OD2 2.71Å; R100-D116 PolarHBondContact NE-OD2 3.46Å; R100-D116 VanDerWaalsContact NH2-CG 3.31Å; R100-D116 IonicContact NH2-OD1 3.04Å; R100-D116 PolarHBondContact NH2-OD1 3.11Å; R100-D116 IonicContact NH2-OD2 2.97Å; R100-D116 PolarHBondContact NH2-OD2 2.87Å
101	G	91.8	Very high	91	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56	-41	177	0	0	0	0	0	112.8	R97 L98 L104 L105 F117	R97-G101 PolarHBondContact O-N 3.4Å; L98-G101 PolarHBondContact O-N 3.22Å; G101-L104 PolarHBondContact O-N 3.17Å; G101-L105 WeakPolarHBondContact O-CB 3.39Å; G101-L105 PolarHBondContact O-N 3.09Å; G101-F117 VanDerWaalsContact C-CZ 3.45Å
102	N	90.3	Very high	90.8	Very high	51 Å²	51	43.8 Å²	43.8	27%	0.273	23%	0.229	S	C	.	.	H	α-helix	trans	-65.4	-38.9	176.3	-72.6	-22.5	0	0	0	113.1	L98 Q99 R100 K106	L98-N102 WeakPolarHBondContact O-CB 3.4Å; L98-N102 PolarHBondContact O-N 2.97Å; L98-N102 PolarHBondContact O-ND2 3.27Å; Q99-N102 PolarHBondContact O-N 3Å; R100-N102 VanDerWaalsContact C-N 3.28Å; R100-N102 PolarHBondContact O-N 3.22Å; N102-K106 WeakPolarHBondContact O-CG 3.43Å; N102-K106 PolarHBondContact O-N 3.43Å; N102-K106 VanDerWaalsContact O-N 3.09Å
103	I	92.5	Very high	90.7	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-67.7	-46.3	176.5	-63.6	159.2	0	0	0	110.2	L71 A76 A79 I80 L83 Q99 R100 L105 K106 Q107 W157	L71-I103 HydrophobicContact CD1-CD1 4.23Å; L71-I103 HydrophobicContact CD2-CD1 3.57Å; L71-I103 HydrophobicContact CD2-CG1 3.88Å; L71-I103 HydrophobicContact CG-CD1 4.41Å; A76-I103 HydrophobicContact CB-CG2 4.34Å; A79-I103 HydrophobicContact CB-CD1 4.44Å; I80-I103 HydrophobicContact CD1-CG2 3.73Å; I80-I103 HydrophobicContact CG1-CD1 4.49Å; I80-I103 HydrophobicContact CG1-CG2 3.87Å; L83-I103 HydrophobicContact CD1-CD1 3.47Å; L83-I103 VanDerWaalsContact CD1-CD1 3.47Å; Q99-I103 WeakPolarHBondContact O-CD1 3.44Å; Q99-I103 VanDerWaalsContact O-CG1 3.25Å; Q99-I103 WeakPolarHBondContact O-CG1 3.45Å; Q99-I103 PolarHBondContact O-N 3.07Å; Q99-I103 VanDerWaalsContact O-N 3.07Å; R100-I103 PolarHBondContact O-N 3.46Å; R100-I103 VanDerWaalsContact O-N 3.08Å; I103-L105 VanDerWaalsContact C-N 3.32Å; I103-L105 PolarHBondContact O-N 3.4Å; I103-K106 PolarHBondContact O-N 3.27Å; I103-K106 VanDerWaalsContact O-N 3.15Å; I103-Q107 WeakPolarHBondContact O-CG 3.28Å; I103-Q107 PolarHBondContact O-N 2.87Å; I103-W157 HydrophobicContact CG1-CZ3 4.45Å; I103-W157 HydrophobicContact CG2-CE3 4.45Å; I103-W157 HydrophobicContact CG2-CZ3 4.13Å
104	L	91.6	Very high	90.4	Very high	18 Å²	18	40.5 Å²	40.5	9%	0.094	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-43.3	177.8	-69.3	169	0	0	0	111.4	R100 G101 K106 Q107 G108 D109 A112 A113	R100-L104 HydrophobicContact CG-CD1 3.89Å; R100-L104 HydrophobicContact CG-CG 4.29Å; R100-L104 VanDerWaalsContact O-CG 3.32Å; R100-L104 WeakPolarHBondContact O-CG 3.47Å; R100-L104 PolarHBondContact O-N 3.43Å; G101-L104 PolarHBondContact O-N 3.17Å; L104-K106 PolarHBondContact O-N 3.2Å; L104-Q107 CarbonylContact O-C 3.17Å; L104-Q107 WeakPolarHBondContact O-CB 3.44Å; L104-Q107 PolarHBondContact O-N 3.03Å; L104-Q107 VanDerWaalsContact O-N 3.14Å; L104-G108 PolarHBondContact O-N 2.93Å; L104-D109 HydrophobicContact CB-CB 4.41Å; L104-D109 HydrophobicContact CD2-CB 4.21Å; L104-D109 PolarHBondContact O-N 3.29Å; L104-A112 HydrophobicContact CD1-CB 3.82Å; L104-A112 HydrophobicContact CD2-CB 4.29Å; L104-A113 HydrophobicContact CB-CB 3.87Å
105	L	88.5	Confident	90.3	Very high	45 Å²	45	46.3 Å²	46.3	24%	0.236	24%	0.236	C	C	.	.	H	α-helix	trans	-58.7	-47.2	173.9	-179.6	63.5	0	0	0	111.4	G101 I103 Q107 G108 L110 A113 F117 P135 M155	G101-L105 WeakPolarHBondContact O-CB 3.39Å; G101-L105 PolarHBondContact O-N 3.09Å; I103-L105 VanDerWaalsContact C-N 3.32Å; I103-L105 PolarHBondContact O-N 3.4Å; L105-Q107 VanDerWaalsContact C-N 3.26Å; L105-Q107 PolarHBondContact O-N 2.87Å; L105-G108 WeakPolarHBondContact O-CA 3.49Å; L105-G108 PolarHBondContact O-N 3.24Å; L105-L110 HydrophobicContact CD1-CD2 3.85Å; L105-A113 HydrophobicContact CB-CB 4.16Å; L105-F117 HydrophobicContact CD2-CE2 4.4Å; L105-P135 HydrophobicContact CD2-CB 3.81Å; L105-P135 HydrophobicContact CD2-CG 3.83Å; L105-M155 HydrophobicContact CD1-CE 4.23Å; L105-M155 WeakPolarHBondContact O-CG 3.28Å
106	K	89.6	Confident	90.2	Very high	90 Å²	90	44.8 Å²	44.8	39%	0.391	22%	0.223	S	C	.	.	H	α-helix	trans	-63.3	-31.2	177.1	-74.3	178.3	179.5	-178.9	0	112.9	N102 I103 L104 G108 M155 P156 W157 S158	N102-K106 WeakPolarHBondContact O-CG 3.43Å; N102-K106 PolarHBondContact O-N 3.43Å; N102-K106 VanDerWaalsContact O-N 3.09Å; I103-K106 PolarHBondContact O-N 3.27Å; I103-K106 VanDerWaalsContact O-N 3.15Å; L104-K106 PolarHBondContact O-N 3.2Å; K106-G108 VanDerWaalsContact C-N 3.27Å; K106-M155 CarbonylContact O-C 3.38Å; K106-M155 WeakPolarHBondContact O-CA 3.48Å; K106-P156 HydrophobicContact CG-CG 4.5Å; K106-W157 HydrophobicContact CB-CD2 3.91Å; K106-W157 HydrophobicContact CB-CE3 3.43Å; K106-W157 VanDerWaalsContact CB-CE3 3.43Å; K106-W157 HydrophobicContact CB-CG 4.4Å; K106-W157 HydrophobicContact CB-CZ3 3.91Å; K106-W157 HydrophobicContact CD-CD2 4.34Å; K106-W157 HydrophobicContact CD-CE3 3.92Å; K106-W157 HydrophobicContact CD-CH2 3.73Å; K106-W157 HydrophobicContact CD-CZ2 4.17Å; K106-W157 HydrophobicContact CD-CZ3 3.59Å; K106-W157 HydrophobicContact CG-CE3 4.32Å; K106-W157 HydrophobicContact CG-CZ3 4.4Å; K106-W157 CarbonylContact O-C 3.52Å; K106-W157 WeakPolarHBondContact O-CA 3.35Å; K106-W157 WeakPolarHBondContact O-CB 3.49Å; K106-W157 PolarHBondContact O-N 2.92Å; K106-S158 PolarHBondContact O-N 3.05Å
107	Q	90.3	Very high	89.9	Confident	54 Å²	54	45.4 Å²	45.4	25%	0.252	23%	0.225	S	C	.	.	H	α-helix	trans	-76.3	-14.6	173.2	-70.3	177	-16.5	0	0	112.9	I103 L104 L105 W157 S158	I103-Q107 WeakPolarHBondContact O-CG 3.28Å; I103-Q107 PolarHBondContact O-N 2.87Å; L104-Q107 CarbonylContact O-C 3.17Å; L104-Q107 WeakPolarHBondContact O-CB 3.44Å; L104-Q107 PolarHBondContact O-N 3.03Å; L104-Q107 VanDerWaalsContact O-N 3.14Å; L105-Q107 VanDerWaalsContact C-N 3.26Å; L105-Q107 PolarHBondContact O-N 2.87Å; Q107-W157 HydrophobicContact CG-CB 4.13Å; Q107-W157 HydrophobicContact CG-CE3 4.46Å; Q107-S158 WeakPolarHBondContact O-CA 3.49Å; Q107-S158 WeakPolarHBondContact O-CB 3.32Å; Q107-S158 PolarHBondContact O-OG 3.04Å; Q107-S158 VanDerWaalsContact O-OG 3.11Å
108	G	86.6	Confident	89.7	Confident	7 Å²	7	49.4 Å²	49.4	7%	0.072	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	19.5	-177.2	0	0	0	0	0	113.9	L104 L105 K106 L110	L104-G108 PolarHBondContact O-N 2.93Å; L105-G108 WeakPolarHBondContact O-CA 3.49Å; L105-G108 PolarHBondContact O-N 3.24Å; K106-G108 VanDerWaalsContact C-N 3.27Å; G108-L110 VanDerWaalsContact C-N 3.32Å; G108-L110 PolarHBondContact O-N 3.1Å
109	D	88.3	Confident	89.6	Confident	73 Å²	73	49.6 Å²	49.6	39%	0.39	25%	0.248	S	C	.	.			trans	-84.7	78.8	168.6	-170.6	-11.3	0	0	0	108.9	L104 A112 A113	L104-D109 HydrophobicContact CB-CB 4.41Å; L104-D109 HydrophobicContact CD2-CB 4.21Å; L104-D109 PolarHBondContact O-N 3.29Å; D109-A112 HydrophobicContact CB-CB 4.47Å; D109-A112 VanDerWaalsContact CG-CB 3.46Å; D109-A112 WeakPolarHBondContact OD1-CB 3.42Å; D109-A112 PolarHBondContact OD1-N 3.49Å; D109-A112 WeakPolarHBondContact OD2-CB 3.46Å; D109-A113 VanDerWaalsContact O-CB 3.27Å; D109-A113 WeakPolarHBondContact O-CB 3.21Å; D109-A113 PolarHBondContact O-N 2.89Å
110	L	84.4	Confident	89.3	Confident	61 Å²	61	46.5 Å²	46.5	32%	0.319	23%	0.234	S	C	.	.	H	α-helix	trans	-69.4	-37.5	-169.9	-55.6	-176.7	0	0	0	112.3	L105 G108 A113 E114 M155	L105-L110 HydrophobicContact CD1-CD2 3.85Å; G108-L110 VanDerWaalsContact C-N 3.32Å; G108-L110 PolarHBondContact O-N 3.1Å; L110-A113 PolarHBondContact O-N 3.38Å; L110-E114 WeakPolarHBondContact O-CB 3.41Å; L110-E114 PolarHBondContact O-N 3.18Å; L110-M155 HydrophobicContact CD1-CE 4.29Å; L110-M155 HydrophobicContact CD2-CE 3.42Å; L110-M155 VanDerWaalsContact CD2-CE 3.42Å; L110-M155 HydrophobicContact CD2-SD 3.8Å; L110-M155 HydrophobicContact CG-CE 4.45Å
111	D	86.4	Confident	88.8	Confident	129 Å²	129	48.6 Å²	48.6	69%	0.69	25%	0.247	S	C	*	.	H	α-helix	trans	-68.7	-44.1	-177.6	-60.3	-37.7	0	0	0	110.5	E114 K115	D111-E114 PolarHBondContact O-N 2.92Å; D111-K115 WeakPolarHBondContact O-CB 3.42Å; D111-K115 PolarHBondContact O-N 3.46Å
112	A	89.6	Confident	88.6	Confident	30 Å²	30	50.3 Å²	50.3	25%	0.248	27%	0.265	C	S	.	.	H	α-helix	trans	-68	-40.8	176.5	0	0	0	0	0	112.1	L104 D109 K115 D116	L104-A112 HydrophobicContact CD1-CB 3.82Å; L104-A112 HydrophobicContact CD2-CB 4.29Å; D109-A112 HydrophobicContact CB-CB 4.47Å; D109-A112 VanDerWaalsContact CG-CB 3.46Å; D109-A112 WeakPolarHBondContact OD1-CB 3.42Å; D109-A112 PolarHBondContact OD1-N 3.49Å; D109-A112 WeakPolarHBondContact OD2-CB 3.46Å; A112-K115 PolarHBondContact O-N 3.25Å; A112-D116 PolarHBondContact O-N 3.28Å; A112-D116 VanDerWaalsContact O-N 3.14Å
113	A	88.7	Confident	88.3	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-62.4	-45.4	175.3	0	0	0	0	0	111.8	L104 L105 D109 L110 K115 D116 F117	L104-A113 HydrophobicContact CB-CB 3.87Å; L105-A113 HydrophobicContact CB-CB 4.16Å; D109-A113 VanDerWaalsContact O-CB 3.27Å; D109-A113 WeakPolarHBondContact O-CB 3.21Å; D109-A113 PolarHBondContact O-N 2.89Å; L110-A113 PolarHBondContact O-N 3.38Å; A113-K115 VanDerWaalsContact C-N 3.35Å; A113-K115 PolarHBondContact O-N 2.89Å; A113-D116 PolarHBondContact O-N 2.83Å; A113-F117 HydrophobicContact CB-CD2 4.42Å; A113-F117 HydrophobicContact CB-CE2 3.96Å; A113-F117 WeakPolarHBondContact O-CD2 3.22Å; A113-F117 WeakPolarHBondContact O-CG 3.27Å; A113-F117 PolarHBondContact O-N 3.15Å
114	E	86.1	Confident	87.7	Confident	49 Å²	49	49.9 Å²	49.9	23%	0.229	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-45.8	176.8	178.1	171.7	-165.8	0	0	111.1	L110 D111 D116 F117 Q118 K137	L110-E114 WeakPolarHBondContact O-CB 3.41Å; L110-E114 PolarHBondContact O-N 3.18Å; D111-E114 PolarHBondContact O-N 2.92Å; E114-D116 VanDerWaalsContact C-N 3.27Å; E114-D116 PolarHBondContact O-N 2.91Å; E114-F117 PolarHBondContact O-N 2.94Å; E114-Q118 HydrophobicContact CG-CG 4.19Å; E114-Q118 WeakPolarHBondContact O-CB 3.45Å; E114-Q118 VanDerWaalsContact O-CG 3.3Å; E114-Q118 WeakPolarHBondContact O-CG 3.29Å; E114-Q118 PolarHBondContact O-N 3.02Å; E114-Q118 PolarHBondContact OE1-NE2 3.3Å; E114-Q118 VanDerWaalsContact OE1-NE2 3.14Å; E114-K137 VanDerWaalsContact CD-NZ 3.29Å; E114-K137 WeakPolarHBondContact OE1-CD 3.24Å; E114-K137 IonicContact OE1-NZ 2.63Å; E114-K137 PolarHBondContact OE1-NZ 3.22Å; E114-K137 VanDerWaalsContact OE2-CE 3.24Å; E114-K137 WeakPolarHBondContact OE2-CE 3.47Å; E114-K137 IonicContact OE2-NZ 2.65Å; E114-K137 PolarHBondContact OE2-NZ 3.16Å
115	K	90.5	Very high	87.1	Confident	148 Å²	148	54.1 Å²	54.1	64%	0.643	29%	0.29	S	S	*	.	H	α-helix	trans	-57.1	-41.7	176.4	-174.5	176.8	-179.1	177.2	0	112.1	D111 A112 A113 T119	D111-K115 WeakPolarHBondContact O-CB 3.42Å; D111-K115 PolarHBondContact O-N 3.46Å; A112-K115 PolarHBondContact O-N 3.25Å; A113-K115 VanDerWaalsContact C-N 3.35Å; A113-K115 PolarHBondContact O-N 2.89Å; K115-T119 WeakPolarHBondContact O-CB 3.38Å; K115-T119 PolarHBondContact O-N 3.37Å; K115-T119 PolarHBondContact O-OG1 3.11Å
116	D	90.1	Very high	86.6	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.011	32%	0.317	C	S	.	.	H	α-helix	trans	-66.8	-46.1	175.9	-89.4	-19.9	0	0	0	112.6	R97 R100 A112 A113 E114 Q118 T119 I120	R97-D116 HydrophobicContact CG-CB 3.87Å; R97-D116 VanDerWaalsContact CG-OD1 3.26Å; R97-D116 WeakPolarHBondContact CG-OD1 3.38Å; R97-D116 IonicContact CZ-OD1 3.24Å; R97-D116 IonicContact NH1-OD1 3.04Å; R97-D116 PolarHBondContact NH1-OD1 2.86Å; R100-D116 IonicContact CZ-OD1 3.13Å; R100-D116 IonicContact CZ-OD2 3.95Å; R100-D116 IonicContact NE-OD1 3.87Å; R100-D116 IonicContact NE-OD2 2.71Å; R100-D116 PolarHBondContact NE-OD2 3.46Å; R100-D116 VanDerWaalsContact NH2-CG 3.31Å; R100-D116 IonicContact NH2-OD1 3.04Å; R100-D116 PolarHBondContact NH2-OD1 3.11Å; R100-D116 IonicContact NH2-OD2 2.97Å; R100-D116 PolarHBondContact NH2-OD2 2.87Å; A112-D116 PolarHBondContact O-N 3.28Å; A112-D116 VanDerWaalsContact O-N 3.14Å; A113-D116 PolarHBondContact O-N 2.83Å; E114-D116 VanDerWaalsContact C-N 3.27Å; E114-D116 PolarHBondContact O-N 2.91Å; D116-Q118 PolarHBondContact O-N 3.35Å; D116-T119 PolarHBondContact O-N 3.31Å; D116-I120 VanDerWaalsContact O-CG1 3.25Å; D116-I120 WeakPolarHBondContact O-CG1 3.26Å; D116-I120 PolarHBondContact O-N 2.81Å
117	F	88.4	Confident	85.9	Confident	13 Å²	13	59.4 Å²	59.4	6%	0.057	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-39.9	178.5	-63.4	-42.6	0	0	0	112.4	L98 G101 L105 A113 E114 T119 I120 I121 V134 P135	L98-F117 HydrophobicContact CD1-CD1 4.45Å; L98-F117 HydrophobicContact CD1-CE1 4.12Å; G101-F117 VanDerWaalsContact C-CZ 3.45Å; L105-F117 HydrophobicContact CD2-CE2 4.4Å; A113-F117 HydrophobicContact CB-CD2 4.42Å; A113-F117 HydrophobicContact CB-CE2 3.96Å; A113-F117 WeakPolarHBondContact O-CD2 3.22Å; A113-F117 WeakPolarHBondContact O-CG 3.27Å; A113-F117 PolarHBondContact O-N 3.15Å; E114-F117 PolarHBondContact O-N 2.94Å; F117-T119 VanDerWaalsContact C-N 3.34Å; F117-T119 PolarHBondContact O-N 3.12Å; F117-I120 HydrophobicContact CD1-CD1 4.19Å; F117-I120 WeakPolarHBondContact O-CB 3.43Å; F117-I120 PolarHBondContact O-N 2.9Å; F117-I121 WeakPolarHBondContact O-CG1 3.35Å; F117-I121 PolarHBondContact O-N 2.63Å; F117-V134 HydrophobicContact CB-CB 3.95Å; F117-V134 HydrophobicContact CB-CG1 4.14Å; F117-V134 HydrophobicContact CB-CG2 4.2Å; F117-V134 HydrophobicContact CD1-CB 3.82Å; F117-V134 HydrophobicContact CD1-CG1 3.75Å; F117-V134 HydrophobicContact CG-CB 3.99Å; F117-V134 HydrophobicContact CG-CG1 4.26Å; F117-P135 HydrophobicContact CE1-CG 4.24Å; F117-P135 HydrophobicContact CE2-CB 4.26Å; F117-P135 HydrophobicContact CE2-CG 3.98Å; F117-P135 HydrophobicContact CZ-CB 4.48Å; F117-P135 HydrophobicContact CZ-CG 3.71Å
118	Q	89.1	Confident	84.9	Confident	112 Å²	112	65.9 Å²	65.9	52%	0.523	35%	0.347	S	S	.	.	H	α-helix	trans	-62.2	-42.2	173.6	-73.6	177.9	-2.2	0	0	111.6	E114 D116 I120 I121 G122	E114-Q118 HydrophobicContact CG-CG 4.19Å; E114-Q118 WeakPolarHBondContact O-CB 3.45Å; E114-Q118 VanDerWaalsContact O-CG 3.3Å; E114-Q118 WeakPolarHBondContact O-CG 3.29Å; E114-Q118 PolarHBondContact O-N 3.02Å; E114-Q118 PolarHBondContact OE1-NE2 3.3Å; E114-Q118 VanDerWaalsContact OE1-NE2 3.14Å; D116-Q118 PolarHBondContact O-N 3.35Å; Q118-I120 VanDerWaalsContact C-N 3.31Å; Q118-I120 PolarHBondContact O-N 3.24Å; Q118-I121 PolarHBondContact O-N 3.34Å; Q118-G122 PolarHBondContact O-N 2.88Å
119	T	89.9	Confident	83.7	Confident	48 Å²	48	71.4 Å²	71.4	29%	0.294	37%	0.369	S	S	.	.	H	α-helix	trans	-63.3	-39.8	175.8	-54.1	0	0	0	0	111.2	K115 D116 F117 G122 L123	K115-T119 WeakPolarHBondContact O-CB 3.38Å; K115-T119 PolarHBondContact O-N 3.37Å; K115-T119 PolarHBondContact O-OG1 3.11Å; D116-T119 PolarHBondContact O-N 3.31Å; F117-T119 VanDerWaalsContact C-N 3.34Å; F117-T119 PolarHBondContact O-N 3.12Å; T119-G122 PolarHBondContact O-N 3.48Å; T119-L123 HydrophobicContact CG2-CD1 4.18Å; T119-L123 HydrophobicContact CG2-CG 4.49Å; T119-L123 WeakPolarHBondContact O-CB 3.24Å; T119-L123 VanDerWaalsContact O-CG 3.31Å; T119-L123 WeakPolarHBondContact O-CG 3.3Å; T119-L123 PolarHBondContact O-N 3.36Å
120	I	87.8	Confident	82	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-62.5	-46.4	175.6	-70.3	165.4	0	0	0	111.1	V94 R97 L98 D116 F117 Q118 G122 L123 A124 I132 V134	V94-I120 HydrophobicContact CG1-CG1 4.27Å; V94-I120 HydrophobicContact CG1-CG2 3.83Å; R97-I120 HydrophobicContact CB-CD1 4.19Å; R97-I120 HydrophobicContact CB-CG1 4.12Å; R97-I120 HydrophobicContact CG-CD1 4.1Å; R97-I120 HydrophobicContact CG-CG1 3.98Å; L98-I120 HydrophobicContact CB-CD1 3.87Å; L98-I120 HydrophobicContact CD1-CD1 4.06Å; D116-I120 VanDerWaalsContact O-CG1 3.25Å; D116-I120 WeakPolarHBondContact O-CG1 3.26Å; D116-I120 PolarHBondContact O-N 2.81Å; F117-I120 HydrophobicContact CD1-CD1 4.19Å; F117-I120 WeakPolarHBondContact O-CB 3.43Å; F117-I120 PolarHBondContact O-N 2.9Å; Q118-I120 VanDerWaalsContact C-N 3.31Å; Q118-I120 PolarHBondContact O-N 3.24Å; I120-G122 VanDerWaalsContact C-N 3.33Å; I120-G122 PolarHBondContact O-N 3.37Å; I120-L123 PolarHBondContact O-N 3.15Å; I120-A124 VanDerWaalsContact O-CB 3.26Å; I120-A124 WeakPolarHBondContact O-CB 3.46Å; I120-A124 PolarHBondContact O-N 3.28Å; I120-I132 HydrophobicContact CG2-CB 4.38Å; I120-I132 HydrophobicContact CG2-CD1 4.41Å; I120-I132 HydrophobicContact CG2-CG2 3.35Å; I120-V134 HydrophobicContact CB-CG1 4.32Å; I120-V134 HydrophobicContact CG2-CG1 3.89Å
121	I	85.1	Confident	80.9	Confident	84 Å²	84	76.8 Å²	76.8	43%	0.431	41%	0.411	S	S	.	.	H	α-helix	trans	-59.2	-47.3	176.2	-67.5	164.2	0	0	0	109.8	F117 Q118 L123 A124 T125 V134	F117-I121 WeakPolarHBondContact O-CG1 3.35Å; F117-I121 PolarHBondContact O-N 2.63Å; Q118-I121 PolarHBondContact O-N 3.34Å; I121-L123 PolarHBondContact O-N 2.85Å; I121-A124 WeakPolarHBondContact O-CB 3.3Å; I121-A124 PolarHBondContact O-N 3.08Å; I121-A124 VanDerWaalsContact O-N 3.16Å; I121-T125 PolarHBondContact O-N 3.18Å; I121-T125 PolarHBondContact O-OG1 3.43Å; I121-V134 HydrophobicContact CD1-CG2 3.6Å; I121-V134 HydrophobicContact CG1-CG2 3.78Å
122	G	86.3	Confident	79.6	Confident	36 Å²	36	73 Å²	73	37%	0.371	39%	0.391	S	S	.	.	H	α-helix	trans	-57.6	-46.4	177.3	0	0	0	0	0	112.7	Q118 T119 I120 T125 M126	Q118-G122 PolarHBondContact O-N 2.88Å; T119-G122 PolarHBondContact O-N 3.48Å; I120-G122 VanDerWaalsContact C-N 3.33Å; I120-G122 PolarHBondContact O-N 3.37Å; G122-T125 PolarHBondContact O-N 3.31Å; G122-M126 WeakPolarHBondContact O-CB 3.32Å; G122-M126 WeakPolarHBondContact O-CG 3.47Å; G122-M126 PolarHBondContact O-N 2.91Å
123	L	84.6	Confident	78.3	Confident	38 Å²	38	78.9 Å²	78.9	20%	0.199	42%	0.416	C	S	.	.	H	α-helix	trans	-64.2	-39.7	175.3	-71.4	171	0	0	0	112.3	D92 V94 T119 I120 I121 M126 L127	D92-L123 HydrophobicContact CB-CD2 4.43Å; V94-L123 HydrophobicContact CG2-CB 4.2Å; V94-L123 HydrophobicContact CG2-CD1 4.11Å; T119-L123 HydrophobicContact CG2-CD1 4.18Å; T119-L123 HydrophobicContact CG2-CG 4.49Å; T119-L123 WeakPolarHBondContact O-CB 3.24Å; T119-L123 VanDerWaalsContact O-CG 3.31Å; T119-L123 WeakPolarHBondContact O-CG 3.3Å; T119-L123 PolarHBondContact O-N 3.36Å; I120-L123 PolarHBondContact O-N 3.15Å; I121-L123 PolarHBondContact O-N 2.85Å; L123-M126 PolarHBondContact O-N 3.34Å; L123-L127 VanDerWaalsContact O-CB 3.26Å; L123-L127 WeakPolarHBondContact O-CB 3.17Å; L123-L127 WeakPolarHBondContact O-CG 3.18Å; L123-L127 PolarHBondContact O-N 3.16Å
124	A	80.1	Confident	77	Confident	9 Å²	9	80 Å²	80	7%	0.074	42%	0.423	C	S	.	.	H	α-helix	trans	-61.7	-46.8	177.9	0	0	0	0	0	111.3	I120 I121 L127 K128 K129 I132	I120-A124 VanDerWaalsContact O-CB 3.26Å; I120-A124 WeakPolarHBondContact O-CB 3.46Å; I120-A124 PolarHBondContact O-N 3.28Å; I121-A124 WeakPolarHBondContact O-CB 3.3Å; I121-A124 PolarHBondContact O-N 3.08Å; I121-A124 VanDerWaalsContact O-N 3.16Å; A124-L127 PolarHBondContact O-N 3.02Å; A124-K128 PolarHBondContact O-N 3.33Å; A124-K128 VanDerWaalsContact O-N 3.1Å; A124-K129 WeakPolarHBondContact CB-O 3.48Å; A124-K129 PolarHBondContact O-N 3.36Å; A124-I132 HydrophobicContact CB-CB 4.38Å; A124-I132 HydrophobicContact CB-CD1 3.54Å; A124-I132 HydrophobicContact CB-CG1 4.4Å
125	T	79.6	Confident	75.8	Confident	107 Å²	107	80.2 Å²	80.2	66%	0.656	43%	0.429	S	S	*	.	H	α-helix	trans	-60.7	-46.2	174.8	-56.6	0	0	0	0	111.1	I121 G122 L127 K128	I121-T125 PolarHBondContact O-N 3.18Å; I121-T125 PolarHBondContact O-OG1 3.43Å; G122-T125 PolarHBondContact O-N 3.31Å; T125-L127 PolarHBondContact O-N 2.61Å; T125-K128 PolarHBondContact O-N 3.08Å
126	M	76.4	Confident	74.1	Confident	161 Å²	161	81.8 Å²	81.8	79%	0.793	44%	0.438	S	S	*	.	H	α-helix	trans	-63.9	-38.5	177.9	-72.1	-69.2	-74.1	0	0	112.9	G122 L123 K128	G122-M126 WeakPolarHBondContact O-CB 3.32Å; G122-M126 WeakPolarHBondContact O-CG 3.47Å; G122-M126 PolarHBondContact O-N 2.91Å; L123-M126 PolarHBondContact O-N 3.34Å; M126-K128 VanDerWaalsContact C-N 3.31Å; M126-K128 PolarHBondContact O-N 2.47Å
127	L	74.9	Confident	72.4	Confident	85 Å²	85	86.6 Å²	86.6	45%	0.445	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	3.2	-179	-65.9	173.3	0	0	0	113.7	L123 A124 T125 K129	L123-L127 VanDerWaalsContact O-CB 3.26Å; L123-L127 WeakPolarHBondContact O-CB 3.17Å; L123-L127 WeakPolarHBondContact O-CG 3.18Å; L123-L127 PolarHBondContact O-N 3.16Å; A124-L127 PolarHBondContact O-N 3.02Å; T125-L127 PolarHBondContact O-N 2.61Å; L127-K129 HydrophobicContact CB-CD 4.28Å; L127-K129 HydrophobicContact CB-CG 4.12Å; L127-K129 PolarHBondContact O-N 3.13Å; L127-K129 VanDerWaalsContact O-N 3.15Å
128	K	69.8	Low	70.6	Confident	190 Å²	190	90.6 Å²	90.6	83%	0.826	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	29.5	-172.4	-57.1	-178.5	-179.2	179.5	0	113.4	A124 T125 M126	A124-K128 PolarHBondContact O-N 3.33Å; A124-K128 VanDerWaalsContact O-N 3.1Å; T125-K128 PolarHBondContact O-N 3.08Å; M126-K128 VanDerWaalsContact C-N 3.31Å; M126-K128 PolarHBondContact O-N 2.47Å
129	K	61.9	Low	68.4	Low	124 Å²	124	93.5 Å²	93.5	54%	0.539	49%	0.492	S	S	.	.			trans	-94.2	105	176.4	-71.4	-176.7	179.3	179.4	0	108.7	A124 L127 I132	A124-K129 WeakPolarHBondContact CB-O 3.48Å; A124-K129 PolarHBondContact O-N 3.36Å; L127-K129 HydrophobicContact CB-CD 4.28Å; L127-K129 HydrophobicContact CB-CG 4.12Å; L127-K129 PolarHBondContact O-N 3.13Å; L127-K129 VanDerWaalsContact O-N 3.15Å; K129-I132 HydrophobicContact CB-CD1 4.41Å
130	T	52.8	Low	66.1	Low	146 Å²	146	95 Å²	95	90%	0.896	50%	0.498	S	S	*	.			trans	-86.6	-3.8	-173.4	48.1	0	0	0	0	114.8
131	S	60.6	Low	63.6	Low	101 Å²	101	100.5 Å²	100.5	71%	0.706	53%	0.531	S	S	*	.			trans	-100.7	8.9	-167.8	56.9	0	0	0	0	115.9	I133	S131-I133 PolarHBondContact O-N 3.27Å
132	I	60.1	Low	61.2	Low	49 Å²	49	102.1 Å²	102.1	25%	0.251	55%	0.545	S	S	.	.			trans	-87.1	106.8	-176.5	-59.5	162.2	0	0	0	110.4	V94 I120 A124 K129 V134	V94-I132 HydrophobicContact CG1-CD1 3.93Å; I120-I132 HydrophobicContact CG2-CB 4.38Å; I120-I132 HydrophobicContact CG2-CD1 4.41Å; I120-I132 HydrophobicContact CG2-CG2 3.35Å; A124-I132 HydrophobicContact CB-CB 4.38Å; A124-I132 HydrophobicContact CB-CD1 3.54Å; A124-I132 HydrophobicContact CB-CG1 4.4Å; K129-I132 HydrophobicContact CB-CD1 4.41Å; I132-V134 HydrophobicContact CG2-CG1 4.2Å
133	I	62.2	Low	59.6	Low	154 Å²	154	103.8 Å²	103.8	79%	0.79	55%	0.551	S	S	*	*			trans	-87.9	119.1	174.8	-56.9	172.6	0	0	0	108.4	S131	S131-I133 PolarHBondContact O-N 3.27Å
134	V	61.5	Low	58.2	Low	25 Å²	25	108 Å²	108	15%	0.152	57%	0.573	C	S	.	*			trans	-112.5	146.7	171.7	-65.1	0	0	0	0	110.5	L98 F117 I120 I121 I132 Q136	L98-V134 HydrophobicContact CD1-CG1 4.38Å; F117-V134 HydrophobicContact CB-CB 3.95Å; F117-V134 HydrophobicContact CB-CG1 4.14Å; F117-V134 HydrophobicContact CB-CG2 4.2Å; F117-V134 HydrophobicContact CD1-CB 3.82Å; F117-V134 HydrophobicContact CD1-CG1 3.75Å; F117-V134 HydrophobicContact CG-CB 3.99Å; F117-V134 HydrophobicContact CG-CG1 4.26Å; I120-V134 HydrophobicContact CB-CG1 4.32Å; I120-V134 HydrophobicContact CG2-CG1 3.89Å; I121-V134 HydrophobicContact CD1-CG2 3.6Å; I121-V134 HydrophobicContact CG1-CG2 3.78Å; I132-V134 HydrophobicContact CG2-CG1 4.2Å; V134-Q136 PolarHBondContact O-N 3.23Å
135	P	60.5	Low	57	Low	53 Å²	53	113.7 Å²	113.7	34%	0.344	59%	0.592	S	S	.	*			trans	-57.7	128	174.7	-21.7	32.7	0	0	0	111.3	L105 F117	L105-P135 HydrophobicContact CD2-CB 3.81Å; L105-P135 HydrophobicContact CD2-CG 3.83Å; F117-P135 HydrophobicContact CE1-CG 4.24Å; F117-P135 HydrophobicContact CE2-CB 4.26Å; F117-P135 HydrophobicContact CE2-CG 3.98Å; F117-P135 HydrophobicContact CZ-CB 4.48Å; F117-P135 HydrophobicContact CZ-CG 3.71Å
136	Q	54.2	Low	56	Low	181 Å²	181	116.6 Å²	116.6	85%	0.846	59%	0.593	S	S	*	*			trans	-76.9	150.9	173.6	-79.6	179.6	-6.4	0	0	111.6	V134 V138	V134-Q136 PolarHBondContact O-N 3.23Å; Q136-V138 PolarHBondContact O-N 2.8Å
137	K	54.5	Low	55.6	Low	103 Å²	103	111 Å²	111	45%	0.448	56%	0.562	S	S	.	*			trans	-62.8	115	-179	-168.3	162	-179.1	173.1	0	110.8	E114 Y139	E114-K137 VanDerWaalsContact CD-NZ 3.29Å; E114-K137 WeakPolarHBondContact OE1-CD 3.24Å; E114-K137 IonicContact OE1-NZ 2.63Å; E114-K137 PolarHBondContact OE1-NZ 3.22Å; E114-K137 VanDerWaalsContact OE2-CE 3.24Å; E114-K137 WeakPolarHBondContact OE2-CE 3.47Å; E114-K137 IonicContact OE2-NZ 2.65Å; E114-K137 PolarHBondContact OE2-NZ 3.16Å; K137-Y139 HydrophobicContact CB-CD2 4.32Å; K137-Y139 HydrophobicContact CB-CE2 4.05Å; K137-Y139 HydrophobicContact CD-CD2 4.28Å; K137-Y139 HydrophobicContact CD-CE1 4.08Å; K137-Y139 HydrophobicContact CD-CE2 3.5Å; K137-Y139 WeakPolarHBondContact CD-OH 3.21Å; K137-Y139 WeakPolarHBondContact CE-OH 3.5Å; K137-Y139 HydrophobicContact CG-CD2 3.91Å; K137-Y139 HydrophobicContact CG-CE1 4.47Å; K137-Y139 HydrophobicContact CG-CE2 3.63Å; K137-Y139 HydrophobicContact CG-CG 4.47Å; K137-Y139 PolarHBondContact NZ-OH 3.3Å; K137-Y139 VanDerWaalsContact NZ-OH 3.12Å; K137-Y139 PolarHBondContact O-N 3.42Å
138	V	50.1	Low	55.8	Low	97 Å²	97	107.6 Å²	107.6	59%	0.588	55%	0.545	S	S	*	.			trans	-83.2	97.5	170.6	-177.5	0	0	0	0	108	Q136 F151	Q136-V138 PolarHBondContact O-N 2.8Å; V138-F151 HydrophobicContact CB-CE1 4.46Å; V138-F151 HydrophobicContact CG1-CE1 3.78Å; V138-F151 HydrophobicContact CG1-CZ 3.99Å
139	Y	44.2	Very low	56.3	Low	172 Å²	172	102.2 Å²	102.2	68%	0.675	52%	0.522	S	S	*	.			trans	-73.3	139.2	171.8	-78.2	-83.3	0	0	0	110.9	K137	K137-Y139 HydrophobicContact CB-CD2 4.32Å; K137-Y139 HydrophobicContact CB-CE2 4.05Å; K137-Y139 HydrophobicContact CD-CD2 4.28Å; K137-Y139 HydrophobicContact CD-CE1 4.08Å; K137-Y139 HydrophobicContact CD-CE2 3.5Å; K137-Y139 WeakPolarHBondContact CD-OH 3.21Å; K137-Y139 WeakPolarHBondContact CE-OH 3.5Å; K137-Y139 HydrophobicContact CG-CD2 3.91Å; K137-Y139 HydrophobicContact CG-CE1 4.47Å; K137-Y139 HydrophobicContact CG-CE2 3.63Å; K137-Y139 HydrophobicContact CG-CG 4.47Å; K137-Y139 PolarHBondContact NZ-OH 3.3Å; K137-Y139 VanDerWaalsContact NZ-OH 3.12Å; K137-Y139 PolarHBondContact O-N 3.42Å
140	L	41.9	Very low	57.1	Low	80 Å²	80	101.3 Å²	101.3	42%	0.419	52%	0.523	S	S	.	.			trans	-106.3	82.1	-166.1	-108	167	0	0	0	110.9	R147 F151	L140-R147 HydrophobicContact CD2-CB 4.09Å; L140-R147 VanDerWaalsContact CD2-CD 3.43Å; L140-R147 HydrophobicContact CD2-CG 4.14Å; L140-R147 PolarHBondContact O-NH1 2.9Å; L140-F151 HydrophobicContact CD1-CD1 4.12Å; L140-F151 HydrophobicContact CD1-CD2 3.98Å; L140-F151 HydrophobicContact CD1-CE1 3.77Å; L140-F151 HydrophobicContact CD1-CE2 3.81Å; L140-F151 HydrophobicContact CD1-CG 4.25Å; L140-F151 HydrophobicContact CD1-CZ 3.66Å; L140-F151 HydrophobicContact CD2-CD2 3.65Å; L140-F151 HydrophobicContact CD2-CE1 4.12Å; L140-F151 HydrophobicContact CD2-CE2 2.89Å; L140-F151 HydrophobicContact CD2-CZ 3.16Å; L140-F151 HydrophobicContact CG-CD2 4.21Å; L140-F151 HydrophobicContact CG-CE1 3.79Å; L140-F151 HydrophobicContact CG-CE2 3.53Å; L140-F151 HydrophobicContact CG-CZ 3.25Å
141	T	34.5	Very low	58.5	Low	116 Å²	116	95.1 Å²	95.1	71%	0.712	48%	0.483	S	S	*	.			trans	-113.3	150.3	161.8	51.1	0	0	0	0	109.8	R147	T141-R147 VanDerWaalsContact C-CZ 3.46Å; T141-R147 PolarHBondContact O-NH1 2.74Å
142	V	35.3	Very low	59.8	Low	117 Å²	117	90.7 Å²	90.7	71%	0.709	45%	0.452	S	S	*	.	S	Bend	trans	97.7	92.1	-177.6	-169	0	0	0	0	120.7	R147	V142-R147 VanDerWaalsContact N-CZ 3.33Å; V142-R147 VanDerWaalsContact N-NH1 3.13Å; V142-R147 WeakPolarHBondContact O-CD 3.47Å; V142-R147 WeakPolarHBondContact O-CG 3.46Å; V142-R147 PolarHBondContact O-NE 3.5Å; V142-R147 PolarHBondContact O-NH2 2.93Å
143	S	51	Low	61	Low	71 Å²	71	94.9 Å²	94.9	50%	0.497	47%	0.473	S	S	.	.			trans	50.9	107.6	167.1	178.8	0	0	0	0	117.8	R145 R147	S143-R145 VanDerWaalsContact C-N 3.28Å; S143-R145 PolarHBondContact O-N 2.98Å; S143-R145 VanDerWaalsContact O-N 3.13Å; S143-R147 VanDerWaalsContact N-NH2 3.14Å; S143-R147 WeakPolarHBondContact O-CB 3.28Å; S143-R147 WeakPolarHBondContact O-CG 3.39Å; S143-R147 PolarHBondContact O-NE 3.29Å
144	L	57.1	Low	62	Low	127 Å²	127	90.2 Å²	90.2	67%	0.665	46%	0.458	S	S	*	.	H	α-helix	trans	-56.9	-30	-172.8	-84.5	150.9	0	0	0	115.1	L148	L144-L148 VanDerWaalsContact O-CG 3.23Å; L144-L148 WeakPolarHBondContact O-CG 3.31Å; L144-L148 PolarHBondContact O-N 3.02Å; L144-L148 VanDerWaalsContact O-N 3.09Å
145	R	54.3	Low	63.3	Low	128 Å²	128	89.7 Å²	89.7	48%	0.483	45%	0.454	S	S	.	.	H	α-helix	trans	-73.5	-58.2	-170.7	-175.6	178.5	174	178.4	-2.2	113.9	S143 R147 L148	S143-R145 VanDerWaalsContact C-N 3.28Å; S143-R145 PolarHBondContact O-N 2.98Å; S143-R145 VanDerWaalsContact O-N 3.13Å; R145-R147 PolarHBondContact O-N 2.93Å; R145-L148 PolarHBondContact O-N 2.71Å
146	Y	58.1	Low	64.7	Low	169 Å²	169	89 Å²	89	66%	0.663	45%	0.45	S	S	*	.	H	α-helix	trans	-60.8	-34.2	179.1	-72.4	-73.8	0	0	0	111.6	E149 I150	Y146-E149 PolarHBondContact O-N 3.21Å; Y146-I150 PolarHBondContact O-N 2.97Å
147	R	69.2	Low	66.5	Low	42 Å²	42	84.3 Å²	84.3	16%	0.158	42%	0.424	C	S	.	.	H	α-helix	trans	-62.8	-47.9	175.7	-80.4	-171.4	-46.8	178.9	-21.5	111.8	L140 T141 V142 S143 R145 E149 I150 F151	L140-R147 HydrophobicContact CD2-CB 4.09Å; L140-R147 VanDerWaalsContact CD2-CD 3.43Å; L140-R147 HydrophobicContact CD2-CG 4.14Å; L140-R147 PolarHBondContact O-NH1 2.9Å; T141-R147 VanDerWaalsContact C-CZ 3.46Å; T141-R147 PolarHBondContact O-NH1 2.74Å; V142-R147 VanDerWaalsContact N-CZ 3.33Å; V142-R147 VanDerWaalsContact N-NH1 3.13Å; V142-R147 WeakPolarHBondContact O-CD 3.47Å; V142-R147 WeakPolarHBondContact O-CG 3.46Å; V142-R147 PolarHBondContact O-NE 3.5Å; V142-R147 PolarHBondContact O-NH2 2.93Å; S143-R147 VanDerWaalsContact N-NH2 3.14Å; S143-R147 WeakPolarHBondContact O-CB 3.28Å; S143-R147 WeakPolarHBondContact O-CG 3.39Å; S143-R147 PolarHBondContact O-NE 3.29Å; R145-R147 PolarHBondContact O-N 2.93Å; R147-E149 PolarHBondContact O-N 3.07Å; R147-I150 CarbonylContact O-C 3.6Å; R147-I150 PolarHBondContact O-N 3.38Å; R147-F151 HydrophobicContact CB-CD2 3.82Å; R147-F151 HydrophobicContact CB-CE2 3.52Å; R147-F151 HydrophobicContact CG-CE2 3.87Å; R147-F151 WeakPolarHBondContact O-CD2 3.28Å; R147-F151 WeakPolarHBondContact O-CE2 3.39Å; R147-F151 PolarHBondContact O-N 2.7Å
148	L	78.1	Confident	68.3	Low	14 Å²	14	79.5 Å²	79.5	7%	0.073	40%	0.403	C	S	.	.	H	α-helix	trans	-59.8	-33	-178	-77.4	170	0	0	0	113.3	L144 R145 V152 L161 K164 R165	L144-L148 VanDerWaalsContact O-CG 3.23Å; L144-L148 WeakPolarHBondContact O-CG 3.31Å; L144-L148 PolarHBondContact O-N 3.02Å; L144-L148 VanDerWaalsContact O-N 3.09Å; R145-L148 PolarHBondContact O-N 2.71Å; L148-V152 WeakPolarHBondContact O-CB 3.29Å; L148-V152 VanDerWaalsContact O-CG2 3.23Å; L148-V152 WeakPolarHBondContact O-CG2 3.46Å; L148-V152 PolarHBondContact O-N 3.17Å; L148-L161 HydrophobicContact CD2-CD2 3.94Å; L148-K164 HydrophobicContact CD1-CB 4.4Å; L148-K164 HydrophobicContact CD2-CB 4.32Å; L148-R165 HydrophobicContact CB-CB 4.3Å; L148-R165 HydrophobicContact CB-CG 4.25Å; L148-R165 HydrophobicContact CD1-CB 4.35Å
149	E	79.7	Confident	70.4	Confident	77 Å²	77	75.5 Å²	75.5	36%	0.36	38%	0.381	S	S	.	.	H	α-helix	trans	-64.4	-47.8	173.6	-69.6	-176.3	176.5	0	0	111.7	Y146 R147 V152 I153 Y169	Y146-E149 PolarHBondContact O-N 3.21Å; R147-E149 PolarHBondContact O-N 3.07Å; E149-V152 PolarHBondContact O-N 3.27Å; E149-I153 VanDerWaalsContact O-CG1 3.32Å; E149-I153 WeakPolarHBondContact O-CG1 3.44Å; E149-I153 PolarHBondContact O-N 2.98Å; E149-I153 VanDerWaalsContact O-N 3.15Å; E149-Y169 PolarHBondContact OE1-OH 3.47Å
150	I	79.1	Confident	72.6	Confident	106 Å²	106	74.9 Å²	74.9	54%	0.544	38%	0.377	S	S	.	.	H	α-helix	trans	-62.9	-43.1	175.9	-65.2	161.8	0	0	0	111.2	Y146 R147 I153 A154	Y146-I150 PolarHBondContact O-N 2.97Å; R147-I150 CarbonylContact O-C 3.6Å; R147-I150 PolarHBondContact O-N 3.38Å; I150-I153 WeakPolarHBondContact O-CB 3.43Å; I150-I153 PolarHBondContact O-N 2.93Å; I150-A154 PolarHBondContact O-N 2.96Å
151	F	82.6	Confident	74.9	Confident	16 Å²	16	72 Å²	72	7%	0.07	36%	0.362	C	S	.	.	H	α-helix	trans	-68	-37	-179.5	-72.5	-63	0	0	0	112.9	V138 L140 R147 I153 A154 M155 L161	V138-F151 HydrophobicContact CB-CE1 4.46Å; V138-F151 HydrophobicContact CG1-CE1 3.78Å; V138-F151 HydrophobicContact CG1-CZ 3.99Å; L140-F151 HydrophobicContact CD1-CD1 4.12Å; L140-F151 HydrophobicContact CD1-CD2 3.98Å; L140-F151 HydrophobicContact CD1-CE1 3.77Å; L140-F151 HydrophobicContact CD1-CE2 3.81Å; L140-F151 HydrophobicContact CD1-CG 4.25Å; L140-F151 HydrophobicContact CD1-CZ 3.66Å; L140-F151 HydrophobicContact CD2-CD2 3.65Å; L140-F151 HydrophobicContact CD2-CE1 4.12Å; L140-F151 HydrophobicContact CD2-CE2 2.89Å; L140-F151 HydrophobicContact CD2-CZ 3.16Å; L140-F151 HydrophobicContact CG-CD2 4.21Å; L140-F151 HydrophobicContact CG-CE1 3.79Å; L140-F151 HydrophobicContact CG-CE2 3.53Å; L140-F151 HydrophobicContact CG-CZ 3.25Å; R147-F151 HydrophobicContact CB-CD2 3.82Å; R147-F151 HydrophobicContact CB-CE2 3.52Å; R147-F151 HydrophobicContact CG-CE2 3.87Å; R147-F151 WeakPolarHBondContact O-CD2 3.28Å; R147-F151 WeakPolarHBondContact O-CE2 3.39Å; R147-F151 PolarHBondContact O-N 2.7Å; F151-I153 VanDerWaalsContact C-N 3.27Å; F151-I153 PolarHBondContact O-N 3.36Å; F151-A154 PolarHBondContact O-N 2.93Å; F151-M155 HydrophobicContact CD1-CE 4.03Å; F151-M155 WeakPolarHBondContact O-CA 3.43Å; F151-M155 VanDerWaalsContact O-CB 3.31Å; F151-M155 WeakPolarHBondContact O-CB 3.23Å; F151-M155 PolarHBondContact O-N 3.06Å; F151-L161 HydrophobicContact CB-CD1 3.92Å
152	V	86.8	Confident	77.7	Confident	8 Å²	8	68.5 Å²	68.5	5%	0.048	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-29.9	174.8	171.9	0	0	0	0	111.2	L148 E149 M155 P156 L161 R162	L148-V152 WeakPolarHBondContact O-CB 3.29Å; L148-V152 VanDerWaalsContact O-CG2 3.23Å; L148-V152 WeakPolarHBondContact O-CG2 3.46Å; L148-V152 PolarHBondContact O-N 3.17Å; E149-V152 PolarHBondContact O-N 3.27Å; V152-M155 CarbonylContact O-C 3.56Å; V152-P156 VanDerWaalsContact O-CA 3.27Å; V152-P156 WeakPolarHBondContact O-CA 3.16Å; V152-L161 HydrophobicContact CG2-CB 4.01Å; V152-R162 HydrophobicContact CG1-CG 4.12Å; V152-R162 HydrophobicContact CG2-CG 4.27Å
153	I	85.3	Confident	80.5	Confident	136 Å²	136	64.8 Å²	64.8	70%	0.697	31%	0.312	S	S	*	.	H	α-helix	trans	-68.7	-45.9	171.8	-67.7	165.3	0	0	0	110.5	E149 I150 F151	E149-I153 VanDerWaalsContact O-CG1 3.32Å; E149-I153 WeakPolarHBondContact O-CG1 3.44Å; E149-I153 PolarHBondContact O-N 2.98Å; E149-I153 VanDerWaalsContact O-N 3.15Å; I150-I153 WeakPolarHBondContact O-CB 3.43Å; I150-I153 PolarHBondContact O-N 2.93Å; F151-I153 VanDerWaalsContact C-N 3.27Å; F151-I153 PolarHBondContact O-N 3.36Å
154	A	83.5	Confident	82.4	Confident	57 Å²	57	66.1 Å²	66.1	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-69.8	-33.6	179.5	0	0	0	0	0	113.2	I150 F151 P156	I150-A154 PolarHBondContact O-N 2.96Å; F151-A154 PolarHBondContact O-N 2.93Å; A154-P156 VanDerWaalsContact C-CD 3.45Å; A154-P156 WeakPolarHBondContact O-CD 3.44Å
155	M	89.8	Confident	84.1	Confident	13 Å²	13	61.9 Å²	61.9	6%	0.064	28%	0.284	C	S	.	.			trans	-125.7	67.4	-173.9	-53.4	172	-169.5	0	0	110	L105 K106 L110 F151 V152 W157 S158 L161	L105-M155 HydrophobicContact CD1-CE 4.23Å; L105-M155 WeakPolarHBondContact O-CG 3.28Å; K106-M155 CarbonylContact O-C 3.38Å; K106-M155 WeakPolarHBondContact O-CA 3.48Å; L110-M155 HydrophobicContact CD1-CE 4.29Å; L110-M155 HydrophobicContact CD2-CE 3.42Å; L110-M155 VanDerWaalsContact CD2-CE 3.42Å; L110-M155 HydrophobicContact CD2-SD 3.8Å; L110-M155 HydrophobicContact CG-CE 4.45Å; F151-M155 HydrophobicContact CD1-CE 4.03Å; F151-M155 WeakPolarHBondContact O-CA 3.43Å; F151-M155 VanDerWaalsContact O-CB 3.31Å; F151-M155 WeakPolarHBondContact O-CB 3.23Å; F151-M155 PolarHBondContact O-N 3.06Å; V152-M155 CarbonylContact O-C 3.56Å; M155-W157 PolarHBondContact O-N 3.4Å; M155-W157 VanDerWaalsContact O-N 3.12Å; M155-S158 WeakPolarHBondContact O-CB 3.46Å; M155-S158 PolarHBondContact O-N 2.94Å; M155-S158 VanDerWaalsContact O-N 3.1Å; M155-L161 HydrophobicContact CB-CD1 4.01Å; M155-L161 HydrophobicContact CG-CD1 4.46Å; M155-L161 HydrophobicContact SD-CD1 3.75Å
156	P	89.7	Confident	85.9	Confident	39 Å²	39	55.9 Å²	55.9	25%	0.253	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-21.5	-168	26.5	-36.3	0	0	0	113.8	K106 V152 A154 R162	K106-P156 HydrophobicContact CG-CG 4.5Å; V152-P156 VanDerWaalsContact O-CA 3.27Å; V152-P156 WeakPolarHBondContact O-CA 3.16Å; A154-P156 VanDerWaalsContact C-CD 3.45Å; A154-P156 WeakPolarHBondContact O-CD 3.44Å; P156-R162 PolarHBondContact O-NE 2.67Å; P156-R162 VanDerWaalsContact O-NE 3.09Å; P156-R162 PolarHBondContact O-NH2 2.83Å
157	W	91.7	Very high	87.5	Confident	82 Å²	82	50.6 Å²	50.6	31%	0.311	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	11	-179	-54	-25.9	0	0	0	112.9	A76 I103 K106 Q107 M155 A159 L188	A76-W157 HydrophobicContact CB-CE3 4.07Å; A76-W157 HydrophobicContact CB-CH2 3.34Å; A76-W157 HydrophobicContact CB-CZ2 4.15Å; A76-W157 HydrophobicContact CB-CZ3 3.3Å; I103-W157 HydrophobicContact CG1-CZ3 4.45Å; I103-W157 HydrophobicContact CG2-CE3 4.45Å; I103-W157 HydrophobicContact CG2-CZ3 4.13Å; K106-W157 HydrophobicContact CB-CD2 3.91Å; K106-W157 HydrophobicContact CB-CE3 3.43Å; K106-W157 VanDerWaalsContact CB-CE3 3.43Å; K106-W157 HydrophobicContact CB-CG 4.4Å; K106-W157 HydrophobicContact CB-CZ3 3.91Å; K106-W157 HydrophobicContact CD-CD2 4.34Å; K106-W157 HydrophobicContact CD-CE3 3.92Å; K106-W157 HydrophobicContact CD-CH2 3.73Å; K106-W157 HydrophobicContact CD-CZ2 4.17Å; K106-W157 HydrophobicContact CD-CZ3 3.59Å; K106-W157 HydrophobicContact CG-CE3 4.32Å; K106-W157 HydrophobicContact CG-CZ3 4.4Å; K106-W157 CarbonylContact O-C 3.52Å; K106-W157 WeakPolarHBondContact O-CA 3.35Å; K106-W157 WeakPolarHBondContact O-CB 3.49Å; K106-W157 PolarHBondContact O-N 2.92Å; Q107-W157 HydrophobicContact CG-CB 4.13Å; Q107-W157 HydrophobicContact CG-CE3 4.46Å; M155-W157 PolarHBondContact O-N 3.4Å; M155-W157 VanDerWaalsContact O-N 3.12Å; W157-A159 PolarHBondContact O-N 3Å; W157-L188 HydrophobicContact CB-CD2 4.09Å; W157-L188 HydrophobicContact CG-CD2 4.41Å
158	S	92	Very high	88.5	Confident	2 Å²	2	50.4 Å²	50.4	1%	0.014	25%	0.248	C	C	.	.			trans	-83	95.9	174.4	-166.1	0	0	0	0	111.8	K106 Q107 M155 R160 L161 R162	K106-S158 PolarHBondContact O-N 3.05Å; Q107-S158 WeakPolarHBondContact O-CA 3.49Å; Q107-S158 WeakPolarHBondContact O-CB 3.32Å; Q107-S158 PolarHBondContact O-OG 3.04Å; Q107-S158 VanDerWaalsContact O-OG 3.11Å; M155-S158 WeakPolarHBondContact O-CB 3.46Å; M155-S158 PolarHBondContact O-N 2.94Å; M155-S158 VanDerWaalsContact O-N 3.1Å; S158-R160 PolarHBondContact O-N 3.41Å; S158-L161 PolarHBondContact O-N 3.05Å; S158-L161 WeakPolarHBondContact OG-CG 2.88Å; S158-L161 PolarHBondContact OG-N 3.4Å; S158-R162 WeakPolarHBondContact O-CG 3.24Å; S158-R162 PolarHBondContact O-N 2.98Å
159	A	93.5	Very high	89.1	Confident	14 Å²	14	50.6 Å²	50.6	12%	0.116	25%	0.248	C	C	.	.	H	α-helix	trans	-57	-39.5	172.6	0	0	0	0	0	111.4	W157 R162 L163 A185 L188 V189	W157-A159 PolarHBondContact O-N 3Å; A159-R162 PolarHBondContact O-N 3.41Å; A159-L163 WeakPolarHBondContact O-CG 3.23Å; A159-L163 PolarHBondContact O-N 3.35Å; A159-A185 HydrophobicContact CB-CB 4.12Å; A159-L188 HydrophobicContact CB-CB 4.07Å; A159-L188 HydrophobicContact CB-CD1 4.32Å; A159-V189 HydrophobicContact CB-CG2 3.74Å
160	R	91.1	Very high	89.7	Confident	158 Å²	158	50.3 Å²	50.3	60%	0.596	25%	0.246	S	C	*	.	H	α-helix	trans	-58.8	-49.6	178.5	-175.6	177.5	67.3	113.2	-2.9	112.4	S158 R162 L163 K164	S158-R160 PolarHBondContact O-N 3.41Å; R160-R162 VanDerWaalsContact C-N 3.35Å; R160-R162 PolarHBondContact O-N 3Å; R160-L163 PolarHBondContact O-N 2.87Å; R160-K164 PolarHBondContact O-N 2.65Å
161	L	90.7	Very high	90.2	Very high	20 Å²	20	55.3 Å²	55.3	11%	0.105	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-39.2	179.8	-69.2	175.1	0	0	0	111.9	L148 F151 V152 M155 S158 K164 R165	L148-L161 HydrophobicContact CD2-CD2 3.94Å; F151-L161 HydrophobicContact CB-CD1 3.92Å; V152-L161 HydrophobicContact CG2-CB 4.01Å; M155-L161 HydrophobicContact CB-CD1 4.01Å; M155-L161 HydrophobicContact CG-CD1 4.46Å; M155-L161 HydrophobicContact SD-CD1 3.75Å; S158-L161 PolarHBondContact O-N 3.05Å; S158-L161 WeakPolarHBondContact OG-CG 2.88Å; S158-L161 PolarHBondContact OG-N 3.4Å; L161-K164 PolarHBondContact O-N 3.13Å; L161-R165 PolarHBondContact O-N 3.46Å
162	R	93.7	Very high	90.4	Very high	42 Å²	42	58.3 Å²	58.3	16%	0.158	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-44.9	174.6	-69.7	177	179.5	-78.8	0.6	111.8	V152 P156 S158 A159 R160 K164 R165 A166 D181 A185	V152-R162 HydrophobicContact CG1-CG 4.12Å; V152-R162 HydrophobicContact CG2-CG 4.27Å; P156-R162 PolarHBondContact O-NE 2.67Å; P156-R162 VanDerWaalsContact O-NE 3.09Å; P156-R162 PolarHBondContact O-NH2 2.83Å; S158-R162 WeakPolarHBondContact O-CG 3.24Å; S158-R162 PolarHBondContact O-N 2.98Å; A159-R162 PolarHBondContact O-N 3.41Å; R160-R162 VanDerWaalsContact C-N 3.35Å; R160-R162 PolarHBondContact O-N 3Å; R162-K164 VanDerWaalsContact C-N 3.34Å; R162-K164 PolarHBondContact O-N 3.01Å; R162-R165 PolarHBondContact O-N 3.17Å; R162-A166 PolarHBondContact O-N 3.23Å; R162-D181 HydrophobicContact CB-CB 4.4Å; R162-D181 IonicContact NH1-OD1 3.92Å; R162-A185 HydrophobicContact CB-CB 4.15Å
163	L	93.8	Very high	90.3	Very high	40 Å²	40	60.4 Å²	60.4	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-39.4	175.9	-68.9	174.7	0	0	0	112.1	A159 R160 A166 E167 I182 A185 A195	A159-L163 WeakPolarHBondContact O-CG 3.23Å; A159-L163 PolarHBondContact O-N 3.35Å; R160-L163 PolarHBondContact O-N 2.87Å; L163-A166 WeakPolarHBondContact O-CB 3.4Å; L163-A166 PolarHBondContact O-N 3.36Å; L163-E167 WeakPolarHBondContact O-CG 3.13Å; L163-E167 PolarHBondContact O-N 3.48Å; L163-I182 HydrophobicContact CD2-CG1 4.02Å; L163-I182 HydrophobicContact CD2-CG2 4.49Å; L163-A185 HydrophobicContact CD1-CB 4.49Å; L163-A185 HydrophobicContact CD2-CB 3.82Å; L163-A185 HydrophobicContact CG-CB 3.8Å; L163-A195 HydrophobicContact CD2-CB 3.9Å
164	K	90.9	Very high	90.5	Very high	98 Å²	98	56.7 Å²	56.7	43%	0.426	28%	0.281	S	S	.	.	H	α-helix	trans	-63.6	-39.7	173.4	-72.5	-59.6	179.2	-157.7	0	113	L148 R160 L161 R162 A166 E167 C168	L148-K164 HydrophobicContact CD1-CB 4.4Å; L148-K164 HydrophobicContact CD2-CB 4.32Å; R160-K164 PolarHBondContact O-N 2.65Å; L161-K164 PolarHBondContact O-N 3.13Å; R162-K164 VanDerWaalsContact C-N 3.34Å; R162-K164 PolarHBondContact O-N 3.01Å; K164-A166 VanDerWaalsContact C-N 3.33Å; K164-E167 VanDerWaalsContact CD-OE2 3.32Å; K164-E167 WeakPolarHBondContact CD-OE2 3.28Å; K164-E167 VanDerWaalsContact NZ-CD 3.28Å; K164-E167 IonicContact NZ-OE1 3.64Å; K164-E167 PolarHBondContact NZ-OE1 3.43Å; K164-E167 IonicContact NZ-OE2 3.97Å; K164-E167 PolarHBondContact NZ-OE2 2.92Å; K164-E167 WeakPolarHBondContact O-CB 3.41Å; K164-E167 PolarHBondContact O-N 3.39Å; K164-C168 PolarHBondContact O-N 2.87Å; K164-C168 VanDerWaalsContact O-N 3.12Å; K164-C168 PolarHBondContact O-SG 3.31Å
165	R	91.4	Very high	90.8	Very high	39 Å²	39	55.1 Å²	55.1	15%	0.147	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-35.4	173.8	-164.8	172.8	66	173.9	2.4	111.9	L148 L161 R162 C168 Y169 D181	L148-R165 HydrophobicContact CB-CB 4.3Å; L148-R165 HydrophobicContact CB-CG 4.25Å; L148-R165 HydrophobicContact CD1-CB 4.35Å; L161-R165 PolarHBondContact O-N 3.46Å; R162-R165 PolarHBondContact O-N 3.17Å; R165-C168 WeakPolarHBondContact O-CB 3.39Å; R165-C168 PolarHBondContact O-N 2.9Å; R165-Y169 HydrophobicContact CG-CD2 4.19Å; R165-Y169 HydrophobicContact CG-CE2 3.65Å; R165-Y169 WeakPolarHBondContact O-CD2 3.43Å; R165-Y169 PolarHBondContact O-N 3.47Å; R165-D181 WeakPolarHBondContact CB-OD2 3.3Å; R165-D181 IonicContact CZ-OD1 2.77Å; R165-D181 IonicContact CZ-OD2 2.8Å; R165-D181 IonicContact NE-OD1 3.53Å; R165-D181 IonicContact NE-OD2 3.55Å; R165-D181 PolarHBondContact NE-OD2 3.14Å; R165-D181 IonicContact NH2-OD1 3.48Å; R165-D181 PolarHBondContact NH2-OD1 3.48Å; R165-D181 IonicContact NH2-OD2 2.92Å; R165-D181 PolarHBondContact NH2-OD2 3.4Å
166	A	93.2	Very high	90.9	Very high	2 Å²	2	59.8 Å²	59.8	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-63.1	-40.8	172	0	0	0	0	0	112.8	R162 L163 K164 C168 Y169 E170 A178 D181 I182	R162-A166 PolarHBondContact O-N 3.23Å; L163-A166 WeakPolarHBondContact O-CB 3.4Å; L163-A166 PolarHBondContact O-N 3.36Å; K164-A166 VanDerWaalsContact C-N 3.33Å; A166-C168 VanDerWaalsContact C-N 3.29Å; A166-C168 PolarHBondContact O-N 3Å; A166-Y169 PolarHBondContact O-N 3.41Å; A166-E170 WeakPolarHBondContact O-CB 3.44Å; A166-E170 PolarHBondContact O-N 3.36Å; A166-A178 HydrophobicContact CB-CB 4.21Å; A166-D181 HydrophobicContact CB-CB 3.95Å; A166-I182 HydrophobicContact CB-CD1 4.21Å; A166-I182 HydrophobicContact CB-CG1 3.75Å
167	E	91.8	Very high	90.9	Very high	58 Å²	58	63.3 Å²	63.3	27%	0.271	30%	0.298	S	S	.	.	H	α-helix	trans	-59.8	-38.3	171.5	-69.1	170.5	-160.7	0	0	111.5	L163 K164 R171	L163-E167 WeakPolarHBondContact O-CG 3.13Å; L163-E167 PolarHBondContact O-N 3.48Å; K164-E167 VanDerWaalsContact CD-OE2 3.32Å; K164-E167 WeakPolarHBondContact CD-OE2 3.28Å; K164-E167 VanDerWaalsContact NZ-CD 3.28Å; K164-E167 IonicContact NZ-OE1 3.64Å; K164-E167 PolarHBondContact NZ-OE1 3.43Å; K164-E167 IonicContact NZ-OE2 3.97Å; K164-E167 PolarHBondContact NZ-OE2 2.92Å; K164-E167 WeakPolarHBondContact O-CB 3.41Å; K164-E167 PolarHBondContact O-N 3.39Å; E167-R171 WeakPolarHBondContact O-CG 3.31Å; E167-R171 PolarHBondContact O-N 2.58Å
168	C	89.3	Confident	91	Very high	37 Å²	37	59.4 Å²	59.4	25%	0.25	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-43.5	173.4	-64.8	0	0	0	0	112.1	K164 R165 A166 E170 R171 L172	K164-C168 PolarHBondContact O-N 2.87Å; K164-C168 VanDerWaalsContact O-N 3.12Å; K164-C168 PolarHBondContact O-SG 3.31Å; R165-C168 WeakPolarHBondContact O-CB 3.39Å; R165-C168 PolarHBondContact O-N 2.9Å; A166-C168 VanDerWaalsContact C-N 3.29Å; A166-C168 PolarHBondContact O-N 3Å; C168-E170 VanDerWaalsContact C-N 3.33Å; C168-E170 PolarHBondContact O-N 3.31Å; C168-R171 PolarHBondContact O-N 3.29Å; C168-L172 WeakPolarHBondContact O-CD1 3.35Å; C168-L172 VanDerWaalsContact O-CG 3.27Å; C168-L172 WeakPolarHBondContact O-CG 3.34Å; C168-L172 PolarHBondContact O-N 3.28Å
169	Y	91.4	Very high	91.1	Very high	19 Å²	19	59.4 Å²	59.4	8%	0.075	28%	0.283	C	S	.	.	H	α-helix	trans	-65.8	-35.2	178.1	-71.3	-42.2	0	0	0	112.9	E149 R165 A166 L172 G173 V174 K177 D181	E149-Y169 PolarHBondContact OE1-OH 3.47Å; R165-Y169 HydrophobicContact CG-CD2 4.19Å; R165-Y169 HydrophobicContact CG-CE2 3.65Å; R165-Y169 WeakPolarHBondContact O-CD2 3.43Å; R165-Y169 PolarHBondContact O-N 3.47Å; A166-Y169 PolarHBondContact O-N 3.41Å; Y169-L172 CarbonylContact O-C 3.5Å; Y169-L172 PolarHBondContact O-N 3.44Å; Y169-G173 PolarHBondContact O-N 3.33Å; Y169-V174 PolarHBondContact O-N 3.37Å; Y169-K177 HydrophobicContact CD1-CB 4.04Å; Y169-K177 HydrophobicContact CD1-CD 4.16Å; Y169-K177 HydrophobicContact CD2-CB 3.53Å; Y169-K177 HydrophobicContact CE1-CB 4.24Å; Y169-K177 HydrophobicContact CE1-CD 3.79Å; Y169-K177 HydrophobicContact CE2-CB 3.71Å; Y169-K177 HydrophobicContact CE2-CD 4.42Å; Y169-K177 HydrophobicContact CG-CB 3.72Å; Y169-D181 WeakPolarHBondContact CE2-OD2 2.84Å
170	E	92.4	Very high	91.2	Very high	71 Å²	71	62 Å²	62	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-58.2	-51	171.7	174.2	-175.9	-148.4	0	0	111.4	A166 C168 L172 G173 K198 F202	A166-E170 WeakPolarHBondContact O-CB 3.44Å; A166-E170 PolarHBondContact O-N 3.36Å; C168-E170 VanDerWaalsContact C-N 3.33Å; C168-E170 PolarHBondContact O-N 3.31Å; E170-L172 PolarHBondContact O-N 3.2Å; E170-G173 PolarHBondContact O-N 2.93Å; E170-K198 VanDerWaalsContact CD-CE 3.47Å; E170-K198 VanDerWaalsContact OE1-CE 3.3Å; E170-K198 WeakPolarHBondContact OE1-CE 3.4Å; E170-K198 IonicContact OE1-NZ 3.63Å; E170-K198 PolarHBondContact OE1-NZ 2.83Å; E170-K198 WeakPolarHBondContact OE2-CE 3.31Å; E170-K198 IonicContact OE2-NZ 2.62Å; E170-K198 PolarHBondContact OE2-NZ 2.96Å; E170-F202 HydrophobicContact CB-CE1 4.39Å; E170-F202 HydrophobicContact CB-CE2 4.36Å; E170-F202 HydrophobicContact CB-CZ 3.7Å; E170-F202 VanDerWaalsContact CD-CZ 3.45Å; E170-F202 HydrophobicContact CG-CE1 3.86Å; E170-F202 HydrophobicContact CG-CZ 3.59Å; E170-F202 WeakPolarHBondContact OE1-CE1 3.45Å; E170-F202 WeakPolarHBondContact OE1-CZ 3.02Å
171	R	89.3	Confident	91.3	Very high	211 Å²	211	54.7 Å²	54.7	80%	0.796	27%	0.273	S	S	*	.	H	α-helix	trans	-62.5	-23.3	177.8	-68.2	178.8	-171.6	-178.2	1.5	113.6	E167 C168	E167-R171 WeakPolarHBondContact O-CG 3.31Å; E167-R171 PolarHBondContact O-N 2.58Å; C168-R171 PolarHBondContact O-N 3.29Å
172	L	87.2	Confident	91.6	Very high	78 Å²	78	53.8 Å²	53.8	41%	0.408	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	0.6	176.9	-66.6	167.6	0	0	0	112.9	C168 Y169 E170 V174	C168-L172 WeakPolarHBondContact O-CD1 3.35Å; C168-L172 VanDerWaalsContact O-CG 3.27Å; C168-L172 WeakPolarHBondContact O-CG 3.34Å; C168-L172 PolarHBondContact O-N 3.28Å; Y169-L172 CarbonylContact O-C 3.5Å; Y169-L172 PolarHBondContact O-N 3.44Å; E170-L172 PolarHBondContact O-N 3.2Å; L172-V174 HydrophobicContact CB-CG2 4.09Å; L172-V174 PolarHBondContact O-N 3.4Å
173	G	84.9	Confident	91.6	Very high	53 Å²	53	58.5 Å²	58.5	55%	0.546	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	4.6	-176.6	0	0	0	0	0	114.9	Y169 E170 L175	Y169-G173 PolarHBondContact O-N 3.33Å; E170-G173 PolarHBondContact O-N 2.93Å; G173-L175 VanDerWaalsContact C-N 3.27Å; G173-L175 PolarHBondContact O-N 3.49Å
174	V	88.3	Confident	91.6	Very high	57 Å²	57	58 Å²	58	35%	0.345	29%	0.286	S	S	.	.			trans	-89.8	62.1	-176.7	-161	0	0	0	0	110.9	Y169 L172 Q176 K177 A178	Y169-V174 PolarHBondContact O-N 3.37Å; L172-V174 HydrophobicContact CB-CG2 4.09Å; L172-V174 PolarHBondContact O-N 3.4Å; V174-Q176 VanDerWaalsContact C-N 3.28Å; V174-Q176 PolarHBondContact O-N 3.33Å; V174-K177 HydrophobicContact CG1-CB 4.11Å; V174-K177 HydrophobicContact CG1-CD 3.78Å; V174-K177 HydrophobicContact CG1-CG 3.75Å; V174-K177 PolarHBondContact O-N 3.11Å; V174-K177 VanDerWaalsContact O-N 3.07Å; V174-A178 PolarHBondContact O-N 3.34Å
175	L	90.8	Very high	91.8	Very high	25 Å²	25	53.3 Å²	53.3	13%	0.131	27%	0.266	C	S	.	.	H	α-helix	trans	-58.3	-33.7	-170.2	-61.3	-179.8	0	0	0	114	G173 K177 A178 I179 F202 M205 L206	G173-L175 VanDerWaalsContact C-N 3.27Å; G173-L175 PolarHBondContact O-N 3.49Å; L175-K177 VanDerWaalsContact C-N 3.33Å; L175-K177 PolarHBondContact O-N 2.84Å; L175-A178 WeakPolarHBondContact O-CB 3.4Å; L175-A178 PolarHBondContact O-N 3.09Å; L175-I179 VanDerWaalsContact O-CG1 3.31Å; L175-I179 WeakPolarHBondContact O-CG1 3.39Å; L175-I179 PolarHBondContact O-N 3.29Å; L175-F202 HydrophobicContact CB-CB 4.45Å; L175-F202 HydrophobicContact CD2-CD1 3.91Å; L175-F202 HydrophobicContact CD2-CE1 4.15Å; L175-F202 HydrophobicContact CD2-CG 4.11Å; L175-M205 HydrophobicContact CD1-CB 3.87Å; L175-M205 HydrophobicContact CD1-CE 3.71Å; L175-M205 HydrophobicContact CD1-SD 4.23Å; L175-M205 HydrophobicContact CD2-CE 4.15Å; L175-L206 HydrophobicContact CB-CD1 3.49Å; L175-L206 VanDerWaalsContact CB-CD1 3.49Å; L175-L206 HydrophobicContact CB-CD2 4.27Å; L175-L206 HydrophobicContact CB-CG 4.04Å; L175-L206 HydrophobicContact CD1-CD1 4.43Å; L175-L206 HydrophobicContact CD1-CD2 4.3Å; L175-L206 HydrophobicContact CD1-CG 4.12Å
176	Q	90.9	Very high	92	Very high	110 Å²	110	52.3 Å²	52.3	51%	0.514	26%	0.264	S	S	.	.	H	α-helix	trans	-60.1	-41.3	176.9	-71.2	-65.1	-14	0	0	112.4	V174 I179 S180 L206	V174-Q176 VanDerWaalsContact C-N 3.28Å; V174-Q176 PolarHBondContact O-N 3.33Å; Q176-I179 PolarHBondContact O-N 3.27Å; Q176-S180 PolarHBondContact O-N 3.2Å; Q176-S180 VanDerWaalsContact O-N 3.09Å; Q176-L206 HydrophobicContact CG-CD1 3.85Å; Q176-L206 VanDerWaalsContact NE2-CD1 3.28Å
177	K	91	Very high	91.9	Very high	113 Å²	113	61.8 Å²	61.8	49%	0.491	30%	0.299	S	S	.	.	H	α-helix	trans	-69.1	-39	176.5	-68.2	-173	-178.4	-177.9	0	111	Y169 V174 L175 S180 D181	Y169-K177 HydrophobicContact CD1-CB 4.04Å; Y169-K177 HydrophobicContact CD1-CD 4.16Å; Y169-K177 HydrophobicContact CD2-CB 3.53Å; Y169-K177 HydrophobicContact CE1-CB 4.24Å; Y169-K177 HydrophobicContact CE1-CD 3.79Å; Y169-K177 HydrophobicContact CE2-CB 3.71Å; Y169-K177 HydrophobicContact CE2-CD 4.42Å; Y169-K177 HydrophobicContact CG-CB 3.72Å; V174-K177 HydrophobicContact CG1-CB 4.11Å; V174-K177 HydrophobicContact CG1-CD 3.78Å; V174-K177 HydrophobicContact CG1-CG 3.75Å; V174-K177 PolarHBondContact O-N 3.11Å; V174-K177 VanDerWaalsContact O-N 3.07Å; L175-K177 VanDerWaalsContact C-N 3.33Å; L175-K177 PolarHBondContact O-N 2.84Å; K177-S180 WeakPolarHBondContact O-CB 3.2Å; K177-S180 PolarHBondContact O-N 3.25Å; K177-D181 PolarHBondContact O-N 3.38Å; K177-D181 VanDerWaalsContact O-N 3.08Å
178	A	94	Very high	91.9	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-46.1	174.7	0	0	0	0	0	111.9	A166 V174 L175 S180 D181 I182 F202	A166-A178 HydrophobicContact CB-CB 4.21Å; V174-A178 PolarHBondContact O-N 3.34Å; L175-A178 WeakPolarHBondContact O-CB 3.4Å; L175-A178 PolarHBondContact O-N 3.09Å; A178-S180 VanDerWaalsContact C-N 3.32Å; A178-S180 PolarHBondContact O-N 3.13Å; A178-D181 PolarHBondContact O-N 2.9Å; A178-I182 VanDerWaalsContact O-CG1 3.28Å; A178-I182 WeakPolarHBondContact O-CG1 3.18Å; A178-I182 PolarHBondContact O-N 2.96Å; A178-F202 HydrophobicContact CB-CD2 3.81Å; A178-F202 HydrophobicContact CB-CE2 3.61Å
179	I	93.9	Very high	92.1	Very high	3 Å²	3	61.4 Å²	61.4	2%	0.015	30%	0.298	C	S	.	.	H	α-helix	trans	-59	-43.2	175.5	-67.4	163.1	0	0	0	110.9	L175 Q176 D181 I182 R183 F202 L206	L175-I179 VanDerWaalsContact O-CG1 3.31Å; L175-I179 WeakPolarHBondContact O-CG1 3.39Å; L175-I179 PolarHBondContact O-N 3.29Å; Q176-I179 PolarHBondContact O-N 3.27Å; I179-D181 PolarHBondContact O-N 3.41Å; I179-I182 PolarHBondContact O-N 2.73Å; I179-R183 HydrophobicContact CG2-CG 4.29Å; I179-R183 WeakPolarHBondContact O-CB 3.45Å; I179-R183 VanDerWaalsContact O-CG 3.31Å; I179-R183 WeakPolarHBondContact O-CG 3.48Å; I179-R183 PolarHBondContact O-N 2.88Å; I179-F202 HydrophobicContact CD1-CB 3.79Å; I179-F202 HydrophobicContact CG1-CB 3.55Å; I179-F202 HydrophobicContact CG1-CD2 4.21Å; I179-F202 HydrophobicContact CG1-CG 4.42Å; I179-L206 HydrophobicContact CD1-CD1 3.55Å
180	S	94.3	Very high	92	Very high	68 Å²	68	64.1 Å²	64.1	48%	0.476	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-44.1	178.7	-173.6	0	0	0	0	112.6	Q176 K177 A178 R183 S184	Q176-S180 PolarHBondContact O-N 3.2Å; Q176-S180 VanDerWaalsContact O-N 3.09Å; K177-S180 WeakPolarHBondContact O-CB 3.2Å; K177-S180 PolarHBondContact O-N 3.25Å; A178-S180 VanDerWaalsContact C-N 3.32Å; A178-S180 PolarHBondContact O-N 3.13Å; S180-R183 PolarHBondContact O-N 2.62Å; S180-S184 WeakPolarHBondContact O-CB 3.43Å; S180-S184 PolarHBondContact O-N 3.44Å; S180-S184 PolarHBondContact O-OG 3.12Å
181	D	94.8	Very high	91.9	Very high	4 Å²	4	66.1 Å²	66.1	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-67.7	-41.4	176.6	-91	-21	0	0	0	112.6	R162 R165 A166 Y169 K177 A178 I179 S184 A185	R162-D181 HydrophobicContact CB-CB 4.4Å; R162-D181 IonicContact NH1-OD1 3.92Å; R165-D181 WeakPolarHBondContact CB-OD2 3.3Å; R165-D181 IonicContact CZ-OD1 2.77Å; R165-D181 IonicContact CZ-OD2 2.8Å; R165-D181 IonicContact NE-OD1 3.53Å; R165-D181 IonicContact NE-OD2 3.55Å; R165-D181 PolarHBondContact NE-OD2 3.14Å; R165-D181 IonicContact NH2-OD1 3.48Å; R165-D181 PolarHBondContact NH2-OD1 3.48Å; R165-D181 IonicContact NH2-OD2 2.92Å; R165-D181 PolarHBondContact NH2-OD2 3.4Å; A166-D181 HydrophobicContact CB-CB 3.95Å; Y169-D181 WeakPolarHBondContact CE2-OD2 2.84Å; K177-D181 PolarHBondContact O-N 3.38Å; K177-D181 VanDerWaalsContact O-N 3.08Å; A178-D181 PolarHBondContact O-N 2.9Å; I179-D181 PolarHBondContact O-N 3.41Å; D181-S184 WeakPolarHBondContact O-CB 3.16Å; D181-S184 PolarHBondContact O-N 2.98Å; D181-A185 WeakPolarHBondContact O-CB 3.12Å; D181-A185 PolarHBondContact O-N 3.44Å
182	I	95.8	Very high	92.1	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-64.3	-42.1	176.7	-66.6	165.2	0	0	0	111	L163 A166 A178 I179 S184 A185 T186 A195 K198 A199 F202	L163-I182 HydrophobicContact CD2-CG1 4.02Å; L163-I182 HydrophobicContact CD2-CG2 4.49Å; A166-I182 HydrophobicContact CB-CD1 4.21Å; A166-I182 HydrophobicContact CB-CG1 3.75Å; A178-I182 VanDerWaalsContact O-CG1 3.28Å; A178-I182 WeakPolarHBondContact O-CG1 3.18Å; A178-I182 PolarHBondContact O-N 2.96Å; I179-I182 PolarHBondContact O-N 2.73Å; I182-S184 VanDerWaalsContact C-N 3.28Å; I182-S184 PolarHBondContact O-N 3.04Å; I182-A185 PolarHBondContact O-N 2.85Å; I182-T186 HydrophobicContact CG2-CG2 4.16Å; I182-T186 WeakPolarHBondContact O-CB 3.48Å; I182-T186 WeakPolarHBondContact O-CG2 3.23Å; I182-T186 PolarHBondContact O-N 3Å; I182-T186 PolarHBondContact O-OG1 3.1Å; I182-A195 HydrophobicContact CG2-CB 3.92Å; I182-A195 VanDerWaalsContact CG2-O 3.26Å; I182-A195 WeakPolarHBondContact CG2-O 3.46Å; I182-K198 HydrophobicContact CD1-CB 4.47Å; I182-K198 HydrophobicContact CD1-CG 4.22Å; I182-A199 HydrophobicContact CB-CB 4.18Å; I182-A199 HydrophobicContact CD1-CB 4.34Å; I182-A199 HydrophobicContact CG2-CB 3.64Å; I182-F202 HydrophobicContact CD1-CD2 3.82Å; I182-F202 HydrophobicContact CD1-CE2 3.62Å
183	R	94.1	Very high	92.4	Very high	142 Å²	142	55.4 Å²	55.4	54%	0.536	29%	0.291	S	S	.	.	H	α-helix	trans	-59.6	-41.4	173.7	-77.2	176.6	176.4	169.2	1.9	111.5	I179 S180 T186 R187	I179-R183 HydrophobicContact CG2-CG 4.29Å; I179-R183 WeakPolarHBondContact O-CB 3.45Å; I179-R183 VanDerWaalsContact O-CG 3.31Å; I179-R183 WeakPolarHBondContact O-CG 3.48Å; I179-R183 PolarHBondContact O-N 2.88Å; S180-R183 PolarHBondContact O-N 2.62Å; R183-T186 WeakPolarHBondContact CA-OG1 3.47Å; R183-T186 PolarHBondContact O-OG1 2.99Å; R183-T186 VanDerWaalsContact O-OG1 3.07Å; R183-R187 WeakPolarHBondContact O-CG 3.34Å; R183-R187 PolarHBondContact O-N 3.12Å; R183-R187 VanDerWaalsContact O-N 3.08Å
184	S	94.2	Very high	92.8	Very high	28 Å²	28	60.7 Å²	60.7	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-66.4	-40.1	176.5	-59.5	0	0	0	0	111.8	S180 D181 I182 L188	S180-S184 WeakPolarHBondContact O-CB 3.43Å; S180-S184 PolarHBondContact O-N 3.44Å; S180-S184 PolarHBondContact O-OG 3.12Å; D181-S184 WeakPolarHBondContact O-CB 3.16Å; D181-S184 PolarHBondContact O-N 2.98Å; I182-S184 VanDerWaalsContact C-N 3.28Å; I182-S184 PolarHBondContact O-N 3.04Å; S184-L188 WeakPolarHBondContact O-CG 3.46Å; S184-L188 PolarHBondContact O-N 2.93Å
185	A	95.5	Very high	93.1	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-68	-39.5	176.9	0	0	0	0	0	112.7	A159 R162 L163 D181 I182 L188 V189	A159-A185 HydrophobicContact CB-CB 4.12Å; R162-A185 HydrophobicContact CB-CB 4.15Å; L163-A185 HydrophobicContact CD1-CB 4.49Å; L163-A185 HydrophobicContact CD2-CB 3.82Å; L163-A185 HydrophobicContact CG-CB 3.8Å; D181-A185 WeakPolarHBondContact O-CB 3.12Å; D181-A185 PolarHBondContact O-N 3.44Å; I182-A185 PolarHBondContact O-N 2.85Å; A185-L188 CarbonylContact O-C 3.58Å; A185-L188 WeakPolarHBondContact O-CA 3.47Å; A185-L188 WeakPolarHBondContact O-CB 3.27Å; A185-L188 PolarHBondContact O-N 3.27Å; A185-L188 VanDerWaalsContact O-N 3.08Å; A185-V189 PolarHBondContact O-N 3.15Å
186	T	94.1	Very high	93.3	Very high	18 Å²	18	58.3 Å²	58.3	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-73.5	-27.2	179	48.3	0	0	0	0	112.4	I182 R183 L188 V189 P190 A195 L196	I182-T186 HydrophobicContact CG2-CG2 4.16Å; I182-T186 WeakPolarHBondContact O-CB 3.48Å; I182-T186 WeakPolarHBondContact O-CG2 3.23Å; I182-T186 PolarHBondContact O-N 3Å; I182-T186 PolarHBondContact O-OG1 3.1Å; R183-T186 WeakPolarHBondContact CA-OG1 3.47Å; R183-T186 PolarHBondContact O-OG1 2.99Å; R183-T186 VanDerWaalsContact O-OG1 3.07Å; T186-L188 PolarHBondContact O-N 3.47Å; T186-V189 CarbonylContact O-C 3.27Å; T186-V189 PolarHBondContact O-N 3.38Å; T186-P190 WeakPolarHBondContact O-CA 3.17Å; T186-P190 VanDerWaalsContact O-N 3.1Å; T186-A195 HydrophobicContact CG2-CB 3.83Å; T186-L196 HydrophobicContact CG2-CD2 3.77Å; T186-L196 HydrophobicContact CG2-CG 3.85Å
187	R	92.7	Very high	93.5	Very high	200 Å²	200	55.3 Å²	55.3	76%	0.755	27%	0.269	S	S	*	.	H	α-helix	trans	-62.9	-33.3	165.1	-72.2	174.3	-171.2	170.6	1.6	112.4	R183	R183-R187 WeakPolarHBondContact O-CG 3.34Å; R183-R187 PolarHBondContact O-N 3.12Å; R183-R187 VanDerWaalsContact O-N 3.08Å
188	L	91.9	Very high	93.6	Very high	34 Å²	34	52.5 Å²	52.5	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-82.6	-28	177.2	-64.7	165.8	0	0	0	112.3	K77 W157 A159 S184 A185 T186	K77-L188 WeakPolarHBondContact CE-O 3.48Å; K77-L188 PolarHBondContact NZ-O 3.46Å; W157-L188 HydrophobicContact CB-CD2 4.09Å; W157-L188 HydrophobicContact CG-CD2 4.41Å; A159-L188 HydrophobicContact CB-CB 4.07Å; A159-L188 HydrophobicContact CB-CD1 4.32Å; S184-L188 WeakPolarHBondContact O-CG 3.46Å; S184-L188 PolarHBondContact O-N 2.93Å; A185-L188 CarbonylContact O-C 3.58Å; A185-L188 WeakPolarHBondContact O-CA 3.47Å; A185-L188 WeakPolarHBondContact O-CB 3.27Å; A185-L188 PolarHBondContact O-N 3.27Å; A185-L188 VanDerWaalsContact O-N 3.08Å; T186-L188 PolarHBondContact O-N 3.47Å
189	V	91.9	Very high	93.6	Very high	53 Å²	53	53 Å²	53	32%	0.321	26%	0.261	S	S	.	.	S	Bend	trans	-139.4	84.2	178.9	-176	0	0	0	0	107.7	A159 A185 T186 D191 N192	A159-V189 HydrophobicContact CB-CG2 3.74Å; A185-V189 PolarHBondContact O-N 3.15Å; T186-V189 CarbonylContact O-C 3.27Å; T186-V189 PolarHBondContact O-N 3.38Å; V189-D191 VanDerWaalsContact C-N 3.28Å; V189-D191 WeakPolarHBondContact CG1-OD1 3.16Å; V189-D191 PolarHBondContact O-N 3.38Å; V189-N192 HydrophobicContact CB-CB 4.47Å; V189-N192 HydrophobicContact CG1-CB 4.1Å; V189-N192 WeakPolarHBondContact O-CB 3.34Å; V189-N192 PolarHBondContact O-N 3.16Å
190	P	90	Very high	93.6	Very high	77 Å²	77	53 Å²	53	50%	0.5	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.6	-170.7	-25.2	35.9	0	0	0	114.6	T186 N192 I221	T186-P190 WeakPolarHBondContact O-CA 3.17Å; T186-P190 VanDerWaalsContact O-N 3.1Å; P190-N192 PolarHBondContact O-N 3.3Å; P190-I221 WeakPolarHBondContact O-CD1 3.43Å
191	D	91.2	Very high	93.5	Very high	113 Å²	113	53.1 Å²	53.1	60%	0.604	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	5.9	-179.3	59.9	-29.1	0	0	0	114	V189 T193 I221	V189-D191 VanDerWaalsContact C-N 3.28Å; V189-D191 WeakPolarHBondContact CG1-OD1 3.16Å; V189-D191 PolarHBondContact O-N 3.38Å; D191-T193 VanDerWaalsContact C-N 3.32Å; D191-T193 PolarHBondContact O-N 3.16Å; D191-I221 HydrophobicContact CB-CG2 4.42Å
192	N	93	Very high	93.3	Very high	42 Å²	42	53.1 Å²	53.1	23%	0.225	25%	0.254	C	S	.	.			trans	-80.3	78.2	178.2	-166.6	-23.5	0	0	0	112.1	V189 P190 K194 A195 L196	V189-N192 HydrophobicContact CB-CB 4.47Å; V189-N192 HydrophobicContact CG1-CB 4.1Å; V189-N192 WeakPolarHBondContact O-CB 3.34Å; V189-N192 PolarHBondContact O-N 3.16Å; P190-N192 PolarHBondContact O-N 3.3Å; N192-K194 VanDerWaalsContact C-N 3.33Å; N192-K194 PolarHBondContact O-N 3.39Å; N192-A195 HydrophobicContact CB-CB 4.11Å; N192-A195 VanDerWaalsContact CG-CB 3.45Å; N192-A195 PolarHBondContact O-N 2.05Å; N192-A195 VanDerWaalsContact OD1-CB 3.31Å; N192-A195 WeakPolarHBondContact OD1-CB 3.47Å; N192-A195 PolarHBondContact OD1-N 3.29Å; N192-L196 PolarHBondContact O-N 3.34Å; N192-L196 VanDerWaalsContact O-N 3.16Å
193	T	93.1	Very high	93.1	Very high	22 Å²	22	53.8 Å²	53.8	14%	0.135	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-37.6	-178.1	63.4	0	0	0	0	113.1	D191 A195 L196 Y197 I221 D222 Q225	D191-T193 VanDerWaalsContact C-N 3.32Å; D191-T193 PolarHBondContact O-N 3.16Å; T193-A195 VanDerWaalsContact C-N 3.32Å; T193-A195 PolarHBondContact O-N 3.28Å; T193-L196 PolarHBondContact O-N 2.82Å; T193-Y197 WeakPolarHBondContact O-CB 3.41Å; T193-Y197 PolarHBondContact O-N 2.88Å; T193-I221 HydrophobicContact CG2-CB 3.91Å; T193-I221 HydrophobicContact CG2-CG2 3.5Å; T193-I221 VanDerWaalsContact CG2-CG2 3.5Å; T193-D222 HydrophobicContact CG2-CB 3.94Å; T193-Q225 PolarHBondContact OG1-OE1 3.08Å
194	K	93.8	Very high	92.9	Very high	163 Å²	163	47.6 Å²	47.6	71%	0.709	24%	0.236	S	C	*	.	H	α-helix	trans	-58.7	-42.3	175.2	-68.2	-177.8	179.5	178.3	0	112.2	N192 K198	N192-K194 VanDerWaalsContact C-N 3.33Å; N192-K194 PolarHBondContact O-N 3.39Å; K194-K198 WeakPolarHBondContact O-CB 3.32Å; K194-K198 PolarHBondContact O-N 3.44Å
195	A	94.9	Very high	92.4	Very high	6 Å²	6	50.5 Å²	50.5	5%	0.05	25%	0.247	C	C	.	.	H	α-helix	trans	-68	-43.2	177.3	0	0	0	0	0	111.4	L163 I182 T186 N192 T193 Y197 K198 A199	L163-A195 HydrophobicContact CD2-CB 3.9Å; I182-A195 HydrophobicContact CG2-CB 3.92Å; I182-A195 VanDerWaalsContact CG2-O 3.26Å; I182-A195 WeakPolarHBondContact CG2-O 3.46Å; T186-A195 HydrophobicContact CG2-CB 3.83Å; N192-A195 HydrophobicContact CB-CB 4.11Å; N192-A195 VanDerWaalsContact CG-CB 3.45Å; N192-A195 PolarHBondContact O-N 2.05Å; N192-A195 VanDerWaalsContact OD1-CB 3.31Å; N192-A195 WeakPolarHBondContact OD1-CB 3.47Å; N192-A195 PolarHBondContact OD1-N 3.29Å; T193-A195 VanDerWaalsContact C-N 3.32Å; T193-A195 PolarHBondContact O-N 3.28Å; A195-Y197 VanDerWaalsContact C-N 3.34Å; A195-Y197 PolarHBondContact O-N 3.24Å; A195-K198 PolarHBondContact O-N 3.5Å; A195-A199 PolarHBondContact O-N 3.18Å
196	L	94.3	Very high	91.7	Very high	26 Å²	26	52.8 Å²	52.8	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-41.3	175.6	-70	170.7	0	0	0	112.7	T186 N192 T193 A199 S200 C218 I221	T186-L196 HydrophobicContact CG2-CD2 3.77Å; T186-L196 HydrophobicContact CG2-CG 3.85Å; N192-L196 PolarHBondContact O-N 3.34Å; N192-L196 VanDerWaalsContact O-N 3.16Å; T193-L196 PolarHBondContact O-N 2.82Å; L196-A199 PolarHBondContact O-N 3.46Å; L196-S200 WeakPolarHBondContact O-CB 3.31Å; L196-S200 PolarHBondContact O-N 2.97Å; L196-S200 PolarHBondContact O-OG 3.25Å; L196-C218 HydrophobicContact CB-CB 4.17Å; L196-I221 HydrophobicContact CD1-CD1 3.21Å
197	Y	94.8	Very high	90.8	Very high	47 Å²	47	54.3 Å²	54.3	18%	0.184	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-50.7	173	-179.7	-112	0	0	0	111.2	T193 A195 A199 S200 Q201 I215 E227 C228 F231	T193-Y197 WeakPolarHBondContact O-CB 3.41Å; T193-Y197 PolarHBondContact O-N 2.88Å; A195-Y197 VanDerWaalsContact C-N 3.34Å; A195-Y197 PolarHBondContact O-N 3.24Å; Y197-A199 PolarHBondContact O-N 3.02Å; Y197-S200 CarbonylContact O-C 3.58Å; Y197-S200 WeakPolarHBondContact O-CA 3.42Å; Y197-S200 VanDerWaalsContact O-CB 3.31Å; Y197-S200 WeakPolarHBondContact O-CB 3.45Å; Y197-S200 PolarHBondContact O-N 2.86Å; Y197-Q201 HydrophobicContact CD1-CG 4.39Å; Y197-Q201 HydrophobicContact CE1-CG 4.01Å; Y197-Q201 HydrophobicContact CE2-CG 4.34Å; Y197-Q201 PolarHBondContact O-N 3.47Å; Y197-Q201 PolarHBondContact OH-NE2 3.37Å; Y197-I215 HydrophobicContact CD2-CD1 3.93Å; Y197-E227 HydrophobicContact CE1-CB 4.38Å; Y197-E227 HydrophobicContact CE2-CB 4.16Å; Y197-E227 WeakPolarHBondContact CE2-O 3.49Å; Y197-C228 VanDerWaalsContact CD2-SG 3.58Å; Y197-F231 HydrophobicContact CD2-CD1 4.38Å; Y197-F231 HydrophobicContact CE2-CB 3.81Å; Y197-F231 AromaticContact CE2-CD1 3.92Å; Y197-F231 HydrophobicContact CE2-CD1 3.92Å; Y197-F231 HydrophobicContact CE2-CG 4.05Å
198	K	94.2	Very high	90.1	Very high	55 Å²	55	45 Å²	45	24%	0.239	23%	0.233	C	C	.	.	H	α-helix	trans	-61.5	-42.4	179.2	-170.6	163.6	-177.8	165.8	0	112.8	E170 I182 K194 A195 S200 Q201 F202	E170-K198 VanDerWaalsContact CD-CE 3.47Å; E170-K198 VanDerWaalsContact OE1-CE 3.3Å; E170-K198 WeakPolarHBondContact OE1-CE 3.4Å; E170-K198 IonicContact OE1-NZ 3.63Å; E170-K198 PolarHBondContact OE1-NZ 2.83Å; E170-K198 WeakPolarHBondContact OE2-CE 3.31Å; E170-K198 IonicContact OE2-NZ 2.62Å; E170-K198 PolarHBondContact OE2-NZ 2.96Å; I182-K198 HydrophobicContact CD1-CB 4.47Å; I182-K198 HydrophobicContact CD1-CG 4.22Å; K194-K198 WeakPolarHBondContact O-CB 3.32Å; K194-K198 PolarHBondContact O-N 3.44Å; A195-K198 PolarHBondContact O-N 3.5Å; K198-S200 VanDerWaalsContact C-N 3.25Å; K198-S200 PolarHBondContact O-N 3.35Å; K198-Q201 PolarHBondContact O-N 2.87Å; K198-F202 HydrophobicContact CD-CE2 4.45Å; K198-F202 HydrophobicContact CD-CZ 4.08Å; K198-F202 HydrophobicContact CG-CD2 4.49Å; K198-F202 HydrophobicContact CG-CE1 4.03Å; K198-F202 HydrophobicContact CG-CE2 3.88Å; K198-F202 HydrophobicContact CG-CZ 3.65Å; K198-F202 VanDerWaalsContact O-CG 3.32Å; K198-F202 WeakPolarHBondContact O-CG 3.31Å; K198-F202 PolarHBondContact O-N 2.89Å
199	A	93.6	Very high	89.1	Confident	10 Å²	10	48.6 Å²	48.6	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-35.5	172.7	0	0	0	0	0	112.5	I182 A195 L196 Y197 F202 S203	I182-A199 HydrophobicContact CB-CB 4.18Å; I182-A199 HydrophobicContact CD1-CB 4.34Å; I182-A199 HydrophobicContact CG2-CB 3.64Å; A195-A199 PolarHBondContact O-N 3.18Å; L196-A199 PolarHBondContact O-N 3.46Å; Y197-A199 PolarHBondContact O-N 3.02Å; A199-F202 PolarHBondContact O-N 2.97Å; A199-S203 WeakPolarHBondContact O-CB 3.45Å; A199-S203 PolarHBondContact O-N 3.18Å; A199-S203 PolarHBondContact O-OG 3.39Å
200	S	93	Very high	88.3	Confident	3 Å²	3	49 Å²	49	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-69	-41	175.4	-56.5	0	0	0	0	111.4	L196 Y197 K198 F202 S203 Y204 T211 G214 I215	L196-S200 WeakPolarHBondContact O-CB 3.31Å; L196-S200 PolarHBondContact O-N 2.97Å; L196-S200 PolarHBondContact O-OG 3.25Å; Y197-S200 CarbonylContact O-C 3.58Å; Y197-S200 WeakPolarHBondContact O-CA 3.42Å; Y197-S200 VanDerWaalsContact O-CB 3.31Å; Y197-S200 WeakPolarHBondContact O-CB 3.45Å; Y197-S200 PolarHBondContact O-N 2.86Å; K198-S200 VanDerWaalsContact C-N 3.25Å; K198-S200 PolarHBondContact O-N 3.35Å; S200-F202 PolarHBondContact O-N 3.48Å; S200-S203 PolarHBondContact O-N 3.09Å; S200-Y204 VanDerWaalsContact O-CB 3.28Å; S200-Y204 WeakPolarHBondContact O-CB 3.26Å; S200-Y204 PolarHBondContact O-N 3.41Å; S200-T211 WeakPolarHBondContact O-CG2 3.36Å; S200-G214 VanDerWaalsContact OG-C 3.3Å; S200-I215 PolarHBondContact OG-N 3.38Å
201	Q	92.2	Very high	88.1	Confident	70 Å²	70	45.5 Å²	45.5	33%	0.327	23%	0.23	S	C	.	.	H	α-helix	trans	-60.9	-43.4	172.7	-67.1	-179.1	-59.7	0	0	111.9	Y197 K198 Y204 M205 F231	Y197-Q201 HydrophobicContact CD1-CG 4.39Å; Y197-Q201 HydrophobicContact CE1-CG 4.01Å; Y197-Q201 HydrophobicContact CE2-CG 4.34Å; Y197-Q201 PolarHBondContact O-N 3.47Å; Y197-Q201 PolarHBondContact OH-NE2 3.37Å; K198-Q201 PolarHBondContact O-N 2.87Å; Q201-Y204 WeakPolarHBondContact O-CB 3.13Å; Q201-Y204 PolarHBondContact O-N 3.18Å; Q201-M205 PolarHBondContact O-N 2.93Å; Q201-M205 VanDerWaalsContact O-N 3.09Å; Q201-F231 HydrophobicContact CG-CE1 4.43Å
202	F	92.1	Very high	88	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-42	176.2	-63.4	-13.8	0	0	0	112.6	E170 L175 A178 I179 I182 K198 A199 S200 Y204 M205 L206	E170-F202 HydrophobicContact CB-CE1 4.39Å; E170-F202 HydrophobicContact CB-CE2 4.36Å; E170-F202 HydrophobicContact CB-CZ 3.7Å; E170-F202 VanDerWaalsContact CD-CZ 3.45Å; E170-F202 HydrophobicContact CG-CE1 3.86Å; E170-F202 HydrophobicContact CG-CZ 3.59Å; E170-F202 WeakPolarHBondContact OE1-CE1 3.45Å; E170-F202 WeakPolarHBondContact OE1-CZ 3.02Å; L175-F202 HydrophobicContact CB-CB 4.45Å; L175-F202 HydrophobicContact CD2-CD1 3.91Å; L175-F202 HydrophobicContact CD2-CE1 4.15Å; L175-F202 HydrophobicContact CD2-CG 4.11Å; A178-F202 HydrophobicContact CB-CD2 3.81Å; A178-F202 HydrophobicContact CB-CE2 3.61Å; I179-F202 HydrophobicContact CD1-CB 3.79Å; I179-F202 HydrophobicContact CG1-CB 3.55Å; I179-F202 HydrophobicContact CG1-CD2 4.21Å; I179-F202 HydrophobicContact CG1-CG 4.42Å; I182-F202 HydrophobicContact CD1-CD2 3.82Å; I182-F202 HydrophobicContact CD1-CE2 3.62Å; K198-F202 HydrophobicContact CD-CE2 4.45Å; K198-F202 HydrophobicContact CD-CZ 4.08Å; K198-F202 HydrophobicContact CG-CD2 4.49Å; K198-F202 HydrophobicContact CG-CE1 4.03Å; K198-F202 HydrophobicContact CG-CE2 3.88Å; K198-F202 HydrophobicContact CG-CZ 3.65Å; K198-F202 VanDerWaalsContact O-CG 3.32Å; K198-F202 WeakPolarHBondContact O-CG 3.31Å; K198-F202 PolarHBondContact O-N 2.89Å; A199-F202 PolarHBondContact O-N 2.97Å; S200-F202 PolarHBondContact O-N 3.48Å; F202-Y204 PolarHBondContact O-N 3.02Å; F202-M205 HydrophobicContact CD1-CE 3.51Å; F202-M205 HydrophobicContact CE1-CE 4.16Å; F202-M205 HydrophobicContact CG-CE 4.48Å; F202-M205 PolarHBondContact O-N 3.22Å; F202-L206 WeakPolarHBondContact O-CG 3.45Å; F202-L206 PolarHBondContact O-N 3.07Å
203	S	90.5	Very high	87.8	Confident	15 Å²	15	48.4 Å²	48.4	11%	0.105	23%	0.23	C	C	.	.	H	α-helix	trans	-63.3	-35.9	175.7	-57.1	0	0	0	0	110.6	A199 S200 L206 V207 T211	A199-S203 WeakPolarHBondContact O-CB 3.45Å; A199-S203 PolarHBondContact O-N 3.18Å; A199-S203 PolarHBondContact O-OG 3.39Å; S200-S203 PolarHBondContact O-N 3.09Å; S203-L206 PolarHBondContact O-N 3.01Å; S203-V207 CarbonylContact O-C 3.47Å; S203-V207 VanDerWaalsContact O-C 3.27Å; S203-V207 PolarHBondContact O-N 2.99Å; S203-T211 PolarHBondContact O-OG1 3.25Å
204	Y	89.6	Confident	87.5	Confident	13 Å²	13	48.6 Å²	48.6	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-44.6	176.6	-176.4	-116.9	0	0	0	113.2	S200 Q201 F202 L206 F208 T211 F231 L235 L238 E268 V271	S200-Y204 VanDerWaalsContact O-CB 3.28Å; S200-Y204 WeakPolarHBondContact O-CB 3.26Å; S200-Y204 PolarHBondContact O-N 3.41Å; Q201-Y204 WeakPolarHBondContact O-CB 3.13Å; Q201-Y204 PolarHBondContact O-N 3.18Å; F202-Y204 PolarHBondContact O-N 3.02Å; Y204-L206 PolarHBondContact O-N 3.07Å; Y204-F208 HydrophobicContact CD2-CB 3.52Å; Y204-F208 HydrophobicContact CE2-CB 3.53Å; Y204-F208 HydrophobicContact CE2-CG 4.49Å; Y204-T211 VanDerWaalsContact CA-OG1 3.31Å; Y204-T211 WeakPolarHBondContact CA-OG1 3.28Å; Y204-T211 PolarHBondContact N-OG1 2.94Å; Y204-T211 VanDerWaalsContact N-OG1 3.11Å; Y204-F231 HydrophobicContact CD1-CE2 4.05Å; Y204-F231 HydrophobicContact CD1-CZ 4.03Å; Y204-F231 HydrophobicContact CD2-CZ 4.29Å; Y204-F231 HydrophobicContact CE1-CE2 4.41Å; Y204-F231 HydrophobicContact CG-CE2 4.14Å; Y204-F231 AromaticContact CG-CZ 3.74Å; Y204-F231 HydrophobicContact CG-CZ 3.74Å; Y204-L235 HydrophobicContact CD2-CD2 3.29Å; Y204-L235 HydrophobicContact CE2-CD2 3.43Å; Y204-L235 VanDerWaalsContact CE2-CD2 3.43Å; Y204-L235 HydrophobicContact CG-CD2 4.25Å; Y204-L238 HydrophobicContact CE2-CD1 4.25Å; Y204-L238 WeakPolarHBondContact OH-CD1 3.42Å; Y204-E268 WeakPolarHBondContact CE1-OE1 3.35Å; Y204-E268 VanDerWaalsContact CZ-OE1 3.26Å; Y204-E268 WeakPolarHBondContact OH-CG 3.47Å; Y204-E268 PolarHBondContact OH-OE1 3.3Å; Y204-V271 HydrophobicContact CE1-CG1 4.34Å; Y204-V271 HydrophobicContact CE1-CG2 3.64Å
205	M	84.6	Confident	87.5	Confident	88 Å²	88	40.9 Å²	40.9	43%	0.433	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-26.2	175.6	-70.5	-172.5	-75.3	0	0	112.8	L175 Q201 F202 N273	L175-M205 HydrophobicContact CD1-CB 3.87Å; L175-M205 HydrophobicContact CD1-CE 3.71Å; L175-M205 HydrophobicContact CD1-SD 4.23Å; L175-M205 HydrophobicContact CD2-CE 4.15Å; Q201-M205 PolarHBondContact O-N 2.93Å; Q201-M205 VanDerWaalsContact O-N 3.09Å; F202-M205 HydrophobicContact CD1-CE 3.51Å; F202-M205 HydrophobicContact CE1-CE 4.16Å; F202-M205 HydrophobicContact CG-CE 4.48Å; F202-M205 PolarHBondContact O-N 3.22Å; M205-N273 PolarHBondContact O-ND2 3.45Å
206	L	80.1	Confident	87.4	Confident	49 Å²	49	47 Å²	47	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-98.1	-48.7	-176.8	-67.7	166.4	0	0	0	114	L175 Q176 I179 F202 S203 Y204 N273	L175-L206 HydrophobicContact CB-CD1 3.49Å; L175-L206 VanDerWaalsContact CB-CD1 3.49Å; L175-L206 HydrophobicContact CB-CD2 4.27Å; L175-L206 HydrophobicContact CB-CG 4.04Å; L175-L206 HydrophobicContact CD1-CD1 4.43Å; L175-L206 HydrophobicContact CD1-CD2 4.3Å; L175-L206 HydrophobicContact CD1-CG 4.12Å; Q176-L206 HydrophobicContact CG-CD1 3.85Å; Q176-L206 VanDerWaalsContact NE2-CD1 3.28Å; I179-L206 HydrophobicContact CD1-CD1 3.55Å; F202-L206 WeakPolarHBondContact O-CG 3.45Å; F202-L206 PolarHBondContact O-N 3.07Å; S203-L206 PolarHBondContact O-N 3.01Å; Y204-L206 PolarHBondContact O-N 3.07Å; L206-N273 WeakPolarHBondContact CA-ND2 3.35Å; L206-N273 PolarHBondContact O-ND2 3.11Å
207	V	76.1	Confident	87.2	Confident	50 Å²	50	50.1 Å²	50.1	30%	0.303	24%	0.239	S	C	.	.			trans	-150.1	79.4	-172.1	-171.6	0	0	0	0	109.2	S203 F209 S210 T211	S203-V207 CarbonylContact O-C 3.47Å; S203-V207 VanDerWaalsContact O-C 3.27Å; S203-V207 PolarHBondContact O-N 2.99Å; V207-F209 VanDerWaalsContact C-N 3.33Å; V207-F209 HydrophobicContact CG1-CD1 3.9Å; V207-F209 HydrophobicContact CG1-CD2 4.23Å; V207-F209 HydrophobicContact CG1-CE1 3.35Å; V207-F209 HydrophobicContact CG1-CE2 3.72Å; V207-F209 HydrophobicContact CG1-CG 4.31Å; V207-F209 HydrophobicContact CG1-CZ 3.24Å; V207-F209 PolarHBondContact O-N 3.34Å; V207-S210 PolarHBondContact O-N 3.37Å; V207-S210 PolarHBondContact O-OG 3.3Å; V207-T211 PolarHBondContact O-OG1 3.33Å
208	F	77.5	Confident	87.2	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.018	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-57.9	-38.2	-168.9	78.5	-93.2	0	0	0	114.8	Y204 S210 T211 H242 M264 V274 L277	Y204-F208 HydrophobicContact CD2-CB 3.52Å; Y204-F208 HydrophobicContact CE2-CB 3.53Å; Y204-F208 HydrophobicContact CE2-CG 4.49Å; F208-S210 PolarHBondContact O-N 3.44Å; F208-T211 VanDerWaalsContact O-CB 3.28Å; F208-T211 WeakPolarHBondContact O-CB 3.26Å; F208-T211 PolarHBondContact O-N 3.03Å; F208-T211 VanDerWaalsContact O-N 3.13Å; F208-T211 PolarHBondContact O-OG1 3.07Å; F208-H242 HydrophobicContact CE2-CB 4.07Å; F208-H242 HydrophobicContact CZ-CB 4.18Å; F208-H242 AromaticContact CZ-CD2 3.49Å; F208-H242 VanDerWaalsContact CZ-CD2 3.49Å; F208-H242 WeakPolarHBondContact CZ-CD2 2.98Å; F208-H242 AromaticContact CZ-CG 3.9Å; F208-M264 HydrophobicContact CE1-CE 4.25Å; F208-M264 HydrophobicContact CE2-CE 3.87Å; F208-M264 HydrophobicContact CZ-CE 3.57Å; F208-V274 HydrophobicContact CD1-CG2 3.94Å; F208-V274 HydrophobicContact CE1-CG2 4.32Å; F208-V274 HydrophobicContact CG-CG2 4.28Å; F208-L277 HydrophobicContact CE1-CB 4.49Å; F208-L277 HydrophobicContact CE1-CD1 3.93Å; F208-L277 HydrophobicContact CE1-CD2 4.18Å; F208-L277 HydrophobicContact CE1-CG 4.41Å; F208-L277 HydrophobicContact CZ-CD1 4.27Å; F208-L277 HydrophobicContact CZ-CD2 4.1Å
209	F	70.3	Confident	87.2	Confident	111 Å²	111	46.4 Å²	46.4	49%	0.487	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-65.9	-27.7	-174.9	58.2	-96.3	0	0	0	112.5	V207	V207-F209 VanDerWaalsContact C-N 3.33Å; V207-F209 HydrophobicContact CG1-CD1 3.9Å; V207-F209 HydrophobicContact CG1-CD2 4.23Å; V207-F209 HydrophobicContact CG1-CE1 3.35Å; V207-F209 HydrophobicContact CG1-CE2 3.72Å; V207-F209 HydrophobicContact CG1-CG 4.31Å; V207-F209 HydrophobicContact CG1-CZ 3.24Å; V207-F209 PolarHBondContact O-N 3.34Å
210	S	75	Confident	87.2	Confident	62 Å²	62	53.7 Å²	53.7	43%	0.434	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-82.3	-14.4	178.3	73.4	0	0	0	0	113.9	V207 F208 L212	V207-S210 PolarHBondContact O-N 3.37Å; V207-S210 PolarHBondContact O-OG 3.3Å; F208-S210 PolarHBondContact O-N 3.44Å; S210-L212 VanDerWaalsContact C-N 3.32Å; S210-L212 PolarHBondContact O-N 2.86Å
211	T	86.7	Confident	87.1	Confident	2 Å²	2	57 Å²	57	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-69.3	-27.7	-172.1	-58.6	0	0	0	0	113.4	S200 S203 Y204 V207 F208 R213 G214 I215 F231 L235	S200-T211 WeakPolarHBondContact O-CG2 3.36Å; S203-T211 PolarHBondContact O-OG1 3.25Å; Y204-T211 VanDerWaalsContact CA-OG1 3.31Å; Y204-T211 WeakPolarHBondContact CA-OG1 3.28Å; Y204-T211 PolarHBondContact N-OG1 2.94Å; Y204-T211 VanDerWaalsContact N-OG1 3.11Å; V207-T211 PolarHBondContact O-OG1 3.33Å; F208-T211 VanDerWaalsContact O-CB 3.28Å; F208-T211 WeakPolarHBondContact O-CB 3.26Å; F208-T211 PolarHBondContact O-N 3.03Å; F208-T211 VanDerWaalsContact O-N 3.13Å; F208-T211 PolarHBondContact O-OG1 3.07Å; T211-R213 PolarHBondContact O-N 3.46Å; T211-R213 VanDerWaalsContact O-N 3.08Å; T211-G214 PolarHBondContact O-N 3.16Å; T211-I215 PolarHBondContact O-N 3.2Å; T211-F231 HydrophobicContact CG2-CE1 4.18Å; T211-F231 HydrophobicContact CG2-CZ 4.46Å; T211-L235 HydrophobicContact CG2-CD1 3.75Å; T211-L235 HydrophobicContact CG2-CD2 4.32Å
212	L	89	Confident	87.2	Confident	17 Å²	17	56.6 Å²	56.6	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-58.7	-29	-175	-166.3	65.4	0	0	0	112.6	S210 I215 R216 Y232 L235 V239	S210-L212 VanDerWaalsContact C-N 3.32Å; S210-L212 PolarHBondContact O-N 2.86Å; L212-I215 HydrophobicContact CD1-CG2 4.22Å; L212-I215 WeakPolarHBondContact O-CG2 3.47Å; L212-R216 WeakPolarHBondContact O-CD 3.1Å; L212-R216 VanDerWaalsContact O-CG 3.23Å; L212-R216 WeakPolarHBondContact O-CG 3.3Å; L212-R216 PolarHBondContact O-N 3.38Å; L212-Y232 HydrophobicContact CD1-CD2 3.82Å; L212-Y232 HydrophobicContact CD1-CE2 3.88Å; L212-L235 HydrophobicContact CD1-CB 3.97Å; L212-V239 HydrophobicContact CD2-CB 4.46Å; L212-V239 HydrophobicContact CD2-CG1 4.27Å; L212-V239 HydrophobicContact CD2-CG2 4.41Å
213	R	87.7	Confident	87.2	Confident	199 Å²	199	60.4 Å²	60.4	75%	0.751	30%	0.297	S	S	*	.	H	α-helix	trans	-66.5	-47.5	173.3	-171.3	-177.2	-63.2	-178.4	0.8	111.5	T211 I215 R216 E217	T211-R213 PolarHBondContact O-N 3.46Å; T211-R213 VanDerWaalsContact O-N 3.08Å; R213-I215 PolarHBondContact O-N 3.22Å; R213-R216 PolarHBondContact O-N 3.05Å; R213-E217 PolarHBondContact O-N 3.41Å
214	G	88.5	Confident	87.2	Confident	27 Å²	27	66.9 Å²	66.9	28%	0.278	33%	0.331	S	S	.	.	H	α-helix	trans	-62	-41.9	-178	0	0	0	0	0	113	S200 T211 R216 E217 C218	S200-G214 VanDerWaalsContact OG-C 3.3Å; T211-G214 PolarHBondContact O-N 3.16Å; G214-R216 VanDerWaalsContact C-N 3.34Å; G214-R216 PolarHBondContact O-N 3.24Å; G214-E217 PolarHBondContact O-N 2.83Å; G214-C218 PolarHBondContact O-N 3.4Å
215	I	93.3	Very high	87.4	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-72.2	-28.6	-179.4	-161.2	58.6	0	0	0	112.9	Y197 S200 T211 L212 R213 E217 C218 L219 C228 F231 Y232 L235	Y197-I215 HydrophobicContact CD2-CD1 3.93Å; S200-I215 PolarHBondContact OG-N 3.38Å; T211-I215 PolarHBondContact O-N 3.2Å; L212-I215 HydrophobicContact CD1-CG2 4.22Å; L212-I215 WeakPolarHBondContact O-CG2 3.47Å; R213-I215 PolarHBondContact O-N 3.22Å; I215-E217 VanDerWaalsContact C-N 3.33Å; I215-C218 HydrophobicContact CD1-CB 4.18Å; I215-C218 WeakPolarHBondContact O-CB 3.35Å; I215-C218 PolarHBondContact O-N 3.02Å; I215-L219 PolarHBondContact O-N 3.08Å; I215-L219 VanDerWaalsContact O-N 3.16Å; I215-C228 HydrophobicContact CD1-CB 3.84Å; I215-F231 HydrophobicContact CD1-CD1 3.71Å; I215-F231 HydrophobicContact CG1-CD1 3.94Å; I215-Y232 HydrophobicContact CG2-CD2 3.96Å; I215-L235 HydrophobicContact CB-CD1 4.2Å; I215-L235 HydrophobicContact CG2-CD1 3.82Å
216	R	92.8	Very high	87.8	Confident	135 Å²	135	72.8 Å²	72.8	51%	0.509	35%	0.349	S	S	.	.	H	α-helix	trans	-66	-37	172.8	-74.4	171.9	-169.5	176.4	2.2	111.6	L212 R213 G214 C218 L219 K220 Y232	L212-R216 WeakPolarHBondContact O-CD 3.1Å; L212-R216 VanDerWaalsContact O-CG 3.23Å; L212-R216 WeakPolarHBondContact O-CG 3.3Å; L212-R216 PolarHBondContact O-N 3.38Å; R213-R216 PolarHBondContact O-N 3.05Å; G214-R216 VanDerWaalsContact C-N 3.34Å; G214-R216 PolarHBondContact O-N 3.24Å; R216-C218 VanDerWaalsContact C-N 3.3Å; R216-C218 PolarHBondContact O-N 3.07Å; R216-L219 PolarHBondContact O-N 2.82Å; R216-K220 WeakPolarHBondContact O-CB 3.46Å; R216-K220 PolarHBondContact O-N 3.38Å; R216-Y232 HydrophobicContact CG-CD2 4.4Å; R216-Y232 HydrophobicContact CG-CE2 4.1Å
217	E	90.7	Very high	88.4	Confident	91 Å²	91	75.3 Å²	75.3	43%	0.425	36%	0.359	S	S	.	.	H	α-helix	trans	-63.1	-37.8	173.9	-63.8	-59.6	131.5	0	0	111.5	R213 G214 I215 K220 I221	R213-E217 PolarHBondContact O-N 3.41Å; G214-E217 PolarHBondContact O-N 2.83Å; I215-E217 VanDerWaalsContact C-N 3.33Å; E217-K220 PolarHBondContact O-N 3.08Å; E217-I221 WeakPolarHBondContact O-CD1 3.48Å; E217-I221 PolarHBondContact O-N 2.83Å
218	C	92.9	Very high	89.2	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-57.6	-53.3	172.2	-178.2	0	0	0	0	111.5	L196 G214 I215 R216 K220 I221 D222 Q225 C228	L196-C218 HydrophobicContact CB-CB 4.17Å; G214-C218 PolarHBondContact O-N 3.4Å; I215-C218 HydrophobicContact CD1-CB 4.18Å; I215-C218 WeakPolarHBondContact O-CB 3.35Å; I215-C218 PolarHBondContact O-N 3.02Å; R216-C218 VanDerWaalsContact C-N 3.3Å; R216-C218 PolarHBondContact O-N 3.07Å; C218-K220 PolarHBondContact O-N 3.21Å; C218-I221 PolarHBondContact O-N 3.41Å; C218-I221 VanDerWaalsContact O-N 3.15Å; C218-D222 PolarHBondContact O-N 3.4Å; C218-D222 VanDerWaalsContact O-N 3.16Å; C218-Q225 PolarHBondContact SG-OE1 2.89Å; C218-C228 HydrophobicContact CB-CB 4.01Å; C218-C228 WeakPolarHBondContact CB-SG 3.5Å; C218-C228 WeakPolarHBondContact SG-CB 3.33Å; C218-C228 CovalentContact SG-SG 2.05Å; C218-C228 PolarHBondContact SG-SG 3.2Å
219	L	94.1	Very high	90.1	Very high	25 Å²	25	77 Å²	77	13%	0.131	36%	0.362	C	S	.	.	H	α-helix	trans	-69.3	-19.7	-178.2	-70.1	173.1	0	0	0	114	I215 R216 I221 D222 P223 C228 F229 Y232	I215-L219 PolarHBondContact O-N 3.08Å; I215-L219 VanDerWaalsContact O-N 3.16Å; R216-L219 PolarHBondContact O-N 2.82Å; L219-I221 VanDerWaalsContact C-N 3.31Å; L219-D222 CarbonylContact O-C 3.21Å; L219-P223 WeakPolarHBondContact O-CA 3.41Å; L219-P223 WeakPolarHBondContact O-CG 3.46Å; L219-C228 HydrophobicContact CD2-CB 3.74Å; L219-C228 HydrophobicContact CG-CB 4.04Å; L219-F229 HydrophobicContact CD1-CD2 4.39Å; L219-F229 HydrophobicContact CD2-CB 4.03Å; L219-F229 HydrophobicContact CD2-CD2 4.49Å; L219-Y232 HydrophobicContact CD1-CD1 4.08Å; L219-Y232 HydrophobicContact CD1-CD2 4.26Å; L219-Y232 HydrophobicContact CD1-CG 3.72Å
220	K	94.1	Very high	91.2	Very high	162 Å²	162	75.3 Å²	75.3	70%	0.704	36%	0.362	S	S	*	.	H	α-helix	trans	-70.4	-31.7	173.8	-175.5	-179.6	176.6	-174.9	0	111.7	R216 E217 C218	R216-K220 WeakPolarHBondContact O-CB 3.46Å; R216-K220 PolarHBondContact O-N 3.38Å; E217-K220 PolarHBondContact O-N 3.08Å; C218-K220 PolarHBondContact O-N 3.21Å
221	I	92.4	Very high	92.1	Very high	73 Å²	73	73.3 Å²	73.3	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-81	-47.1	177.7	-65.2	154.3	0	0	0	110	P190 D191 T193 L196 E217 C218 L219	P190-I221 WeakPolarHBondContact O-CD1 3.43Å; D191-I221 HydrophobicContact CB-CG2 4.42Å; T193-I221 HydrophobicContact CG2-CB 3.91Å; T193-I221 HydrophobicContact CG2-CG2 3.5Å; T193-I221 VanDerWaalsContact CG2-CG2 3.5Å; L196-I221 HydrophobicContact CD1-CD1 3.21Å; E217-I221 WeakPolarHBondContact O-CD1 3.48Å; E217-I221 PolarHBondContact O-N 2.83Å; C218-I221 PolarHBondContact O-N 3.41Å; C218-I221 VanDerWaalsContact O-N 3.15Å; L219-I221 VanDerWaalsContact C-N 3.31Å
222	D	92.4	Very high	92.5	Very high	61 Å²	61	75.4 Å²	75.4	33%	0.326	35%	0.353	S	S	.	.			trans	-135.5	96.4	179.8	-175.9	-1.4	0	0	0	110.2	T193 C218 L219 D224 Q225	T193-D222 HydrophobicContact CG2-CB 3.94Å; C218-D222 PolarHBondContact O-N 3.4Å; C218-D222 VanDerWaalsContact O-N 3.16Å; L219-D222 CarbonylContact O-C 3.21Å; D222-D224 PolarHBondContact O-N 3.48Å; D222-D224 PolarHBondContact OD1-N 2.95Å; D222-Q225 HydrophobicContact CB-CB 4.22Å; D222-Q225 PolarHBondContact O-N 3.21Å; D222-Q225 PolarHBondContact OD1-N 3Å
223	P	92.7	Very high	92.7	Very high	84 Å²	84	79.4 Å²	79.4	55%	0.545	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-24.9	178.4	-22.8	33.9	0	0	0	114	L219 Q225	L219-P223 WeakPolarHBondContact O-CA 3.41Å; L219-P223 WeakPolarHBondContact O-CG 3.46Å; P223-Q225 VanDerWaalsContact C-N 3.34Å
224	D	91.2	Very high	92.8	Very high	152 Å²	152	73.9 Å²	73.9	81%	0.813	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-2	-174	-66	-34.9	0	0	0	112.4	D222 R226	D222-D224 PolarHBondContact O-N 3.48Å; D222-D224 PolarHBondContact OD1-N 2.95Å; D224-R226 PolarHBondContact O-N 2.9Å
225	Q	92.6	Very high	93	Very high	22 Å²	22	72.6 Å²	72.6	10%	0.103	34%	0.338	C	S	.	.			trans	-66.6	106.4	178.5	-169.1	174.9	12.4	0	0	111.9	T193 C218 D222 P223 E227 C228 F229	T193-Q225 PolarHBondContact OG1-OE1 3.08Å; C218-Q225 PolarHBondContact SG-OE1 2.89Å; D222-Q225 HydrophobicContact CB-CB 4.22Å; D222-Q225 PolarHBondContact O-N 3.21Å; D222-Q225 PolarHBondContact OD1-N 3Å; P223-Q225 VanDerWaalsContact C-N 3.34Å; Q225-E227 PolarHBondContact O-N 3.3Å; Q225-C228 HydrophobicContact CB-CB 4.3Å; Q225-C228 HydrophobicContact CG-CB 4.31Å; Q225-C228 PolarHBondContact O-N 3.5Å; Q225-C228 PolarHBondContact OE1-SG 3.43Å; Q225-C228 VanDerWaalsContact OE1-SG 3.39Å; Q225-F229 WeakPolarHBondContact O-CB 3.37Å; Q225-F229 PolarHBondContact O-N 2.98Å
226	R	93.5	Very high	92.9	Very high	202 Å²	202	78.4 Å²	78.4	76%	0.762	36%	0.363	S	S	*	.	H	α-helix	trans	-56.2	-45.4	-173.4	-170.3	176	-179.5	176.8	0	113.1	D224 F229 T230	D224-R226 PolarHBondContact O-N 2.9Å; R226-F229 PolarHBondContact O-N 3.2Å; R226-T230 HydrophobicContact CG-CG2 4.4Å; R226-T230 VanDerWaalsContact O-CG2 3.23Å; R226-T230 WeakPolarHBondContact O-CG2 3.22Å; R226-T230 PolarHBondContact O-N 3.26Å; R226-T230 PolarHBondContact O-OG1 3.19Å; R226-T230 VanDerWaalsContact O-OG1 3.12Å
227	E	93.2	Very high	92.8	Very high	102 Å²	102	79.6 Å²	79.6	48%	0.477	37%	0.368	S	S	.	.	H	α-helix	trans	-68.3	-41.6	-177.6	-58.4	89.4	159	0	0	112.3	Y197 Q225 F229 T230 F231	Y197-E227 HydrophobicContact CE1-CB 4.38Å; Y197-E227 HydrophobicContact CE2-CB 4.16Å; Y197-E227 WeakPolarHBondContact CE2-O 3.49Å; Q225-E227 PolarHBondContact O-N 3.3Å; E227-F229 VanDerWaalsContact C-N 3.3Å; E227-F229 PolarHBondContact O-N 3.18Å; E227-T230 PolarHBondContact O-OG1 3.35Å; E227-F231 VanDerWaalsContact O-CB 3.27Å; E227-F231 WeakPolarHBondContact O-CB 3.41Å; E227-F231 PolarHBondContact O-N 3.22Å; E227-F231 VanDerWaalsContact O-N 3.1Å
228	C	93.8	Very high	92.7	Very high	0 Å²	0	75.2 Å²	75.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-38	176	-80.5	0	0	0	0	110.9	Y197 I215 C218 L219 Q225 Y232	Y197-C228 VanDerWaalsContact CD2-SG 3.58Å; I215-C228 HydrophobicContact CD1-CB 3.84Å; C218-C228 HydrophobicContact CB-CB 4.01Å; C218-C228 WeakPolarHBondContact CB-SG 3.5Å; C218-C228 WeakPolarHBondContact SG-CB 3.33Å; C218-C228 CovalentContact SG-SG 2.05Å; C218-C228 PolarHBondContact SG-SG 3.2Å; L219-C228 HydrophobicContact CD2-CB 3.74Å; L219-C228 HydrophobicContact CG-CB 4.04Å; Q225-C228 HydrophobicContact CB-CB 4.3Å; Q225-C228 HydrophobicContact CG-CB 4.31Å; Q225-C228 PolarHBondContact O-N 3.5Å; Q225-C228 PolarHBondContact OE1-SG 3.43Å; Q225-C228 VanDerWaalsContact OE1-SG 3.39Å; C228-Y232 VanDerWaalsContact O-CB 3.24Å; C228-Y232 WeakPolarHBondContact O-CB 3.34Å; C228-Y232 PolarHBondContact O-N 3.27Å
229	F	94.3	Very high	92.6	Very high	89 Å²	89	76 Å²	76	39%	0.39	35%	0.352	S	S	.	.	H	α-helix	trans	-72.1	-42.5	-179	-172.4	-115.9	0	0	0	113.2	L219 Q225 R226 E227 F231 Y232 K233	L219-F229 HydrophobicContact CD1-CD2 4.39Å; L219-F229 HydrophobicContact CD2-CB 4.03Å; L219-F229 HydrophobicContact CD2-CD2 4.49Å; Q225-F229 WeakPolarHBondContact O-CB 3.37Å; Q225-F229 PolarHBondContact O-N 2.98Å; R226-F229 PolarHBondContact O-N 3.2Å; E227-F229 VanDerWaalsContact C-N 3.3Å; E227-F229 PolarHBondContact O-N 3.18Å; F229-F231 VanDerWaalsContact C-N 3.33Å; F229-Y232 PolarHBondContact O-N 3.06Å; F229-K233 HydrophobicContact CD1-CD 4.37Å; F229-K233 HydrophobicContact CE1-CD 4.07Å; F229-K233 HydrophobicContact CZ-CD 4.39Å; F229-K233 WeakPolarHBondContact O-CG 3.48Å; F229-K233 PolarHBondContact O-N 3.31Å
230	T	94.5	Very high	92.4	Very high	77 Å²	77	82.5 Å²	82.5	47%	0.472	38%	0.379	S	S	.	.	H	α-helix	trans	-62.3	-43.6	175.3	54.7	0	0	0	0	110.7	R226 E227 K233 K234	R226-T230 HydrophobicContact CG-CG2 4.4Å; R226-T230 VanDerWaalsContact O-CG2 3.23Å; R226-T230 WeakPolarHBondContact O-CG2 3.22Å; R226-T230 PolarHBondContact O-N 3.26Å; R226-T230 PolarHBondContact O-OG1 3.19Å; R226-T230 VanDerWaalsContact O-OG1 3.12Å; E227-T230 PolarHBondContact O-OG1 3.35Å; T230-K233 PolarHBondContact O-N 3.46Å; T230-K234 PolarHBondContact O-N 3.38Å; T230-K234 VanDerWaalsContact O-N 3.17Å
231	F	93.7	Very high	92.1	Very high	20 Å²	20	75.7 Å²	75.7	9%	0.088	35%	0.351	C	S	.	.	H	α-helix	trans	-67	-42.4	177.8	-171.3	-131.4	0	0	0	112.5	Y197 Q201 Y204 T211 I215 E227 F229 K233 K234 L235	Y197-F231 HydrophobicContact CD2-CD1 4.38Å; Y197-F231 HydrophobicContact CE2-CB 3.81Å; Y197-F231 AromaticContact CE2-CD1 3.92Å; Y197-F231 HydrophobicContact CE2-CD1 3.92Å; Y197-F231 HydrophobicContact CE2-CG 4.05Å; Q201-F231 HydrophobicContact CG-CE1 4.43Å; Y204-F231 HydrophobicContact CD1-CE2 4.05Å; Y204-F231 HydrophobicContact CD1-CZ 4.03Å; Y204-F231 HydrophobicContact CD2-CZ 4.29Å; Y204-F231 HydrophobicContact CE1-CE2 4.41Å; Y204-F231 HydrophobicContact CG-CE2 4.14Å; Y204-F231 AromaticContact CG-CZ 3.74Å; Y204-F231 HydrophobicContact CG-CZ 3.74Å; T211-F231 HydrophobicContact CG2-CE1 4.18Å; T211-F231 HydrophobicContact CG2-CZ 4.46Å; I215-F231 HydrophobicContact CD1-CD1 3.71Å; I215-F231 HydrophobicContact CG1-CD1 3.94Å; E227-F231 VanDerWaalsContact O-CB 3.27Å; E227-F231 WeakPolarHBondContact O-CB 3.41Å; E227-F231 PolarHBondContact O-N 3.22Å; E227-F231 VanDerWaalsContact O-N 3.1Å; F229-F231 VanDerWaalsContact C-N 3.33Å; F231-K233 VanDerWaalsContact C-N 3.34Å; F231-K233 PolarHBondContact O-N 3.12Å; F231-K234 PolarHBondContact O-N 3.09Å; F231-L235 HydrophobicContact CD1-CD1 3.73Å; F231-L235 HydrophobicContact CD2-CD1 4.4Å; F231-L235 HydrophobicContact CD2-CG 4.36Å; F231-L235 HydrophobicContact CE1-CD1 3.53Å; F231-L235 HydrophobicContact CE1-CG 4.32Å; F231-L235 HydrophobicContact CE2-CD1 4.21Å; F231-L235 HydrophobicContact CE2-CD2 4.4Å; F231-L235 HydrophobicContact CE2-CG 4.12Å; F231-L235 HydrophobicContact CG-CD1 4.17Å; F231-L235 HydrophobicContact CZ-CD1 3.78Å; F231-L235 HydrophobicContact CZ-CD2 4.24Å; F231-L235 HydrophobicContact CZ-CG 4.11Å; F231-L235 WeakPolarHBondContact O-CB 3.16Å; F231-L235 WeakPolarHBondContact O-CG 3.44Å; F231-L235 PolarHBondContact O-N 3.39Å
232	Y	94.5	Very high	91.8	Very high	45 Å²	45	73 Å²	73	18%	0.176	34%	0.337	C	S	.	.	H	α-helix	trans	-56.8	-44.6	172.9	167.5	-101.3	0	0	0	112.3	L212 I215 R216 L219 C228 F229 K234 L235 K236	L212-Y232 HydrophobicContact CD1-CD2 3.82Å; L212-Y232 HydrophobicContact CD1-CE2 3.88Å; I215-Y232 HydrophobicContact CG2-CD2 3.96Å; R216-Y232 HydrophobicContact CG-CD2 4.4Å; R216-Y232 HydrophobicContact CG-CE2 4.1Å; L219-Y232 HydrophobicContact CD1-CD1 4.08Å; L219-Y232 HydrophobicContact CD1-CD2 4.26Å; L219-Y232 HydrophobicContact CD1-CG 3.72Å; C228-Y232 VanDerWaalsContact O-CB 3.24Å; C228-Y232 WeakPolarHBondContact O-CB 3.34Å; C228-Y232 PolarHBondContact O-N 3.27Å; F229-Y232 PolarHBondContact O-N 3.06Å; Y232-K234 VanDerWaalsContact C-N 3.34Å; Y232-K234 PolarHBondContact O-N 3.33Å; Y232-L235 PolarHBondContact O-N 3.41Å; Y232-K236 HydrophobicContact CE1-CD 4.17Å; Y232-K236 VanDerWaalsContact O-CB 3.3Å; Y232-K236 WeakPolarHBondContact O-CB 3.49Å; Y232-K236 PolarHBondContact O-N 2.99Å
233	K	93.4	Very high	91.6	Very high	102 Å²	102	73.7 Å²	73.7	44%	0.443	34%	0.341	S	S	.	.	H	α-helix	trans	-60.3	-43.3	177.4	-79.6	-178.2	173.2	174.3	0	112.1	F229 T230 F231 R237	F229-K233 HydrophobicContact CD1-CD 4.37Å; F229-K233 HydrophobicContact CE1-CD 4.07Å; F229-K233 HydrophobicContact CZ-CD 4.39Å; F229-K233 WeakPolarHBondContact O-CG 3.48Å; F229-K233 PolarHBondContact O-N 3.31Å; T230-K233 PolarHBondContact O-N 3.46Å; F231-K233 VanDerWaalsContact C-N 3.34Å; F231-K233 PolarHBondContact O-N 3.12Å; K233-R237 WeakPolarHBondContact O-CG 3.08Å; K233-R237 PolarHBondContact O-N 3.35Å
234	K	91	Very high	91.4	Very high	82 Å²	82	73 Å²	73	36%	0.357	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-53.7	176.1	-168.5	-177.2	-166.2	-171.4	0	110.6	T230 F231 Y232 K236 R237 L238 E268	T230-K234 PolarHBondContact O-N 3.38Å; T230-K234 VanDerWaalsContact O-N 3.17Å; F231-K234 PolarHBondContact O-N 3.09Å; Y232-K234 VanDerWaalsContact C-N 3.34Å; Y232-K234 PolarHBondContact O-N 3.33Å; K234-K236 VanDerWaalsContact C-N 3.33Å; K234-K236 PolarHBondContact O-N 3.38Å; K234-R237 PolarHBondContact O-N 2.73Å; K234-R237 VanDerWaalsContact O-N 3.15Å; K234-L238 HydrophobicContact CG-CD1 4.26Å; K234-L238 PolarHBondContact O-N 3.05Å; K234-L238 VanDerWaalsContact O-N 3.16Å; K234-E268 WeakPolarHBondContact CE-OE1 3.34Å; K234-E268 IonicContact NZ-OE1 3.52Å; K234-E268 PolarHBondContact NZ-OE1 2.97Å; K234-E268 IonicContact NZ-OE2 2.67Å; K234-E268 PolarHBondContact NZ-OE2 3.42Å
235	L	91.2	Very high	90.8	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57	-43.4	179.2	-75.8	171.6	0	0	0	112.8	Y204 T211 L212 I215 F231 Y232 R237 L238 V239	Y204-L235 HydrophobicContact CD2-CD2 3.29Å; Y204-L235 HydrophobicContact CE2-CD2 3.43Å; Y204-L235 VanDerWaalsContact CE2-CD2 3.43Å; Y204-L235 HydrophobicContact CG-CD2 4.25Å; T211-L235 HydrophobicContact CG2-CD1 3.75Å; T211-L235 HydrophobicContact CG2-CD2 4.32Å; L212-L235 HydrophobicContact CD1-CB 3.97Å; I215-L235 HydrophobicContact CB-CD1 4.2Å; I215-L235 HydrophobicContact CG2-CD1 3.82Å; F231-L235 HydrophobicContact CD1-CD1 3.73Å; F231-L235 HydrophobicContact CD2-CD1 4.4Å; F231-L235 HydrophobicContact CD2-CG 4.36Å; F231-L235 HydrophobicContact CE1-CD1 3.53Å; F231-L235 HydrophobicContact CE1-CG 4.32Å; F231-L235 HydrophobicContact CE2-CD1 4.21Å; F231-L235 HydrophobicContact CE2-CD2 4.4Å; F231-L235 HydrophobicContact CE2-CG 4.12Å; F231-L235 HydrophobicContact CG-CD1 4.17Å; F231-L235 HydrophobicContact CZ-CD1 3.78Å; F231-L235 HydrophobicContact CZ-CD2 4.24Å; F231-L235 HydrophobicContact CZ-CG 4.11Å; F231-L235 WeakPolarHBondContact O-CB 3.16Å; F231-L235 WeakPolarHBondContact O-CG 3.44Å; F231-L235 PolarHBondContact O-N 3.39Å; Y232-L235 PolarHBondContact O-N 3.41Å; L235-R237 VanDerWaalsContact C-N 3.29Å; L235-R237 PolarHBondContact O-N 2.69Å; L235-L238 PolarHBondContact O-N 3.36Å; L235-V239 WeakPolarHBondContact O-CB 3.31Å; L235-V239 VanDerWaalsContact O-CG2 3.32Å; L235-V239 WeakPolarHBondContact O-CG2 3.34Å; L235-V239 PolarHBondContact O-N 2.93Å
236	K	92.5	Very high	90.2	Very high	122 Å²	122	69.2 Å²	69.2	53%	0.53	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-37.8	179.8	-173.6	179.3	-176	174.4	0	112.2	Y232 K234 K240	Y232-K236 HydrophobicContact CE1-CD 4.17Å; Y232-K236 VanDerWaalsContact O-CB 3.3Å; Y232-K236 WeakPolarHBondContact O-CB 3.49Å; Y232-K236 PolarHBondContact O-N 2.99Å; K234-K236 VanDerWaalsContact C-N 3.33Å; K234-K236 PolarHBondContact O-N 3.38Å; K236-K240 WeakPolarHBondContact O-CB 3.49Å; K236-K240 PolarHBondContact O-N 3.19Å
237	R	90.8	Very high	89.8	Confident	160 Å²	160	64 Å²	64	60%	0.604	31%	0.305	S	S	*	.	H	α-helix	trans	-68.2	-47.9	176.3	-67.2	175.9	-166.9	173.1	1.8	111	K233 K234 L235 K240 V241	K233-R237 WeakPolarHBondContact O-CG 3.08Å; K233-R237 PolarHBondContact O-N 3.35Å; K234-R237 PolarHBondContact O-N 2.73Å; K234-R237 VanDerWaalsContact O-N 3.15Å; L235-R237 VanDerWaalsContact C-N 3.29Å; L235-R237 PolarHBondContact O-N 2.69Å; R237-K240 PolarHBondContact O-N 3.38Å; R237-V241 WeakPolarHBondContact O-CG2 3.44Å; R237-V241 PolarHBondContact O-N 3.16Å; R237-V241 VanDerWaalsContact O-N 3.11Å
238	L	88.3	Confident	89.1	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-45.9	179.9	-68.9	169.7	0	0	0	112.4	Y204 K234 L235 K240 V241 H242 Q267 E268	Y204-L238 HydrophobicContact CE2-CD1 4.25Å; Y204-L238 WeakPolarHBondContact OH-CD1 3.42Å; K234-L238 HydrophobicContact CG-CD1 4.26Å; K234-L238 PolarHBondContact O-N 3.05Å; K234-L238 VanDerWaalsContact O-N 3.16Å; L235-L238 PolarHBondContact O-N 3.36Å; L238-K240 VanDerWaalsContact C-N 3.32Å; L238-K240 PolarHBondContact O-N 3.29Å; L238-V241 PolarHBondContact O-N 3.12Å; L238-H242 WeakPolarHBondContact O-CB 3.36Å; L238-H242 PolarHBondContact O-N 3.42Å; L238-Q267 HydrophobicContact CD2-CB 3.77Å; L238-E268 HydrophobicContact CD1-CG 3.63Å; L238-E268 HydrophobicContact CD2-CG 4.03Å; L238-E268 HydrophobicContact CG-CG 4.47Å
239	V	89.5	Confident	87.9	Confident	16 Å²	16	62.1 Å²	62.1	10%	0.097	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-40.9	176.7	171.2	0	0	0	0	110.9	L212 L235 V241 H242 D243	L212-V239 HydrophobicContact CD2-CB 4.46Å; L212-V239 HydrophobicContact CD2-CG1 4.27Å; L212-V239 HydrophobicContact CD2-CG2 4.41Å; L235-V239 WeakPolarHBondContact O-CB 3.31Å; L235-V239 VanDerWaalsContact O-CG2 3.32Å; L235-V239 WeakPolarHBondContact O-CG2 3.34Å; L235-V239 PolarHBondContact O-N 2.93Å; V239-V241 VanDerWaalsContact C-N 3.34Å; V239-V241 PolarHBondContact O-N 3.36Å; V239-H242 WeakPolarHBondContact O-CB 3.2Å; V239-H242 PolarHBondContact O-N 3.3Å; V239-D243 WeakPolarHBondContact CG1-OD2 3.37Å; V239-D243 WeakPolarHBondContact O-CB 3.46Å; V239-D243 PolarHBondContact O-N 3.19Å
240	K	91.3	Very high	87.1	Confident	162 Å²	162	65.2 Å²	65.2	70%	0.704	32%	0.317	S	S	*	.	H	α-helix	trans	-60.8	-41.4	176.1	-174	-177.8	179	-174.5	0	112.5	K236 R237 L238 S244	K236-K240 WeakPolarHBondContact O-CB 3.49Å; K236-K240 PolarHBondContact O-N 3.19Å; R237-K240 PolarHBondContact O-N 3.38Å; L238-K240 VanDerWaalsContact C-N 3.32Å; L238-K240 PolarHBondContact O-N 3.29Å; K240-S244 WeakPolarHBondContact O-CB 3.45Å; K240-S244 PolarHBondContact O-N 2.59Å; K240-S244 VanDerWaalsContact O-N 3.15Å
241	V	87.9	Confident	86.7	Confident	19 Å²	19	66.6 Å²	66.6	12%	0.115	32%	0.321	C	S	.	.	H	α-helix	trans	-68	-43.8	177.1	-179.8	0	0	0	0	110.3	R237 L238 V239 S244 M245 G260 Q263 M264	R237-V241 WeakPolarHBondContact O-CG2 3.44Å; R237-V241 PolarHBondContact O-N 3.16Å; R237-V241 VanDerWaalsContact O-N 3.11Å; L238-V241 PolarHBondContact O-N 3.12Å; V239-V241 VanDerWaalsContact C-N 3.34Å; V239-V241 PolarHBondContact O-N 3.36Å; V241-S244 WeakPolarHBondContact O-CB 3.45Å; V241-S244 PolarHBondContact O-N 2.83Å; V241-M245 HydrophobicContact CG1-CG 4.48Å; V241-M245 HydrophobicContact CG1-SD 4.16Å; V241-M245 WeakPolarHBondContact O-CG 3.38Å; V241-M245 PolarHBondContact O-N 3.11Å; V241-G260 WeakPolarHBondContact CG1-O 3.43Å; V241-Q263 HydrophobicContact CG1-CB 4.24Å; V241-M264 HydrophobicContact CB-CG 3.93Å; V241-M264 HydrophobicContact CB-SD 4.44Å; V241-M264 HydrophobicContact CG1-CG 3.53Å; V241-M264 HydrophobicContact CG1-SD 4.18Å
242	H	84.7	Confident	85.8	Confident	16 Å²	16	72.4 Å²	72.4	7%	0.074	35%	0.348	C	S	.	.	H	α-helix	trans	-58.2	-48.1	176	172.1	-93.1	0	0	0	112.8	F208 L238 V239 S244 M245 L246 M264	F208-H242 HydrophobicContact CE2-CB 4.07Å; F208-H242 HydrophobicContact CZ-CB 4.18Å; F208-H242 AromaticContact CZ-CD2 3.49Å; F208-H242 VanDerWaalsContact CZ-CD2 3.49Å; F208-H242 WeakPolarHBondContact CZ-CD2 2.98Å; F208-H242 AromaticContact CZ-CG 3.9Å; L238-H242 WeakPolarHBondContact O-CB 3.36Å; L238-H242 PolarHBondContact O-N 3.42Å; V239-H242 WeakPolarHBondContact O-CB 3.2Å; V239-H242 PolarHBondContact O-N 3.3Å; H242-S244 VanDerWaalsContact C-N 3.3Å; H242-S244 PolarHBondContact O-N 2.65Å; H242-M245 WeakPolarHBondContact O-CB 3.47Å; H242-M245 PolarHBondContact O-N 3.4Å; H242-L246 WeakPolarHBondContact CE1-CD1 3.47Å; H242-L246 PolarHBondContact O-N 2.68Å; H242-M264 HydrophobicContact CB-CE 4.26Å; H242-M264 HydrophobicContact CB-SD 4.01Å
243	D	88.5	Confident	84.5	Confident	75 Å²	75	74.6 Å²	74.6	40%	0.401	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-41.4	179	-63.4	-14.1	0	0	0	110.3	V239 M245 L246 D247	V239-D243 WeakPolarHBondContact CG1-OD2 3.37Å; V239-D243 WeakPolarHBondContact O-CB 3.46Å; V239-D243 PolarHBondContact O-N 3.19Å; D243-M245 VanDerWaalsContact C-N 3.29Å; D243-M245 PolarHBondContact O-N 3.13Å; D243-L246 PolarHBondContact O-N 3.33Å; D243-D247 PolarHBondContact O-N 3.29Å
244	S	88.4	Confident	82.9	Confident	69 Å²	69	77.1 Å²	77.1	48%	0.483	37%	0.367	S	S	.	.	H	α-helix	trans	-63.4	-31.4	173	-175.6	0	0	0	0	113.5	K240 V241 H242 A248	K240-S244 WeakPolarHBondContact O-CB 3.45Å; K240-S244 PolarHBondContact O-N 2.59Å; K240-S244 VanDerWaalsContact O-N 3.15Å; V241-S244 WeakPolarHBondContact O-CB 3.45Å; V241-S244 PolarHBondContact O-N 2.83Å; H242-S244 VanDerWaalsContact C-N 3.3Å; H242-S244 PolarHBondContact O-N 2.65Å; S244-A248 VanDerWaalsContact O-CB 3.28Å; S244-A248 WeakPolarHBondContact O-CB 3.27Å; S244-A248 PolarHBondContact O-N 2.94Å
245	M	79.5	Confident	81.6	Confident	13 Å²	13	81 Å²	81	6%	0.064	38%	0.384	C	S	.	.	H	α-helix	trans	-72.6	-37.9	175	-71.7	168.5	59.2	0	0	111.6	V241 H242 D243 A248 T249 A261 M264	V241-M245 HydrophobicContact CG1-CG 4.48Å; V241-M245 HydrophobicContact CG1-SD 4.16Å; V241-M245 WeakPolarHBondContact O-CG 3.38Å; V241-M245 PolarHBondContact O-N 3.11Å; H242-M245 WeakPolarHBondContact O-CB 3.47Å; H242-M245 PolarHBondContact O-N 3.4Å; D243-M245 VanDerWaalsContact C-N 3.29Å; D243-M245 PolarHBondContact O-N 3.13Å; M245-A248 PolarHBondContact O-N 3.22Å; M245-T249 WeakPolarHBondContact O-CB 3.46Å; M245-T249 PolarHBondContact O-N 3.47Å; M245-T249 PolarHBondContact O-OG1 3.3Å; M245-A261 HydrophobicContact CE-CB 3.5Å; M245-A261 HydrophobicContact SD-CB 4.2Å; M245-A261 PolarHBondContact SD-N 2.67Å; M245-A261 VanDerWaalsContact SD-N 3.37Å; M245-M264 HydrophobicContact CE-SD 4.41Å; M245-M264 HydrophobicContact SD-CG 4.13Å; M245-M264 HydrophobicContact SD-SD 3.42Å
246	L	80.3	Confident	80.6	Confident	83 Å²	83	85.5 Å²	85.5	44%	0.435	41%	0.408	S	S	.	.	H	α-helix	trans	-62.7	-49.2	173.2	-70	-179.6	0	0	0	110.5	H242 D243 A248 T249 E250	H242-L246 WeakPolarHBondContact CE1-CD1 3.47Å; H242-L246 PolarHBondContact O-N 2.68Å; D243-L246 PolarHBondContact O-N 3.33Å; L246-A248 VanDerWaalsContact C-N 3.31Å; L246-A248 PolarHBondContact O-N 2.86Å; L246-T249 WeakPolarHBondContact O-CA 3.35Å; L246-T249 WeakPolarHBondContact O-CB 3.36Å; L246-T249 PolarHBondContact O-N 2.81Å; L246-E250 PolarHBondContact O-N 2.94Å
247	D	85.3	Confident	79.3	Confident	91 Å²	91	80.9 Å²	80.9	49%	0.487	39%	0.39	S	S	.	.	H	α-helix	trans	-57.6	-44.1	175.7	-67.6	-17	0	0	0	111.3	D243 T249 E250 N251	D243-D247 PolarHBondContact O-N 3.29Å; D247-T249 VanDerWaalsContact C-N 3.29Å; D247-T249 PolarHBondContact O-N 3.34Å; D247-E250 PolarHBondContact O-N 3.5Å; D247-N251 WeakPolarHBondContact O-CB 3.49Å; D247-N251 PolarHBondContact O-N 3.2Å; D247-N251 VanDerWaalsContact O-N 3.08Å; D247-N251 PolarHBondContact O-ND2 3.43Å
248	A	77.4	Confident	78	Confident	3 Å²	3	79.2 Å²	79.2	3%	0.025	39%	0.393	C	S	.	.	H	α-helix	trans	-64	-35.1	176.5	0	0	0	0	0	112.2	S244 M245 L246 N251 E252 Q253 L256 C257	S244-A248 VanDerWaalsContact O-CB 3.28Å; S244-A248 WeakPolarHBondContact O-CB 3.27Å; S244-A248 PolarHBondContact O-N 2.94Å; M245-A248 PolarHBondContact O-N 3.22Å; L246-A248 VanDerWaalsContact C-N 3.31Å; L246-A248 PolarHBondContact O-N 2.86Å; A248-N251 CarbonylContact O-C 3.56Å; A248-N251 PolarHBondContact O-N 3.23Å; A248-E252 PolarHBondContact O-N 2.91Å; A248-E252 VanDerWaalsContact O-N 3.15Å; A248-Q253 HydrophobicContact CB-CB 4.12Å; A248-Q253 PolarHBondContact O-N 3.23Å; A248-L256 HydrophobicContact CB-CB 3.98Å; A248-C257 HydrophobicContact CB-CB 4.23Å
249	T	69	Low	77.2	Confident	60 Å²	60	83.3 Å²	83.3	37%	0.368	41%	0.414	S	S	.	.	H	α-helix	trans	-69.3	-43.7	177.7	-57.9	0	0	0	0	111	M245 L246 D247 N251 E252 W254 C257	M245-T249 WeakPolarHBondContact O-CB 3.46Å; M245-T249 PolarHBondContact O-N 3.47Å; M245-T249 PolarHBondContact O-OG1 3.3Å; L246-T249 WeakPolarHBondContact O-CA 3.35Å; L246-T249 WeakPolarHBondContact O-CB 3.36Å; L246-T249 PolarHBondContact O-N 2.81Å; D247-T249 VanDerWaalsContact C-N 3.29Å; D247-T249 PolarHBondContact O-N 3.34Å; T249-N251 PolarHBondContact O-N 3.34Å; T249-E252 PolarHBondContact O-N 3.17Å; T249-E252 VanDerWaalsContact O-N 3.16Å; T249-W254 HydrophobicContact CG2-CZ3 4.37Å; T249-C257 PolarHBondContact OG1-SG 3Å
250	E	78.1	Confident	76.5	Confident	155 Å²	155	82.9 Å²	82.9	72%	0.724	41%	0.414	S	S	*	.	H	α-helix	trans	-62.4	-32.8	175.9	-71	-177.8	-179.6	0	0	112.4	L246 D247	L246-E250 PolarHBondContact O-N 2.94Å; D247-E250 PolarHBondContact O-N 3.5Å
251	N	85	Confident	75.5	Confident	106 Å²	106	75.4 Å²	75.4	57%	0.567	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	10.4	177.8	-67	-67	0	0	0	113.9	D247 A248 T249 Q253	D247-N251 WeakPolarHBondContact O-CB 3.49Å; D247-N251 PolarHBondContact O-N 3.2Å; D247-N251 VanDerWaalsContact O-N 3.08Å; D247-N251 PolarHBondContact O-ND2 3.43Å; A248-N251 CarbonylContact O-C 3.56Å; A248-N251 PolarHBondContact O-N 3.23Å; T249-N251 PolarHBondContact O-N 3.34Å; N251-Q253 HydrophobicContact CB-CG 4.03Å; N251-Q253 PolarHBondContact O-N 2.93Å; N251-Q253 VanDerWaalsContact O-N 3.11Å
252	E	75.5	Confident	74.7	Confident	141 Å²	141	75.7 Å²	75.7	66%	0.659	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	26.6	-178.9	-55.5	-176.7	174.2	0	0	114.3	A248 T249 W254	A248-E252 PolarHBondContact O-N 2.91Å; A248-E252 VanDerWaalsContact O-N 3.15Å; T249-E252 PolarHBondContact O-N 3.17Å; T249-E252 VanDerWaalsContact O-N 3.16Å; E252-W254 VanDerWaalsContact C-N 3.32Å; E252-W254 HydrophobicContact CB-CZ2 3.97Å; E252-W254 HydrophobicContact CG-CZ2 4.1Å; E252-W254 PolarHBondContact O-N 3.12Å; E252-W254 VanDerWaalsContact O-N 3.09Å; E252-W254 PolarHBondContact O-NE1 3.33Å
253	Q	66.3	Low	74.5	Confident	92 Å²	92	79.6 Å²	79.6	43%	0.43	41%	0.407	S	S	.	.			trans	-86.7	67.2	179.4	-65	174.8	-13.1	0	0	111.1	A248 N251 K255 L256 C257	A248-Q253 HydrophobicContact CB-CB 4.12Å; A248-Q253 PolarHBondContact O-N 3.23Å; N251-Q253 HydrophobicContact CB-CG 4.03Å; N251-Q253 PolarHBondContact O-N 2.93Å; N251-Q253 VanDerWaalsContact O-N 3.11Å; Q253-K255 VanDerWaalsContact C-N 3.28Å; Q253-K255 PolarHBondContact O-N 3.47Å; Q253-K255 VanDerWaalsContact O-N 3.15Å; Q253-L256 HydrophobicContact CB-CB 4.28Å; Q253-L256 HydrophobicContact CB-CD1 4.1Å; Q253-L256 HydrophobicContact CG-CD1 4.48Å; Q253-L256 PolarHBondContact O-N 3.04Å; Q253-L256 VanDerWaalsContact OE1-CD1 3.26Å; Q253-C257 PolarHBondContact O-N 3.22Å; Q253-C257 VanDerWaalsContact O-N 3.1Å
254	W	60.6	Low	74.1	Confident	154 Å²	154	76 Å²	76	58%	0.583	39%	0.388	S	S	*	.	H	α-helix	trans	-55.4	-37.6	-171.8	-51.1	112	0	0	0	114.5	T249 E252 C257 L258	T249-W254 HydrophobicContact CG2-CZ3 4.37Å; E252-W254 VanDerWaalsContact C-N 3.32Å; E252-W254 HydrophobicContact CB-CZ2 3.97Å; E252-W254 HydrophobicContact CG-CZ2 4.1Å; E252-W254 PolarHBondContact O-N 3.12Å; E252-W254 VanDerWaalsContact O-N 3.09Å; E252-W254 PolarHBondContact O-NE1 3.33Å; W254-C257 WeakPolarHBondContact O-CB 3.48Å; W254-C257 PolarHBondContact O-N 3.15Å; W254-L258 WeakPolarHBondContact O-CG 3.08Å; W254-L258 PolarHBondContact O-N 3.03Å
255	K	63.9	Low	73.4	Confident	163 Å²	163	73.9 Å²	73.9	71%	0.709	37%	0.371	S	S	*	.	H	α-helix	trans	-62.1	-44.9	178	-173.9	178.2	178.5	-178.9	0	112	Q253 C257 L258 D259	Q253-K255 VanDerWaalsContact C-N 3.28Å; Q253-K255 PolarHBondContact O-N 3.47Å; Q253-K255 VanDerWaalsContact O-N 3.15Å; K255-C257 VanDerWaalsContact C-N 3.33Å; K255-L258 PolarHBondContact O-N 3.08Å; K255-D259 WeakPolarHBondContact O-CB 3.49Å; K255-D259 VanDerWaalsContact O-CG 3.3Å; K255-D259 PolarHBondContact O-N 2.87Å
256	L	70.8	Confident	73.4	Confident	96 Å²	96	82.2 Å²	82.2	50%	0.503	41%	0.407	S	S	.	.	H	α-helix	trans	-67.7	-36.9	178.1	-71.8	173	0	0	0	111.5	A248 Q253 D259 G260	A248-L256 HydrophobicContact CB-CB 3.98Å; Q253-L256 HydrophobicContact CB-CB 4.28Å; Q253-L256 HydrophobicContact CB-CD1 4.1Å; Q253-L256 HydrophobicContact CG-CD1 4.48Å; Q253-L256 PolarHBondContact O-N 3.04Å; Q253-L256 VanDerWaalsContact OE1-CD1 3.26Å; L256-D259 PolarHBondContact O-N 3.44Å; L256-G260 PolarHBondContact O-N 3.34Å
257	C	64.5	Low	73.4	Confident	24 Å²	24	81.7 Å²	81.7	16%	0.162	40%	0.402	C	S	.	.	H	α-helix	trans	-60.3	-49.1	173.1	-173.2	0	0	0	0	111	A248 T249 Q253 W254 K255 D259 G260 A261	A248-C257 HydrophobicContact CB-CB 4.23Å; T249-C257 PolarHBondContact OG1-SG 3Å; Q253-C257 PolarHBondContact O-N 3.22Å; Q253-C257 VanDerWaalsContact O-N 3.1Å; W254-C257 WeakPolarHBondContact O-CB 3.48Å; W254-C257 PolarHBondContact O-N 3.15Å; K255-C257 VanDerWaalsContact C-N 3.33Å; C257-D259 PolarHBondContact O-N 3.46Å; C257-G260 PolarHBondContact O-N 3.33Å; C257-A261 WeakPolarHBondContact O-CB 3.45Å; C257-A261 PolarHBondContact O-N 3.35Å
258	L	62.7	Low	73	Confident	125 Å²	125	78.1 Å²	78.1	65%	0.654	38%	0.382	S	S	*	.	H	α-helix	trans	-61.8	-43.5	177	-71.8	171	0	0	0	112.8	W254 K255 G260 A261 G262	W254-L258 WeakPolarHBondContact O-CG 3.08Å; W254-L258 PolarHBondContact O-N 3.03Å; K255-L258 PolarHBondContact O-N 3.08Å; L258-G260 VanDerWaalsContact C-N 3.34Å; L258-G260 PolarHBondContact O-N 3.28Å; L258-A261 PolarHBondContact O-N 2.82Å; L258-G262 PolarHBondContact O-N 3.22Å
259	D	72.2	Confident	72.6	Confident	86 Å²	86	81.7 Å²	81.7	46%	0.46	41%	0.407	S	S	.	.	H	α-helix	trans	-61.9	-42.8	177	-73.7	-24.1	0	0	0	111.2	K255 L256 C257 G262 Q263	K255-D259 WeakPolarHBondContact O-CB 3.49Å; K255-D259 VanDerWaalsContact O-CG 3.3Å; K255-D259 PolarHBondContact O-N 2.87Å; L256-D259 PolarHBondContact O-N 3.44Å; C257-D259 PolarHBondContact O-N 3.46Å; D259-G262 PolarHBondContact O-N 2.85Å; D259-Q263 WeakPolarHBondContact O-CG 3.28Å; D259-Q263 PolarHBondContact O-N 2.85Å
260	G	74.3	Confident	72.6	Confident	8 Å²	8	86.9 Å²	86.9	8%	0.082	43%	0.428	C	S	.	.	H	α-helix	trans	-62.6	-43.6	173.9	0	0	0	0	0	112.2	V241 L256 C257 L258 G262 Q263 M264	V241-G260 WeakPolarHBondContact CG1-O 3.43Å; L256-G260 PolarHBondContact O-N 3.34Å; C257-G260 PolarHBondContact O-N 3.33Å; L258-G260 VanDerWaalsContact C-N 3.34Å; L258-G260 PolarHBondContact O-N 3.28Å; G260-G262 VanDerWaalsContact C-N 3.35Å; G260-G262 PolarHBondContact O-N 3.29Å; G260-Q263 WeakPolarHBondContact O-CB 3.33Å; G260-Q263 PolarHBondContact O-N 3.12Å; G260-Q263 VanDerWaalsContact O-N 3.09Å; G260-M264 PolarHBondContact O-N 3.49Å
261	A	70.4	Confident	72.1	Confident	5 Å²	5	80.5 Å²	80.5	4%	0.041	40%	0.399	C	S	.	.	H	α-helix	trans	-63.3	-42.7	179.7	0	0	0	0	0	111.3	M245 C257 L258 Q263 M264 L265 V278	M245-A261 HydrophobicContact CE-CB 3.5Å; M245-A261 HydrophobicContact SD-CB 4.2Å; M245-A261 PolarHBondContact SD-N 2.67Å; M245-A261 VanDerWaalsContact SD-N 3.37Å; C257-A261 WeakPolarHBondContact O-CB 3.45Å; C257-A261 PolarHBondContact O-N 3.35Å; L258-A261 PolarHBondContact O-N 2.82Å; A261-Q263 VanDerWaalsContact C-N 3.34Å; A261-Q263 PolarHBondContact O-N 2.91Å; A261-M264 PolarHBondContact O-N 3.04Å; A261-L265 PolarHBondContact O-N 3.27Å; A261-V278 HydrophobicContact CB-CB 4.04Å; A261-V278 HydrophobicContact CB-CG1 3.41Å; A261-V278 VanDerWaalsContact CB-CG1 3.41Å; A261-V278 HydrophobicContact CB-CG2 3.95Å
262	G	71.1	Confident	71.2	Confident	25 Å²	25	77.8 Å²	77.8	26%	0.258	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-36	172.2	0	0	0	0	0	113.4	L258 D259 G260 K266	L258-G262 PolarHBondContact O-N 3.22Å; D259-G262 PolarHBondContact O-N 2.85Å; G260-G262 VanDerWaalsContact C-N 3.35Å; G260-G262 PolarHBondContact O-N 3.29Å; G262-K266 VanDerWaalsContact O-CG 3.28Å; G262-K266 WeakPolarHBondContact O-CG 3.48Å; G262-K266 PolarHBondContact O-N 3.48Å; G262-K266 VanDerWaalsContact O-N 3.09Å
263	Q	82	Confident	70.6	Confident	98 Å²	98	73.5 Å²	73.5	46%	0.458	36%	0.362	S	S	.	.	H	α-helix	trans	-66.4	-38.3	173	-73.4	176	40.4	0	0	112.5	V241 D259 G260 A261 Q267	V241-Q263 HydrophobicContact CG1-CB 4.24Å; D259-Q263 WeakPolarHBondContact O-CG 3.28Å; D259-Q263 PolarHBondContact O-N 2.85Å; G260-Q263 WeakPolarHBondContact O-CB 3.33Å; G260-Q263 PolarHBondContact O-N 3.12Å; G260-Q263 VanDerWaalsContact O-N 3.09Å; A261-Q263 VanDerWaalsContact C-N 3.34Å; A261-Q263 PolarHBondContact O-N 2.91Å; Q263-Q267 WeakPolarHBondContact O-CG 3.23Å; Q263-Q267 PolarHBondContact O-N 3.09Å
264	M	78.9	Confident	70.4	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-65.2	-47.3	176.4	-71.5	-171.9	61	0	0	111.3	F208 V241 H242 M245 G260 A261 K266 Q267 E268 V274 L277 V278	F208-M264 HydrophobicContact CE1-CE 4.25Å; F208-M264 HydrophobicContact CE2-CE 3.87Å; F208-M264 HydrophobicContact CZ-CE 3.57Å; V241-M264 HydrophobicContact CB-CG 3.93Å; V241-M264 HydrophobicContact CB-SD 4.44Å; V241-M264 HydrophobicContact CG1-CG 3.53Å; V241-M264 HydrophobicContact CG1-SD 4.18Å; H242-M264 HydrophobicContact CB-CE 4.26Å; H242-M264 HydrophobicContact CB-SD 4.01Å; M245-M264 HydrophobicContact CE-SD 4.41Å; M245-M264 HydrophobicContact SD-CG 4.13Å; M245-M264 HydrophobicContact SD-SD 3.42Å; G260-M264 PolarHBondContact O-N 3.49Å; A261-M264 PolarHBondContact O-N 3.04Å; M264-K266 VanDerWaalsContact C-N 3.33Å; M264-K266 PolarHBondContact O-N 3.13Å; M264-Q267 PolarHBondContact O-N 2.9Å; M264-Q267 VanDerWaalsContact O-N 3.08Å; M264-E268 PolarHBondContact O-N 3.31Å; M264-V274 HydrophobicContact CB-CG1 4.23Å; M264-V274 HydrophobicContact CE-CG1 4.04Å; M264-L277 HydrophobicContact CE-CD2 4.25Å; M264-V278 HydrophobicContact CB-CG2 4.14Å
265	L	73	Confident	70.5	Confident	23 Å²	23	61.9 Å²	61.9	12%	0.12	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-38	177.5	-72.4	175.3	0	0	0	113.2	A261 Q267 E268 S269 I275 V278 Q280	A261-L265 PolarHBondContact O-N 3.27Å; L265-Q267 PolarHBondContact O-N 2.95Å; L265-E268 CarbonylContact O-C 3.22Å; L265-E268 PolarHBondContact O-N 3.07Å; L265-S269 PolarHBondContact O-N 3.29Å; L265-I275 HydrophobicContact CD2-CB 4.28Å; L265-I275 HydrophobicContact CD2-CG1 3.98Å; L265-I275 HydrophobicContact CD2-CG2 4.36Å; L265-V278 HydrophobicContact CD1-CB 4.29Å; L265-V278 HydrophobicContact CD1-CG1 3.38Å; L265-V278 HydrophobicContact CD2-CB 4.3Å; L265-V278 HydrophobicContact CD2-CG1 4.27Å; L265-V278 HydrophobicContact CD2-CG2 4.33Å; L265-V278 HydrophobicContact CG-CB 4.13Å; L265-V278 HydrophobicContact CG-CG1 3.68Å; L265-V278 HydrophobicContact CG-CG2 4.06Å; L265-Q280 VanDerWaalsContact CD1-CD 3.43Å; L265-Q280 HydrophobicContact CD1-CG 4.23Å
266	K	80.3	Confident	70.4	Confident	188 Å²	188	55.2 Å²	55.2	82%	0.817	29%	0.287	S	S	*	.	H	α-helix	trans	-62.9	-30.5	175	-77.2	175.9	-176.4	179.8	0	112.9	G262 M264	G262-K266 VanDerWaalsContact O-CG 3.28Å; G262-K266 WeakPolarHBondContact O-CG 3.48Å; G262-K266 PolarHBondContact O-N 3.48Å; G262-K266 VanDerWaalsContact O-N 3.09Å; M264-K266 VanDerWaalsContact C-N 3.33Å; M264-K266 PolarHBondContact O-N 3.13Å
267	Q	79.8	Confident	69.9	Low	73 Å²	73	54 Å²	54	34%	0.341	28%	0.28	S	S	.	.	H	α-helix	trans	-87.3	-28.3	178.2	-70.5	-179.3	43.9	0	0	112.4	L238 Q263 M264 L265	L238-Q267 HydrophobicContact CD2-CB 3.77Å; Q263-Q267 WeakPolarHBondContact O-CG 3.23Å; Q263-Q267 PolarHBondContact O-N 3.09Å; M264-Q267 PolarHBondContact O-N 2.9Å; M264-Q267 VanDerWaalsContact O-N 3.08Å; L265-Q267 PolarHBondContact O-N 2.95Å
268	E	76.7	Confident	69.7	Low	15 Å²	15	53.7 Å²	53.7	7%	0.07	28%	0.277	C	S	.	.			trans	-145.8	87.7	-176.9	-68.7	-72.1	-150.4	0	0	111.4	Y204 K234 L238 M264 L265 V271 V274	Y204-E268 WeakPolarHBondContact CE1-OE1 3.35Å; Y204-E268 VanDerWaalsContact CZ-OE1 3.26Å; Y204-E268 WeakPolarHBondContact OH-CG 3.47Å; Y204-E268 PolarHBondContact OH-OE1 3.3Å; K234-E268 WeakPolarHBondContact CE-OE1 3.34Å; K234-E268 IonicContact NZ-OE1 3.52Å; K234-E268 PolarHBondContact NZ-OE1 2.97Å; K234-E268 IonicContact NZ-OE2 2.67Å; K234-E268 PolarHBondContact NZ-OE2 3.42Å; L238-E268 HydrophobicContact CD1-CG 3.63Å; L238-E268 HydrophobicContact CD2-CG 4.03Å; L238-E268 HydrophobicContact CG-CG 4.47Å; M264-E268 PolarHBondContact O-N 3.31Å; L265-E268 CarbonylContact O-C 3.22Å; L265-E268 PolarHBondContact O-N 3.07Å; E268-V271 HydrophobicContact CB-CG2 4.35Å; E268-V271 HydrophobicContact CG-CG2 4.44Å; E268-V274 HydrophobicContact CB-CB 4.47Å; E268-V274 HydrophobicContact CB-CG1 4.15Å; E268-V274 HydrophobicContact CB-CG2 4.45Å
269	S	70.1	Confident	69.6	Low	78 Å²	78	49.8 Å²	49.8	55%	0.545	27%	0.268	S	S	.	.	S	Bend	trans	-87.1	-13.5	176.9	53.7	0	0	0	0	113.5	L265 I275	L265-S269 PolarHBondContact O-N 3.29Å; S269-I275 WeakPolarHBondContact O-CD1 3.48Å
270	E	68.1	Low	69.3	Low	170 Å²	170	50.2 Å²	50.2	79%	0.794	27%	0.267	S	S	*	.	S	Bend	trans	-105.5	-21.8	-172.4	-63.3	-179.6	179.9	0	0	113	R272	E270-R272 PolarHBondContact O-N 3.38Å
271	V	68.1	Low	69.1	Low	21 Å²	21	51 Å²	51	13%	0.127	27%	0.269	C	S	.	.			trans	-79.5	96.3	-176.2	-175.6	0	0	0	0	108.5	Y204 E268 N273 V274 I275	Y204-V271 HydrophobicContact CE1-CG1 4.34Å; Y204-V271 HydrophobicContact CE1-CG2 3.64Å; E268-V271 HydrophobicContact CB-CG2 4.35Å; E268-V271 HydrophobicContact CG-CG2 4.44Å; V271-N273 PolarHBondContact O-N 3.42Å; V271-V274 HydrophobicContact CB-CB 4.17Å; V271-V274 HydrophobicContact CB-CG2 3.9Å; V271-V274 HydrophobicContact CG1-CB 4.4Å; V271-V274 HydrophobicContact CG1-CG2 3.82Å; V271-V274 WeakPolarHBondContact O-CA 3.36Å; V271-V274 VanDerWaalsContact O-CB 3.28Å; V271-V274 WeakPolarHBondContact O-CB 3.28Å; V271-V274 PolarHBondContact O-N 3.05Å; V271-I275 PolarHBondContact O-N 3.27Å
272	R	66.6	Low	69.2	Low	48 Å²	48	56.4 Å²	56.4	18%	0.181	30%	0.297	C	S	.	.	H	α-helix	trans	-42.4	-44.7	-177.7	-175.3	-174.5	-177.9	176.6	5.4	115.4	E270 V274 I275 M276 C288 P300 A301 S304	E270-R272 PolarHBondContact O-N 3.38Å; R272-V274 VanDerWaalsContact C-N 3.29Å; R272-V274 PolarHBondContact O-N 3.43Å; R272-I275 WeakPolarHBondContact O-CB 3.43Å; R272-I275 PolarHBondContact O-N 3.47Å; R272-I275 VanDerWaalsContact O-N 3.15Å; R272-M276 HydrophobicContact CG-CG 4.46Å; R272-M276 WeakPolarHBondContact O-CG 3.46Å; R272-M276 PolarHBondContact O-N 3.15Å; R272-C288 PolarHBondContact NH2-SG 3.49Å; R272-P300 PolarHBondContact NH1-O 3.27Å; R272-P300 VanDerWaalsContact NH2-C 3.34Å; R272-P300 PolarHBondContact NH2-O 3.19Å; R272-A301 VanDerWaalsContact CZ-CA 3.48Å; R272-A301 VanDerWaalsContact NH1-CA 3.27Å; R272-A301 VanDerWaalsContact NH2-C 3.32Å; R272-A301 PolarHBondContact NH2-O 3.36Å; R272-S304 VanDerWaalsContact CZ-CB 3.4Å; R272-S304 PolarHBondContact NE-OG 2.94Å; R272-S304 VanDerWaalsContact NH2-CA 3.26Å; R272-S304 VanDerWaalsContact NH2-N 3.1Å; R272-S304 PolarHBondContact NH2-OG 3.34Å
273	N	62	Low	69.2	Low	51 Å²	51	57.4 Å²	57.4	27%	0.273	30%	0.295	S	S	.	.	H	α-helix	trans	-68.4	-28.2	-179.3	-76.2	-28.8	0	0	0	113.1	M205 L206 V271 L277	M205-N273 PolarHBondContact O-ND2 3.45Å; L206-N273 WeakPolarHBondContact CA-ND2 3.35Å; L206-N273 PolarHBondContact O-ND2 3.11Å; V271-N273 PolarHBondContact O-N 3.42Å; N273-L277 VanDerWaalsContact O-CB 3.28Å; N273-L277 WeakPolarHBondContact O-CB 3.27Å; N273-L277 PolarHBondContact O-N 3.45Å; N273-L277 VanDerWaalsContact O-N 3.11Å
274	V	62.5	Low	68.6	Low	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.5	-42.8	170.2	174.2	0	0	0	0	109.9	F208 M264 E268 V271 R272 L277 V278	F208-V274 HydrophobicContact CD1-CG2 3.94Å; F208-V274 HydrophobicContact CE1-CG2 4.32Å; F208-V274 HydrophobicContact CG-CG2 4.28Å; M264-V274 HydrophobicContact CB-CG1 4.23Å; M264-V274 HydrophobicContact CE-CG1 4.04Å; E268-V274 HydrophobicContact CB-CB 4.47Å; E268-V274 HydrophobicContact CB-CG1 4.15Å; E268-V274 HydrophobicContact CB-CG2 4.45Å; V271-V274 HydrophobicContact CB-CB 4.17Å; V271-V274 HydrophobicContact CB-CG2 3.9Å; V271-V274 HydrophobicContact CG1-CB 4.4Å; V271-V274 HydrophobicContact CG1-CG2 3.82Å; V271-V274 WeakPolarHBondContact O-CA 3.36Å; V271-V274 VanDerWaalsContact O-CB 3.28Å; V271-V274 WeakPolarHBondContact O-CB 3.28Å; V271-V274 PolarHBondContact O-N 3.05Å; R272-V274 VanDerWaalsContact C-N 3.29Å; R272-V274 PolarHBondContact O-N 3.43Å; V274-L277 PolarHBondContact O-N 2.91Å; V274-V278 VanDerWaalsContact O-CG2 3.32Å; V274-V278 WeakPolarHBondContact O-CG2 3.4Å; V274-V278 PolarHBondContact O-N 3.48Å; V274-V278 VanDerWaalsContact O-N 3.1Å
275	I	62.9	Low	68.7	Low	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-48.5	177.9	-52.8	173.6	0	0	0	111.1	L265 S269 V271 R272 L277 V278 E283 A284 V287	L265-I275 HydrophobicContact CD2-CB 4.28Å; L265-I275 HydrophobicContact CD2-CG1 3.98Å; L265-I275 HydrophobicContact CD2-CG2 4.36Å; S269-I275 WeakPolarHBondContact O-CD1 3.48Å; V271-I275 PolarHBondContact O-N 3.27Å; R272-I275 WeakPolarHBondContact O-CB 3.43Å; R272-I275 PolarHBondContact O-N 3.47Å; R272-I275 VanDerWaalsContact O-N 3.15Å; I275-L277 VanDerWaalsContact C-N 3.3Å; I275-L277 PolarHBondContact O-N 3.2Å; I275-V278 PolarHBondContact O-N 3.02Å; I275-E283 HydrophobicContact CG2-CB 4.3Å; I275-E283 HydrophobicContact CG2-CG 4Å; I275-A284 HydrophobicContact CG2-CB 4.19Å; I275-V287 HydrophobicContact CD1-CB 4.36Å; I275-V287 HydrophobicContact CD1-CG1 4.18Å; I275-V287 HydrophobicContact CD1-CG2 3.94Å
276	M	61.9	Low	69.2	Low	24 Å²	24	59.2 Å²	59.2	12%	0.118	30%	0.298	C	S	.	.	H	α-helix	trans	-59	-40.3	176.3	-72.2	-64.1	-56.6	0	0	112.1	R272 V278 G279 A284 E307 A308	R272-M276 HydrophobicContact CG-CG 4.46Å; R272-M276 WeakPolarHBondContact O-CG 3.46Å; R272-M276 PolarHBondContact O-N 3.15Å; M276-V278 VanDerWaalsContact C-N 3.34Å; M276-V278 PolarHBondContact O-N 2.92Å; M276-G279 PolarHBondContact O-N 2.8Å; M276-A284 HydrophobicContact SD-CB 3.53Å; M276-A284 VanDerWaalsContact SD-CB 3.53Å; M276-E307 HydrophobicContact CE-CB 4.17Å; M276-A308 HydrophobicContact CE-CB 4.35Å; M276-A308 HydrophobicContact SD-CB 4.32Å
277	L	60.6	Low	69	Low	70 Å²	70	51.5 Å²	51.5	37%	0.366	27%	0.267	S	S	.	.	H	α-helix	trans	-69.1	-31.1	-179.4	-177	128.4	0	0	0	112.8	F208 M264 N273 V274 I275 G279	F208-L277 HydrophobicContact CE1-CB 4.49Å; F208-L277 HydrophobicContact CE1-CD1 3.93Å; F208-L277 HydrophobicContact CE1-CD2 4.18Å; F208-L277 HydrophobicContact CE1-CG 4.41Å; F208-L277 HydrophobicContact CZ-CD1 4.27Å; F208-L277 HydrophobicContact CZ-CD2 4.1Å; M264-L277 HydrophobicContact CE-CD2 4.25Å; N273-L277 VanDerWaalsContact O-CB 3.28Å; N273-L277 WeakPolarHBondContact O-CB 3.27Å; N273-L277 PolarHBondContact O-N 3.45Å; N273-L277 VanDerWaalsContact O-N 3.11Å; V274-L277 PolarHBondContact O-N 2.91Å; I275-L277 VanDerWaalsContact C-N 3.3Å; I275-L277 PolarHBondContact O-N 3.2Å; L277-G279 PolarHBondContact O-N 3.2Å
278	V	59.9	Low	68.7	Low	17 Å²	17	48.1 Å²	48.1	10%	0.103	25%	0.251	C	S	.	.	H	α-helix	trans	-72.4	-11.6	178.2	163.6	0	0	0	0	112.4	A261 M264 L265 V274 I275 M276 Q280	A261-V278 HydrophobicContact CB-CB 4.04Å; A261-V278 HydrophobicContact CB-CG1 3.41Å; A261-V278 VanDerWaalsContact CB-CG1 3.41Å; A261-V278 HydrophobicContact CB-CG2 3.95Å; M264-V278 HydrophobicContact CB-CG2 4.14Å; L265-V278 HydrophobicContact CD1-CB 4.29Å; L265-V278 HydrophobicContact CD1-CG1 3.38Å; L265-V278 HydrophobicContact CD2-CB 4.3Å; L265-V278 HydrophobicContact CD2-CG1 4.27Å; L265-V278 HydrophobicContact CD2-CG2 4.33Å; L265-V278 HydrophobicContact CG-CB 4.13Å; L265-V278 HydrophobicContact CG-CG1 3.68Å; L265-V278 HydrophobicContact CG-CG2 4.06Å; V274-V278 VanDerWaalsContact O-CG2 3.32Å; V274-V278 WeakPolarHBondContact O-CG2 3.4Å; V274-V278 PolarHBondContact O-N 3.48Å; V274-V278 VanDerWaalsContact O-N 3.1Å; I275-V278 PolarHBondContact O-N 3.02Å; M276-V278 VanDerWaalsContact C-N 3.34Å; M276-V278 PolarHBondContact O-N 2.92Å; V278-Q280 HydrophobicContact CG1-CG 4.06Å; V278-Q280 PolarHBondContact O-N 2.96Å
279	G	60.7	Low	69.1	Low	44 Å²	44	48.7 Å²	48.7	45%	0.454	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	12.7	174.1	0	0	0	0	0	114.3	M276 L277 L281	M276-G279 PolarHBondContact O-N 2.8Å; L277-G279 PolarHBondContact O-N 3.2Å; G279-L281 VanDerWaalsContact C-N 3.26Å; G279-L281 PolarHBondContact O-N 3.37Å
280	Q	65.7	Low	69.8	Low	94 Å²	94	49.6 Å²	49.6	44%	0.439	25%	0.252	S	S	.	.			trans	-79.1	81	168	-73.3	-169.8	-9.9	0	0	109.1	L265 V278 D282 E283 A284	L265-Q280 VanDerWaalsContact CD1-CD 3.43Å; L265-Q280 HydrophobicContact CD1-CG 4.23Å; V278-Q280 HydrophobicContact CG1-CG 4.06Å; V278-Q280 PolarHBondContact O-N 2.96Å; Q280-D282 VanDerWaalsContact C-N 3.29Å; Q280-D282 PolarHBondContact O-N 3.23Å; Q280-E283 HydrophobicContact CB-CB 3.81Å; Q280-E283 WeakPolarHBondContact O-CB 3.24Å; Q280-E283 PolarHBondContact O-N 3.08Å; Q280-E283 VanDerWaalsContact O-N 3.16Å; Q280-A284 PolarHBondContact O-N 3.06Å
281	L	69	Low	70.1	Confident	26 Å²	26	44.2 Å²	44.2	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-39.2	-175.1	-59.6	177.1	0	0	0	112.1	G279 E283 A284 I285 A308 Q311 N312	G279-L281 VanDerWaalsContact C-N 3.26Å; G279-L281 PolarHBondContact O-N 3.37Å; L281-E283 VanDerWaalsContact C-N 3.34Å; L281-E283 PolarHBondContact O-N 3.4Å; L281-A284 PolarHBondContact O-N 3.35Å; L281-I285 WeakPolarHBondContact O-CB 3.32Å; L281-I285 WeakPolarHBondContact O-CD1 3.48Å; L281-I285 WeakPolarHBondContact O-CG1 3.32Å; L281-I285 PolarHBondContact O-N 3.48Å; L281-A308 HydrophobicContact CD2-CB 4.39Å; L281-Q311 VanDerWaalsContact CD1-C 3.42Å; L281-Q311 HydrophobicContact CD1-CB 3.68Å; L281-Q311 HydrophobicContact CD2-CB 3.63Å; L281-Q311 HydrophobicContact CD2-CG 4.49Å; L281-Q311 HydrophobicContact CG-CB 4.32Å; L281-N312 HydrophobicContact CB-CB 4.38Å; L281-N312 HydrophobicContact CD1-CB 3.88Å
282	D	74.2	Confident	70.6	Confident	118 Å²	118	43.9 Å²	43.9	63%	0.631	23%	0.228	S	C	*	.	H	α-helix	trans	-62.3	-42.2	176.8	-62.9	-37.1	0	0	0	111.8	Q280 I285 R286	Q280-D282 VanDerWaalsContact C-N 3.29Å; Q280-D282 PolarHBondContact O-N 3.23Å; D282-I285 PolarHBondContact O-N 3.03Å; D282-R286 WeakPolarHBondContact O-CB 3.45Å; D282-R286 PolarHBondContact O-N 3.41Å
283	E	70.9	Confident	71.5	Confident	45 Å²	45	49 Å²	49	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-68	-41.3	177.6	-171.8	54.8	-136.1	0	0	111	I275 Q280 L281 I285 R286 V287	I275-E283 HydrophobicContact CG2-CB 4.3Å; I275-E283 HydrophobicContact CG2-CG 4Å; Q280-E283 HydrophobicContact CB-CB 3.81Å; Q280-E283 WeakPolarHBondContact O-CB 3.24Å; Q280-E283 PolarHBondContact O-N 3.08Å; Q280-E283 VanDerWaalsContact O-N 3.16Å; L281-E283 VanDerWaalsContact C-N 3.34Å; L281-E283 PolarHBondContact O-N 3.4Å; E283-I285 PolarHBondContact O-N 3.42Å; E283-R286 PolarHBondContact O-N 2.94Å; E283-R286 IonicContact OE1-CZ 3.59Å; E283-R286 IonicContact OE1-NE 3.55Å; E283-R286 PolarHBondContact OE1-NE 3.03Å; E283-R286 IonicContact OE1-NH2 2.65Å; E283-R286 PolarHBondContact OE1-NH2 2.97Å; E283-R286 IonicContact OE2-CZ 3.35Å; E283-R286 IonicContact OE2-NE 2.69Å; E283-R286 PolarHBondContact OE2-NE 3Å; E283-R286 IonicContact OE2-NH1 2.73Å; E283-R286 IonicContact OE2-NH2 3.45Å; E283-R286 PolarHBondContact OE2-NH2 3.34Å; E283-V287 WeakPolarHBondContact O-CG2 3.48Å; E283-V287 PolarHBondContact O-N 2.68Å; E283-V287 WeakPolarHBondContact OE1-CG2 3.29Å
284	A	69.3	Low	72.3	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-42.7	173.5	0	0	0	0	0	112.2	I275 M276 Q280 L281 C288 A308	I275-A284 HydrophobicContact CG2-CB 4.19Å; M276-A284 HydrophobicContact SD-CB 3.53Å; M276-A284 VanDerWaalsContact SD-CB 3.53Å; Q280-A284 PolarHBondContact O-N 3.06Å; L281-A284 PolarHBondContact O-N 3.35Å; A284-C288 VanDerWaalsContact O-CB 3.31Å; A284-C288 WeakPolarHBondContact O-CB 3.48Å; A284-C288 PolarHBondContact O-N 3.29Å; A284-C288 PolarHBondContact O-SG 3.16Å; A284-A308 HydrophobicContact CB-CB 4.15Å
285	I	80.4	Confident	73.1	Confident	20 Å²	20	57.1 Å²	57.1	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-42.9	175.8	-70.1	161.9	0	0	0	110.2	L281 D282 E283 S289 A308 Y309	L281-I285 WeakPolarHBondContact O-CB 3.32Å; L281-I285 WeakPolarHBondContact O-CD1 3.48Å; L281-I285 WeakPolarHBondContact O-CG1 3.32Å; L281-I285 PolarHBondContact O-N 3.48Å; D282-I285 PolarHBondContact O-N 3.03Å; E283-I285 PolarHBondContact O-N 3.42Å; I285-S289 VanDerWaalsContact O-CB 3.29Å; I285-S289 WeakPolarHBondContact O-CB 3.43Å; I285-S289 PolarHBondContact O-N 3.22Å; I285-S289 PolarHBondContact O-OG 3.36Å; I285-A308 HydrophobicContact CD1-CB 4.37Å; I285-A308 HydrophobicContact CG1-CB 3.72Å; I285-Y309 HydrophobicContact CD1-CD1 3.64Å; I285-Y309 HydrophobicContact CD1-CE1 3.72Å; I285-Y309 HydrophobicContact CD1-CG 4.44Å; I285-Y309 HydrophobicContact CG1-CD1 4.19Å; I285-Y309 HydrophobicContact CG1-CE1 4.1Å; I285-Y309 HydrophobicContact CG2-CE1 3.91Å
286	R	83.8	Confident	73.8	Confident	137 Å²	137	61.1 Å²	61.1	52%	0.517	32%	0.324	S	S	.	.	H	α-helix	trans	-59.4	-57.1	177.4	-176.1	179.9	74.9	161.5	7.7	111.3	D282 E283 C288 S289 E290	D282-R286 WeakPolarHBondContact O-CB 3.45Å; D282-R286 PolarHBondContact O-N 3.41Å; E283-R286 PolarHBondContact O-N 2.94Å; E283-R286 IonicContact OE1-CZ 3.59Å; E283-R286 IonicContact OE1-NE 3.55Å; E283-R286 PolarHBondContact OE1-NE 3.03Å; E283-R286 IonicContact OE1-NH2 2.65Å; E283-R286 PolarHBondContact OE1-NH2 2.97Å; E283-R286 IonicContact OE2-CZ 3.35Å; E283-R286 IonicContact OE2-NE 2.69Å; E283-R286 PolarHBondContact OE2-NE 3Å; E283-R286 IonicContact OE2-NH1 2.73Å; E283-R286 IonicContact OE2-NH2 3.45Å; E283-R286 PolarHBondContact OE2-NH2 3.34Å; R286-C288 VanDerWaalsContact C-N 3.34Å; R286-C288 PolarHBondContact O-N 3.44Å; R286-S289 WeakPolarHBondContact O-CA 3.19Å; R286-S289 WeakPolarHBondContact O-CB 3.44Å; R286-S289 PolarHBondContact O-N 3.11Å; R286-E290 PolarHBondContact O-N 2.77Å
287	V	75.7	Confident	74.3	Confident	26 Å²	26	66.3 Å²	66.3	16%	0.158	35%	0.352	C	S	.	.	H	α-helix	trans	-60.4	-43	-179.2	172.7	0	0	0	0	111.5	I275 E283 S289 E290 V291	I275-V287 HydrophobicContact CD1-CB 4.36Å; I275-V287 HydrophobicContact CD1-CG1 4.18Å; I275-V287 HydrophobicContact CD1-CG2 3.94Å; E283-V287 WeakPolarHBondContact O-CG2 3.48Å; E283-V287 PolarHBondContact O-N 2.68Å; E283-V287 WeakPolarHBondContact OE1-CG2 3.29Å; V287-S289 PolarHBondContact O-N 3.44Å; V287-E290 PolarHBondContact O-N 3.46Å; V287-V291 WeakPolarHBondContact O-CG2 3.32Å; V287-V291 PolarHBondContact O-N 3.4Å; V287-V291 VanDerWaalsContact O-N 3.12Å
288	C	74	Confident	74.9	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.014	35%	0.346	C	S	.	.	H	α-helix	trans	-65.3	-31.4	176.2	-64.6	0	0	0	0	112.1	R272 A284 R286 L292 R305	R272-C288 PolarHBondContact NH2-SG 3.49Å; A284-C288 VanDerWaalsContact O-CB 3.31Å; A284-C288 WeakPolarHBondContact O-CB 3.48Å; A284-C288 PolarHBondContact O-N 3.29Å; A284-C288 PolarHBondContact O-SG 3.16Å; R286-C288 VanDerWaalsContact C-N 3.34Å; R286-C288 PolarHBondContact O-N 3.44Å; C288-L292 WeakPolarHBondContact O-CD1 3.2Å; C288-L292 WeakPolarHBondContact O-CG 3.47Å; C288-L292 PolarHBondContact O-N 3Å; C288-L292 VanDerWaalsContact O-N 3.13Å; C288-R305 HydrophobicContact CB-CB 3.67Å; C288-R305 HydrophobicContact CB-CG 4.04Å
289	S	84.7	Confident	75.1	Confident	26 Å²	26	68.1 Å²	68.1	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-72.1	-40.5	177.2	-59.2	0	0	0	0	111.8	I285 R286 V287 V291 L292 E293 R305	I285-S289 VanDerWaalsContact O-CB 3.29Å; I285-S289 WeakPolarHBondContact O-CB 3.43Å; I285-S289 PolarHBondContact O-N 3.22Å; I285-S289 PolarHBondContact O-OG 3.36Å; R286-S289 WeakPolarHBondContact O-CA 3.19Å; R286-S289 WeakPolarHBondContact O-CB 3.44Å; R286-S289 PolarHBondContact O-N 3.11Å; V287-S289 PolarHBondContact O-N 3.44Å; S289-V291 VanDerWaalsContact C-N 3.31Å; S289-V291 PolarHBondContact O-N 3.01Å; S289-L292 CarbonylContact O-C 3.55Å; S289-L292 PolarHBondContact O-N 2.98Å; S289-L292 VanDerWaalsContact O-N 3.14Å; S289-E293 WeakPolarHBondContact O-CG 3.36Å; S289-E293 PolarHBondContact O-N 3Å; S289-R305 WeakPolarHBondContact OG-CD 3.31Å; S289-R305 PolarHBondContact OG-NH1 3.35Å
290	E	84	Confident	75.3	Confident	97 Å²	97	68.8 Å²	68.8	45%	0.453	35%	0.353	S	S	.	.	H	α-helix	trans	-60.3	-38.2	172.7	-69	174.9	-170.7	0	0	112.4	R286 V287 N294	R286-E290 PolarHBondContact O-N 2.77Å; V287-E290 PolarHBondContact O-N 3.46Å; E290-N294 PolarHBondContact O-ND2 3.34Å
291	V	74.8	Confident	75.5	Confident	58 Å²	58	64.3 Å²	64.3	35%	0.352	33%	0.332	S	S	.	.	H	α-helix	trans	-65	-42.6	173.9	174.6	0	0	0	0	111.1	V287 S289 E293 N294 D295 E298 A301	V287-V291 WeakPolarHBondContact O-CG2 3.32Å; V287-V291 PolarHBondContact O-N 3.4Å; V287-V291 VanDerWaalsContact O-N 3.12Å; S289-V291 VanDerWaalsContact C-N 3.31Å; S289-V291 PolarHBondContact O-N 3.01Å; V291-E293 VanDerWaalsContact C-N 3.33Å; V291-E293 PolarHBondContact O-N 3.47Å; V291-N294 PolarHBondContact O-N 2.95Å; V291-D295 PolarHBondContact O-N 3.42Å; V291-E298 HydrophobicContact CG1-CB 4.25Å; V291-E298 HydrophobicContact CG1-CG 4.09Å; V291-A301 HydrophobicContact CB-CB 4.15Å; V291-A301 HydrophobicContact CG1-CB 3.78Å
292	L	78.6	Confident	75.5	Confident	13 Å²	13	64 Å²	64	7%	0.068	33%	0.33	C	S	.	.	H	α-helix	trans	-74.3	-20.4	-179.1	-68.3	167	0	0	0	113.7	C288 S289 N294 D295 P296 E298 A301 L302	C288-L292 WeakPolarHBondContact O-CD1 3.2Å; C288-L292 WeakPolarHBondContact O-CG 3.47Å; C288-L292 PolarHBondContact O-N 3Å; C288-L292 VanDerWaalsContact O-N 3.13Å; S289-L292 CarbonylContact O-C 3.55Å; S289-L292 PolarHBondContact O-N 2.98Å; S289-L292 VanDerWaalsContact O-N 3.14Å; L292-N294 VanDerWaalsContact C-N 3.28Å; L292-D295 WeakPolarHBondContact CA-O 3.29Å; L292-D295 WeakPolarHBondContact CD2-O 3.45Å; L292-D295 CarbonylContact O-C 3.51Å; L292-P296 VanDerWaalsContact O-CA 3.26Å; L292-P296 WeakPolarHBondContact O-CA 3.48Å; L292-P296 VanDerWaalsContact O-N 3.14Å; L292-E298 HydrophobicContact CD2-CB 4.33Å; L292-A301 HydrophobicContact CD1-CB 4.09Å; L292-A301 HydrophobicContact CD2-CB 3.61Å; L292-A301 HydrophobicContact CG-CB 3.59Å; L292-L302 HydrophobicContact CD1-CD2 3.89Å; L292-L302 HydrophobicContact CD2-CD2 3.68Å; L292-L302 HydrophobicContact CD2-CG 3.78Å; L292-L302 HydrophobicContact CG-CD2 4.47Å
293	E	85.5	Confident	75.1	Confident	156 Å²	156	59.8 Å²	59.8	73%	0.729	31%	0.308	S	S	*	.	H	α-helix	trans	-64.9	-35.3	168.2	-76.7	173.7	-169.5	0	0	111.4	S289 V291	S289-E293 WeakPolarHBondContact O-CG 3.36Å; S289-E293 PolarHBondContact O-N 3Å; V291-E293 VanDerWaalsContact C-N 3.33Å; V291-E293 PolarHBondContact O-N 3.47Å
294	N	80.1	Confident	75.1	Confident	145 Å²	145	58.2 Å²	58.2	78%	0.775	30%	0.302	S	S	*	.	H	α-helix	trans	-83.2	-39.6	177.7	-68.2	-65.5	0	0	0	112.7	E290 V291 L292	E290-N294 PolarHBondContact O-ND2 3.34Å; V291-N294 PolarHBondContact O-N 2.95Å; L292-N294 VanDerWaalsContact C-N 3.28Å
295	D	78	Confident	75.5	Confident	77 Å²	77	60.6 Å²	60.6	41%	0.412	31%	0.31	S	S	.	.			trans	-138.8	96.1	175	-178.6	4	0	0	0	110.8	V291 L292 N297 E298	V291-D295 PolarHBondContact O-N 3.42Å; L292-D295 WeakPolarHBondContact CA-O 3.29Å; L292-D295 WeakPolarHBondContact CD2-O 3.45Å; L292-D295 CarbonylContact O-C 3.51Å; D295-N297 PolarHBondContact O-N 3.36Å; D295-N297 PolarHBondContact OD1-N 3.3Å; D295-E298 HydrophobicContact CB-CB 4.12Å; D295-E298 WeakPolarHBondContact O-CB 3.44Å; D295-E298 PolarHBondContact O-N 2.89Å; D295-E298 VanDerWaalsContact O-N 3.11Å
296	P	78.5	Confident	74.9	Confident	86 Å²	86	59.6 Å²	59.6	56%	0.558	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-17.7	-178.8	-26	34.5	0	0	0	114.8	L292	L292-P296 VanDerWaalsContact O-CA 3.26Å; L292-P296 WeakPolarHBondContact O-CA 3.48Å; L292-P296 VanDerWaalsContact O-N 3.14Å
297	N	72.3	Confident	74.2	Confident	132 Å²	132	55 Å²	55	71%	0.706	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	11.3	-177.1	-63.3	-47.1	0	0	0	112.9	D295 F299	D295-N297 PolarHBondContact O-N 3.36Å; D295-N297 PolarHBondContact OD1-N 3.3Å; N297-F299 PolarHBondContact O-N 3.3Å
298	E	72.7	Confident	74.3	Confident	53 Å²	53	53.7 Å²	53.7	25%	0.248	28%	0.282	C	S	.	.			trans	-66.3	96.5	178.1	-153.5	-84.9	145.5	0	0	109.7	V291 L292 D295 P300 A301 L302	V291-E298 HydrophobicContact CG1-CB 4.25Å; V291-E298 HydrophobicContact CG1-CG 4.09Å; L292-E298 HydrophobicContact CD2-CB 4.33Å; D295-E298 HydrophobicContact CB-CB 4.12Å; D295-E298 WeakPolarHBondContact O-CB 3.44Å; D295-E298 PolarHBondContact O-N 2.89Å; D295-E298 VanDerWaalsContact O-N 3.11Å; E298-P300 VanDerWaalsContact OE1-CB 3.3Å; E298-P300 WeakPolarHBondContact OE1-CB 3.25Å; E298-P300 WeakPolarHBondContact OE1-CD 3.5Å; E298-P300 WeakPolarHBondContact OE1-CG 3.4Å; E298-A301 HydrophobicContact CB-CB 4.12Å; E298-A301 WeakPolarHBondContact O-CA 3.45Å; E298-A301 WeakPolarHBondContact O-CB 3.31Å; E298-A301 PolarHBondContact O-N 2.9Å; E298-A301 WeakPolarHBondContact OE2-CA 3.32Å; E298-A301 WeakPolarHBondContact OE2-CB 3.41Å; E298-A301 PolarHBondContact OE2-N 3.34Å; E298-L302 PolarHBondContact O-N 3.31Å
299	F	64.4	Low	74.4	Confident	72 Å²	72	55.1 Å²	55.1	32%	0.316	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-43.6	-170.2	177.3	-99.7	0	0	0	113.7	N297 A301 L302 L303 L323	N297-F299 PolarHBondContact O-N 3.3Å; F299-A301 PolarHBondContact O-N 3.2Å; F299-L302 PolarHBondContact O-N 2.98Å; F299-L303 HydrophobicContact CD1-CD1 3.84Å; F299-L303 HydrophobicContact CD1-CG 4.46Å; F299-L303 HydrophobicContact CE1-CD1 3.21Å; F299-L303 HydrophobicContact CE1-CG 4.01Å; F299-L303 HydrophobicContact CE2-CD1 4.34Å; F299-L303 HydrophobicContact CE2-CG 4.31Å; F299-L303 HydrophobicContact CZ-CD1 3.51Å; F299-L303 HydrophobicContact CZ-CD2 4.32Å; F299-L303 HydrophobicContact CZ-CG 3.93Å; F299-L303 PolarHBondContact O-N 3.1Å; F299-L323 HydrophobicContact CE2-CD2 4.17Å
300	P	63.9	Low	73.6	Confident	58 Å²	58	55.3 Å²	55.3	38%	0.377	29%	0.286	S	S	.	.	H	α-helix	trans	-51.4	-52.8	169.3	-27	34.4	0	0	0	111.9	R272 E298 L302 L303 S304	R272-P300 PolarHBondContact NH1-O 3.27Å; R272-P300 VanDerWaalsContact NH2-C 3.34Å; R272-P300 PolarHBondContact NH2-O 3.19Å; E298-P300 VanDerWaalsContact OE1-CB 3.3Å; E298-P300 WeakPolarHBondContact OE1-CB 3.25Å; E298-P300 WeakPolarHBondContact OE1-CD 3.5Å; E298-P300 WeakPolarHBondContact OE1-CG 3.4Å; P300-L302 VanDerWaalsContact C-N 3.34Å; P300-L302 PolarHBondContact O-N 3.4Å; P300-L303 WeakPolarHBondContact O-CB 3.4Å; P300-L303 PolarHBondContact O-N 2.88Å; P300-S304 PolarHBondContact O-N 3.32Å
301	A	70.2	Confident	72.8	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-55.4	-47.8	-177	0	0	0	0	0	111.1	R272 V291 L292 E298 F299 L303 R305	R272-A301 VanDerWaalsContact CZ-CA 3.48Å; R272-A301 VanDerWaalsContact NH1-CA 3.27Å; R272-A301 VanDerWaalsContact NH2-C 3.32Å; R272-A301 PolarHBondContact NH2-O 3.36Å; V291-A301 HydrophobicContact CB-CB 4.15Å; V291-A301 HydrophobicContact CG1-CB 3.78Å; L292-A301 HydrophobicContact CD1-CB 4.09Å; L292-A301 HydrophobicContact CD2-CB 3.61Å; L292-A301 HydrophobicContact CG-CB 3.59Å; E298-A301 HydrophobicContact CB-CB 4.12Å; E298-A301 WeakPolarHBondContact O-CA 3.45Å; E298-A301 WeakPolarHBondContact O-CB 3.31Å; E298-A301 PolarHBondContact O-N 2.9Å; E298-A301 WeakPolarHBondContact OE2-CA 3.32Å; E298-A301 WeakPolarHBondContact OE2-CB 3.41Å; E298-A301 PolarHBondContact OE2-N 3.34Å; F299-A301 PolarHBondContact O-N 3.2Å; A301-L303 VanDerWaalsContact C-N 3.34Å; A301-L303 PolarHBondContact O-N 3.42Å; A301-R305 VanDerWaalsContact O-CB 3.23Å; A301-R305 WeakPolarHBondContact O-CB 3.43Å; A301-R305 PolarHBondContact O-N 3.14Å
302	L	69.7	Low	72.9	Confident	18 Å²	18	55.2 Å²	55.2	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-55	-48.4	173.9	-65	172.6	0	0	0	111.6	L292 E298 F299 P300 A306 L321 L323	L292-L302 HydrophobicContact CD1-CD2 3.89Å; L292-L302 HydrophobicContact CD2-CD2 3.68Å; L292-L302 HydrophobicContact CD2-CG 3.78Å; L292-L302 HydrophobicContact CG-CD2 4.47Å; E298-L302 PolarHBondContact O-N 3.31Å; F299-L302 PolarHBondContact O-N 2.98Å; P300-L302 VanDerWaalsContact C-N 3.34Å; P300-L302 PolarHBondContact O-N 3.4Å; L302-A306 WeakPolarHBondContact O-CB 3.43Å; L302-A306 PolarHBondContact O-N 3.13Å; L302-L321 HydrophobicContact CB-CD2 4.33Å; L302-L321 HydrophobicContact CD2-CD2 3.35Å; L302-L321 HydrophobicContact CG-CD2 4.45Å; L302-L323 HydrophobicContact CB-CD2 4.33Å
303	L	66.1	Low	72.6	Confident	30 Å²	30	60.4 Å²	60.4	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-58.2	-178.7	-82.3	176.4	0	0	0	113.2	F299 P300 A301 R305 A306 E307 L323	F299-L303 HydrophobicContact CD1-CD1 3.84Å; F299-L303 HydrophobicContact CD1-CG 4.46Å; F299-L303 HydrophobicContact CE1-CD1 3.21Å; F299-L303 HydrophobicContact CE1-CG 4.01Å; F299-L303 HydrophobicContact CE2-CD1 4.34Å; F299-L303 HydrophobicContact CE2-CG 4.31Å; F299-L303 HydrophobicContact CZ-CD1 3.51Å; F299-L303 HydrophobicContact CZ-CD2 4.32Å; F299-L303 HydrophobicContact CZ-CG 3.93Å; F299-L303 PolarHBondContact O-N 3.1Å; P300-L303 WeakPolarHBondContact O-CB 3.4Å; P300-L303 PolarHBondContact O-N 2.88Å; A301-L303 VanDerWaalsContact C-N 3.34Å; A301-L303 PolarHBondContact O-N 3.42Å; L303-R305 VanDerWaalsContact C-N 3.27Å; L303-R305 PolarHBondContact O-N 2.94Å; L303-A306 WeakPolarHBondContact O-CB 3.27Å; L303-A306 PolarHBondContact O-N 3.09Å; L303-A306 VanDerWaalsContact O-N 3.12Å; L303-E307 WeakPolarHBondContact O-CG 3.46Å; L303-E307 PolarHBondContact O-N 2.92Å; L303-L323 HydrophobicContact CD2-CD2 3.85Å; L303-L323 HydrophobicContact CG-CD2 4.22Å
304	S	69.6	Low	72.2	Confident	13 Å²	13	55.4 Å²	55.4	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-72.8	-20.3	-177.2	-28.2	0	0	0	0	113.1	R272 P300 A308	R272-S304 VanDerWaalsContact CZ-CB 3.4Å; R272-S304 PolarHBondContact NE-OG 2.94Å; R272-S304 VanDerWaalsContact NH2-CA 3.26Å; R272-S304 VanDerWaalsContact NH2-N 3.1Å; R272-S304 PolarHBondContact NH2-OG 3.34Å; P300-S304 PolarHBondContact O-N 3.32Å; S304-A308 VanDerWaalsContact O-CB 3.29Å; S304-A308 WeakPolarHBondContact O-CB 3.4Å; S304-A308 PolarHBondContact O-N 3.33Å
305	R	77.8	Confident	71.6	Confident	52 Å²	52	53.2 Å²	53.2	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-42.6	167.1	-164.1	170.9	69.7	174.5	-2.8	111	C288 S289 A301 L303 A308 Y309 L321	C288-R305 HydrophobicContact CB-CB 3.67Å; C288-R305 HydrophobicContact CB-CG 4.04Å; S289-R305 WeakPolarHBondContact OG-CD 3.31Å; S289-R305 PolarHBondContact OG-NH1 3.35Å; A301-R305 VanDerWaalsContact O-CB 3.23Å; A301-R305 WeakPolarHBondContact O-CB 3.43Å; A301-R305 PolarHBondContact O-N 3.14Å; L303-R305 VanDerWaalsContact C-N 3.27Å; L303-R305 PolarHBondContact O-N 2.94Å; R305-A308 PolarHBondContact O-N 3.48Å; R305-Y309 HydrophobicContact CG-CD2 4Å; R305-Y309 HydrophobicContact CG-CE2 3.61Å; R305-Y309 VanDerWaalsContact O-CD2 3.24Å; R305-Y309 WeakPolarHBondContact O-CD2 3.23Å; R305-Y309 PolarHBondContact O-N 2.76Å; R305-L321 HydrophobicContact CB-CD1 4.49Å; R305-L321 VanDerWaalsContact NH2-CD2 3.28Å
306	A	69.7	Low	71.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-45.2	173.4	0	0	0	0	0	111.2	L302 L303 A308 Y309 I310 L321 L331	L302-A306 WeakPolarHBondContact O-CB 3.43Å; L302-A306 PolarHBondContact O-N 3.13Å; L303-A306 WeakPolarHBondContact O-CB 3.27Å; L303-A306 PolarHBondContact O-N 3.09Å; L303-A306 VanDerWaalsContact O-N 3.12Å; A306-A308 VanDerWaalsContact C-N 3.34Å; A306-A308 PolarHBondContact O-N 2.95Å; A306-Y309 PolarHBondContact O-N 3.33Å; A306-I310 WeakPolarHBondContact O-CB 3.34Å; A306-I310 WeakPolarHBondContact O-CD1 3.46Å; A306-I310 VanDerWaalsContact O-CG1 3.23Å; A306-I310 WeakPolarHBondContact O-CG1 3.44Å; A306-I310 PolarHBondContact O-N 2.95Å; A306-L321 HydrophobicContact CB-CD1 3.76Å; A306-L331 HydrophobicContact CB-CD1 3.79Å; A306-L331 HydrophobicContact CB-CD2 4.34Å
307	E	68.5	Low	70.9	Confident	39 Å²	39	57 Å²	57	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-41.6	175.3	-68.2	173.7	170.4	0	0	111.9	M276 L303 I310 Q311 L331 K334	M276-E307 HydrophobicContact CE-CB 4.17Å; L303-E307 WeakPolarHBondContact O-CG 3.46Å; L303-E307 PolarHBondContact O-N 2.92Å; E307-I310 PolarHBondContact O-N 3Å; E307-Q311 WeakPolarHBondContact O-CB 3.47Å; E307-Q311 VanDerWaalsContact O-CG 3.27Å; E307-Q311 WeakPolarHBondContact O-CG 2.87Å; E307-Q311 PolarHBondContact O-N 2.88Å; E307-L331 HydrophobicContact CG-CD1 4.39Å; E307-K334 IonicContact OE1-NZ 3.98Å; E307-K334 PolarHBondContact OE1-NZ 3.44Å
308	A	77.1	Confident	70.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-44.8	177	0	0	0	0	0	111.7	M276 L281 A284 I285 S304 R305 A306 I310 Q311 N312	M276-A308 HydrophobicContact CE-CB 4.35Å; M276-A308 HydrophobicContact SD-CB 4.32Å; L281-A308 HydrophobicContact CD2-CB 4.39Å; A284-A308 HydrophobicContact CB-CB 4.15Å; I285-A308 HydrophobicContact CD1-CB 4.37Å; I285-A308 HydrophobicContact CG1-CB 3.72Å; S304-A308 VanDerWaalsContact O-CB 3.29Å; S304-A308 WeakPolarHBondContact O-CB 3.4Å; S304-A308 PolarHBondContact O-N 3.33Å; R305-A308 PolarHBondContact O-N 3.48Å; A306-A308 VanDerWaalsContact C-N 3.34Å; A306-A308 PolarHBondContact O-N 2.95Å; A308-I310 PolarHBondContact O-N 2.79Å; A308-Q311 PolarHBondContact O-N 3.07Å; A308-N312 WeakPolarHBondContact O-CB 3.31Å; A308-N312 PolarHBondContact O-N 3.17Å
309	Y	76.5	Confident	69.8	Low	32 Å²	32	52.4 Å²	52.4	13%	0.125	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-43.8	173.9	-78.1	-48.9	0	0	0	112.5	I285 R305 A306 Q311 N312 N313 E314 K317 L321	I285-Y309 HydrophobicContact CD1-CD1 3.64Å; I285-Y309 HydrophobicContact CD1-CE1 3.72Å; I285-Y309 HydrophobicContact CD1-CG 4.44Å; I285-Y309 HydrophobicContact CG1-CD1 4.19Å; I285-Y309 HydrophobicContact CG1-CE1 4.1Å; I285-Y309 HydrophobicContact CG2-CE1 3.91Å; R305-Y309 HydrophobicContact CG-CD2 4Å; R305-Y309 HydrophobicContact CG-CE2 3.61Å; R305-Y309 VanDerWaalsContact O-CD2 3.24Å; R305-Y309 WeakPolarHBondContact O-CD2 3.23Å; R305-Y309 PolarHBondContact O-N 2.76Å; A306-Y309 PolarHBondContact O-N 3.33Å; Y309-Q311 VanDerWaalsContact C-N 3.34Å; Y309-Q311 PolarHBondContact O-N 3.43Å; Y309-N312 CarbonylContact O-C 3.16Å; Y309-N312 PolarHBondContact O-N 3.28Å; Y309-N312 VanDerWaalsContact O-N 3.1Å; Y309-N313 PolarHBondContact O-N 3.4Å; Y309-E314 HydrophobicContact CD1-CB 3.91Å; Y309-E314 HydrophobicContact CG-CB 4.43Å; Y309-E314 WeakPolarHBondContact O-CA 3.38Å; Y309-E314 PolarHBondContact O-N 2.91Å; Y309-K317 HydrophobicContact CD1-CB 3.85Å; Y309-K317 HydrophobicContact CD1-CD 3.96Å; Y309-K317 HydrophobicContact CD2-CB 3.73Å; Y309-K317 HydrophobicContact CE1-CB 4.03Å; Y309-K317 HydrophobicContact CE1-CD 3.52Å; Y309-K317 HydrophobicContact CE1-CG 4.45Å; Y309-K317 HydrophobicContact CE2-CB 3.9Å; Y309-K317 HydrophobicContact CG-CB 3.72Å; Y309-L321 HydrophobicContact CD2-CD1 3.84Å; Y309-L321 HydrophobicContact CE2-CD1 4.08Å
310	I	68	Low	69.8	Low	30 Å²	30	56.7 Å²	56.7	15%	0.154	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-43.9	177.5	-70.5	161.6	0	0	0	110.7	A306 E307 A308 N312 N313 F315 L331 I335	A306-I310 WeakPolarHBondContact O-CB 3.34Å; A306-I310 WeakPolarHBondContact O-CD1 3.46Å; A306-I310 VanDerWaalsContact O-CG1 3.23Å; A306-I310 WeakPolarHBondContact O-CG1 3.44Å; A306-I310 PolarHBondContact O-N 2.95Å; E307-I310 PolarHBondContact O-N 3Å; A308-I310 PolarHBondContact O-N 2.79Å; I310-N312 PolarHBondContact O-N 3.45Å; I310-N313 PolarHBondContact O-N 3.47Å; I310-F315 HydrophobicContact CG2-CD1 4.44Å; I310-F315 HydrophobicContact CG2-CE1 4.22Å; I310-L331 HydrophobicContact CD1-CD1 3.88Å; I310-L331 HydrophobicContact CD1-CD2 3.74Å; I310-L331 HydrophobicContact CD1-CG 3.76Å; I310-I335 HydrophobicContact CD1-CD1 3.79Å; I310-I335 HydrophobicContact CD1-CG1 4.11Å; I310-I335 HydrophobicContact CG2-CG1 4.42Å
311	Q	67.6	Low	69.5	Low	100 Å²	100	54.6 Å²	54.6	47%	0.467	26%	0.262	S	S	.	.	H	α-helix	trans	-65.2	-28.1	175.8	-71.2	179.1	31	0	0	112.1	L281 E307 A308 Y309 N313	L281-Q311 VanDerWaalsContact CD1-C 3.42Å; L281-Q311 HydrophobicContact CD1-CB 3.68Å; L281-Q311 HydrophobicContact CD2-CB 3.63Å; L281-Q311 HydrophobicContact CD2-CG 4.49Å; L281-Q311 HydrophobicContact CG-CB 4.32Å; E307-Q311 WeakPolarHBondContact O-CB 3.47Å; E307-Q311 VanDerWaalsContact O-CG 3.27Å; E307-Q311 WeakPolarHBondContact O-CG 2.87Å; E307-Q311 PolarHBondContact O-N 2.88Å; A308-Q311 PolarHBondContact O-N 3.07Å; Y309-Q311 VanDerWaalsContact C-N 3.34Å; Y309-Q311 PolarHBondContact O-N 3.43Å; Q311-N313 VanDerWaalsContact C-N 3.25Å; Q311-N313 PolarHBondContact O-N 3.45Å
312	N	75.5	Confident	68.6	Low	53 Å²	53	59.7 Å²	59.7	28%	0.283	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	8.1	177	-149.8	30.4	0	0	0	113.4	L281 A308 Y309 I310 E314	L281-N312 HydrophobicContact CB-CB 4.38Å; L281-N312 HydrophobicContact CD1-CB 3.88Å; A308-N312 WeakPolarHBondContact O-CB 3.31Å; A308-N312 PolarHBondContact O-N 3.17Å; Y309-N312 CarbonylContact O-C 3.16Å; Y309-N312 PolarHBondContact O-N 3.28Å; Y309-N312 VanDerWaalsContact O-N 3.1Å; I310-N312 PolarHBondContact O-N 3.45Å; N312-E314 HydrophobicContact CB-CG 4.38Å; N312-E314 PolarHBondContact ND2-OE1 2.91Å; N312-E314 PolarHBondContact O-N 2.91Å
313	N	74	Confident	67.8	Low	121 Å²	121	59.5 Å²	59.5	65%	0.647	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	18.8	-173.2	-55.4	-65.7	0	0	0	114.9	Y309 I310 Q311 F315	Y309-N313 PolarHBondContact O-N 3.4Å; I310-N313 PolarHBondContact O-N 3.47Å; Q311-N313 VanDerWaalsContact C-N 3.25Å; Q311-N313 PolarHBondContact O-N 3.45Å; N313-F315 VanDerWaalsContact C-N 3.32Å; N313-F315 HydrophobicContact CB-CE2 3.93Å; N313-F315 HydrophobicContact CB-CZ 4.32Å; N313-F315 WeakPolarHBondContact O-CD2 3.3Å; N313-F315 PolarHBondContact O-N 2.98Å
314	E	76	Confident	67	Low	52 Å²	52	62.4 Å²	62.4	24%	0.243	31%	0.312	C	S	.	.			trans	-93	57.5	175.9	-64.6	-174	-104.5	0	0	111.1	Y309 N312 E316 K317 G318	Y309-E314 HydrophobicContact CD1-CB 3.91Å; Y309-E314 HydrophobicContact CG-CB 4.43Å; Y309-E314 WeakPolarHBondContact O-CA 3.38Å; Y309-E314 PolarHBondContact O-N 2.91Å; N312-E314 HydrophobicContact CB-CG 4.38Å; N312-E314 PolarHBondContact ND2-OE1 2.91Å; N312-E314 PolarHBondContact O-N 2.91Å; E314-E316 VanDerWaalsContact C-N 3.32Å; E314-E316 PolarHBondContact O-N 2.7Å; E314-K317 HydrophobicContact CB-CB 4.43Å; E314-K317 HydrophobicContact CB-CD 4.48Å; E314-K317 PolarHBondContact O-N 3.36Å; E314-K317 WeakPolarHBondContact OE2-CD 3.37Å; E314-K317 WeakPolarHBondContact OE2-CE 3.44Å; E314-K317 IonicContact OE2-NZ 3.4Å; E314-K317 PolarHBondContact OE2-NZ 2.91Å; E314-G318 PolarHBondContact O-N 3.5Å; E314-G318 VanDerWaalsContact O-N 3.13Å
315	F	68.2	Low	65.7	Low	98 Å²	98	70.3 Å²	70.3	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-56.1	-41.2	-170.5	-58.4	-75.7	0	0	0	113.6	I310 N313 K317 G318 T319	I310-F315 HydrophobicContact CG2-CD1 4.44Å; I310-F315 HydrophobicContact CG2-CE1 4.22Å; N313-F315 VanDerWaalsContact C-N 3.32Å; N313-F315 HydrophobicContact CB-CE2 3.93Å; N313-F315 HydrophobicContact CB-CZ 4.32Å; N313-F315 WeakPolarHBondContact O-CD2 3.3Å; N313-F315 PolarHBondContact O-N 2.98Å; F315-K317 VanDerWaalsContact C-N 3.29Å; F315-K317 PolarHBondContact O-N 3.29Å; F315-G318 PolarHBondContact O-N 3.48Å; F315-G318 VanDerWaalsContact O-N 3.16Å; F315-T319 WeakPolarHBondContact O-CG2 3.36Å; F315-T319 PolarHBondContact O-N 2.87Å; F315-T319 PolarHBondContact O-OG1 3.2Å; F315-T319 VanDerWaalsContact O-OG1 3.06Å
316	E	67	Low	64.3	Low	138 Å²	138	71.8 Å²	71.8	65%	0.645	36%	0.359	S	S	*	.	H	α-helix	trans	-60.3	-37.4	178.6	-70.4	-170.9	-164.5	0	0	113.1	E314 T319 K320	E314-E316 VanDerWaalsContact C-N 3.32Å; E314-E316 PolarHBondContact O-N 2.7Å; E316-T319 PolarHBondContact O-OG1 2.94Å; E316-K320 WeakPolarHBondContact O-CB 3.27Å; E316-K320 VanDerWaalsContact O-CG 3.27Å; E316-K320 WeakPolarHBondContact O-CG 3.22Å; E316-K320 PolarHBondContact O-N 2.96Å; E316-K320 IonicContact OE2-NZ 3.82Å
317	K	74.2	Confident	63.4	Low	106 Å²	106	71.8 Å²	71.8	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-73.8	-36.6	177.7	-64.8	-172.1	-171.7	167.6	0	110.9	Y309 E314 F315 L321	Y309-K317 HydrophobicContact CD1-CB 3.85Å; Y309-K317 HydrophobicContact CD1-CD 3.96Å; Y309-K317 HydrophobicContact CD2-CB 3.73Å; Y309-K317 HydrophobicContact CE1-CB 4.03Å; Y309-K317 HydrophobicContact CE1-CD 3.52Å; Y309-K317 HydrophobicContact CE1-CG 4.45Å; Y309-K317 HydrophobicContact CE2-CB 3.9Å; Y309-K317 HydrophobicContact CG-CB 3.72Å; E314-K317 HydrophobicContact CB-CB 4.43Å; E314-K317 HydrophobicContact CB-CD 4.48Å; E314-K317 PolarHBondContact O-N 3.36Å; E314-K317 WeakPolarHBondContact OE2-CD 3.37Å; E314-K317 WeakPolarHBondContact OE2-CE 3.44Å; E314-K317 IonicContact OE2-NZ 3.4Å; E314-K317 PolarHBondContact OE2-NZ 2.91Å; F315-K317 VanDerWaalsContact C-N 3.29Å; F315-K317 PolarHBondContact O-N 3.29Å; K317-L321 WeakPolarHBondContact O-CD1 3.28Å
318	G	63.5	Low	62.3	Low	0 Å²	0	73.6 Å²	73.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-37.2	175	0	0	0	0	0	113.5	E314 F315	E314-G318 PolarHBondContact O-N 3.5Å; E314-G318 VanDerWaalsContact O-N 3.13Å; F315-G318 PolarHBondContact O-N 3.48Å; F315-G318 VanDerWaalsContact O-N 3.16Å
319	T	58.2	Low	60.9	Low	88 Å²	88	79.1 Å²	79.1	54%	0.54	40%	0.398	S	S	.	.	H	α-helix	trans	-89.2	-28.5	-178.3	56.3	0	0	0	0	114.1	F315 E316 L321	F315-T319 WeakPolarHBondContact O-CG2 3.36Å; F315-T319 PolarHBondContact O-N 2.87Å; F315-T319 PolarHBondContact O-OG1 3.2Å; F315-T319 VanDerWaalsContact O-OG1 3.06Å; E316-T319 PolarHBondContact O-OG1 2.94Å; T319-L321 VanDerWaalsContact C-N 3.27Å; T319-L321 PolarHBondContact O-N 2.87Å
320	K	63.9	Low	59.7	Low	161 Å²	161	83.5 Å²	83.5	70%	0.7	42%	0.418	S	S	*	.	H	α-helix	trans	-71.9	-16.1	175.7	-83.3	174.7	176.6	162.6	0	114.4	E316 S322	E316-K320 WeakPolarHBondContact O-CB 3.27Å; E316-K320 VanDerWaalsContact O-CG 3.27Å; E316-K320 WeakPolarHBondContact O-CG 3.22Å; E316-K320 PolarHBondContact O-N 2.96Å; E316-K320 IonicContact OE2-NZ 3.82Å; K320-S322 PolarHBondContact O-N 3.19Å; K320-S322 VanDerWaalsContact O-N 3.13Å
321	L	58.1	Low	58.6	Low	15 Å²	15	82.5 Å²	82.5	8%	0.079	41%	0.412	C	S	.	.	S	Bend	trans	-60.1	117.7	172.4	-88.5	146.7	0	0	0	108.3	L302 R305 A306 Y309 K317 T319 L323	L302-L321 HydrophobicContact CB-CD2 4.33Å; L302-L321 HydrophobicContact CD2-CD2 3.35Å; L302-L321 HydrophobicContact CG-CD2 4.45Å; R305-L321 HydrophobicContact CB-CD1 4.49Å; R305-L321 VanDerWaalsContact NH2-CD2 3.28Å; A306-L321 HydrophobicContact CB-CD1 3.76Å; Y309-L321 HydrophobicContact CD2-CD1 3.84Å; Y309-L321 HydrophobicContact CE2-CD1 4.08Å; K317-L321 WeakPolarHBondContact O-CD1 3.28Å; T319-L321 VanDerWaalsContact C-N 3.27Å; T319-L321 PolarHBondContact O-N 2.87Å; L321-L323 PolarHBondContact O-N 3.4Å
322	S	51.2	Low	57.5	Low	108 Å²	108	82 Å²	82	76%	0.755	41%	0.413	S	S	*	.			trans	-56.4	67.4	179.3	164.6	0	0	0	0	112.3	K320	K320-S322 PolarHBondContact O-N 3.19Å; K320-S322 VanDerWaalsContact O-N 3.13Å
323	L	53.1	Low	55.9	Low	14 Å²	14	80.7 Å²	80.7	7%	0.073	41%	0.412	C	S	.	.			trans	-79.7	132.9	172	-69.6	167.8	0	0	0	107.1	F299 L302 L303 L321 I328 L331	F299-L323 HydrophobicContact CE2-CD2 4.17Å; L302-L323 HydrophobicContact CB-CD2 4.33Å; L303-L323 HydrophobicContact CD2-CD2 3.85Å; L303-L323 HydrophobicContact CG-CD2 4.22Å; L321-L323 PolarHBondContact O-N 3.4Å; L323-I328 HydrophobicContact CB-CG1 3.79Å; L323-L331 HydrophobicContact CD1-CB 4.28Å; L323-L331 HydrophobicContact CD1-CD1 4.31Å; L323-L331 HydrophobicContact CD1-CD2 3.84Å; L323-L331 HydrophobicContact CD1-CG 4.39Å
324	D	49.2	Very low	54.5	Low	90 Å²	90	81 Å²	81	48%	0.481	41%	0.407	S	S	.	.			trans	-58.2	163.5	166.3	63.1	1.2	0	0	0	110.2	V326 G327 I328	D324-V326 PolarHBondContact O-N 3.38Å; D324-G327 WeakPolarHBondContact O-CA 3.26Å; D324-G327 PolarHBondContact O-N 3.34Å; D324-G327 PolarHBondContact OD1-N 3Å; D324-I328 PolarHBondContact O-N 2.86Å
325	K	43.1	Very low	52.9	Low	180 Å²	180	82.2 Å²	82.2	78%	0.783	41%	0.414	S	S	*	.	H	α-helix	trans	-46.2	-35.4	-179.8	-97.5	-177.2	173.2	-177.9	0	112.6	I329	K325-I329 WeakPolarHBondContact O-CB 3.48Å; K325-I329 WeakPolarHBondContact O-CD1 3.5Å; K325-I329 WeakPolarHBondContact O-CG1 3.5Å; K325-I329 PolarHBondContact O-N 3.25Å
326	V	49	Very low	51.5	Low	82 Å²	82	80.3 Å²	80.3	50%	0.497	41%	0.411	S	S	.	.	H	α-helix	trans	-71.7	-41.6	179.7	-178	0	0	0	0	112	D324 I329 K330	D324-V326 PolarHBondContact O-N 3.38Å; V326-I329 PolarHBondContact O-N 3.38Å; V326-K330 PolarHBondContact O-N 3.23Å
327	G	49.2	Very low	50.3	Low	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-63.3	-42.7	173.7	0	0	0	0	0	112.3	D324 K330 L331	D324-G327 WeakPolarHBondContact O-CA 3.26Å; D324-G327 PolarHBondContact O-N 3.34Å; D324-G327 PolarHBondContact OD1-N 3Å; G327-K330 PolarHBondContact O-N 3.29Å; G327-L331 VanDerWaalsContact O-CB 3.26Å; G327-L331 WeakPolarHBondContact O-CB 3.45Å; G327-L331 PolarHBondContact O-N 3.18Å
328	I	46.4	Very low	49	Very low	77 Å²	77	81.2 Å²	81.2	40%	0.395	42%	0.419	S	S	.	.	H	α-helix	trans	-61.8	-48.2	174.6	-64.9	176.9	0	0	0	110.5	L323 D324 K330 L331 L332	L323-I328 HydrophobicContact CB-CG1 3.79Å; D324-I328 PolarHBondContact O-N 2.86Å; I328-K330 PolarHBondContact O-N 3.16Å; I328-L331 PolarHBondContact O-N 3Å; I328-L332 HydrophobicContact CG2-CD1 3.56Å; I328-L332 HydrophobicContact CG2-CG 4.07Å; I328-L332 VanDerWaalsContact O-CB 3.3Å; I328-L332 WeakPolarHBondContact O-CB 3.49Å; I328-L332 VanDerWaalsContact O-CG 3.24Å; I328-L332 WeakPolarHBondContact O-CG 3.35Å; I328-L332 PolarHBondContact O-N 3.11Å
329	I	47.6	Very low	47.9	Very low	117 Å²	117	88.6 Å²	88.6	60%	0.6	45%	0.452	S	S	*	.	H	α-helix	trans	-60.4	-42.7	178.4	-71.2	164.9	0	0	0	111.7	K325 V326 G333	K325-I329 WeakPolarHBondContact O-CB 3.48Å; K325-I329 WeakPolarHBondContact O-CD1 3.5Å; K325-I329 WeakPolarHBondContact O-CG1 3.5Å; K325-I329 PolarHBondContact O-N 3.25Å; V326-I329 PolarHBondContact O-N 3.38Å; I329-G333 PolarHBondContact O-N 3.15Å
330	K	50.1	Low	47	Very low	123 Å²	123	88.3 Å²	88.3	54%	0.535	45%	0.453	S	S	.	.	H	α-helix	trans	-67.6	-38.8	176.9	-81.9	-178.3	178.4	175	0	112.9	V326 G327 I328 K334	V326-K330 PolarHBondContact O-N 3.23Å; G327-K330 PolarHBondContact O-N 3.29Å; I328-K330 PolarHBondContact O-N 3.16Å; K330-K334 WeakPolarHBondContact O-CG 3.32Å; K330-K334 PolarHBondContact O-N 3Å; K330-K334 VanDerWaalsContact O-N 3.08Å
331	L	45.4	Very low	46.5	Very low	9 Å²	9	86.6 Å²	86.6	5%	0.047	45%	0.448	C	S	.	.	H	α-helix	trans	-68	-47.7	178.5	-160.6	85.9	0	0	0	110.1	A306 E307 I310 L323 G327 I328 G333 K334 I335	A306-L331 HydrophobicContact CB-CD1 3.79Å; A306-L331 HydrophobicContact CB-CD2 4.34Å; E307-L331 HydrophobicContact CG-CD1 4.39Å; I310-L331 HydrophobicContact CD1-CD1 3.88Å; I310-L331 HydrophobicContact CD1-CD2 3.74Å; I310-L331 HydrophobicContact CD1-CG 3.76Å; L323-L331 HydrophobicContact CD1-CB 4.28Å; L323-L331 HydrophobicContact CD1-CD1 4.31Å; L323-L331 HydrophobicContact CD1-CD2 3.84Å; L323-L331 HydrophobicContact CD1-CG 4.39Å; G327-L331 VanDerWaalsContact O-CB 3.26Å; G327-L331 WeakPolarHBondContact O-CB 3.45Å; G327-L331 PolarHBondContact O-N 3.18Å; I328-L331 PolarHBondContact O-N 3Å; L331-G333 PolarHBondContact O-N 3.4Å; L331-K334 PolarHBondContact O-N 3.08Å; L331-K334 VanDerWaalsContact O-N 3.16Å; L331-I335 HydrophobicContact CD2-CD1 4.37Å; L331-I335 HydrophobicContact CG-CD1 4.21Å; L331-I335 WeakPolarHBondContact O-CD1 3.35Å; L331-I335 VanDerWaalsContact O-CG1 3.23Å; L331-I335 WeakPolarHBondContact O-CG1 3.48Å; L331-I335 PolarHBondContact O-N 2.9Å
332	L	44	Very low	46.6	Very low	91 Å²	91	92.1 Å²	92.1	48%	0.476	48%	0.477	S	S	.	.	H	α-helix	trans	-59.4	-45.2	174.9	-71.2	174.7	0	0	0	111.4	I328 K334 I335 T336	I328-L332 HydrophobicContact CG2-CD1 3.56Å; I328-L332 HydrophobicContact CG2-CG 4.07Å; I328-L332 VanDerWaalsContact O-CB 3.3Å; I328-L332 WeakPolarHBondContact O-CB 3.49Å; I328-L332 VanDerWaalsContact O-CG 3.24Å; I328-L332 WeakPolarHBondContact O-CG 3.35Å; I328-L332 PolarHBondContact O-N 3.11Å; L332-K334 VanDerWaalsContact C-N 3.3Å; L332-K334 PolarHBondContact O-N 3.3Å; L332-I335 PolarHBondContact O-N 3.46Å; L332-I335 VanDerWaalsContact O-N 3.09Å; L332-T336 WeakPolarHBondContact O-CG2 3.33Å; L332-T336 PolarHBondContact O-N 2.97Å; L332-T336 PolarHBondContact O-OG1 2.96Å
333	G	43.3	Very low	47.3	Very low	25 Å²	25	87.9 Å²	87.9	26%	0.258	45%	0.449	S	S	.	.	H	α-helix	trans	-60.4	-34.4	175	0	0	0	0	0	113.7	I329 L331 T336 T337	I329-G333 PolarHBondContact O-N 3.15Å; L331-G333 PolarHBondContact O-N 3.4Å; G333-T336 WeakPolarHBondContact CA-OG1 3.28Å; G333-T336 PolarHBondContact O-OG1 3.48Å; G333-T337 WeakPolarHBondContact O-CB 3.31Å; G333-T337 WeakPolarHBondContact O-CG2 3.45Å; G333-T337 PolarHBondContact O-N 2.97Å; G333-T337 PolarHBondContact O-OG1 3.15Å
334	K	44.8	Very low	48.5	Very low	128 Å²	128	91.4 Å²	91.4	56%	0.557	47%	0.468	S	S	*	.	H	α-helix	trans	-75	-31	173.2	-76.4	-173.5	-179.5	-173.1	0	113.4	E307 K330 L331 L332 T337	E307-K334 IonicContact OE1-NZ 3.98Å; E307-K334 PolarHBondContact OE1-NZ 3.44Å; K330-K334 WeakPolarHBondContact O-CG 3.32Å; K330-K334 PolarHBondContact O-N 3Å; K330-K334 VanDerWaalsContact O-N 3.08Å; L331-K334 PolarHBondContact O-N 3.08Å; L331-K334 VanDerWaalsContact O-N 3.16Å; L332-K334 VanDerWaalsContact C-N 3.3Å; L332-K334 PolarHBondContact O-N 3.3Å; K334-T337 WeakPolarHBondContact CA-OG1 2.84Å; K334-T337 PolarHBondContact O-OG1 2.91Å
335	I	42.4	Very low	50	Low	76 Å²	76	93.1 Å²	93.1	39%	0.39	47%	0.471	S	S	.	.	H	α-helix	trans	-71.3	-40.2	176.6	-68.1	162.3	0	0	0	110.2	I310 L331 L332	I310-I335 HydrophobicContact CD1-CD1 3.79Å; I310-I335 HydrophobicContact CD1-CG1 4.11Å; I310-I335 HydrophobicContact CG2-CG1 4.42Å; L331-I335 HydrophobicContact CD2-CD1 4.37Å; L331-I335 HydrophobicContact CG-CD1 4.21Å; L331-I335 WeakPolarHBondContact O-CD1 3.35Å; L331-I335 VanDerWaalsContact O-CG1 3.23Å; L331-I335 WeakPolarHBondContact O-CG1 3.48Å; L331-I335 PolarHBondContact O-N 2.9Å; L332-I335 PolarHBondContact O-N 3.46Å; L332-I335 VanDerWaalsContact O-N 3.09Å
336	T	38.4	Very low	51.7	Low	59 Å²	59	87.6 Å²	87.6	36%	0.362	46%	0.459	S	S	.	.	H	α-helix	trans	-75.8	-31.9	-179.8	51.3	0	0	0	0	112.9	L332 G333 K338 F339	L332-T336 WeakPolarHBondContact O-CG2 3.33Å; L332-T336 PolarHBondContact O-N 2.97Å; L332-T336 PolarHBondContact O-OG1 2.96Å; G333-T336 WeakPolarHBondContact CA-OG1 3.28Å; G333-T336 PolarHBondContact O-OG1 3.48Å; T336-K338 VanDerWaalsContact C-N 3.29Å; T336-K338 PolarHBondContact O-N 3.23Å; T336-F339 PolarHBondContact O-N 2.96Å
337	T	41.4	Very low	52.9	Low	76 Å²	76	87.1 Å²	87.1	47%	0.466	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-4.2	-175.5	42.5	0	0	0	0	116.6	G333 K334 F339 E341	G333-T337 WeakPolarHBondContact O-CB 3.31Å; G333-T337 WeakPolarHBondContact O-CG2 3.45Å; G333-T337 PolarHBondContact O-N 2.97Å; G333-T337 PolarHBondContact O-OG1 3.15Å; K334-T337 WeakPolarHBondContact CA-OG1 2.84Å; K334-T337 PolarHBondContact O-OG1 2.91Å; T337-F339 CarbonylContact C-O 3.48Å; T337-F339 PolarHBondContact O-N 3.44Å; T337-E341 HydrophobicContact CG2-CG 4Å; T337-E341 WeakPolarHBondContact CG2-OE1 3.33Å
338	K	46.1	Very low	54.1	Low	187 Å²	187	88.1 Å²	88.1	81%	0.813	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-8.4	169.4	-106.8	-176.2	179.8	180	0	113.6	T336	T336-K338 VanDerWaalsContact C-N 3.29Å; T336-K338 PolarHBondContact O-N 3.23Å
339	F	40.1	Very low	55.6	Low	155 Å²	155	86.9 Å²	86.9	68%	0.68	46%	0.455	S	S	*	.	S	Bend	trans	-122	136.6	158.2	-74.7	-90.9	0	0	0	106.8	T336 T337 E341	T336-F339 PolarHBondContact O-N 2.96Å; T337-F339 CarbonylContact C-O 3.48Å; T337-F339 PolarHBondContact O-N 3.44Å; F339-E341 PolarHBondContact O-N 2.94Å; F339-E341 VanDerWaalsContact O-N 3.1Å
340	S	40.3	Very low	57	Low	82 Å²	82	88 Å²	88	57%	0.573	46%	0.456	S	S	*	.			trans	-41.5	122.3	176.1	170	0	0	0	0	110.3	N342 A343	S340-N342 PolarHBondContact O-N 2.92Å; S340-N342 PolarHBondContact OG-N 3.49Å; S340-A343 PolarHBondContact O-N 3.36Å; S340-A343 PolarHBondContact OG-N 3.23Å
341	E	54	Low	58.2	Low	124 Å²	124	83.9 Å²	83.9	58%	0.579	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-18.1	172.8	-71.7	177.7	160.9	0	0	111.5	T337 F339 R392	T337-E341 HydrophobicContact CG2-CG 4Å; T337-E341 WeakPolarHBondContact CG2-OE1 3.33Å; F339-E341 PolarHBondContact O-N 2.94Å; F339-E341 VanDerWaalsContact O-N 3.1Å; E341-R392 PolarHBondContact O-NH2 3.35Å
342	N	59.5	Low	59.8	Low	131 Å²	131	86.1 Å²	86.1	70%	0.701	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	34	179	-63	-39.5	0	0	0	113.4	S340 D344	S340-N342 PolarHBondContact O-N 2.92Å; S340-N342 PolarHBondContact OG-N 3.49Å; N342-D344 PolarHBondContact O-N 3.07Å
343	A	65.3	Low	61.5	Low	19 Å²	19	90.1 Å²	90.1	16%	0.157	46%	0.461	C	S	.	.			trans	-55.1	127.1	172.5	0	0	0	0	0	110	S340 I348 R392	S340-A343 PolarHBondContact O-N 3.36Å; S340-A343 PolarHBondContact OG-N 3.23Å; A343-I348 HydrophobicContact CB-CD1 4.47Å; A343-I348 HydrophobicContact CB-CG1 4.11Å; A343-I348 WeakPolarHBondContact O-CD1 3.49Å; A343-R392 PolarHBondContact O-NH1 3.24Å
344	D	78.7	Confident	63.3	Low	89 Å²	89	95.7 Å²	95.7	48%	0.476	48%	0.478	S	S	.	.			trans	-71.3	160	179	72.2	-10.9	0	0	0	110.9	N342 A346 T347 I348	N342-D344 PolarHBondContact O-N 3.07Å; D344-A346 PolarHBondContact O-N 3.16Å; D344-A346 VanDerWaalsContact O-N 3.13Å; D344-T347 PolarHBondContact O-N 3.42Å; D344-T347 VanDerWaalsContact O-N 3.11Å; D344-T347 WeakPolarHBondContact OD1-CB 3.45Å; D344-T347 PolarHBondContact OD1-N 3.06Å; D344-T347 PolarHBondContact OD1-OG1 2.83Å; D344-I348 WeakPolarHBondContact O-CG1 3.32Å; D344-I348 PolarHBondContact O-N 3.04Å; D344-I348 VanDerWaalsContact O-N 3.1Å
345	K	80.8	Confident	65	Low	125 Å²	125	93.2 Å²	93.2	54%	0.543	47%	0.471	S	S	.	.	H	α-helix	trans	-54.9	-34.7	-179	-173.5	170	-179.1	160	0	112.1	I349 T387	K345-I349 HydrophobicContact CG-CD1 3.95Å; K345-I349 WeakPolarHBondContact O-CD1 3.43Å; K345-I349 VanDerWaalsContact O-CG1 3.24Å; K345-I349 WeakPolarHBondContact O-CG1 3.32Å; K345-I349 PolarHBondContact O-N 2.59Å; K345-T387 HydrophobicContact CG-CG2 4.28Å; K345-T387 PolarHBondContact NZ-O 3.29Å
346	A	78.5	Confident	66.8	Low	64 Å²	64	90.1 Å²	90.1	53%	0.529	46%	0.457	S	S	.	.	H	α-helix	trans	-66.7	-44	178.7	0	0	0	0	0	112.6	D344 I349 K350	D344-A346 PolarHBondContact O-N 3.16Å; D344-A346 VanDerWaalsContact O-N 3.13Å; A346-I349 PolarHBondContact O-N 2.99Å; A346-K350 WeakPolarHBondContact O-CB 3.43Å; A346-K350 PolarHBondContact O-N 3.09Å
347	T	75.2	Confident	69	Low	73 Å²	73	94.5 Å²	94.5	45%	0.448	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-41.9	177.1	-60.6	0	0	0	0	111.2	D344 K350 A351	D344-T347 PolarHBondContact O-N 3.42Å; D344-T347 VanDerWaalsContact O-N 3.11Å; D344-T347 WeakPolarHBondContact OD1-CB 3.45Å; D344-T347 PolarHBondContact OD1-N 3.06Å; D344-T347 PolarHBondContact OD1-OG1 2.83Å; T347-K350 PolarHBondContact O-N 2.87Å; T347-A351 WeakPolarHBondContact O-CB 3.36Å; T347-A351 PolarHBondContact O-N 3.05Å
348	I	73.6	Confident	71	Confident	21 Å²	21	96.7 Å²	96.7	11%	0.108	48%	0.476	C	S	.	.	H	α-helix	trans	-60.5	-48.2	176.7	-65.3	160.9	0	0	0	110.6	A343 D344 K350 A351 Y352 L386 T387	A343-I348 HydrophobicContact CB-CD1 4.47Å; A343-I348 HydrophobicContact CB-CG1 4.11Å; A343-I348 WeakPolarHBondContact O-CD1 3.49Å; D344-I348 WeakPolarHBondContact O-CG1 3.32Å; D344-I348 PolarHBondContact O-N 3.04Å; D344-I348 VanDerWaalsContact O-N 3.1Å; I348-K350 VanDerWaalsContact C-N 3.31Å; I348-K350 PolarHBondContact O-N 3.31Å; I348-A351 PolarHBondContact O-N 3.48Å; I348-Y352 WeakPolarHBondContact O-CB 3.24Å; I348-Y352 PolarHBondContact O-N 3.36Å; I348-L386 HydrophobicContact CD1-CB 3.96Å; I348-L386 HydrophobicContact CG2-CB 4.17Å; I348-T387 HydrophobicContact CB-CG2 4.47Å; I348-T387 HydrophobicContact CG2-CG2 3.8Å
349	I	78	Confident	72.9	Confident	50 Å²	50	90.9 Å²	90.9	26%	0.256	45%	0.449	S	S	.	.	H	α-helix	trans	-62.1	-39.6	178.4	-69.3	167.6	0	0	0	111.3	K345 A346 Y352 R353 T387	K345-I349 HydrophobicContact CG-CD1 3.95Å; K345-I349 WeakPolarHBondContact O-CD1 3.43Å; K345-I349 VanDerWaalsContact O-CG1 3.24Å; K345-I349 WeakPolarHBondContact O-CG1 3.32Å; K345-I349 PolarHBondContact O-N 2.59Å; A346-I349 PolarHBondContact O-N 2.99Å; I349-Y352 PolarHBondContact O-N 2.95Å; I349-R353 WeakPolarHBondContact O-CG 3.26Å; I349-R353 PolarHBondContact O-N 3.45Å; I349-T387 HydrophobicContact CG1-CG2 4.32Å
350	K	77.7	Confident	75.3	Confident	142 Å²	142	86.9 Å²	86.9	62%	0.617	43%	0.432	S	S	*	.	H	α-helix	trans	-65.6	-40.9	177.5	-173.5	176.3	-179.3	179.4	0	112	A346 T347 I348 K354	A346-K350 WeakPolarHBondContact O-CB 3.43Å; A346-K350 PolarHBondContact O-N 3.09Å; T347-K350 PolarHBondContact O-N 2.87Å; I348-K350 VanDerWaalsContact C-N 3.31Å; I348-K350 PolarHBondContact O-N 3.31Å; K350-K354 PolarHBondContact O-N 3.49Å
351	A	75.1	Confident	77.6	Confident	35 Å²	35	83.9 Å²	83.9	29%	0.289	41%	0.411	S	S	.	.	H	α-helix	trans	-66	-45.3	175.1	0	0	0	0	0	111.6	T347 I348 R353 K354 L355	T347-A351 WeakPolarHBondContact O-CB 3.36Å; T347-A351 PolarHBondContact O-N 3.05Å; I348-A351 PolarHBondContact O-N 3.48Å; A351-R353 PolarHBondContact O-N 2.9Å; A351-K354 PolarHBondContact O-N 2.92Å; A351-L355 WeakPolarHBondContact O-CG 3.39Å; A351-L355 PolarHBondContact O-N 2.87Å
352	Y	77.8	Confident	79.3	Confident	57 Å²	57	83.8 Å²	83.8	22%	0.224	41%	0.414	C	S	.	.	H	α-helix	trans	-53.6	-50.1	174.8	166.6	-100.3	0	0	0	111.6	I348 I349 K354 L355 A356 I379 K383	I348-Y352 WeakPolarHBondContact O-CB 3.24Å; I348-Y352 PolarHBondContact O-N 3.36Å; I349-Y352 PolarHBondContact O-N 2.95Å; Y352-K354 VanDerWaalsContact C-N 3.34Å; Y352-K354 PolarHBondContact O-N 3.3Å; Y352-L355 PolarHBondContact O-N 2.95Å; Y352-A356 HydrophobicContact CD2-CB 4.41Å; Y352-A356 HydrophobicContact CE1-CB 4.44Å; Y352-A356 HydrophobicContact CE2-CB 4.03Å; Y352-A356 WeakPolarHBondContact O-CB 3.41Å; Y352-A356 PolarHBondContact O-N 2.72Å; Y352-I379 HydrophobicContact CD2-CG2 3.61Å; Y352-I379 HydrophobicContact CE2-CG2 3.99Å; Y352-K383 HydrophobicContact CD1-CD 3.87Å; Y352-K383 HydrophobicContact CD1-CG 4.45Å; Y352-K383 HydrophobicContact CD2-CB 3.73Å; Y352-K383 HydrophobicContact CD2-CD 3.76Å; Y352-K383 HydrophobicContact CD2-CG 4.03Å; Y352-K383 HydrophobicContact CE1-CD 3.82Å; Y352-K383 HydrophobicContact CE2-CB 4.2Å; Y352-K383 HydrophobicContact CE2-CD 3.72Å; Y352-K383 HydrophobicContact CE2-CG 4.45Å; Y352-K383 HydrophobicContact CG-CB 4.17Å; Y352-K383 HydrophobicContact CG-CD 3.83Å; Y352-K383 HydrophobicContact CG-CG 4.03Å
353	R	81.5	Confident	80.7	Confident	174 Å²	174	82.2 Å²	82.2	66%	0.657	41%	0.406	S	S	*	.	H	α-helix	trans	-57.4	-45	-179.8	-73.4	178.1	-173.9	172.4	2.3	112.5	I349 A351 Q357	I349-R353 WeakPolarHBondContact O-CG 3.26Å; I349-R353 PolarHBondContact O-N 3.45Å; A351-R353 PolarHBondContact O-N 2.9Å; R353-Q357 VanDerWaalsContact O-CB 3.3Å; R353-Q357 WeakPolarHBondContact O-CB 3.41Å; R353-Q357 PolarHBondContact O-N 3.5Å
354	K	80.7	Confident	81.9	Confident	143 Å²	143	83.5 Å²	83.5	62%	0.622	41%	0.407	S	S	*	.	H	α-helix	trans	-64.5	-44.2	178.6	-72.6	-174.4	174.5	-170	0	112.1	K350 A351 Y352 K358	K350-K354 PolarHBondContact O-N 3.49Å; A351-K354 PolarHBondContact O-N 2.92Å; Y352-K354 VanDerWaalsContact C-N 3.34Å; Y352-K354 PolarHBondContact O-N 3.3Å; K354-K358 WeakPolarHBondContact O-CB 3.3Å; K354-K358 PolarHBondContact O-N 3.46Å
355	L	79.4	Confident	82.4	Confident	76 Å²	76	85.8 Å²	85.8	40%	0.398	42%	0.419	S	S	.	.	H	α-helix	trans	-73.4	-41.5	-177.8	-72	173.7	0	0	0	112.1	A351 Y352 Q357 K358 W359 I379	A351-L355 WeakPolarHBondContact O-CG 3.39Å; A351-L355 PolarHBondContact O-N 2.87Å; Y352-L355 PolarHBondContact O-N 2.95Å; L355-Q357 VanDerWaalsContact C-N 3.34Å; L355-K358 PolarHBondContact O-N 2.95Å; L355-W359 WeakPolarHBondContact O-CB 3.46Å; L355-W359 PolarHBondContact O-N 2.92Å; L355-I379 HydrophobicContact CB-CD1 3.85Å; L355-I379 HydrophobicContact CB-CG1 4.2Å; L355-I379 HydrophobicContact CB-CG2 4.05Å
356	A	80	Confident	82.5	Confident	11 Å²	11	88.6 Å²	88.6	9%	0.091	43%	0.431	C	S	.	.	H	α-helix	trans	-62.7	-41.4	175.5	0	0	0	0	0	111.2	Y352 H360 F376	Y352-A356 HydrophobicContact CD2-CB 4.41Å; Y352-A356 HydrophobicContact CE1-CB 4.44Å; Y352-A356 HydrophobicContact CE2-CB 4.03Å; Y352-A356 WeakPolarHBondContact O-CB 3.41Å; Y352-A356 PolarHBondContact O-N 2.72Å; A356-H360 WeakPolarHBondContact O-CB 3.38Å; A356-H360 PolarHBondContact O-N 3.3Å; A356-F376 HydrophobicContact CB-CE2 3.94Å; A356-F376 WeakPolarHBondContact O-CE2 3.45Å
357	Q	85.1	Confident	82.5	Confident	151 Å²	151	91.5 Å²	91.5	71%	0.706	44%	0.438	S	S	*	.	H	α-helix	trans	-64	-42	173.4	-175.1	-179.4	9.1	0	0	111.7	R353 L355 N363	R353-Q357 VanDerWaalsContact O-CB 3.3Å; R353-Q357 WeakPolarHBondContact O-CB 3.41Å; R353-Q357 PolarHBondContact O-N 3.5Å; L355-Q357 VanDerWaalsContact C-N 3.34Å; Q357-N363 PolarHBondContact O-ND2 3.01Å
358	K	84	Confident	82.9	Confident	122 Å²	122	93.7 Å²	93.7	53%	0.53	44%	0.443	S	S	.	.	H	α-helix	trans	-64.8	-50.3	179.3	179.3	176.7	177.8	176.9	0	111.7	K354 L355 H360 N363 Y364	K354-K358 WeakPolarHBondContact O-CB 3.3Å; K354-K358 PolarHBondContact O-N 3.46Å; L355-K358 PolarHBondContact O-N 2.95Å; K358-H360 VanDerWaalsContact C-N 3.33Å; K358-H360 PolarHBondContact O-N 3.48Å; K358-N363 PolarHBondContact O-ND2 2.83Å; K358-Y364 WeakPolarHBondContact O-CE2 3.48Å; K358-Y364 PolarHBondContact O-OH 3.41Å; K358-Y364 VanDerWaalsContact O-OH 3.13Å
359	W	85	Confident	83.6	Confident	65 Å²	65	96.4 Å²	96.4	25%	0.246	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	14.6	-173.1	-69.3	107.1	0	0	0	113.9	L355 Y364 A372 R375 I379	L355-W359 WeakPolarHBondContact O-CB 3.46Å; L355-W359 PolarHBondContact O-N 2.92Å; W359-Y364 HydrophobicContact CE3-CE2 4.1Å; W359-Y364 AromaticContact CE3-CZ 3.93Å; W359-A372 HydrophobicContact CE3-CB 4.05Å; W359-R375 HydrophobicContact CB-CB 4.25Å; W359-R375 HydrophobicContact CD2-CB 3.77Å; W359-R375 HydrophobicContact CD2-CG 4.05Å; W359-R375 HydrophobicContact CE3-CB 3.89Å; W359-R375 HydrophobicContact CE3-CG 3.95Å; W359-R375 HydrophobicContact CG-CB 3.97Å; W359-R375 HydrophobicContact CH2-CG 4.17Å; W359-R375 HydrophobicContact CZ2-CG 4.27Å; W359-R375 HydrophobicContact CZ3-CB 4.45Å; W359-R375 HydrophobicContact CZ3-CG 4.01Å; W359-I379 HydrophobicContact CB-CD1 3.81Å; W359-I379 HydrophobicContact CG-CD1 3.88Å
360	H	90.7	Very high	84	Confident	71 Å²	71	101.2 Å²	101.2	33%	0.329	47%	0.473	S	S	.	.			trans	-60	129.6	175.1	-161.4	-93.5	0	0	0	109.5	A356 K358 D362 N363 Y364 F376	A356-H360 WeakPolarHBondContact O-CB 3.38Å; A356-H360 PolarHBondContact O-N 3.3Å; K358-H360 VanDerWaalsContact C-N 3.33Å; K358-H360 PolarHBondContact O-N 3.48Å; H360-D362 VanDerWaalsContact CE1-CG 3.41Å; H360-D362 IonicContact CE1-OD1 2.83Å; H360-D362 IonicContact CE1-OD2 2.61Å; H360-D362 PolarHBondContact CE1-OD2 3.16Å; H360-D362 WeakPolarHBondContact ND1-CB 3.02Å; H360-D362 VanDerWaalsContact ND1-CG 3.35Å; H360-D362 PolarHBondContact ND1-N 3.48Å; H360-D362 IonicContact ND1-OD1 3.3Å; H360-D362 IonicContact ND1-OD2 3.13Å; H360-D362 PolarHBondContact ND1-OD2 2.94Å; H360-D362 PolarHBondContact O-N 3.28Å; H360-N363 WeakPolarHBondContact O-CB 3.45Å; H360-N363 PolarHBondContact O-N 2.83Å; H360-Y364 WeakPolarHBondContact O-CD2 3.26Å; H360-F376 AromaticContact CD2-CE2 3.78Å
361	P	88.5	Confident	84.2	Confident	19 Å²	19	101.6 Å²	101.6	12%	0.123	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-55.8	-23.8	-178.1	-29.1	36.6	0	0	0	114.5	N363 Y364 K369 E373	P361-N363 PolarHBondContact O-N 3.29Å; P361-Y364 PolarHBondContact O-N 3.18Å; P361-K369 HydrophobicContact CB-CG 4.1Å; P361-E373 HydrophobicContact CB-CG 3.8Å; P361-E373 HydrophobicContact CG-CB 4.49Å; P361-E373 HydrophobicContact CG-CG 3.58Å
362	D	90.7	Very high	84.6	Confident	122 Å²	122	99.9 Å²	99.9	65%	0.652	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-70.6	-14.6	177.1	-62.5	-12.3	0	0	0	113.8	H360 Y364	H360-D362 VanDerWaalsContact CE1-CG 3.41Å; H360-D362 IonicContact CE1-OD1 2.83Å; H360-D362 IonicContact CE1-OD2 2.61Å; H360-D362 PolarHBondContact CE1-OD2 3.16Å; H360-D362 WeakPolarHBondContact ND1-CB 3.02Å; H360-D362 VanDerWaalsContact ND1-CG 3.35Å; H360-D362 PolarHBondContact ND1-N 3.48Å; H360-D362 IonicContact ND1-OD1 3.3Å; H360-D362 IonicContact ND1-OD2 3.13Å; H360-D362 PolarHBondContact ND1-OD2 2.94Å; H360-D362 PolarHBondContact O-N 3.28Å; D362-Y364 VanDerWaalsContact C-N 3.33Å
363	N	89.1	Confident	85.1	Confident	97 Å²	97	101 Å²	101	52%	0.519	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-84.6	-6.1	177.4	-61.9	-22.5	0	0	0	113.3	Q357 K358 H360 P361	Q357-N363 PolarHBondContact O-ND2 3.01Å; K358-N363 PolarHBondContact O-ND2 2.83Å; H360-N363 WeakPolarHBondContact O-CB 3.45Å; H360-N363 PolarHBondContact O-N 2.83Å; P361-N363 PolarHBondContact O-N 3.29Å
364	Y	90.9	Very high	85.1	Confident	47 Å²	47	95 Å²	95	18%	0.184	46%	0.456	C	S	.	.			trans	-133.4	142.9	-168.8	-60	-87.1	0	0	0	112	K358 W359 H360 P361 D362 E368 K369 A372	K358-Y364 WeakPolarHBondContact O-CE2 3.48Å; K358-Y364 PolarHBondContact O-OH 3.41Å; K358-Y364 VanDerWaalsContact O-OH 3.13Å; W359-Y364 HydrophobicContact CE3-CE2 4.1Å; W359-Y364 AromaticContact CE3-CZ 3.93Å; H360-Y364 WeakPolarHBondContact O-CD2 3.26Å; P361-Y364 PolarHBondContact O-N 3.18Å; D362-Y364 VanDerWaalsContact C-N 3.33Å; Y364-E368 HydrophobicContact CD1-CB 4.02Å; Y364-E368 HydrophobicContact CG-CB 4.38Å; Y364-K369 WeakPolarHBondContact O-CB 3.32Å; Y364-A372 HydrophobicContact CD2-CB 3.26Å; Y364-A372 HydrophobicContact CE2-CB 3.69Å; Y364-A372 HydrophobicContact CG-CB 3.79Å
365	D	87.4	Confident	85	Confident	137 Å²	137	93.9 Å²	93.9	73%	0.733	45%	0.448	S	S	*	.			trans	-102.9	149.5	-180	-74.1	-42.6	0	0	0	112.6	D367 E368 K369	D365-D367 PolarHBondContact O-N 2.71Å; D365-E368 PolarHBondContact O-N 2.88Å; D365-E368 VanDerWaalsContact O-N 3.08Å; D365-K369 PolarHBondContact O-N 2.83Å
366	K	83.5	Confident	85.1	Confident	184 Å²	184	93 Å²	93	80%	0.8	44%	0.441	S	S	*	.	H	α-helix	trans	50.1	-113.5	169.5	-60	176.9	-177.8	174.6	0	114.1	E368 K369	K366-E368 VanDerWaalsContact C-N 3.33Å; K366-K369 WeakPolarHBondContact O-CB 3.45Å; K366-K369 PolarHBondContact O-N 3.49Å
367	D	78.1	Confident	85.1	Confident	125 Å²	125	97.8 Å²	97.8	67%	0.668	46%	0.464	S	S	*	.	H	α-helix	trans	-73.7	-26.4	-174.9	-63.3	-42.3	0	0	0	112.4	D365 K369	D365-D367 PolarHBondContact O-N 2.71Å; D367-K369 VanDerWaalsContact C-N 3.32Å
368	E	84	Confident	84.8	Confident	118 Å²	118	94.9 Å²	94.9	55%	0.551	45%	0.453	S	S	*	.	H	α-helix	trans	-72	-30.6	174.2	-63.3	-165.6	158.2	0	0	111.4	Y364 D365 K366 K370 K371 A372	Y364-E368 HydrophobicContact CD1-CB 4.02Å; Y364-E368 HydrophobicContact CG-CB 4.38Å; D365-E368 PolarHBondContact O-N 2.88Å; D365-E368 VanDerWaalsContact O-N 3.08Å; K366-E368 VanDerWaalsContact C-N 3.33Å; E368-K370 PolarHBondContact O-N 3.43Å; E368-K371 PolarHBondContact O-N 2.67Å; E368-A372 WeakPolarHBondContact O-CB 3.27Å; E368-A372 PolarHBondContact O-N 3.49Å
369	K	88.9	Confident	84.4	Confident	78 Å²	78	90.1 Å²	90.1	34%	0.339	43%	0.434	S	S	.	.	H	α-helix	trans	-58.7	-45.2	175.7	-169.5	170.9	-178.3	168	0	112.1	P361 Y364 D365 K366 D367 K371 A372 E373	P361-K369 HydrophobicContact CB-CG 4.1Å; Y364-K369 WeakPolarHBondContact O-CB 3.32Å; D365-K369 PolarHBondContact O-N 2.83Å; K366-K369 WeakPolarHBondContact O-CB 3.45Å; K366-K369 PolarHBondContact O-N 3.49Å; D367-K369 VanDerWaalsContact C-N 3.32Å; K369-K371 VanDerWaalsContact C-N 3.33Å; K369-K371 PolarHBondContact O-N 3.06Å; K369-A372 PolarHBondContact O-N 3.14Å; K369-E373 WeakPolarHBondContact CE-OE1 3.08Å; K369-E373 HydrophobicContact CG-CG 4.47Å; K369-E373 WeakPolarHBondContact O-CB 3.19Å; K369-E373 VanDerWaalsContact O-CG 3.32Å; K369-E373 WeakPolarHBondContact O-CG 3.35Å; K369-E373 PolarHBondContact O-N 3.45Å
370	K	85.4	Confident	84.1	Confident	151 Å²	151	88.9 Å²	88.9	66%	0.657	44%	0.437	S	S	*	.	H	α-helix	trans	-61.5	-40.3	176.2	-73.8	-176.5	177.3	176.6	0	112.6	E368 A374	E368-K370 PolarHBondContact O-N 3.43Å; K370-A374 PolarHBondContact O-N 3.41Å; K370-A374 VanDerWaalsContact O-N 3.13Å
371	K	82.8	Confident	83.7	Confident	150 Å²	150	86.9 Å²	86.9	65%	0.652	43%	0.433	S	S	*	.	H	α-helix	trans	-65.9	-40.9	175.5	-68.7	179	-179	174.3	0	111	E368 K369 A374 R375	E368-K371 PolarHBondContact O-N 2.67Å; K369-K371 VanDerWaalsContact C-N 3.33Å; K369-K371 PolarHBondContact O-N 3.06Å; K371-A374 PolarHBondContact O-N 3.3Å; K371-R375 WeakPolarHBondContact O-CG 3.33Å; K371-R375 PolarHBondContact O-N 3.24Å; K371-R375 VanDerWaalsContact O-N 3.09Å
372	A	83.9	Confident	83.3	Confident	0 Å²	0	88.1 Å²	88.1	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-66.5	-41.5	177.3	0	0	0	0	0	112.1	W359 Y364 E368 K369 A374 R375 F376	W359-A372 HydrophobicContact CE3-CB 4.05Å; Y364-A372 HydrophobicContact CD2-CB 3.26Å; Y364-A372 HydrophobicContact CE2-CB 3.69Å; Y364-A372 HydrophobicContact CG-CB 3.79Å; E368-A372 WeakPolarHBondContact O-CB 3.27Å; E368-A372 PolarHBondContact O-N 3.49Å; K369-A372 PolarHBondContact O-N 3.14Å; A372-A374 PolarHBondContact O-N 3.45Å; A372-R375 PolarHBondContact O-N 3.12Å; A372-F376 VanDerWaalsContact O-CB 3.3Å; A372-F376 WeakPolarHBondContact O-CB 3.33Å; A372-F376 PolarHBondContact O-N 3.4Å
373	E	87.1	Confident	82.9	Confident	79 Å²	79	86 Å²	86	37%	0.369	43%	0.429	S	S	.	.	H	α-helix	trans	-57	-48.8	173.6	-76	169.8	-177.6	0	0	111.6	P361 K369 R375 F376 I377	P361-E373 HydrophobicContact CB-CG 3.8Å; P361-E373 HydrophobicContact CG-CB 4.49Å; P361-E373 HydrophobicContact CG-CG 3.58Å; K369-E373 WeakPolarHBondContact CE-OE1 3.08Å; K369-E373 HydrophobicContact CG-CG 4.47Å; K369-E373 WeakPolarHBondContact O-CB 3.19Å; K369-E373 VanDerWaalsContact O-CG 3.32Å; K369-E373 WeakPolarHBondContact O-CG 3.35Å; K369-E373 PolarHBondContact O-N 3.45Å; E373-R375 PolarHBondContact O-N 2.86Å; E373-F376 PolarHBondContact O-N 3.27Å; E373-I377 VanDerWaalsContact O-CG1 3.32Å; E373-I377 WeakPolarHBondContact O-CG1 3.47Å; E373-I377 PolarHBondContact O-N 3.33Å
374	A	81.6	Confident	82.7	Confident	50 Å²	50	85.7 Å²	85.7	41%	0.413	43%	0.425	S	S	.	.	H	α-helix	trans	-58.5	-46.3	176	0	0	0	0	0	111.9	K370 K371 A372 F376 I377 D378	K370-A374 PolarHBondContact O-N 3.41Å; K370-A374 VanDerWaalsContact O-N 3.13Å; K371-A374 PolarHBondContact O-N 3.3Å; A372-A374 PolarHBondContact O-N 3.45Å; A374-F376 VanDerWaalsContact C-N 3.34Å; A374-F376 PolarHBondContact O-N 3.32Å; A374-I377 PolarHBondContact O-N 3.47Å; A374-D378 PolarHBondContact O-N 3.41Å; A374-D378 VanDerWaalsContact O-N 3.12Å
375	R	79.4	Confident	82.4	Confident	119 Å²	119	84 Å²	84	45%	0.449	42%	0.419	S	S	.	.	H	α-helix	trans	-63.3	-39.4	176.4	-68.4	-59.1	-172.2	-174.2	1	112.5	W359 K371 A372 E373 I377 D378 I379	W359-R375 HydrophobicContact CB-CB 4.25Å; W359-R375 HydrophobicContact CD2-CB 3.77Å; W359-R375 HydrophobicContact CD2-CG 4.05Å; W359-R375 HydrophobicContact CE3-CB 3.89Å; W359-R375 HydrophobicContact CE3-CG 3.95Å; W359-R375 HydrophobicContact CG-CB 3.97Å; W359-R375 HydrophobicContact CH2-CG 4.17Å; W359-R375 HydrophobicContact CZ2-CG 4.27Å; W359-R375 HydrophobicContact CZ3-CB 4.45Å; W359-R375 HydrophobicContact CZ3-CG 4.01Å; K371-R375 WeakPolarHBondContact O-CG 3.33Å; K371-R375 PolarHBondContact O-N 3.24Å; K371-R375 VanDerWaalsContact O-N 3.09Å; A372-R375 PolarHBondContact O-N 3.12Å; E373-R375 PolarHBondContact O-N 2.86Å; R375-I377 VanDerWaalsContact C-N 3.31Å; R375-I377 PolarHBondContact O-N 2.93Å; R375-D378 PolarHBondContact O-N 3.22Å; R375-I379 WeakPolarHBondContact O-CB 3.26Å; R375-I379 WeakPolarHBondContact O-CD1 3.46Å; R375-I379 WeakPolarHBondContact O-CG1 3.46Å; R375-I379 PolarHBondContact O-N 3.5Å
376	F	80.7	Confident	82.1	Confident	56 Å²	56	80.1 Å²	80.1	25%	0.246	40%	0.399	C	S	.	.	H	α-helix	trans	-64.3	-38.7	179.8	-167	-92.1	0	0	0	111.4	A356 H360 A372 E373 A374 I379 A380	A356-F376 HydrophobicContact CB-CE2 3.94Å; A356-F376 WeakPolarHBondContact O-CE2 3.45Å; H360-F376 AromaticContact CD2-CE2 3.78Å; A372-F376 VanDerWaalsContact O-CB 3.3Å; A372-F376 WeakPolarHBondContact O-CB 3.33Å; A372-F376 PolarHBondContact O-N 3.4Å; E373-F376 PolarHBondContact O-N 3.27Å; A374-F376 VanDerWaalsContact C-N 3.34Å; A374-F376 PolarHBondContact O-N 3.32Å; F376-I379 PolarHBondContact O-N 3.3Å; F376-A380 WeakPolarHBondContact O-CB 3.31Å; F376-A380 PolarHBondContact O-N 3.48Å
377	I	80.2	Confident	81.9	Confident	113 Å²	113	72.9 Å²	72.9	58%	0.579	37%	0.369	S	S	*	.	H	α-helix	trans	-62.4	-49.3	173.3	-66.2	164.4	0	0	0	110.5	E373 A374 R375 I379 A380 A381	E373-I377 VanDerWaalsContact O-CG1 3.32Å; E373-I377 WeakPolarHBondContact O-CG1 3.47Å; E373-I377 PolarHBondContact O-N 3.33Å; A374-I377 PolarHBondContact O-N 3.47Å; R375-I377 VanDerWaalsContact C-N 3.31Å; R375-I377 PolarHBondContact O-N 2.93Å; I377-I379 VanDerWaalsContact C-N 3.3Å; I377-I379 PolarHBondContact O-N 3.46Å; I377-A380 PolarHBondContact O-N 3.48Å; I377-A380 VanDerWaalsContact O-N 3.13Å; I377-A381 WeakPolarHBondContact O-CB 3.25Å; I377-A381 PolarHBondContact O-N 3.13Å
378	D	79.4	Confident	82.3	Confident	89 Å²	89	69.5 Å²	69.5	48%	0.476	35%	0.351	S	S	.	.	H	α-helix	trans	-57.8	-42.7	178.1	-65	-21.4	0	0	0	111.9	A374 R375 A380 A381 A382	A374-D378 PolarHBondContact O-N 3.41Å; A374-D378 VanDerWaalsContact O-N 3.12Å; R375-D378 PolarHBondContact O-N 3.22Å; D378-A380 VanDerWaalsContact C-N 3.34Å; D378-A380 PolarHBondContact O-N 3.2Å; D378-A381 PolarHBondContact O-N 3.49Å; D378-A382 WeakPolarHBondContact O-CB 3.28Å; D378-A382 PolarHBondContact O-N 3.1Å
379	I	74.6	Confident	82.4	Confident	23 Å²	23	68.6 Å²	68.6	12%	0.118	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-38.6	179.4	-67.7	157.6	0	0	0	111	Y352 L355 W359 R375 F376 I377 K383	Y352-I379 HydrophobicContact CD2-CG2 3.61Å; Y352-I379 HydrophobicContact CE2-CG2 3.99Å; L355-I379 HydrophobicContact CB-CD1 3.85Å; L355-I379 HydrophobicContact CB-CG1 4.2Å; L355-I379 HydrophobicContact CB-CG2 4.05Å; W359-I379 HydrophobicContact CB-CD1 3.81Å; W359-I379 HydrophobicContact CG-CD1 3.88Å; R375-I379 WeakPolarHBondContact O-CB 3.26Å; R375-I379 WeakPolarHBondContact O-CD1 3.46Å; R375-I379 WeakPolarHBondContact O-CG1 3.46Å; R375-I379 PolarHBondContact O-N 3.5Å; F376-I379 PolarHBondContact O-N 3.3Å; I377-I379 VanDerWaalsContact C-N 3.3Å; I377-I379 PolarHBondContact O-N 3.46Å; I379-K383 PolarHBondContact O-N 3.08Å
380	A	80.1	Confident	82.3	Confident	39 Å²	39	70.6 Å²	70.6	32%	0.322	37%	0.37	S	S	.	.	H	α-helix	trans	-68.5	-44.9	176.7	0	0	0	0	0	111.7	F376 I377 D378 K383 E384	F376-A380 WeakPolarHBondContact O-CB 3.31Å; F376-A380 PolarHBondContact O-N 3.48Å; I377-A380 PolarHBondContact O-N 3.48Å; I377-A380 VanDerWaalsContact O-N 3.13Å; D378-A380 VanDerWaalsContact C-N 3.34Å; D378-A380 PolarHBondContact O-N 3.2Å; A380-K383 PolarHBondContact O-N 3.48Å; A380-E384 PolarHBondContact O-N 3.39Å; A380-E384 VanDerWaalsContact O-N 3.08Å
381	A	81.5	Confident	82.3	Confident	29 Å²	29	65.4 Å²	65.4	24%	0.24	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-46.8	175.5	0	0	0	0	0	111.8	I377 D378 K383 E384 V385 L402	I377-A381 WeakPolarHBondContact O-CB 3.25Å; I377-A381 PolarHBondContact O-N 3.13Å; D378-A381 PolarHBondContact O-N 3.49Å; A381-K383 VanDerWaalsContact C-N 3.32Å; A381-K383 PolarHBondContact O-N 3Å; A381-E384 WeakPolarHBondContact O-CB 3.24Å; A381-E384 PolarHBondContact O-N 2.97Å; A381-E384 VanDerWaalsContact O-N 3.13Å; A381-V385 WeakPolarHBondContact O-CG2 3.2Å; A381-V385 PolarHBondContact O-N 3.44Å; A381-L402 HydrophobicContact CB-CD1 3.66Å
382	A	80.4	Confident	82.3	Confident	44 Å²	44	60.7 Å²	60.7	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-39.3	177.8	0	0	0	0	0	112.6	D378 L386	D378-A382 WeakPolarHBondContact O-CB 3.28Å; D378-A382 PolarHBondContact O-N 3.1Å; A382-L386 HydrophobicContact CB-CD1 4.49Å; A382-L386 VanDerWaalsContact O-CB 3.25Å; A382-L386 WeakPolarHBondContact O-CB 3.36Å; A382-L386 WeakPolarHBondContact O-CG 3.3Å; A382-L386 PolarHBondContact O-N 2.74Å
383	K	82.1	Confident	82.2	Confident	78 Å²	78	63.4 Å²	63.4	34%	0.339	35%	0.348	S	S	.	.	H	α-helix	trans	-62.3	-44.5	174.7	178.9	-152.6	174.9	-171.7	0	111	Y352 I379 A380 A381 T387	Y352-K383 HydrophobicContact CD1-CD 3.87Å; Y352-K383 HydrophobicContact CD1-CG 4.45Å; Y352-K383 HydrophobicContact CD2-CB 3.73Å; Y352-K383 HydrophobicContact CD2-CD 3.76Å; Y352-K383 HydrophobicContact CD2-CG 4.03Å; Y352-K383 HydrophobicContact CE1-CD 3.82Å; Y352-K383 HydrophobicContact CE2-CB 4.2Å; Y352-K383 HydrophobicContact CE2-CD 3.72Å; Y352-K383 HydrophobicContact CE2-CG 4.45Å; Y352-K383 HydrophobicContact CG-CB 4.17Å; Y352-K383 HydrophobicContact CG-CD 3.83Å; Y352-K383 HydrophobicContact CG-CG 4.03Å; I379-K383 PolarHBondContact O-N 3.08Å; A380-K383 PolarHBondContact O-N 3.48Å; A381-K383 VanDerWaalsContact C-N 3.32Å; A381-K383 PolarHBondContact O-N 3Å; K383-T387 HydrophobicContact CG-CG2 4.3Å; K383-T387 WeakPolarHBondContact O-CB 3.25Å; K383-T387 VanDerWaalsContact O-CG2 3.32Å; K383-T387 WeakPolarHBondContact O-CG2 3.39Å; K383-T387 PolarHBondContact O-N 3.05Å; K383-T387 PolarHBondContact O-OG1 3.17Å
384	E	84.5	Confident	81.8	Confident	90 Å²	90	63.1 Å²	63.1	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-47	179.3	-173.7	179	162.1	0	0	111.6	A380 A381 D388 K391 L402	A380-E384 PolarHBondContact O-N 3.39Å; A380-E384 VanDerWaalsContact O-N 3.08Å; A381-E384 WeakPolarHBondContact O-CB 3.24Å; A381-E384 PolarHBondContact O-N 2.97Å; A381-E384 VanDerWaalsContact O-N 3.13Å; E384-D388 WeakPolarHBondContact O-CB 3.45Å; E384-K391 HydrophobicContact CG-CD 4.34Å; E384-K391 IonicContact OE1-NZ 2.58Å; E384-K391 PolarHBondContact OE1-NZ 3.33Å; E384-L402 HydrophobicContact CG-CD2 4.41Å
385	V	84.2	Confident	81.6	Confident	11 Å²	11	66.2 Å²	66.2	7%	0.067	35%	0.349	C	S	.	.	H	α-helix	trans	-68.7	-46.5	-179.5	173.8	0	0	0	0	112.5	A381 T387 K391 R392 Y395 P401 L402	A381-V385 WeakPolarHBondContact O-CG2 3.2Å; A381-V385 PolarHBondContact O-N 3.44Å; V385-T387 PolarHBondContact O-N 3.46Å; V385-K391 HydrophobicContact CG1-CB 4.37Å; V385-R392 PolarHBondContact O-N 3.19Å; V385-Y395 HydrophobicContact CG1-CD2 4.31Å; V385-Y395 HydrophobicContact CG1-CG 4.05Å; V385-P401 HydrophobicContact CB-CG 4.24Å; V385-P401 HydrophobicContact CG1-CG 3.71Å; V385-P401 HydrophobicContact CG2-CG 3.57Å; V385-L402 HydrophobicContact CG2-CD1 3.71Å; V385-L402 HydrophobicContact CG2-CD2 4.14Å; V385-L402 HydrophobicContact CG2-CG 3.69Å
386	L	81.9	Confident	81.5	Confident	57 Å²	57	65.6 Å²	65.6	30%	0.298	35%	0.354	S	S	.	.	H	α-helix	trans	-82	-15.7	-170	-62.5	173.4	0	0	0	114	I348 A382	I348-L386 HydrophobicContact CD1-CB 3.96Å; I348-L386 HydrophobicContact CG2-CB 4.17Å; A382-L386 HydrophobicContact CB-CD1 4.49Å; A382-L386 VanDerWaalsContact O-CB 3.25Å; A382-L386 WeakPolarHBondContact O-CB 3.36Å; A382-L386 WeakPolarHBondContact O-CG 3.3Å; A382-L386 PolarHBondContact O-N 2.74Å
387	T	80	Confident	81.4	Confident	31 Å²	31	66.9 Å²	66.9	19%	0.19	37%	0.371	C	S	.	.	H	α-helix	trans	-98.6	-11.2	179.2	63.5	0	0	0	0	114.5	K345 I348 I349 K383 V385	K345-T387 HydrophobicContact CG-CG2 4.28Å; K345-T387 PolarHBondContact NZ-O 3.29Å; I348-T387 HydrophobicContact CB-CG2 4.47Å; I348-T387 HydrophobicContact CG2-CG2 3.8Å; I349-T387 HydrophobicContact CG1-CG2 4.32Å; K383-T387 HydrophobicContact CG-CG2 4.3Å; K383-T387 WeakPolarHBondContact O-CB 3.25Å; K383-T387 VanDerWaalsContact O-CG2 3.32Å; K383-T387 WeakPolarHBondContact O-CG2 3.39Å; K383-T387 PolarHBondContact O-N 3.05Å; K383-T387 PolarHBondContact O-OG1 3.17Å; V385-T387 PolarHBondContact O-N 3.46Å
388	D	85.6	Confident	81.3	Confident	54 Å²	54	65 Å²	65	29%	0.289	38%	0.379	S	S	.	.	S	Bend	trans	-98.1	118.9	172.3	-175.8	-57.7	0	0	0	109.2	E384 D390 K391 R392	E384-D388 WeakPolarHBondContact O-CB 3.45Å; D388-D390 VanDerWaalsContact C-N 3.29Å; D388-D390 PolarHBondContact O-N 3.01Å; D388-D390 PolarHBondContact OD1-N 3.04Å; D388-K391 HydrophobicContact CB-CB 4.02Å; D388-K391 HydrophobicContact CB-CD 4.06Å; D388-K391 HydrophobicContact CB-CG 4.04Å; D388-K391 PolarHBondContact O-N 2.71Å; D388-K391 PolarHBondContact OD1-N 2.65Å; D388-R392 VanDerWaalsContact O-CB 3.27Å; D388-R392 WeakPolarHBondContact O-CB 3.2Å; D388-R392 PolarHBondContact O-N 3.12Å
389	P	86.4	Confident	81.2	Confident	100 Å²	100	63.9 Å²	63.9	65%	0.649	38%	0.375	S	S	*	.	H	α-helix	trans	-59.1	-35.9	-177.1	-24.8	34.4	0	0	0	114.4	A393	P389-A393 WeakPolarHBondContact O-CB 3.36Å; P389-A393 PolarHBondContact O-N 3.23Å
390	D	87	Confident	81.3	Confident	119 Å²	119	67.1 Å²	67.1	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-77	-43.5	-175.5	-64.4	-29.9	0	0	0	110.2	D388 R392 A393 Q394	D388-D390 VanDerWaalsContact C-N 3.29Å; D388-D390 PolarHBondContact O-N 3.01Å; D388-D390 PolarHBondContact OD1-N 3.04Å; D390-R392 VanDerWaalsContact C-N 3.32Å; D390-R392 PolarHBondContact O-N 2.89Å; D390-A393 PolarHBondContact O-N 3.49Å; D390-Q394 WeakPolarHBondContact O-CG 3.48Å; D390-Q394 PolarHBondContact O-N 2.82Å
391	K	84.3	Confident	81.2	Confident	42 Å²	42	65.4 Å²	65.4	18%	0.183	38%	0.378	C	S	.	.	H	α-helix	trans	-64.3	-38.4	174	-63.8	-175.4	175.3	169.3	0	111.8	E384 V385 D388 Q394 Y395 P401	E384-K391 HydrophobicContact CG-CD 4.34Å; E384-K391 IonicContact OE1-NZ 2.58Å; E384-K391 PolarHBondContact OE1-NZ 3.33Å; V385-K391 HydrophobicContact CG1-CB 4.37Å; D388-K391 HydrophobicContact CB-CB 4.02Å; D388-K391 HydrophobicContact CB-CD 4.06Å; D388-K391 HydrophobicContact CB-CG 4.04Å; D388-K391 PolarHBondContact O-N 2.71Å; D388-K391 PolarHBondContact OD1-N 2.65Å; K391-Q394 PolarHBondContact O-N 3.49Å; K391-Y395 WeakPolarHBondContact O-CB 3.2Å; K391-Y395 PolarHBondContact O-N 3.2Å; K391-P401 HydrophobicContact CB-CB 3.73Å; K391-P401 HydrophobicContact CB-CG 4.03Å; K391-P401 HydrophobicContact CD-CB 4.47Å; K391-P401 HydrophobicContact CG-CB 3.9Å
392	R	82.9	Confident	81.1	Confident	51 Å²	51	66.7 Å²	66.7	19%	0.192	38%	0.381	C	S	.	.	H	α-helix	trans	-63	-44	174.5	-177.5	173.2	-179.6	163.6	1.8	111.3	E341 A343 V385 D388 D390 Q394 Y395 D396	E341-R392 PolarHBondContact O-NH2 3.35Å; A343-R392 PolarHBondContact O-NH1 3.24Å; V385-R392 PolarHBondContact O-N 3.19Å; D388-R392 VanDerWaalsContact O-CB 3.27Å; D388-R392 WeakPolarHBondContact O-CB 3.2Å; D388-R392 PolarHBondContact O-N 3.12Å; D390-R392 VanDerWaalsContact C-N 3.32Å; D390-R392 PolarHBondContact O-N 2.89Å; R392-Q394 VanDerWaalsContact C-N 3.34Å; R392-Q394 PolarHBondContact O-N 2.93Å; R392-Y395 WeakPolarHBondContact O-CB 3.26Å; R392-Y395 PolarHBondContact O-N 2.91Å; R392-D396 IonicContact NE-OD2 3.03Å; R392-D396 WeakPolarHBondContact O-CB 3.39Å; R392-D396 PolarHBondContact O-N 3.45Å
393	A	82.3	Confident	80.9	Confident	57 Å²	57	67.3 Å²	67.3	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-40.5	176.6	0	0	0	0	0	112.3	P389 D390 D396 S397	P389-A393 WeakPolarHBondContact O-CB 3.36Å; P389-A393 PolarHBondContact O-N 3.23Å; D390-A393 PolarHBondContact O-N 3.49Å; A393-D396 PolarHBondContact O-N 3.42Å; A393-S397 WeakPolarHBondContact O-CB 3.46Å; A393-S397 PolarHBondContact O-N 3.37Å; A393-S397 PolarHBondContact O-OG 3.31Å
394	Q	78.8	Confident	80.3	Confident	73 Å²	73	67.8 Å²	67.8	34%	0.341	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-49.3	172.7	-71.3	174.7	26.5	0	0	111.1	D390 K391 R392 D396 S397 G398 V399 P401	D390-Q394 WeakPolarHBondContact O-CG 3.48Å; D390-Q394 PolarHBondContact O-N 2.82Å; K391-Q394 PolarHBondContact O-N 3.49Å; R392-Q394 VanDerWaalsContact C-N 3.34Å; R392-Q394 PolarHBondContact O-N 2.93Å; Q394-D396 PolarHBondContact O-N 3.32Å; Q394-S397 WeakPolarHBondContact CA-OG 3.31Å; Q394-S397 CarbonylContact O-C 3.57Å; Q394-S397 WeakPolarHBondContact O-CA 3.26Å; Q394-S397 PolarHBondContact O-N 2.92Å; Q394-S397 PolarHBondContact O-OG 2.85Å; Q394-G398 PolarHBondContact O-N 3.35Å; Q394-V399 CarbonylContact C-O 3.6Å; Q394-V399 HydrophobicContact CB-CB 4.26Å; Q394-V399 PolarHBondContact O-N 2.9Å; Q394-V399 VanDerWaalsContact O-O 3.08Å; Q394-P401 HydrophobicContact CB-CB 4.13Å
395	Y	77	Confident	79.2	Confident	115 Å²	115	70 Å²	70	45%	0.451	40%	0.399	S	S	.	.	H	α-helix	trans	-57.8	-46.6	176.4	177.5	-96.5	0	0	0	112.6	V385 K391 R392 S397 G398 V399	V385-Y395 HydrophobicContact CG1-CD2 4.31Å; V385-Y395 HydrophobicContact CG1-CG 4.05Å; K391-Y395 WeakPolarHBondContact O-CB 3.2Å; K391-Y395 PolarHBondContact O-N 3.2Å; R392-Y395 WeakPolarHBondContact O-CB 3.26Å; R392-Y395 PolarHBondContact O-N 2.91Å; Y395-S397 PolarHBondContact O-N 2.69Å; Y395-G398 PolarHBondContact O-N 2.92Å; Y395-V399 WeakPolarHBondContact CA-O 3.48Å; Y395-V399 PolarHBondContact N-O 3.14Å
396	D	77	Confident	77.9	Confident	106 Å²	106	70.5 Å²	70.5	57%	0.567	41%	0.405	S	S	*	.	H	α-helix	trans	-64.6	-25.5	178.1	-67.6	-18.3	0	0	0	111.9	R392 A393 Q394 G398	R392-D396 IonicContact NE-OD2 3.03Å; R392-D396 WeakPolarHBondContact O-CB 3.39Å; R392-D396 PolarHBondContact O-N 3.45Å; A393-D396 PolarHBondContact O-N 3.42Å; Q394-D396 PolarHBondContact O-N 3.32Å; D396-G398 VanDerWaalsContact C-N 3.33Å
397	S	78.3	Confident	76.5	Confident	84 Å²	84	73 Å²	73	59%	0.587	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-2.9	173.7	76.7	0	0	0	0	114.3	A393 Q394 Y395	A393-S397 WeakPolarHBondContact O-CB 3.46Å; A393-S397 PolarHBondContact O-N 3.37Å; A393-S397 PolarHBondContact O-OG 3.31Å; Q394-S397 WeakPolarHBondContact CA-OG 3.31Å; Q394-S397 CarbonylContact O-C 3.57Å; Q394-S397 WeakPolarHBondContact O-CA 3.26Å; Q394-S397 PolarHBondContact O-N 2.92Å; Q394-S397 PolarHBondContact O-OG 2.85Å; Y395-S397 PolarHBondContact O-N 2.69Å
398	G	79.1	Confident	75	Confident	73 Å²	73	79.1 Å²	79.1	75%	0.753	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	16.1	-178.4	0	0	0	0	0	114.8	Q394 Y395 D396	Q394-G398 PolarHBondContact O-N 3.35Å; Y395-G398 PolarHBondContact O-N 2.92Å; D396-G398 VanDerWaalsContact C-N 3.33Å
399	V	76.7	Confident	73	Confident	66 Å²	66	84.3 Å²	84.3	40%	0.4	46%	0.464	S	S	.	.			trans	-98.2	133	173.2	179.2	0	0	0	0	108.5	Q394 Y395 P401 A406	Q394-V399 CarbonylContact C-O 3.6Å; Q394-V399 HydrophobicContact CB-CB 4.26Å; Q394-V399 PolarHBondContact O-N 2.9Å; Q394-V399 VanDerWaalsContact O-O 3.08Å; Y395-V399 WeakPolarHBondContact CA-O 3.48Å; Y395-V399 PolarHBondContact N-O 3.14Å; V399-P401 WeakPolarHBondContact O-CD 3.22Å; V399-A406 HydrophobicContact CG1-CB 4.39Å
400	D	77.9	Confident	70.8	Confident	91 Å²	91	83 Å²	83	49%	0.487	46%	0.462	S	S	.	.			trans	-78.3	110.3	174.9	-173.5	-10.8	0	0	0	110.3	L402 D403	D400-L402 PolarHBondContact O-N 3.47Å; D400-L402 PolarHBondContact OD1-N 3.16Å; D400-D403 HydrophobicContact CB-CB 3.95Å; D400-D403 PolarHBondContact O-N 2.81Å
401	P	77.7	Confident	68.2	Low	2 Å²	2	84.8 Å²	84.8	1%	0.013	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-11.5	-177.4	31.7	-37.3	0	0	0	114.2	V385 K391 Q394 V399 Q407	V385-P401 HydrophobicContact CB-CG 4.24Å; V385-P401 HydrophobicContact CG1-CG 3.71Å; V385-P401 HydrophobicContact CG2-CG 3.57Å; K391-P401 HydrophobicContact CB-CB 3.73Å; K391-P401 HydrophobicContact CB-CG 4.03Å; K391-P401 HydrophobicContact CD-CB 4.47Å; K391-P401 HydrophobicContact CG-CB 3.9Å; Q394-P401 HydrophobicContact CB-CB 4.13Å; V399-P401 WeakPolarHBondContact O-CD 3.22Å; P401-Q407 PolarHBondContact O-NE2 3.1Å
402	L	78.1	Confident	65.7	Low	56 Å²	56	91.5 Å²	91.5	29%	0.293	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-3.4	178.9	-60.1	-179.1	0	0	0	112.5	A381 E384 V385 D400 P404	A381-L402 HydrophobicContact CB-CD1 3.66Å; E384-L402 HydrophobicContact CG-CD2 4.41Å; V385-L402 HydrophobicContact CG2-CD1 3.71Å; V385-L402 HydrophobicContact CG2-CD2 4.14Å; V385-L402 HydrophobicContact CG2-CG 3.69Å; D400-L402 PolarHBondContact O-N 3.47Å; D400-L402 PolarHBondContact OD1-N 3.16Å; L402-P404 WeakPolarHBondContact O-CD 3.46Å
403	D	77.8	Confident	63.2	Low	57 Å²	57	94.8 Å²	94.8	31%	0.305	53%	0.525	S	S	.	.			trans	-69.7	118.5	175.9	-176.6	1.4	0	0	0	110.5	D400 E405 A406 Q407	D400-D403 HydrophobicContact CB-CB 3.95Å; D400-D403 PolarHBondContact O-N 2.81Å; D403-E405 PolarHBondContact O-N 3.03Å; D403-E405 PolarHBondContact OD1-N 3.15Å; D403-A406 HydrophobicContact CB-CB 3.94Å; D403-A406 PolarHBondContact O-N 3.49Å; D403-A406 VanDerWaalsContact O-N 3.13Å; D403-Q407 PolarHBondContact O-N 2.93Å
404	P	68	Low	60.5	Low	89 Å²	89	100.1 Å²	100.1	58%	0.578	54%	0.538	S	S	*	.	H	α-helix	trans	-57.3	-28	176.8	-22.5	33	0	0	0	113.6	L402	L402-P404 WeakPolarHBondContact O-CD 3.46Å
405	E	62.3	Low	58.3	Low	135 Å²	135	106.8 Å²	106.8	63%	0.631	56%	0.562	S	S	*	*	H	α-helix	trans	-76.2	-34.6	178.5	-66.4	-174.7	173.4	0	0	111.9	D403 Q408	D403-E405 PolarHBondContact O-N 3.03Å; D403-E405 PolarHBondContact OD1-N 3.15Å; E405-Q408 PolarHBondContact O-N 3.47Å
406	A	55.9	Low	55.9	Low	23 Å²	23	109.5 Å²	109.5	19%	0.19	58%	0.578	C	S	.	*	H	α-helix	trans	-71.2	-33	177.4	0	0	0	0	0	112.5	V399 D403 Q408 Q409 A410	V399-A406 HydrophobicContact CG1-CB 4.39Å; D403-A406 HydrophobicContact CB-CB 3.94Å; D403-A406 PolarHBondContact O-N 3.49Å; D403-A406 VanDerWaalsContact O-N 3.13Å; A406-Q408 VanDerWaalsContact C-N 3.29Å; A406-Q408 PolarHBondContact O-N 3.37Å; A406-Q409 PolarHBondContact O-N 3.48Å; A406-A410 PolarHBondContact O-N 3.32Å
407	Q	52.8	Low	53.5	Low	108 Å²	108	113.8 Å²	113.8	51%	0.505	59%	0.588	S	S	.	*	H	α-helix	trans	-71.2	-22.8	176.4	-69.1	-179.3	3.9	0	0	113.2	P401 D403	P401-Q407 PolarHBondContact O-NE2 3.1Å; D403-Q407 PolarHBondContact O-N 2.93Å
408	Q	50.2	Low	51.1	Low	160 Å²	160	116.5 Å²	116.5	75%	0.748	59%	0.59	S	S	*	*	H	α-helix	trans	-81.5	-19.9	174.2	-70.2	178.3	17.6	0	0	113	E405 A406	E405-Q408 PolarHBondContact O-N 3.47Å; A406-Q408 VanDerWaalsContact C-N 3.29Å; A406-Q408 PolarHBondContact O-N 3.37Å
409	Q	43.6	Very low	48.8	Very low	164 Å²	164	121 Å²	121	77%	0.766	59%	0.591	S	S	*	*	H	α-helix	trans	-96.1	-7.6	-177.5	-71.6	173.3	9.3	0	0	114	A406 H411	A406-Q409 PolarHBondContact O-N 3.48Å; Q409-H411 VanDerWaalsContact C-N 3.34Å; Q409-H411 PolarHBondContact O-N 2.99Å
410	A	38.4	Very low	46.4	Very low	73 Å²	73	121.3 Å²	121.3	60%	0.603	61%	0.607	S	S	*	*	S	Bend	trans	-83.6	0.3	-176.6	0	0	0	0	0	115.3	A406	A406-A410 PolarHBondContact O-N 3.32Å
411	H	33.5	Very low	44	Very low	156 Å²	156	126 Å²	126	72%	0.722	62%	0.624	S	S	*	*	S	Bend	trans	-124.7	83.4	175.5	-81.2	-65.8	0	0	0	110.9	Q409	Q409-H411 VanDerWaalsContact C-N 3.34Å; Q409-H411 PolarHBondContact O-N 2.99Å
412	H	31.3	Very low	41.8	Very low	183 Å²	183	132 Å²	132	85%	0.847	66%	0.656	S	S	*	*			trans	-170.5	97	146.4	-83.6	-49.2	0	0	0	110.2
413	P	29.6	Very low	39.7	Very low	119 Å²	119	134 Å²	134	77%	0.773	68%	0.68	S	S	*	*			trans	-76.5	137.1	160.8	31.9	-26.2	0	0	0	107.6
414	F	26.3	Very low	37.7	Very low	170 Å²	170	136.8 Å²	136.8	75%	0.746	70%	0.702	S	S	*	*			trans	79	101.4	169.7	-138	-97.6	0	0	0	114.9
415	Y	32.9	Very low	36.1	Very low	213 Å²	213	143 Å²	143	84%	0.835	72%	0.72	S	S	*	*				178.3	114.2	121.6	-102.9	-77.1	0	0	0	112.4
416	Q	27.5	Very low	34.6	Very low	171 Å²	171	142.2 Å²	142.2	80%	0.799	72%	0.72	S	S	*	*			trans	-46.6	145.4	160.3	-112.6	166.1	-22.3	0	0	114.4
417	Y	26.6	Very low	33.6	Very low	197 Å²	197	149.5 Å²	149.5	77%	0.773	75%	0.75	S	S	*	*			trans	79	120.6	136.8	-135.1	-107.2	0	0	0	119.1
418	F	26.9	Very low	32.6	Very low	140 Å²	140	148.2 Å²	148.2	61%	0.614	77%	0.766	S	S	*	*			trans	87.2	123.5	150.8	-103.4	-122.4	0	0	0	121.6
419	Q	30.6	Very low	31.7	Very low	168 Å²	168	144.8 Å²	144.8	79%	0.785	77%	0.773	S	S	*	*			trans	64.9	121.7	146.3	-67.4	179.1	-10.1	0	0	117.7
420	G	27.2	Very low	31.3	Very low	72 Å²	72	140.1 Å²	140.1	74%	0.742	77%	0.769	S	S	*	*			cis	91.3	81	32.9	0	0	0	0	0	110.8
421	F	28.1	Very low	31.3	Very low	191 Å²	191	142.6 Å²	142.6	84%	0.838	78%	0.779	S	S	*	*			trans	-176.7	118.8	141.6	-141.2	-108.8	0	0	0	112.6
422	D	31.4	Very low	31.5	Very low	128 Å²	128	144.2 Å²	144.2	68%	0.684	78%	0.784	S	S	*	*			trans	32.3	130.3	143.1	-63.9	-32.9	0	0	0	125.4
423	A	33.4	Very low	31.4	Very low	97 Å²	97	142 Å²	142	80%	0.802	78%	0.784	S	S	*	*				116.6	147.4	122.6	0	0	0	0	0	119.4
424	P	35.8	Very low	31.8	Very low	116 Å²	116	144.4 Å²	144.4	75%	0.753	78%	0.783	S	S	*	*			trans	-114.5	157	-146.6	38.4	-25	0	0	0	114.2
425	F	33.3	Very low	32	Very low	220 Å²	220	145.4 Å²	145.4	97%	0.965	79%	0.787	S	S	*	*			trans	-149.6	153	161	-121.7	-89.2	0	0	0	113.4
426	D	32.6	Very low	32.4	Very low	118 Å²	118	143.1 Å²	143.1	63%	0.631	78%	0.782	S	S	*	*			trans	-100	167.2	-151.7	-174.8	24.6	0	0	0	114
427	Q	33.9	Very low	32.5	Very low	175 Å²	175	143.3 Å²	143.3	82%	0.818	78%	0.782	S	S	*	*			trans	74.6	127.4	154.9	-84.7	166.6	48.3	0	0	122.2
428	G	32.6	Very low	33.4	Very low	81 Å²	81	143 Å²	143	84%	0.835	79%	0.785	S	S	*	*			trans	147.3	102.9	144.3	0	0	0	0	0	115.1
429	G	30.1	Very low	34	Very low	88 Å²	88	149.2 Å²	149.2	91%	0.907	82%	0.816	S	S	*	*			trans	-90.1	176	-175.5	0	0	0	0	0	116.5
430	G	34.8	Very low	34.2	Very low	66 Å²	66	148.3 Å²	148.3	68%	0.68	82%	0.818	S	S	*	*			trans	154.8	120.7	166	0	0	0	0	0	113.9
431	P	38.4	Very low	34.5	Very low	126 Å²	126	152.3 Å²	152.3	82%	0.818	82%	0.821	S	S	*	*			trans	-93	137.7	-178.1	35.1	-29.8	0	0	0	112.4
432	F	37.5	Very low	34.9	Very low	189 Å²	189	150.1 Å²	150.1	83%	0.829	82%	0.821	S	S	*	*			trans	-71.1	133.5	179.7	-72.4	-83.1	0	0	0	112.9	F434	F432-F434 HydrophobicContact CB-CE2 4.14Å
433	T	30.6	Very low	35.1	Very low	138 Å²	138	151.4 Å²	151.4	85%	0.847	83%	0.829	S	S	*	*			trans	-110.3	131.7	167.3	25.1	0	0	0	0	108.8
434	F	38.1	Very low	35.2	Very low	169 Å²	169	154.8 Å²	154.8	74%	0.741	83%	0.83	S	S	*	*			trans	-117.2	126.1	171.3	-77.4	-81.5	0	0	0	110.9	F432 F436	F432-F434 HydrophobicContact CB-CE2 4.14Å; F434-F436 HydrophobicContact CB-CE2 4.43Å
435	K	29.5	Very low	35.2	Very low	191 Å²	191	157.4 Å²	157.4	83%	0.83	84%	0.835	S	S	*	*			trans	-100	133.7	167.9	-82	-177.3	174.7	179.8	0	108.9
436	F	42.8	Very low	35.3	Very low	165 Å²	165	152.9 Å²	152.9	72%	0.724	83%	0.826	S	S	*	*			trans	-112.1	134.1	165.6	-73.6	-79.2	0	0	0	110.4	F434 F438	F434-F436 HydrophobicContact CB-CE2 4.43Å; F436-F438 HydrophobicContact CB-CD2 4.48Å; F436-F438 HydrophobicContact CB-CE2 3.98Å
437	H	28.6	Very low	35.5	Very low	174 Å²	174	155.6 Å²	155.6	81%	0.806	84%	0.841	S	S	*	*			trans	-99.4	133.9	166.6	-71.2	59.7	0	0	0	107.8
438	F	46.3	Very low	35.6	Very low	190 Å²	190	154 Å²	154	83%	0.833	84%	0.843	S	S	*	*			trans	-117.3	131.1	167.6	-74.8	-80.6	0	0	0	108.7	F436	F436-F438 HydrophobicContact CB-CD2 4.48Å; F436-F438 HydrophobicContact CB-CE2 3.98Å
439	Q	38.3	Very low	35.9	Very low	271 Å²	271	160.6 Å²	160.6	100%	1.266	84%	0.844	S	S	*	*			trans	-73.9	0	165.6	-80.3	-178.6	-22.9	0	0	110.9

Retrieved 439 of 439 residues in 997 ms (Link to these results)

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