A0A077Z648_TRITR Loading...

Transcription initiation factor TFIID subunit 6

AlphaFold DB , UniProt , Accession A0A077Z648, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 731 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	66.7	Low	177 Å²	177	88.1 Å²	88.1	87%	0.872	47%	0.466	S	S	*	.				0	-42.6	0	-70.6	-153.9	-93.8	0	0	113.1	E3 E59	M1-E3 PolarHBondContact O-N 3.22Å; M1-E59 HydrophobicContact CE-CG 4.48Å
2	I	61.6	Low	67.1	Low	33 Å²	33	81.4 Å²	81.4	17%	0.169	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-82.5	-9.5	-169.2	-41.5	-177.6	0	0	0	114	G4 W5 Q10 L58	I2-G4 PolarHBondContact O-N 3.13Å; I2-G4 VanDerWaalsContact O-N 3.08Å; I2-W5 HydrophobicContact CG2-CB 4.28Å; I2-W5 HydrophobicContact CG2-CD2 3.79Å; I2-W5 HydrophobicContact CG2-CE3 3.47Å; I2-W5 VanDerWaalsContact CG2-CE3 3.47Å; I2-W5 HydrophobicContact CG2-CG 4.16Å; I2-W5 HydrophobicContact CG2-CZ3 4.09Å; I2-W5 WeakPolarHBondContact O-CB 3.31Å; I2-W5 PolarHBondContact O-N 3.2Å; I2-Q10 HydrophobicContact CG2-CB 4.26Å; I2-Q10 HydrophobicContact CG2-CG 3.98Å; I2-Q10 WeakPolarHBondContact O-CG 3.19Å; I2-Q10 PolarHBondContact O-NE2 2.87Å; I2-L58 HydrophobicContact CD1-CD2 3.96Å
3	E	61.9	Low	67.5	Low	182 Å²	182	75.2 Å²	75.2	85%	0.85	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-62.8	-18.9	-177.1	-69.2	-177.9	164.6	0	0	114.5	M1 Q10	M1-E3 PolarHBondContact O-N 3.22Å; E3-Q10 PolarHBondContact O-NE2 3.46Å
4	G	61.2	Low	68.3	Low	57 Å²	57	79.4 Å²	79.4	59%	0.588	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-85.3	-2.7	174.3	0	0	0	0	0	115.1	I2	I2-G4 PolarHBondContact O-N 3.13Å; I2-G4 VanDerWaalsContact O-N 3.08Å
5	W	68.4	Low	68.9	Low	17 Å²	17	75.9 Å²	75.9	6%	0.064	40%	0.396	C	S	.	.	S	Bend	trans	-91.5	160.9	-177.1	-63.5	2.8	0	0	0	112	I2 L9 Q10 L58 L65 P66 L71	I2-W5 HydrophobicContact CG2-CB 4.28Å; I2-W5 HydrophobicContact CG2-CD2 3.79Å; I2-W5 HydrophobicContact CG2-CE3 3.47Å; I2-W5 VanDerWaalsContact CG2-CE3 3.47Å; I2-W5 HydrophobicContact CG2-CG 4.16Å; I2-W5 HydrophobicContact CG2-CZ3 4.09Å; I2-W5 WeakPolarHBondContact O-CB 3.31Å; I2-W5 PolarHBondContact O-N 3.2Å; W5-L9 HydrophobicContact CB-CB 4Å; W5-L9 HydrophobicContact CE3-CB 3.99Å; W5-Q10 HydrophobicContact CB-CG 4.07Å; W5-Q10 PolarHBondContact O-NE2 2.8Å; W5-L58 HydrophobicContact CH2-CD2 3.91Å; W5-L58 HydrophobicContact CZ3-CD2 4.1Å; W5-L65 HydrophobicContact CG-CD2 4.21Å; W5-P66 HydrophobicContact CH2-CG 3.85Å; W5-P66 HydrophobicContact CZ2-CG 4.28Å; W5-P66 HydrophobicContact CZ3-CG 4.31Å; W5-L71 HydrophobicContact CZ3-CD1 4.34Å; W5-L71 HydrophobicContact CZ3-CD2 4.42Å
6	S	69.1	Low	69.4	Low	67 Å²	67	71.2 Å²	71.2	47%	0.469	37%	0.372	S	S	.	.			trans	-61	149.6	172.9	73.7	0	0	0	0	111	A8 L9 Q10	S6-A8 PolarHBondContact O-N 3.33Å; S6-L9 PolarHBondContact O-N 3.35Å; S6-L9 WeakPolarHBondContact OG-CD1 3.48Å; S6-Q10 WeakPolarHBondContact O-CG 3.38Å; S6-Q10 PolarHBondContact O-N 3.5Å
7	M	70.6	Confident	69.9	Low	155 Å²	155	74.8 Å²	74.8	76%	0.764	38%	0.381	S	S	*	.	H	α-helix	trans	-52	-35.4	-177	-78.2	-74.2	-78.7	0	0	113.6	W11	M7-W11 PolarHBondContact O-N 3.12Å
8	A	66.5	Low	70.6	Confident	51 Å²	51	73.7 Å²	73.7	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-66.3	-47	175.9	0	0	0	0	0	112	S6 Q10 W11 V12	S6-A8 PolarHBondContact O-N 3.33Å; A8-Q10 VanDerWaalsContact C-N 3.32Å; A8-Q10 PolarHBondContact O-N 2.95Å; A8-W11 PolarHBondContact O-N 2.96Å; A8-V12 WeakPolarHBondContact O-CG2 3.49Å; A8-V12 PolarHBondContact O-N 3.47Å
9	L	68.9	Low	70.9	Confident	17 Å²	17	70.7 Å²	70.7	9%	0.089	37%	0.369	C	S	.	.	H	α-helix	trans	-66.9	-33.4	176.8	-74.2	166.4	0	0	0	112	W5 S6 W11 G13 L65 Q68	W5-L9 HydrophobicContact CB-CB 4Å; W5-L9 HydrophobicContact CE3-CB 3.99Å; S6-L9 PolarHBondContact O-N 3.35Å; S6-L9 WeakPolarHBondContact OG-CD1 3.48Å; L9-W11 VanDerWaalsContact C-N 3.33Å; L9-W11 PolarHBondContact O-N 3.3Å; L9-G13 PolarHBondContact O-N 3.39Å; L9-L65 HydrophobicContact CD1-CD2 3.85Å; L9-Q68 HydrophobicContact CD2-CB 4.36Å
10	Q	71.4	Confident	71.2	Confident	37 Å²	37	67.8 Å²	67.8	17%	0.173	35%	0.354	C	S	.	.	H	α-helix	trans	-62.2	-41.5	174.1	-71	-171.2	6.3	0	0	112.3	I2 E3 W5 S6 A8 K14	I2-Q10 HydrophobicContact CG2-CB 4.26Å; I2-Q10 HydrophobicContact CG2-CG 3.98Å; I2-Q10 WeakPolarHBondContact O-CG 3.19Å; I2-Q10 PolarHBondContact O-NE2 2.87Å; E3-Q10 PolarHBondContact O-NE2 3.46Å; W5-Q10 HydrophobicContact CB-CG 4.07Å; W5-Q10 PolarHBondContact O-NE2 2.8Å; S6-Q10 WeakPolarHBondContact O-CG 3.38Å; S6-Q10 PolarHBondContact O-N 3.5Å; A8-Q10 VanDerWaalsContact C-N 3.32Å; A8-Q10 PolarHBondContact O-N 2.95Å; Q10-K14 WeakPolarHBondContact O-CB 3.24Å; Q10-K14 VanDerWaalsContact O-CG 3.3Å; Q10-K14 WeakPolarHBondContact O-CG 3.29Å; Q10-K14 PolarHBondContact O-N 3.14Å
11	W	76.1	Confident	71.7	Confident	176 Å²	176	68.3 Å²	68.3	67%	0.667	36%	0.357	S	S	*	.	H	α-helix	trans	-68.7	-44.6	-178.8	-168.7	82.5	0	0	0	111.9	M7 A8 L9 S15	M7-W11 PolarHBondContact O-N 3.12Å; A8-W11 PolarHBondContact O-N 2.96Å; L9-W11 VanDerWaalsContact C-N 3.33Å; L9-W11 PolarHBondContact O-N 3.3Å; W11-S15 WeakPolarHBondContact O-CB 3.47Å; W11-S15 PolarHBondContact O-N 3.28Å; W11-S15 PolarHBondContact O-OG 3.44Å
12	V	72.1	Confident	72.7	Confident	8 Å²	8	62 Å²	62	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-67.4	-40.6	176.6	-170.5	0	0	0	0	110.5	A8 S15 L16 L71 D72 L75	A8-V12 WeakPolarHBondContact O-CG2 3.49Å; A8-V12 PolarHBondContact O-N 3.47Å; V12-S15 PolarHBondContact O-N 3.23Å; V12-L16 WeakPolarHBondContact O-CB 3.44Å; V12-L16 PolarHBondContact O-N 3.3Å; V12-L71 HydrophobicContact CB-CD2 3.64Å; V12-L71 HydrophobicContact CG1-CB 4.04Å; V12-L71 HydrophobicContact CG1-CD2 3.57Å; V12-L71 HydrophobicContact CG1-CG 4.13Å; V12-D72 WeakPolarHBondContact CG1-OD1 3.45Å; V12-L75 HydrophobicContact CG1-CD1 3.56Å
13	G	72	Confident	73.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-40.4	176.6	0	0	0	0	0	113.8	L9 S15 L16 Y17	L9-G13 PolarHBondContact O-N 3.39Å; G13-S15 VanDerWaalsContact C-N 3.35Å; G13-L16 PolarHBondContact O-N 2.89Å; G13-Y17 WeakPolarHBondContact O-CB 3.48Å; G13-Y17 PolarHBondContact O-N 2.96Å
14	K	78.4	Confident	73.8	Confident	134 Å²	134	56.1 Å²	56.1	58%	0.583	30%	0.298	S	S	*	.	H	α-helix	trans	-64.9	-39.5	172.5	-77.9	178.3	179.2	178.3	0	111.9	Q10 Y17 A18	Q10-K14 WeakPolarHBondContact O-CB 3.24Å; Q10-K14 VanDerWaalsContact O-CG 3.3Å; Q10-K14 WeakPolarHBondContact O-CG 3.29Å; Q10-K14 PolarHBondContact O-N 3.14Å; K14-Y17 PolarHBondContact O-N 3.47Å; K14-A18 WeakPolarHBondContact O-CB 3.37Å; K14-A18 PolarHBondContact O-N 2.89Å
15	S	76.8	Confident	74.6	Confident	27 Å²	27	60 Å²	60	19%	0.189	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-41.1	177.6	-59.2	0	0	0	0	111.7	W11 V12 G13 A18 L19	W11-S15 WeakPolarHBondContact O-CB 3.47Å; W11-S15 PolarHBondContact O-N 3.28Å; W11-S15 PolarHBondContact O-OG 3.44Å; V12-S15 PolarHBondContact O-N 3.23Å; G13-S15 VanDerWaalsContact C-N 3.35Å; S15-A18 PolarHBondContact O-N 3.3Å; S15-L19 PolarHBondContact O-N 2.9Å
16	L	77.1	Confident	74.7	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-47.2	174.1	-173.5	69.1	0	0	0	110.8	V12 G13 A18 L19 M20 L58 A74 L75 L78	V12-L16 WeakPolarHBondContact O-CB 3.44Å; V12-L16 PolarHBondContact O-N 3.3Å; G13-L16 PolarHBondContact O-N 2.89Å; L16-A18 PolarHBondContact O-N 3.4Å; L16-L19 PolarHBondContact O-N 3.42Å; L16-M20 HydrophobicContact CG-SD 4.04Å; L16-M20 WeakPolarHBondContact O-CG 3.45Å; L16-M20 PolarHBondContact O-N 3.08Å; L16-L58 HydrophobicContact CD2-CD1 4.46Å; L16-L58 HydrophobicContact CD2-CG 4.36Å; L16-A74 HydrophobicContact CD1-CB 4.46Å; L16-L75 HydrophobicContact CD1-CB 4.14Å; L16-L75 HydrophobicContact CD1-CG 4.39Å; L16-L78 HydrophobicContact CD1-CD2 4.06Å
17	Y	79.2	Confident	74.7	Confident	132 Å²	132	57.8 Å²	57.8	52%	0.518	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-41.2	177.7	-175.9	-100.8	0	0	0	112.9	G13 K14 M20 L21	G13-Y17 WeakPolarHBondContact O-CB 3.48Å; G13-Y17 PolarHBondContact O-N 2.96Å; K14-Y17 PolarHBondContact O-N 3.47Å; Y17-M20 PolarHBondContact O-N 3.05Å; Y17-L21 HydrophobicContact CD1-CD1 4.01Å; Y17-L21 HydrophobicContact CE1-CD1 3.53Å; Y17-L21 HydrophobicContact CE1-CG 4.17Å; Y17-L21 PolarHBondContact O-N 3.26Å; Y17-L21 VanDerWaalsContact O-N 3.08Å
18	A	81.6	Confident	74.6	Confident	56 Å²	56	57 Å²	57	46%	0.463	28%	0.278	S	S	.	.	H	α-helix	trans	-62.7	-43	175.9	0	0	0	0	0	112.1	K14 S15 L16 M20 L21 E22	K14-A18 WeakPolarHBondContact O-CB 3.37Å; K14-A18 PolarHBondContact O-N 2.89Å; S15-A18 PolarHBondContact O-N 3.3Å; L16-A18 PolarHBondContact O-N 3.4Å; A18-M20 VanDerWaalsContact C-N 3.33Å; A18-M20 PolarHBondContact O-N 3.46Å; A18-L21 PolarHBondContact O-N 3.2Å; A18-E22 PolarHBondContact O-N 3.48Å; A18-E22 VanDerWaalsContact O-N 3.09Å
19	L	76.8	Confident	74.6	Confident	16 Å²	16	59.2 Å²	59.2	8%	0.084	28%	0.279	C	S	.	.	H	α-helix	trans	-66.5	-33.3	175.5	-78	158.7	0	0	0	112.4	S15 L16 E22 A23 L75 L78 R79 I82 M109	S15-L19 PolarHBondContact O-N 2.9Å; L16-L19 PolarHBondContact O-N 3.42Å; L19-E22 PolarHBondContact O-N 3.09Å; L19-A23 WeakPolarHBondContact O-CB 3.33Å; L19-A23 PolarHBondContact O-N 3.31Å; L19-L75 HydrophobicContact CD1-CD2 3.71Å; L19-L75 HydrophobicContact CD1-CG 3.96Å; L19-L78 HydrophobicContact CB-CD2 3.56Å; L19-L78 HydrophobicContact CB-CG 4.31Å; L19-R79 HydrophobicContact CD1-CG 3.84Å; L19-R79 HydrophobicContact CD2-CG 4.13Å; L19-I82 HydrophobicContact CB-CD1 4.3Å; L19-I82 HydrophobicContact CD2-CD1 3.75Å; L19-M109 HydrophobicContact CD2-CE 4.16Å
20	M	77.3	Confident	74.3	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.059	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-39.2	175.3	-70.2	163.9	65.4	0	0	111.8	L16 Y17 A18 A23 M24 V51 I55 L58 L78	L16-M20 HydrophobicContact CG-SD 4.04Å; L16-M20 WeakPolarHBondContact O-CG 3.45Å; L16-M20 PolarHBondContact O-N 3.08Å; Y17-M20 PolarHBondContact O-N 3.05Å; A18-M20 VanDerWaalsContact C-N 3.33Å; A18-M20 PolarHBondContact O-N 3.46Å; M20-A23 PolarHBondContact O-N 3.5Å; M20-M24 WeakPolarHBondContact O-CG 3.42Å; M20-M24 PolarHBondContact O-N 3.33Å; M20-V51 HydrophobicContact CB-CG1 4.42Å; M20-V51 HydrophobicContact CE-CG1 4Å; M20-V51 WeakPolarHBondContact CE-O 3.45Å; M20-V51 HydrophobicContact CG-CG1 4.45Å; M20-I55 HydrophobicContact CE-CB 4.32Å; M20-I55 HydrophobicContact CE-CD1 4.23Å; M20-I55 HydrophobicContact CE-CG1 3.27Å; M20-L58 HydrophobicContact SD-CD1 4.05Å; M20-L78 HydrophobicContact CB-CD2 4.46Å; M20-L78 HydrophobicContact CG-CD2 3.65Å
21	L	80.4	Confident	73.7	Confident	80 Å²	80	65.1 Å²	65.1	42%	0.419	31%	0.307	S	S	.	.	H	α-helix	trans	-63.8	-44.2	173.5	-73.4	171.3	0	0	0	111.4	Y17 A18 A23 M24 E25	Y17-L21 HydrophobicContact CD1-CD1 4.01Å; Y17-L21 HydrophobicContact CE1-CD1 3.53Å; Y17-L21 HydrophobicContact CE1-CG 4.17Å; Y17-L21 PolarHBondContact O-N 3.26Å; Y17-L21 VanDerWaalsContact O-N 3.08Å; A18-L21 PolarHBondContact O-N 3.2Å; L21-A23 VanDerWaalsContact C-N 3.34Å; L21-A23 PolarHBondContact O-N 2.99Å; L21-M24 PolarHBondContact O-N 3.05Å; L21-E25 PolarHBondContact O-N 3.35Å
22	E	78.9	Confident	72.7	Confident	44 Å²	44	64 Å²	64	21%	0.206	31%	0.309	C	S	.	.	H	α-helix	trans	-61.1	-42.4	175.9	-172.6	177.1	-179	0	0	111.7	A18 L19 M24 E25 L26 K105	A18-E22 PolarHBondContact O-N 3.48Å; A18-E22 VanDerWaalsContact O-N 3.09Å; L19-E22 PolarHBondContact O-N 3.09Å; E22-M24 PolarHBondContact O-N 3.04Å; E22-E25 PolarHBondContact O-N 3.12Å; E22-L26 HydrophobicContact CG-CD1 4.18Å; E22-L26 PolarHBondContact O-N 3.44Å; E22-K105 WeakPolarHBondContact OE1-CE 3.26Å; E22-K105 IonicContact OE1-NZ 3.6Å; E22-K105 PolarHBondContact OE1-NZ 3.47Å
23	A	73.4	Confident	71.5	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-43.8	173.6	0	0	0	0	0	111.8	L19 M20 L21 E25 L26 T27 L47 V51 L78 I82	L19-A23 WeakPolarHBondContact O-CB 3.33Å; L19-A23 PolarHBondContact O-N 3.31Å; M20-A23 PolarHBondContact O-N 3.5Å; L21-A23 VanDerWaalsContact C-N 3.34Å; L21-A23 PolarHBondContact O-N 2.99Å; A23-E25 PolarHBondContact O-N 3.3Å; A23-L26 PolarHBondContact O-N 3.09Å; A23-T27 PolarHBondContact O-N 2.91Å; A23-L47 HydrophobicContact CB-CD1 4.19Å; A23-L47 HydrophobicContact CB-CD2 3.76Å; A23-L47 HydrophobicContact CB-CG 3.97Å; A23-L47 VanDerWaalsContact O-CD2 3.23Å; A23-L47 WeakPolarHBondContact O-CD2 3.46Å; A23-V51 HydrophobicContact CB-CG2 3.72Å; A23-L78 HydrophobicContact CB-CD1 4.36Å; A23-I82 HydrophobicContact CB-CD1 4.21Å; A23-I82 HydrophobicContact CB-CG1 4.26Å
24	M	74.8	Confident	70.1	Confident	91 Å²	91	75.9 Å²	75.9	45%	0.448	36%	0.363	S	S	.	.	H	α-helix	trans	-63.9	-39.4	176.2	-73.9	-175	66.8	0	0	112.7	M20 L21 E22 T27 K28	M20-M24 WeakPolarHBondContact O-CG 3.42Å; M20-M24 PolarHBondContact O-N 3.33Å; L21-M24 PolarHBondContact O-N 3.05Å; E22-M24 PolarHBondContact O-N 3.04Å; M24-T27 PolarHBondContact O-N 3.26Å; M24-T27 PolarHBondContact O-OG1 3.45Å; M24-K28 PolarHBondContact O-N 2.97Å
25	E	77.5	Confident	68.7	Low	139 Å²	139	71.1 Å²	71.1	65%	0.65	35%	0.348	S	S	*	.	H	α-helix	trans	-64.2	-41.7	174.1	-74.9	-179	175.5	0	0	111.9	L21 E22 A23 T27 K28 H29	L21-E25 PolarHBondContact O-N 3.35Å; E22-E25 PolarHBondContact O-N 3.12Å; A23-E25 PolarHBondContact O-N 3.3Å; E25-T27 PolarHBondContact O-N 2.72Å; E25-K28 PolarHBondContact O-N 2.98Å; E25-H29 PolarHBondContact O-N 3.23Å
26	L	70.8	Confident	67.6	Low	18 Å²	18	75 Å²	75	9%	0.094	37%	0.373	C	S	.	.	H	α-helix	trans	-61.1	-39.4	174.6	-84.1	154.3	0	0	0	112.5	E22 A23 K28 H29 N30 I82 V85	E22-L26 HydrophobicContact CG-CD1 4.18Å; E22-L26 PolarHBondContact O-N 3.44Å; A23-L26 PolarHBondContact O-N 3.09Å; L26-K28 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 3.4Å; L26-H29 PolarHBondContact O-N 2.96Å; L26-N30 VanDerWaalsContact O-CB 3.3Å; L26-N30 WeakPolarHBondContact O-CB 3.41Å; L26-N30 PolarHBondContact O-N 3.37Å; L26-N30 PolarHBondContact O-ND2 2.98Å; L26-I82 HydrophobicContact CD1-CG1 4.46Å; L26-I82 HydrophobicContact CD1-CG2 3.72Å; L26-V85 HydrophobicContact CD2-CG1 4.08Å
27	T	68.7	Low	66.5	Low	19 Å²	19	82.3 Å²	82.3	12%	0.117	41%	0.407	C	S	.	.	H	α-helix	trans	-64.1	-37.4	174.9	58.2	0	0	0	0	113	A23 M24 E25 Q31 L47 L48	A23-T27 PolarHBondContact O-N 2.91Å; M24-T27 PolarHBondContact O-N 3.26Å; M24-T27 PolarHBondContact O-OG1 3.45Å; E25-T27 PolarHBondContact O-N 2.72Å; T27-Q31 PolarHBondContact O-N 3.36Å; T27-L47 HydrophobicContact CG2-CD2 3.26Å; T27-L48 HydrophobicContact CG2-CD2 4.26Å; T27-L48 HydrophobicContact CG2-CG 4.38Å
28	K	68.6	Low	65.5	Low	139 Å²	139	78.4 Å²	78.4	60%	0.604	41%	0.407	S	S	*	.	H	α-helix	trans	-67.5	-44.9	176.7	-72.2	-179	-179	177.5	0	110.9	M24 E25 L26 N30 Q31	M24-K28 PolarHBondContact O-N 2.97Å; E25-K28 PolarHBondContact O-N 2.98Å; L26-K28 VanDerWaalsContact C-N 3.34Å; L26-K28 PolarHBondContact O-N 3.4Å; K28-N30 VanDerWaalsContact C-N 3.33Å; K28-N30 PolarHBondContact O-N 3.23Å; K28-Q31 WeakPolarHBondContact O-CB 3.36Å; K28-Q31 PolarHBondContact O-N 2.68Å
29	H	65.8	Low	64.4	Low	97 Å²	97	84 Å²	84	45%	0.449	42%	0.421	S	S	.	.	H	α-helix	trans	-67.3	-34.2	179	-160.9	55.3	0	0	0	112.5	E25 L26 Q31 E32	E25-H29 PolarHBondContact O-N 3.23Å; L26-H29 PolarHBondContact O-N 2.96Å; H29-Q31 PolarHBondContact O-N 2.79Å; H29-E32 IonicContact ND1-OE2 2.92Å; H29-E32 PolarHBondContact O-N 3.44Å; H29-E32 VanDerWaalsContact O-N 3.14Å
30	N	63	Low	63.5	Low	16 Å²	16	85.1 Å²	85.1	9%	0.086	43%	0.425	C	S	.	.	H	α-helix	trans	-66.8	-20.1	175.6	-79.4	-15.4	0	0	0	114	L26 K28 E32 N44 V85 Q89	L26-N30 VanDerWaalsContact O-CB 3.3Å; L26-N30 WeakPolarHBondContact O-CB 3.41Å; L26-N30 PolarHBondContact O-N 3.37Å; L26-N30 PolarHBondContact O-ND2 2.98Å; K28-N30 VanDerWaalsContact C-N 3.33Å; K28-N30 PolarHBondContact O-N 3.23Å; N30-E32 VanDerWaalsContact C-N 3.26Å; N30-N44 PolarHBondContact ND2-OD1 3.5Å; N30-N44 VanDerWaalsContact ND2-OD1 3.17Å; N30-V85 WeakPolarHBondContact ND2-CG1 3.25Å; N30-Q89 PolarHBondContact OD1-NE2 2.7Å
31	Q	59.1	Low	63	Low	163 Å²	163	88.5 Å²	88.5	76%	0.762	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-17.5	173.9	-72.6	-179.1	-9	0	0	112.8	T27 K28 H29	T27-Q31 PolarHBondContact O-N 3.36Å; K28-Q31 WeakPolarHBondContact O-CB 3.36Å; K28-Q31 PolarHBondContact O-N 2.68Å; H29-Q31 PolarHBondContact O-N 2.79Å
32	E	55	Low	62.3	Low	151 Å²	151	88.4 Å²	88.4	71%	0.706	45%	0.446	S	S	*	.	S	Bend	trans	-97.2	-8.5	-174.5	-63.9	179.8	162.6	0	0	113.9	H29 N30	H29-E32 IonicContact ND1-OE2 2.92Å; H29-E32 PolarHBondContact O-N 3.44Å; H29-E32 VanDerWaalsContact O-N 3.14Å; N30-E32 VanDerWaalsContact C-N 3.26Å
33	L	46.6	Very low	61.7	Low	52 Å²	52	87.7 Å²	87.7	27%	0.272	44%	0.444	S	S	.	.	S	Bend	trans	-106.3	133.3	-174.9	-74.4	161.3	0	0	0	113.4	A35 K40	L33-A35 PolarHBondContact O-N 3.28Å; L33-K40 PolarHBondContact O-NZ 2.92Å
34	F	41.8	Very low	61.5	Low	206 Å²	206	88.8 Å²	88.8	90%	0.904	45%	0.45	S	S	*	.			trans	-74.9	100.3	178.6	-84.2	-92.6	0	0	0	112.5
35	A	50.4	Low	61.4	Low	34 Å²	34	89.1 Å²	89.1	28%	0.281	45%	0.452	S	S	.	.	S	Bend	trans	-146.2	169.9	162.1	0	0	0	0	0	110.9	L33 Q37 K40	L33-A35 PolarHBondContact O-N 3.28Å; A35-Q37 PolarHBondContact O-N 3.4Å; A35-K40 HydrophobicContact CB-CD 3.76Å
36	P	52.2	Low	61	Low	109 Å²	109	86.8 Å²	86.8	71%	0.708	44%	0.441	S	S	*	.			trans	-63.7	125.2	-169	23.2	-30.4	0	0	0	111.8	G38	P36-G38 PolarHBondContact O-N 3.42Å
37	Q	54.9	Low	61.2	Low	155 Å²	155	85.9 Å²	85.9	72%	0.724	44%	0.437	S	S	*	.	H	α-helix	trans	-56.8	-29.2	-164.6	-70.3	-172.1	-15.9	0	0	115	A35 N41	A35-Q37 PolarHBondContact O-N 3.4Å; Q37-N41 VanDerWaalsContact O-CB 3.27Å; Q37-N41 WeakPolarHBondContact O-CB 3.3Å; Q37-N41 PolarHBondContact O-N 2.85Å; Q37-N41 PolarHBondContact O-ND2 3.49Å; Q37-N41 PolarHBondContact O-OD1 3.47Å
38	G	57.4	Low	61.5	Low	50 Å²	50	89.5 Å²	89.5	52%	0.515	46%	0.455	S	S	.	.	H	α-helix	trans	-65.5	-52.4	-172.1	0	0	0	0	0	115.1	P36 T42	P36-G38 PolarHBondContact O-N 3.42Å; G38-T42 PolarHBondContact O-N 3.41Å; G38-T42 PolarHBondContact O-OG1 2.66Å
39	K	58.3	Low	61.8	Low	172 Å²	172	87.1 Å²	87.1	75%	0.748	45%	0.448	S	S	*	.	H	α-helix	trans	-71.8	-38.7	-179.1	-74.3	-173.6	177	-176.6	0	112	N41 T42 L43	K39-N41 PolarHBondContact O-N 3.02Å; K39-T42 PolarHBondContact O-N 3.11Å; K39-L43 PolarHBondContact O-N 3.4Å
40	K	59.5	Low	62	Low	40 Å²	40	83.6 Å²	83.6	17%	0.174	44%	0.435	C	S	.	.	H	α-helix	trans	-60.4	-44.1	175.9	-79.9	-175.1	158.8	175.2	0	112.5	L33 A35 T42 N44	L33-K40 PolarHBondContact O-NZ 2.92Å; A35-K40 HydrophobicContact CB-CD 3.76Å; K40-T42 VanDerWaalsContact C-N 3.35Å; K40-N44 WeakPolarHBondContact O-CB 3.13Å; K40-N44 PolarHBondContact O-N 2.96Å; K40-N44 PolarHBondContact O-ND2 3.29Å
41	N	66	Low	62.7	Low	84 Å²	84	83.3 Å²	83.3	45%	0.449	43%	0.433	S	S	.	.	H	α-helix	trans	-65.7	-39.8	178.2	-71	-10.2	0	0	0	111.6	Q37 K39 N44 I45	Q37-N41 VanDerWaalsContact O-CB 3.27Å; Q37-N41 WeakPolarHBondContact O-CB 3.3Å; Q37-N41 PolarHBondContact O-N 2.85Å; Q37-N41 PolarHBondContact O-ND2 3.49Å; Q37-N41 PolarHBondContact O-OD1 3.47Å; K39-N41 PolarHBondContact O-N 3.02Å; N41-N44 PolarHBondContact O-N 3.28Å; N41-I45 WeakPolarHBondContact O-CB 3.26Å; N41-I45 WeakPolarHBondContact O-CD1 3.08Å; N41-I45 WeakPolarHBondContact O-CG1 3.41Å; N41-I45 PolarHBondContact O-N 2.64Å
42	T	66.5	Low	63.5	Low	78 Å²	78	82.4 Å²	82.4	48%	0.479	42%	0.423	S	S	.	.	H	α-helix	trans	-63.9	-47.5	179.6	-48.6	0	0	0	0	111.2	G38 K39 K40 I45 E46	G38-T42 PolarHBondContact O-N 3.41Å; G38-T42 PolarHBondContact O-OG1 2.66Å; K39-T42 PolarHBondContact O-N 3.11Å; K40-T42 VanDerWaalsContact C-N 3.35Å; T42-I45 PolarHBondContact O-N 3.21Å; T42-E46 PolarHBondContact O-N 2.98Å
43	L	65.3	Low	64.3	Low	29 Å²	29	79.1 Å²	79.1	15%	0.152	41%	0.41	C	S	.	.	H	α-helix	trans	-66.8	-39.1	177.4	-69.4	170.2	0	0	0	112.7	K39 I45 E46 L47 L84 V85 T88	K39-L43 PolarHBondContact O-N 3.4Å; L43-I45 VanDerWaalsContact C-N 3.32Å; L43-I45 PolarHBondContact O-N 2.94Å; L43-E46 PolarHBondContact O-N 3.16Å; L43-L47 VanDerWaalsContact O-CB 3.3Å; L43-L47 WeakPolarHBondContact O-CB 3.25Å; L43-L47 PolarHBondContact O-N 3.19Å; L43-L84 HydrophobicContact CD2-CB 4.36Å; L43-V85 HydrophobicContact CB-CG2 4.34Å; L43-T88 HydrophobicContact CD1-CG2 3.63Å
44	N	70	Confident	65.5	Low	23 Å²	23	76.7 Å²	76.7	12%	0.123	40%	0.397	C	S	.	.	H	α-helix	trans	-65.2	-36.1	174.5	-79.6	-19.9	0	0	0	111.9	N30 K40 N41 L48	N30-N44 PolarHBondContact ND2-OD1 3.5Å; N30-N44 VanDerWaalsContact ND2-OD1 3.17Å; K40-N44 WeakPolarHBondContact O-CB 3.13Å; K40-N44 PolarHBondContact O-N 2.96Å; K40-N44 PolarHBondContact O-ND2 3.29Å; N41-N44 PolarHBondContact O-N 3.28Å; N44-L48 WeakPolarHBondContact O-CB 3.45Å; N44-L48 VanDerWaalsContact O-CG 3.26Å; N44-L48 WeakPolarHBondContact O-CG 3.5Å; N44-L48 PolarHBondContact O-N 3.14Å
45	I	72.7	Confident	67	Low	98 Å²	98	70.1 Å²	70.1	50%	0.503	37%	0.371	S	S	.	.	H	α-helix	trans	-66.2	-48.5	174.8	-71.4	163.5	0	0	0	110.2	N41 T42 L43 L47 L48 L49	N41-I45 WeakPolarHBondContact O-CB 3.26Å; N41-I45 WeakPolarHBondContact O-CD1 3.08Å; N41-I45 WeakPolarHBondContact O-CG1 3.41Å; N41-I45 PolarHBondContact O-N 2.64Å; T42-I45 PolarHBondContact O-N 3.21Å; L43-I45 VanDerWaalsContact C-N 3.32Å; L43-I45 PolarHBondContact O-N 2.94Å; I45-L47 VanDerWaalsContact C-N 3.28Å; I45-L47 PolarHBondContact O-N 3.11Å; I45-L48 PolarHBondContact O-N 3.31Å; I45-L49 HydrophobicContact CG2-CD1 3.84Å; I45-L49 HydrophobicContact CG2-CG 4.28Å; I45-L49 WeakPolarHBondContact O-CB 3.44Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 3.48Å; I45-L49 PolarHBondContact O-N 2.82Å
46	E	69.7	Low	68.3	Low	89 Å²	89	73 Å²	73	42%	0.416	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-37.2	177.5	-75.7	-177.2	174.5	0	0	112.6	T42 L43 L49 S50 V81	T42-E46 PolarHBondContact O-N 2.98Å; L43-E46 PolarHBondContact O-N 3.16Å; E46-L49 PolarHBondContact O-N 2.96Å; E46-S50 WeakPolarHBondContact O-CB 3.48Å; E46-S50 PolarHBondContact O-N 3.34Å; E46-S50 PolarHBondContact O-OG 2.95Å; E46-V81 HydrophobicContact CB-CG1 4.42Å
47	L	73.8	Confident	69.2	Low	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-66.9	-43.7	175.4	-164.7	104.8	0	0	0	111.5	A23 T27 L43 I45 S50 V51 V81 I82 V85	A23-L47 HydrophobicContact CB-CD1 4.19Å; A23-L47 HydrophobicContact CB-CD2 3.76Å; A23-L47 HydrophobicContact CB-CG 3.97Å; A23-L47 VanDerWaalsContact O-CD2 3.23Å; A23-L47 WeakPolarHBondContact O-CD2 3.46Å; T27-L47 HydrophobicContact CG2-CD2 3.26Å; L43-L47 VanDerWaalsContact O-CB 3.3Å; L43-L47 WeakPolarHBondContact O-CB 3.25Å; L43-L47 PolarHBondContact O-N 3.19Å; I45-L47 VanDerWaalsContact C-N 3.28Å; I45-L47 PolarHBondContact O-N 3.11Å; L47-S50 PolarHBondContact O-N 3.4Å; L47-V51 VanDerWaalsContact O-CG2 3.31Å; L47-V51 WeakPolarHBondContact O-CG2 3.41Å; L47-V51 PolarHBondContact O-N 3.45Å; L47-V81 HydrophobicContact CB-CG1 3.85Å; L47-V81 HydrophobicContact CD1-CB 4.19Å; L47-V81 HydrophobicContact CD1-CG1 3.65Å; L47-V81 HydrophobicContact CG-CG1 4.26Å; L47-I82 HydrophobicContact CD1-CG1 3.98Å; L47-V85 HydrophobicContact CD1-CG2 4.12Å
48	L	74.9	Confident	69.9	Low	95 Å²	95	62.5 Å²	62.5	50%	0.497	32%	0.321	S	S	.	.	H	α-helix	trans	-67	-36.7	176.3	-72.8	173.4	0	0	0	112.6	T27 N44 I45 V51 R52	T27-L48 HydrophobicContact CG2-CD2 4.26Å; T27-L48 HydrophobicContact CG2-CG 4.38Å; N44-L48 WeakPolarHBondContact O-CB 3.45Å; N44-L48 VanDerWaalsContact O-CG 3.26Å; N44-L48 WeakPolarHBondContact O-CG 3.5Å; N44-L48 PolarHBondContact O-N 3.14Å; I45-L48 PolarHBondContact O-N 3.31Å; L48-V51 PolarHBondContact O-N 2.98Å; L48-R52 WeakPolarHBondContact O-CB 2.81Å; L48-R52 PolarHBondContact O-N 2.66Å
49	L	74.9	Confident	70.4	Confident	88 Å²	88	66.2 Å²	66.2	46%	0.461	33%	0.325	S	S	.	.	H	α-helix	trans	-64.3	-44.5	173.4	-71.5	172.3	0	0	0	110.9	I45 E46 V51 R52 D53	I45-L49 HydrophobicContact CG2-CD1 3.84Å; I45-L49 HydrophobicContact CG2-CG 4.28Å; I45-L49 WeakPolarHBondContact O-CB 3.44Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 3.48Å; I45-L49 PolarHBondContact O-N 2.82Å; E46-L49 PolarHBondContact O-N 2.96Å; L49-V51 VanDerWaalsContact C-N 3.32Å; L49-V51 PolarHBondContact O-N 3.39Å; L49-R52 WeakPolarHBondContact O-CB 3.31Å; L49-R52 PolarHBondContact O-N 3.42Å; L49-R52 VanDerWaalsContact O-N 3.14Å; L49-D53 PolarHBondContact O-N 3.29Å
50	S	71.2	Confident	70.8	Confident	24 Å²	24	62 Å²	62	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-36.7	176.8	-57.9	0	0	0	0	112.6	E46 L47 G54	E46-S50 WeakPolarHBondContact O-CB 3.48Å; E46-S50 PolarHBondContact O-N 3.34Å; E46-S50 PolarHBondContact O-OG 2.95Å; L47-S50 PolarHBondContact O-N 3.4Å; S50-G54 PolarHBondContact O-N 2.87Å; S50-G54 VanDerWaalsContact O-N 3.17Å
51	V	75.9	Confident	70.5	Confident	9 Å²	9	64 Å²	64	6%	0.055	33%	0.326	C	S	.	.	H	α-helix	trans	-65.8	-43.5	172.6	170.3	0	0	0	0	110.6	M20 A23 L47 L48 L49 D53 G54 I55 L78	M20-V51 HydrophobicContact CB-CG1 4.42Å; M20-V51 HydrophobicContact CE-CG1 4Å; M20-V51 WeakPolarHBondContact CE-O 3.45Å; M20-V51 HydrophobicContact CG-CG1 4.45Å; A23-V51 HydrophobicContact CB-CG2 3.72Å; L47-V51 VanDerWaalsContact O-CG2 3.31Å; L47-V51 WeakPolarHBondContact O-CG2 3.41Å; L47-V51 PolarHBondContact O-N 3.45Å; L48-V51 PolarHBondContact O-N 2.98Å; L49-V51 VanDerWaalsContact C-N 3.32Å; L49-V51 PolarHBondContact O-N 3.39Å; V51-D53 PolarHBondContact O-N 2.92Å; V51-G54 PolarHBondContact O-N 3.26Å; V51-I55 HydrophobicContact CG1-CD1 4.28Å; V51-I55 WeakPolarHBondContact O-CG1 3.37Å; V51-I55 PolarHBondContact O-N 2.75Å; V51-L78 HydrophobicContact CG2-CD1 3.98Å
52	R	76.8	Confident	69.9	Low	145 Å²	145	65.8 Å²	65.8	55%	0.547	34%	0.335	S	S	.	.	H	α-helix	trans	-59.9	-46.3	177	178.7	-175.9	168	-176.2	-5.2	111.7	L48 L49 G54 I55 E56	L48-R52 WeakPolarHBondContact O-CB 2.81Å; L48-R52 PolarHBondContact O-N 2.66Å; L49-R52 WeakPolarHBondContact O-CB 3.31Å; L49-R52 PolarHBondContact O-N 3.42Å; L49-R52 VanDerWaalsContact O-N 3.14Å; R52-G54 PolarHBondContact O-N 2.95Å; R52-I55 WeakPolarHBondContact O-CB 3.5Å; R52-I55 PolarHBondContact O-N 3.21Å; R52-E56 IonicContact CZ-OE1 3.84Å; R52-E56 IonicContact NE-OE1 3.27Å; R52-E56 PolarHBondContact NE-OE1 3.5Å; R52-E56 IonicContact NH2-OE1 2.59Å; R52-E56 PolarHBondContact NH2-OE1 2.76Å; R52-E56 PolarHBondContact O-N 2.95Å
53	D	72	Confident	69.1	Low	81 Å²	81	70.9 Å²	70.9	43%	0.433	35%	0.353	S	S	.	.	H	α-helix	trans	-59.3	-38	177.2	-69.2	-8.3	0	0	0	111.1	L49 V51 E56 L57	L49-D53 PolarHBondContact O-N 3.29Å; V51-D53 PolarHBondContact O-N 2.92Å; D53-E56 PolarHBondContact O-N 3.04Å; D53-L57 WeakPolarHBondContact O-CG 3.38Å; D53-L57 PolarHBondContact O-N 2.95Å; D53-L57 VanDerWaalsContact O-N 3.09Å
54	G	70.7	Confident	68.8	Low	1 Å²	1	77.1 Å²	77.1	1%	0.01	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-39.8	172.3	0	0	0	0	0	113.8	S50 V51 R52 L57 L58	S50-G54 PolarHBondContact O-N 2.87Å; S50-G54 VanDerWaalsContact O-N 3.17Å; V51-G54 PolarHBondContact O-N 3.26Å; R52-G54 PolarHBondContact O-N 2.95Å; G54-L57 PolarHBondContact O-N 3.46Å; G54-L58 WeakPolarHBondContact O-CG 3.48Å; G54-L58 PolarHBondContact O-N 3.48Å; G54-L58 VanDerWaalsContact O-N 3.11Å
55	I	75.1	Confident	68.2	Low	69 Å²	69	80.2 Å²	80.2	35%	0.354	40%	0.395	S	S	.	.	H	α-helix	trans	-64	-49	174.5	-63.5	172.7	0	0	0	110.1	M20 V51 R52 L57 L58 E59	M20-I55 HydrophobicContact CE-CB 4.32Å; M20-I55 HydrophobicContact CE-CD1 4.23Å; M20-I55 HydrophobicContact CE-CG1 3.27Å; V51-I55 HydrophobicContact CG1-CD1 4.28Å; V51-I55 WeakPolarHBondContact O-CG1 3.37Å; V51-I55 PolarHBondContact O-N 2.75Å; R52-I55 WeakPolarHBondContact O-CB 3.5Å; R52-I55 PolarHBondContact O-N 3.21Å; I55-L57 PolarHBondContact O-N 2.9Å; I55-L58 PolarHBondContact O-N 3.46Å; I55-E59 HydrophobicContact CG2-CG 4.04Å; I55-E59 WeakPolarHBondContact O-CB 3.31Å; I55-E59 WeakPolarHBondContact O-CG 3.11Å; I55-E59 PolarHBondContact O-N 3.44Å
56	E	76.1	Confident	67.7	Low	93 Å²	93	75.8 Å²	75.8	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-59.9	-35	-179	-70.7	-175.3	-171.5	0	0	111.6	R52 D53 K60	R52-E56 IonicContact CZ-OE1 3.84Å; R52-E56 IonicContact NE-OE1 3.27Å; R52-E56 PolarHBondContact NE-OE1 3.5Å; R52-E56 IonicContact NH2-OE1 2.59Å; R52-E56 PolarHBondContact NH2-OE1 2.76Å; R52-E56 PolarHBondContact O-N 2.95Å; D53-E56 PolarHBondContact O-N 3.04Å; E56-K60 PolarHBondContact O-N 2.53Å
57	L	71.1	Confident	67.6	Low	22 Å²	22	74 Å²	74	12%	0.115	37%	0.37	C	S	.	.	H	α-helix	trans	-70.9	-35.6	173.9	-74.1	170.8	0	0	0	113.6	D53 G54 I55 K60 P66 E70 A74	D53-L57 WeakPolarHBondContact O-CG 3.38Å; D53-L57 PolarHBondContact O-N 2.95Å; D53-L57 VanDerWaalsContact O-N 3.09Å; G54-L57 PolarHBondContact O-N 3.46Å; I55-L57 PolarHBondContact O-N 2.9Å; L57-K60 HydrophobicContact CD2-CD 4.4Å; L57-P66 HydrophobicContact CD2-CB 4.4Å; L57-E70 HydrophobicContact CD2-CB 4.43Å; L57-A74 HydrophobicContact CD1-CB 3.5Å
58	L	70	Confident	67.4	Low	22 Å²	22	77.9 Å²	77.9	12%	0.115	39%	0.388	C	S	.	.	H	α-helix	trans	-77.2	-24.6	177.1	-71.4	172.7	0	0	0	112.9	I2 W5 L16 M20 G54 I55	I2-L58 HydrophobicContact CD1-CD2 3.96Å; W5-L58 HydrophobicContact CH2-CD2 3.91Å; W5-L58 HydrophobicContact CZ3-CD2 4.1Å; L16-L58 HydrophobicContact CD2-CD1 4.46Å; L16-L58 HydrophobicContact CD2-CG 4.36Å; M20-L58 HydrophobicContact SD-CD1 4.05Å; G54-L58 WeakPolarHBondContact O-CG 3.48Å; G54-L58 PolarHBondContact O-N 3.48Å; G54-L58 VanDerWaalsContact O-N 3.11Å; I55-L58 PolarHBondContact O-N 3.46Å
59	E	69	Low	66.7	Low	128 Å²	128	78.1 Å²	78.1	60%	0.598	39%	0.39	S	S	*	.	H	α-helix	trans	-87	-9	178	-73.4	-173.7	165.9	0	0	114	M1 I55 S61	M1-E59 HydrophobicContact CE-CG 4.48Å; I55-E59 HydrophobicContact CG2-CG 4.04Å; I55-E59 WeakPolarHBondContact O-CB 3.31Å; I55-E59 WeakPolarHBondContact O-CG 3.11Å; I55-E59 PolarHBondContact O-N 3.44Å; E59-S61 PolarHBondContact O-N 2.93Å; E59-S61 VanDerWaalsContact O-N 3.13Å
60	K	65.8	Low	66.3	Low	85 Å²	85	77.6 Å²	77.6	37%	0.37	39%	0.385	S	S	.	.	S	Bend	trans	-55.3	121.4	174.8	-82.5	-179.1	-176.4	175.7	0	110.3	E56 L57 E70	E56-K60 PolarHBondContact O-N 2.53Å; L57-K60 HydrophobicContact CD2-CD 4.4Å; K60-E70 IonicContact NZ-OE2 3.8Å; K60-E70 PolarHBondContact NZ-OE2 2.91Å
61	S	52.7	Low	66.2	Low	80 Å²	80	76.4 Å²	76.4	56%	0.559	38%	0.377	S	S	*	.			trans	-52.6	145.7	179.7	46.2	0	0	0	0	112.6	E59 E63 K64	E59-S61 PolarHBondContact O-N 2.93Å; E59-S61 VanDerWaalsContact O-N 3.13Å; S61-E63 PolarHBondContact O-N 2.87Å; S61-K64 PolarHBondContact O-N 3.43Å
62	L	52.8	Low	65.8	Low	122 Å²	122	77.5 Å²	77.5	64%	0.639	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-23.1	-175.3	-121.9	98.2	0	0	0	115.4	K64 L65	L62-K64 VanDerWaalsContact C-N 3.34Å; L62-L65 WeakPolarHBondContact O-CD1 3.45Å
63	E	51.2	Low	65.4	Low	185 Å²	185	73.4 Å²	73.4	86%	0.864	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-15.5	179.2	-64.4	-175.9	168.3	0	0	114.4	S61	S61-E63 PolarHBondContact O-N 2.87Å
64	K	57.5	Low	65.2	Low	160 Å²	160	70.4 Å²	70.4	70%	0.696	36%	0.36	S	S	*	.	S	Bend	trans	-131.3	73.5	175.3	-70.1	-176.3	-179.1	177.8	0	109.4	S61 L62	S61-K64 PolarHBondContact O-N 3.43Å; L62-K64 VanDerWaalsContact C-N 3.34Å
65	L	59.4	Low	65.3	Low	89 Å²	89	70.7 Å²	70.7	47%	0.466	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-55.3	129.5	173.2	-83.3	104.7	0	0	0	109.5	W5 L9 L62 S67	W5-L65 HydrophobicContact CG-CD2 4.21Å; L9-L65 HydrophobicContact CD1-CD2 3.85Å; L62-L65 WeakPolarHBondContact O-CD1 3.45Å; L65-S67 PolarHBondContact O-N 3Å
66	P	61.4	Low	65	Low	5 Å²	5	67.6 Å²	67.6	3%	0.032	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-59.5	138.7	173.2	24.2	-31.9	0	0	0	109.6	W5 L57 L71	W5-P66 HydrophobicContact CH2-CG 3.85Å; W5-P66 HydrophobicContact CZ2-CG 4.28Å; W5-P66 HydrophobicContact CZ3-CG 4.31Å; L57-P66 HydrophobicContact CD2-CB 4.4Å; P66-L71 HydrophobicContact CB-CD1 3.97Å; P66-L71 HydrophobicContact CG-CD1 3.73Å
67	S	67.6	Low	64.5	Low	50 Å²	50	67.3 Å²	67.3	35%	0.35	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-61.9	146.6	173.7	63	0	0	0	0	109.6	L65 D69 E70 L71	L65-S67 PolarHBondContact O-N 3Å; S67-D69 PolarHBondContact O-N 3.18Å; S67-E70 WeakPolarHBondContact O-CB 3.02Å; S67-E70 PolarHBondContact O-N 3.05Å; S67-E70 VanDerWaalsContact O-N 3.09Å; S67-E70 WeakPolarHBondContact OG-CB 3.25Å; S67-E70 VanDerWaalsContact OG-CG 3.26Å; S67-E70 WeakPolarHBondContact OG-CG 3.1Å; S67-E70 PolarHBondContact OG-N 3.33Å; S67-E70 PolarHBondContact OG-OE1 2.81Å; S67-L71 PolarHBondContact O-N 3.35Å
68	Q	68.7	Low	64.5	Low	82 Å²	82	66.3 Å²	66.3	38%	0.383	34%	0.338	S	S	.	.	H	α-helix	trans	-56.3	-33.5	177	-178.2	172.8	-11.1	0	0	111.1	L9 L71 D72	L9-Q68 HydrophobicContact CD2-CB 4.36Å; Q68-L71 PolarHBondContact O-N 2.92Å; Q68-D72 WeakPolarHBondContact O-CB 3.21Å; Q68-D72 PolarHBondContact O-N 3.31Å
69	D	61.3	Low	64.7	Low	100 Å²	100	67.6 Å²	67.6	54%	0.535	34%	0.341	S	S	.	.	H	α-helix	trans	-67	-39	177.7	-62.4	-23.5	0	0	0	112.5	S67 T73	S67-D69 PolarHBondContact O-N 3.18Å; D69-T73 WeakPolarHBondContact O-CB 2.89Å; D69-T73 PolarHBondContact O-N 3.49Å; D69-T73 PolarHBondContact O-OG1 3.03Å
70	E	66.6	Low	64.7	Low	77 Å²	77	62 Å²	62	36%	0.36	32%	0.315	S	S	.	.	H	α-helix	trans	-62.2	-44.5	173.1	-83.4	164.3	-115.2	0	0	111.2	L57 K60 S67 T73 A74	L57-E70 HydrophobicContact CD2-CB 4.43Å; K60-E70 IonicContact NZ-OE2 3.8Å; K60-E70 PolarHBondContact NZ-OE2 2.91Å; S67-E70 WeakPolarHBondContact O-CB 3.02Å; S67-E70 PolarHBondContact O-N 3.05Å; S67-E70 VanDerWaalsContact O-N 3.09Å; S67-E70 WeakPolarHBondContact OG-CB 3.25Å; S67-E70 VanDerWaalsContact OG-CG 3.26Å; S67-E70 WeakPolarHBondContact OG-CG 3.1Å; S67-E70 PolarHBondContact OG-N 3.33Å; S67-E70 PolarHBondContact OG-OE1 2.81Å; E70-T73 PolarHBondContact O-N 3.36Å; E70-A74 WeakPolarHBondContact O-CB 3.4Å; E70-A74 PolarHBondContact O-N 3.22Å
71	L	69.4	Low	64.7	Low	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-67.5	-43	-179.4	-132	87.8	0	0	0	111.5	W5 V12 P66 S67 Q68 T73 A74 L75	W5-L71 HydrophobicContact CZ3-CD1 4.34Å; W5-L71 HydrophobicContact CZ3-CD2 4.42Å; V12-L71 HydrophobicContact CB-CD2 3.64Å; V12-L71 HydrophobicContact CG1-CB 4.04Å; V12-L71 HydrophobicContact CG1-CD2 3.57Å; V12-L71 HydrophobicContact CG1-CG 4.13Å; P66-L71 HydrophobicContact CB-CD1 3.97Å; P66-L71 HydrophobicContact CG-CD1 3.73Å; S67-L71 PolarHBondContact O-N 3.35Å; Q68-L71 PolarHBondContact O-N 2.92Å; L71-T73 VanDerWaalsContact C-N 3.33Å; L71-T73 PolarHBondContact O-N 3.41Å; L71-A74 PolarHBondContact O-N 2.98Å; L71-L75 VanDerWaalsContact O-CB 3.28Å; L71-L75 WeakPolarHBondContact O-CB 3.37Å; L71-L75 PolarHBondContact O-N 3.25Å
72	D	67.2	Low	65.6	Low	32 Å²	32	54.6 Å²	54.6	17%	0.171	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-36.4	177.9	-76	-22	0	0	0	111.3	V12 Q68 L75 A76	V12-D72 WeakPolarHBondContact CG1-OD1 3.45Å; Q68-D72 WeakPolarHBondContact O-CB 3.21Å; Q68-D72 PolarHBondContact O-N 3.31Å; D72-L75 PolarHBondContact O-N 3.05Å; D72-A76 WeakPolarHBondContact O-CB 3.4Å; D72-A76 PolarHBondContact O-N 3.28Å
73	T	67.6	Low	66.4	Low	59 Å²	59	48.9 Å²	48.9	36%	0.362	24%	0.244	S	C	.	.	H	α-helix	trans	-68.4	-45.2	176.1	-54.5	0	0	0	0	111.7	D69 E70 L71 L75 A76 K77	D69-T73 WeakPolarHBondContact O-CB 2.89Å; D69-T73 PolarHBondContact O-N 3.49Å; D69-T73 PolarHBondContact O-OG1 3.03Å; E70-T73 PolarHBondContact O-N 3.36Å; L71-T73 VanDerWaalsContact C-N 3.33Å; L71-T73 PolarHBondContact O-N 3.41Å; T73-L75 VanDerWaalsContact C-N 3.29Å; T73-L75 PolarHBondContact O-N 3.48Å; T73-A76 PolarHBondContact O-N 3.39Å; T73-K77 WeakPolarHBondContact O-CG 3.34Å; T73-K77 PolarHBondContact O-N 3.04Å
74	A	67.6	Low	67.1	Low	17 Å²	17	41 Å²	41	14%	0.14	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-39.1	176.3	0	0	0	0	0	111.7	L16 L57 E70 L71 K77 L78	L16-A74 HydrophobicContact CD1-CB 4.46Å; L57-A74 HydrophobicContact CD1-CB 3.5Å; E70-A74 WeakPolarHBondContact O-CB 3.4Å; E70-A74 PolarHBondContact O-N 3.22Å; L71-A74 PolarHBondContact O-N 2.98Å; A74-K77 PolarHBondContact O-N 3.24Å; A74-L78 WeakPolarHBondContact O-CB 3.49Å; A74-L78 PolarHBondContact O-N 3.46Å
75	L	72.4	Confident	67.6	Low	7 Å²	7	33.5 Å²	33.5	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-65.8	-41.5	176.1	-158.4	162.4	0	0	0	111.3	V12 L16 L19 L71 D72 T73 L78 R79	V12-L75 HydrophobicContact CG1-CD1 3.56Å; L16-L75 HydrophobicContact CD1-CB 4.14Å; L16-L75 HydrophobicContact CD1-CG 4.39Å; L19-L75 HydrophobicContact CD1-CD2 3.71Å; L19-L75 HydrophobicContact CD1-CG 3.96Å; L71-L75 VanDerWaalsContact O-CB 3.28Å; L71-L75 WeakPolarHBondContact O-CB 3.37Å; L71-L75 PolarHBondContact O-N 3.25Å; D72-L75 PolarHBondContact O-N 3.05Å; T73-L75 VanDerWaalsContact C-N 3.29Å; T73-L75 PolarHBondContact O-N 3.48Å; L75-L78 PolarHBondContact O-N 2.99Å; L75-R79 HydrophobicContact CD2-CG 4.07Å; L75-R79 VanDerWaalsContact CD2-NH1 3.35Å; L75-R79 WeakPolarHBondContact O-CG 3.17Å; L75-R79 PolarHBondContact O-N 3.22Å
76	A	68.8	Low	68	Low	4 Å²	4	29.7 Å²	29.7	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-61.2	-46.9	175.5	0	0	0	0	0	112.4	D72 T73 L78 R79 H80 S113 S116	D72-A76 WeakPolarHBondContact O-CB 3.4Å; D72-A76 PolarHBondContact O-N 3.28Å; T73-A76 PolarHBondContact O-N 3.39Å; A76-L78 PolarHBondContact O-N 3.39Å; A76-R79 PolarHBondContact O-N 3.49Å; A76-H80 PolarHBondContact O-N 3.02Å; A76-S113 PolarHBondContact O-OG 3.37Å; A76-S116 WeakPolarHBondContact CB-OG 3.41Å
77	K	66.6	Low	68.2	Low	88 Å²	88	30.2 Å²	30.2	38%	0.383	16%	0.157	S	C	.	.	H	α-helix	trans	-59.1	-47.6	176.1	-74.6	-174.8	174.7	-166.8	0	111.8	T73 A74 R79 H80 V81	T73-K77 WeakPolarHBondContact O-CG 3.34Å; T73-K77 PolarHBondContact O-N 3.04Å; A74-K77 PolarHBondContact O-N 3.24Å; K77-R79 VanDerWaalsContact C-N 3.35Å; K77-R79 PolarHBondContact O-N 3.04Å; K77-H80 WeakPolarHBondContact O-CB 3.36Å; K77-H80 PolarHBondContact O-N 2.93Å; K77-H80 VanDerWaalsContact O-N 3.13Å; K77-V81 WeakPolarHBondContact O-CG2 3.03Å; K77-V81 PolarHBondContact O-N 2.73Å
78	L	71	Confident	68	Low	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-63.8	-39.8	-179.1	-165.9	67.8	0	0	0	112.1	L16 L19 M20 A23 V51 A74 L75 A76 H80 I82	L16-L78 HydrophobicContact CD1-CD2 4.06Å; L19-L78 HydrophobicContact CB-CD2 3.56Å; L19-L78 HydrophobicContact CB-CG 4.31Å; M20-L78 HydrophobicContact CB-CD2 4.46Å; M20-L78 HydrophobicContact CG-CD2 3.65Å; A23-L78 HydrophobicContact CB-CD1 4.36Å; V51-L78 HydrophobicContact CG2-CD1 3.98Å; A74-L78 WeakPolarHBondContact O-CB 3.49Å; A74-L78 PolarHBondContact O-N 3.46Å; L75-L78 PolarHBondContact O-N 2.99Å; A76-L78 PolarHBondContact O-N 3.39Å; L78-H80 VanDerWaalsContact C-N 3.34Å; L78-H80 PolarHBondContact O-N 3.28Å; L78-I82 HydrophobicContact CG-CD1 4.18Å; L78-I82 WeakPolarHBondContact O-CD1 3.39Å; L78-I82 VanDerWaalsContact O-CG1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.46Å; L78-I82 PolarHBondContact O-N 2.93Å
79	R	73.3	Confident	67.7	Low	49 Å²	49	28.1 Å²	28.1	19%	0.185	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-40.7	172.7	-77.2	176.9	172.1	156.8	2.2	112.5	L19 L75 A76 K77 A83 S112	L19-R79 HydrophobicContact CD1-CG 3.84Å; L19-R79 HydrophobicContact CD2-CG 4.13Å; L75-R79 HydrophobicContact CD2-CG 4.07Å; L75-R79 VanDerWaalsContact CD2-NH1 3.35Å; L75-R79 WeakPolarHBondContact O-CG 3.17Å; L75-R79 PolarHBondContact O-N 3.22Å; A76-R79 PolarHBondContact O-N 3.49Å; K77-R79 VanDerWaalsContact C-N 3.35Å; K77-R79 PolarHBondContact O-N 3.04Å; R79-A83 WeakPolarHBondContact O-CB 3.49Å; R79-A83 PolarHBondContact O-N 3.22Å; R79-S112 VanDerWaalsContact CD-OG 3.3Å; R79-S112 WeakPolarHBondContact CD-OG 2.89Å; R79-S112 PolarHBondContact NE-OG 2.93Å; R79-S112 VanDerWaalsContact NH1-CB 3.35Å; R79-S112 PolarHBondContact NH1-O 2.94Å; R79-S112 PolarHBondContact NH1-OG 3.23Å
80	H	68.9	Low	67.8	Low	9 Å²	9	23.8 Å²	23.8	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-63.4	-49	178.5	176.9	-114.1	0	0	0	111.6	A76 K77 L78 I82 A83 L84 E181	A76-H80 PolarHBondContact O-N 3.02Å; K77-H80 WeakPolarHBondContact O-CB 3.36Å; K77-H80 PolarHBondContact O-N 2.93Å; K77-H80 VanDerWaalsContact O-N 3.13Å; L78-H80 VanDerWaalsContact C-N 3.34Å; L78-H80 PolarHBondContact O-N 3.28Å; H80-I82 PolarHBondContact O-N 3.45Å; H80-A83 WeakPolarHBondContact O-CB 3.29Å; H80-A83 PolarHBondContact O-N 3.14Å; H80-L84 PolarHBondContact O-N 3.47Å; H80-E181 IonicContact ND1-OE1 2.87Å; H80-E181 IonicContact ND1-OE2 3.35Å
81	V	67	Low	67.2	Low	11 Å²	11	27.8 Å²	27.8	7%	0.067	14%	0.141	C	C	.	.	H	α-helix	trans	-67.2	-35.2	-179.8	-171.4	0	0	0	0	112	E46 L47 K77 L84 V85	E46-V81 HydrophobicContact CB-CG1 4.42Å; L47-V81 HydrophobicContact CB-CG1 3.85Å; L47-V81 HydrophobicContact CD1-CB 4.19Å; L47-V81 HydrophobicContact CD1-CG1 3.65Å; L47-V81 HydrophobicContact CG-CG1 4.26Å; K77-V81 WeakPolarHBondContact O-CG2 3.03Å; K77-V81 PolarHBondContact O-N 2.73Å; V81-L84 WeakPolarHBondContact O-CB 3.35Å; V81-L84 PolarHBondContact O-N 3.29Å; V81-V85 WeakPolarHBondContact O-CG2 3.37Å; V81-V85 PolarHBondContact O-N 2.77Å
82	I	71.1	Confident	66.4	Low	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-43	172.7	-69	166.1	0	0	0	111.1	L19 A23 L26 L47 L78 H80 L84 V85 Q86 M109	L19-I82 HydrophobicContact CB-CD1 4.3Å; L19-I82 HydrophobicContact CD2-CD1 3.75Å; A23-I82 HydrophobicContact CB-CD1 4.21Å; A23-I82 HydrophobicContact CB-CG1 4.26Å; L26-I82 HydrophobicContact CD1-CG1 4.46Å; L26-I82 HydrophobicContact CD1-CG2 3.72Å; L47-I82 HydrophobicContact CD1-CG1 3.98Å; L78-I82 HydrophobicContact CG-CD1 4.18Å; L78-I82 WeakPolarHBondContact O-CD1 3.39Å; L78-I82 VanDerWaalsContact O-CG1 3.25Å; L78-I82 WeakPolarHBondContact O-CG1 3.46Å; L78-I82 PolarHBondContact O-N 2.93Å; H80-I82 PolarHBondContact O-N 3.45Å; I82-L84 VanDerWaalsContact C-N 3.34Å; I82-L84 PolarHBondContact O-N 3.07Å; I82-V85 PolarHBondContact O-N 2.99Å; I82-Q86 WeakPolarHBondContact O-CG 3.37Å; I82-Q86 PolarHBondContact O-N 3.23Å; I82-M109 HydrophobicContact CB-SD 3.95Å; I82-M109 HydrophobicContact CG2-CE 3.81Å; I82-M109 HydrophobicContact CG2-SD 3.46Å; I82-M109 WeakPolarHBondContact CG2-SD 3.35Å
83	A	69.4	Low	65.8	Low	2 Å²	2	36.1 Å²	36.1	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-40.9	177	0	0	0	0	0	111.7	R79 H80 Q86 M87 M109 L110	R79-A83 WeakPolarHBondContact O-CB 3.49Å; R79-A83 PolarHBondContact O-N 3.22Å; H80-A83 WeakPolarHBondContact O-CB 3.29Å; H80-A83 PolarHBondContact O-N 3.14Å; A83-Q86 PolarHBondContact O-N 3.48Å; A83-M87 WeakPolarHBondContact O-CB 3.43Å; A83-M87 WeakPolarHBondContact O-CG 3.16Å; A83-M87 PolarHBondContact O-N 3.13Å; A83-M109 HydrophobicContact CB-CB 4.34Å; A83-L110 HydrophobicContact CB-CD1 4.5Å; A83-L110 HydrophobicContact CB-CD2 3.98Å; A83-L110 HydrophobicContact CB-CG 3.97Å
84	L	66.6	Low	65	Low	20 Å²	20	37 Å²	37	11%	0.105	19%	0.189	C	C	.	.	H	α-helix	trans	-57	-48.7	173.6	-84	167.6	0	0	0	112.2	L43 H80 V81 I82 Q86 M87 T88 E174	L43-L84 HydrophobicContact CD2-CB 4.36Å; H80-L84 PolarHBondContact O-N 3.47Å; V81-L84 WeakPolarHBondContact O-CB 3.35Å; V81-L84 PolarHBondContact O-N 3.29Å; I82-L84 VanDerWaalsContact C-N 3.34Å; I82-L84 PolarHBondContact O-N 3.07Å; L84-Q86 VanDerWaalsContact C-N 3.33Å; L84-Q86 PolarHBondContact O-N 2.85Å; L84-M87 PolarHBondContact O-N 3.32Å; L84-T88 PolarHBondContact O-N 3.2Å; L84-E174 HydrophobicContact CD2-CG 3.52Å; L84-E174 WeakPolarHBondContact CD2-OE1 3.36Å; L84-E174 HydrophobicContact CG-CG 4.41Å
85	V	67.9	Low	64.2	Low	1 Å²	1	39.7 Å²	39.7	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-61.6	-43.8	177.8	172.3	0	0	0	0	110.9	L26 N30 L43 L47 V81 I82 M87 T88 Q89	L26-V85 HydrophobicContact CD2-CG1 4.08Å; N30-V85 WeakPolarHBondContact ND2-CG1 3.25Å; L43-V85 HydrophobicContact CB-CG2 4.34Å; L47-V85 HydrophobicContact CD1-CG2 4.12Å; V81-V85 WeakPolarHBondContact O-CG2 3.37Å; V81-V85 PolarHBondContact O-N 2.77Å; I82-V85 PolarHBondContact O-N 2.99Å; V85-M87 VanDerWaalsContact C-N 3.34Å; V85-M87 PolarHBondContact O-N 3.41Å; V85-T88 PolarHBondContact O-N 2.9Å; V85-T88 PolarHBondContact O-OG1 2.89Å; V85-Q89 WeakPolarHBondContact O-CG 3.34Å; V85-Q89 PolarHBondContact O-N 3.33Å
86	Q	68.4	Low	63.5	Low	9 Å²	9	41.8 Å²	41.8	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-37.9	177.1	-71.7	174.9	2.3	0	0	112.2	I82 A83 L84 Q89 M90	I82-Q86 WeakPolarHBondContact O-CG 3.37Å; I82-Q86 PolarHBondContact O-N 3.23Å; A83-Q86 PolarHBondContact O-N 3.48Å; L84-Q86 VanDerWaalsContact C-N 3.33Å; L84-Q86 PolarHBondContact O-N 2.85Å; Q86-Q89 WeakPolarHBondContact O-CB 3.47Å; Q86-Q89 PolarHBondContact O-N 3.33Å; Q86-M90 WeakPolarHBondContact O-CG 3.4Å; Q86-M90 PolarHBondContact O-N 2.85Å
87	M	64.5	Low	63.1	Low	16 Å²	16	47.1 Å²	47.1	8%	0.079	26%	0.261	C	S	.	.	H	α-helix	trans	-64.3	-40	176.4	-69.8	-108.8	-67.5	0	0	112	A83 L84 V85 Q89 M90 L170 L171 E174	A83-M87 WeakPolarHBondContact O-CB 3.43Å; A83-M87 WeakPolarHBondContact O-CG 3.16Å; A83-M87 PolarHBondContact O-N 3.13Å; L84-M87 PolarHBondContact O-N 3.32Å; V85-M87 VanDerWaalsContact C-N 3.34Å; V85-M87 PolarHBondContact O-N 3.41Å; M87-Q89 PolarHBondContact O-N 2.71Å; M87-M90 WeakPolarHBondContact O-CB 3.1Å; M87-M90 PolarHBondContact O-N 3.05Å; M87-L170 HydrophobicContact CE-CB 3.89Å; M87-L170 HydrophobicContact SD-CB 3.47Å; M87-L170 WeakPolarHBondContact SD-CB 3.44Å; M87-L170 HydrophobicContact SD-CD1 4.09Å; M87-L170 HydrophobicContact SD-CG 4.38Å; M87-L171 HydrophobicContact CE-CB 4.48Å; M87-L171 HydrophobicContact CE-CD2 4.14Å; M87-L171 HydrophobicContact CE-CG 3.89Å; M87-E174 HydrophobicContact CE-CB 4.47Å; M87-E174 WeakPolarHBondContact CE-OE2 3.46Å
88	T	63.4	Low	63	Low	61 Å²	61	45.9 Å²	45.9	37%	0.374	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-25.2	174.8	59.8	0	0	0	0	113.7	L43 L84 V85 M90	L43-T88 HydrophobicContact CD1-CG2 3.63Å; L84-T88 PolarHBondContact O-N 3.2Å; V85-T88 PolarHBondContact O-N 2.9Å; V85-T88 PolarHBondContact O-OG1 2.89Å; T88-M90 VanDerWaalsContact C-N 3.34Å
89	Q	63.8	Low	62.7	Low	28 Å²	28	46.2 Å²	46.2	13%	0.131	26%	0.263	C	S	.	.	H	α-helix	trans	-77.6	-22.1	172.6	-65.8	173.3	-4	0	0	112	N30 V85 Q86 M87 E91 E92 Y93	N30-Q89 PolarHBondContact OD1-NE2 2.7Å; V85-Q89 WeakPolarHBondContact O-CG 3.34Å; V85-Q89 PolarHBondContact O-N 3.33Å; Q86-Q89 WeakPolarHBondContact O-CB 3.47Å; Q86-Q89 PolarHBondContact O-N 3.33Å; M87-Q89 PolarHBondContact O-N 2.71Å; Q89-E91 PolarHBondContact O-N 2.82Å; Q89-E92 PolarHBondContact O-N 2.9Å; Q89-Y93 WeakPolarHBondContact O-CD2 3.35Å
90	M	62.5	Low	62.3	Low	8 Å²	8	47.5 Å²	47.5	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-74	-23.4	-177.5	-64.4	-124.3	-66.1	0	0	113.8	Q86 M87 T88 E92 Y93 L99 M102 I103 V167	Q86-M90 WeakPolarHBondContact O-CG 3.4Å; Q86-M90 PolarHBondContact O-N 2.85Å; M87-M90 WeakPolarHBondContact O-CB 3.1Å; M87-M90 PolarHBondContact O-N 3.05Å; T88-M90 VanDerWaalsContact C-N 3.34Å; M90-E92 PolarHBondContact O-N 3.42Å; M90-Y93 PolarHBondContact O-N 3.04Å; M90-L99 HydrophobicContact CB-CD1 3.83Å; M90-L99 HydrophobicContact CE-CD1 4.45Å; M90-L99 HydrophobicContact CG-CD1 4.1Å; M90-L99 HydrophobicContact SD-CD1 3.54Å; M90-L99 VanDerWaalsContact SD-CD1 3.54Å; M90-L99 HydrophobicContact SD-CG 4.29Å; M90-M102 HydrophobicContact CG-CB 4.04Å; M90-M102 HydrophobicContact CG-CE 4.35Å; M90-M102 HydrophobicContact CG-SD 4.41Å; M90-M102 HydrophobicContact SD-CB 3.28Å; M90-M102 WeakPolarHBondContact SD-CB 3.49Å; M90-M102 HydrophobicContact SD-CE 4.45Å; M90-I103 HydrophobicContact CE-CB 4.12Å; M90-I103 HydrophobicContact CE-CD1 4.27Å; M90-I103 HydrophobicContact CE-CG1 3.18Å; M90-I103 HydrophobicContact SD-CG1 3.74Å; M90-V167 HydrophobicContact CE-CG2 3.77Å
91	E	54.4	Low	62.3	Low	161 Å²	161	53.9 Å²	53.9	75%	0.752	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-23.1	174.3	-69.8	-172.4	160.8	0	0	112.6	Q89	Q89-E91 PolarHBondContact O-N 2.82Å
92	E	52.8	Low	62.3	Low	104 Å²	104	55 Å²	55	49%	0.486	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-14.7	-175.4	-70.1	-178.4	173.6	0	0	114.4	Q89 M90	Q89-E92 PolarHBondContact O-N 2.9Å; M90-E92 PolarHBondContact O-N 3.42Å
93	Y	54.5	Low	62.2	Low	104 Å²	104	55.7 Å²	55.7	41%	0.408	31%	0.308	S	S	.	.			trans	-116.2	53.6	-173.8	-68.5	-80.8	0	0	0	113.7	Q89 M90 G95 M102	Q89-Y93 WeakPolarHBondContact O-CD2 3.35Å; M90-Y93 PolarHBondContact O-N 3.04Å; Y93-G95 PolarHBondContact O-N 3.38Å; Y93-M102 HydrophobicContact CD2-CE 4.08Å; Y93-M102 HydrophobicContact CG-CE 4.39Å
94	A	49.8	Very low	62.3	Low	77 Å²	77	60.9 Å²	60.9	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	23.2	-178.4	0	0	0	0	0	116
95	G	50.8	Low	62.5	Low	73 Å²	73	64.1 Å²	64.1	75%	0.753	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159	16.9	-172.8	0	0	0	0	0	118.8	Y93	Y93-G95 PolarHBondContact O-N 3.38Å
96	S	57.9	Low	62.5	Low	52 Å²	52	64.1 Å²	64.1	36%	0.364	34%	0.344	S	S	.	.	S	Bend	trans	-130	147.7	-174.3	163.6	0	0	0	0	111.8	T98 L99	S96-T98 VanDerWaalsContact CB-OG1 3.28Å; S96-T98 WeakPolarHBondContact CB-OG1 3.26Å; S96-T98 PolarHBondContact O-N 3.05Å; S96-T98 WeakPolarHBondContact OG-CB 3.37Å; S96-T98 WeakPolarHBondContact OG-CG2 3.45Å; S96-T98 PolarHBondContact OG-N 3.35Å; S96-T98 VanDerWaalsContact OG-N 3.15Å; S96-T98 PolarHBondContact OG-OG1 2.8Å; S96-L99 WeakPolarHBondContact O-CB 3.44Å; S96-L99 PolarHBondContact O-N 2.95Å
97	D	60	Low	62.6	Low	115 Å²	115	63.9 Å²	63.9	62%	0.615	34%	0.343	S	S	*	.	H	α-helix	trans	-55.2	-18.3	171.6	-83.4	-37.3	0	0	0	112.9	L99 K100	D97-L99 VanDerWaalsContact C-N 3.27Å; D97-L99 PolarHBondContact O-N 3.27Å; D97-K100 PolarHBondContact O-N 3.12Å; D97-K100 IonicContact OD1-NZ 3.45Å; D97-K100 PolarHBondContact OD1-NZ 3.16Å
98	T	64.3	Low	63	Low	62 Å²	62	68 Å²	68	38%	0.38	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-30.3	171	57.6	0	0	0	0	113.1	S96 Q101 M102	S96-T98 VanDerWaalsContact CB-OG1 3.28Å; S96-T98 WeakPolarHBondContact CB-OG1 3.26Å; S96-T98 PolarHBondContact O-N 3.05Å; S96-T98 WeakPolarHBondContact OG-CB 3.37Å; S96-T98 WeakPolarHBondContact OG-CG2 3.45Å; S96-T98 PolarHBondContact OG-N 3.35Å; S96-T98 VanDerWaalsContact OG-N 3.15Å; S96-T98 PolarHBondContact OG-OG1 2.8Å; T98-Q101 PolarHBondContact O-N 3.41Å; T98-M102 WeakPolarHBondContact O-CG 3.47Å; T98-M102 PolarHBondContact O-N 3.2Å
99	L	65.2	Low	63.3	Low	8 Å²	8	65.7 Å²	65.7	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-66.4	-39.2	178.3	-169.7	73.8	0	0	0	111.4	M90 S96 D97 Q101 M102 I103 N163	M90-L99 HydrophobicContact CB-CD1 3.83Å; M90-L99 HydrophobicContact CE-CD1 4.45Å; M90-L99 HydrophobicContact CG-CD1 4.1Å; M90-L99 HydrophobicContact SD-CD1 3.54Å; M90-L99 VanDerWaalsContact SD-CD1 3.54Å; M90-L99 HydrophobicContact SD-CG 4.29Å; S96-L99 WeakPolarHBondContact O-CB 3.44Å; S96-L99 PolarHBondContact O-N 2.95Å; D97-L99 VanDerWaalsContact C-N 3.27Å; D97-L99 PolarHBondContact O-N 3.27Å; L99-Q101 VanDerWaalsContact C-N 3.32Å; L99-Q101 PolarHBondContact O-N 3.48Å; L99-M102 HydrophobicContact CD1-CE 4.36Å; L99-M102 PolarHBondContact O-N 3.1Å; L99-I103 HydrophobicContact CD2-CD1 4.39Å; L99-I103 HydrophobicContact CG-CD1 4.01Å; L99-I103 HydrophobicContact CG-CG1 4.48Å; L99-I103 WeakPolarHBondContact O-CB 3.44Å; L99-I103 VanDerWaalsContact O-CG1 3.25Å; L99-I103 WeakPolarHBondContact O-CG1 3.48Å; L99-I103 PolarHBondContact O-N 3.28Å; L99-N163 HydrophobicContact CD2-CB 3.79Å
100	K	65	Low	63.5	Low	76 Å²	76	64.6 Å²	64.6	33%	0.33	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-40.4	176.6	-70.8	175.7	-176.7	158.5	0	111.6	D97 F104 E159	D97-K100 PolarHBondContact O-N 3.12Å; D97-K100 IonicContact OD1-NZ 3.45Å; D97-K100 PolarHBondContact OD1-NZ 3.16Å; K100-F104 WeakPolarHBondContact O-CB 3.49Å; K100-F104 PolarHBondContact O-N 3.35Å; K100-E159 IonicContact NZ-OE1 2.95Å; K100-E159 PolarHBondContact NZ-OE1 2.95Å; K100-E159 IonicContact NZ-OE2 2.87Å; K100-E159 PolarHBondContact NZ-OE2 3.12Å
101	Q	69.2	Low	63.9	Low	144 Å²	144	66.7 Å²	66.7	67%	0.673	36%	0.359	S	S	*	.	H	α-helix	trans	-68.1	-40.2	177.4	-67.1	-176.9	-2.2	0	0	111.8	T98 L99 F104 K105	T98-Q101 PolarHBondContact O-N 3.41Å; L99-Q101 VanDerWaalsContact C-N 3.32Å; L99-Q101 PolarHBondContact O-N 3.48Å; Q101-F104 PolarHBondContact O-N 3.45Å; Q101-K105 WeakPolarHBondContact O-CB 3.45Å; Q101-K105 PolarHBondContact O-N 2.92Å
102	M	66.7	Low	64.6	Low	34 Å²	34	60.1 Å²	60.1	17%	0.167	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-42.2	175.7	-71.1	-169.1	-70.1	0	0	112.1	M90 Y93 T98 L99 F104 K105 A106	M90-M102 HydrophobicContact CG-CB 4.04Å; M90-M102 HydrophobicContact CG-CE 4.35Å; M90-M102 HydrophobicContact CG-SD 4.41Å; M90-M102 HydrophobicContact SD-CB 3.28Å; M90-M102 WeakPolarHBondContact SD-CB 3.49Å; M90-M102 HydrophobicContact SD-CE 4.45Å; Y93-M102 HydrophobicContact CD2-CE 4.08Å; Y93-M102 HydrophobicContact CG-CE 4.39Å; T98-M102 WeakPolarHBondContact O-CG 3.47Å; T98-M102 PolarHBondContact O-N 3.2Å; L99-M102 HydrophobicContact CD1-CE 4.36Å; L99-M102 PolarHBondContact O-N 3.1Å; M102-F104 PolarHBondContact O-N 2.64Å; M102-K105 PolarHBondContact O-N 3.38Å; M102-A106 WeakPolarHBondContact O-CB 3.38Å; M102-A106 PolarHBondContact O-N 3.39Å
103	I	68.5	Low	65.2	Low	14 Å²	14	55.2 Å²	55.2	7%	0.072	31%	0.307	C	S	.	.	H	α-helix	trans	-57.9	-48.9	172.4	-69.5	164.9	0	0	0	110.4	M90 L99 K105 A106 T107 V149 N163 L170	M90-I103 HydrophobicContact CE-CB 4.12Å; M90-I103 HydrophobicContact CE-CD1 4.27Å; M90-I103 HydrophobicContact CE-CG1 3.18Å; M90-I103 HydrophobicContact SD-CG1 3.74Å; L99-I103 HydrophobicContact CD2-CD1 4.39Å; L99-I103 HydrophobicContact CG-CD1 4.01Å; L99-I103 HydrophobicContact CG-CG1 4.48Å; L99-I103 WeakPolarHBondContact O-CB 3.44Å; L99-I103 VanDerWaalsContact O-CG1 3.25Å; L99-I103 WeakPolarHBondContact O-CG1 3.48Å; L99-I103 PolarHBondContact O-N 3.28Å; I103-K105 VanDerWaalsContact C-N 3.34Å; I103-K105 PolarHBondContact O-N 2.92Å; I103-A106 PolarHBondContact O-N 3.05Å; I103-T107 WeakPolarHBondContact O-CB 3.45Å; I103-T107 PolarHBondContact O-N 3.49Å; I103-T107 PolarHBondContact O-OG1 2.94Å; I103-V149 HydrophobicContact CG2-CG1 4.42Å; I103-N163 HydrophobicContact CD1-CB 4.09Å; I103-L170 HydrophobicContact CG2-CD1 4.19Å
104	F	71.9	Confident	65.7	Low	111 Å²	111	50.5 Å²	50.5	49%	0.487	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-43.5	-179.2	-177.1	-99.9	0	0	0	111.8	K100 Q101 M102 T107 L108	K100-F104 WeakPolarHBondContact O-CB 3.49Å; K100-F104 PolarHBondContact O-N 3.35Å; Q101-F104 PolarHBondContact O-N 3.45Å; M102-F104 PolarHBondContact O-N 2.64Å; F104-T107 PolarHBondContact O-N 2.95Å; F104-L108 HydrophobicContact CE1-CD1 4.18Å; F104-L108 HydrophobicContact CZ-CD1 4.2Å; F104-L108 WeakPolarHBondContact O-CB 3.49Å; F104-L108 PolarHBondContact O-N 3.22Å
105	K	70	Confident	66.5	Low	88 Å²	88	50.7 Å²	50.7	38%	0.383	28%	0.282	S	S	.	.	H	α-helix	trans	-64.7	-45.9	178.5	-166.7	175.9	-177.3	-173.1	0	111.9	E22 Q101 M102 I103 T107 L108 M109	E22-K105 WeakPolarHBondContact OE1-CE 3.26Å; E22-K105 IonicContact OE1-NZ 3.6Å; E22-K105 PolarHBondContact OE1-NZ 3.47Å; Q101-K105 WeakPolarHBondContact O-CB 3.45Å; Q101-K105 PolarHBondContact O-N 2.92Å; M102-K105 PolarHBondContact O-N 3.38Å; I103-K105 VanDerWaalsContact C-N 3.34Å; I103-K105 PolarHBondContact O-N 2.92Å; K105-T107 PolarHBondContact O-N 3.14Å; K105-L108 PolarHBondContact O-N 3.43Å; K105-M109 HydrophobicContact CG-CE 4.43Å; K105-M109 WeakPolarHBondContact O-CG 3.39Å; K105-M109 PolarHBondContact O-N 3.36Å
106	A	68.2	Low	67	Low	1 Å²	1	48.5 Å²	48.5	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-42.9	176.3	0	0	0	0	0	111.9	M102 I103 L108 M109 L110 L170	M102-A106 WeakPolarHBondContact O-CB 3.38Å; M102-A106 PolarHBondContact O-N 3.39Å; I103-A106 PolarHBondContact O-N 3.05Å; A106-L108 VanDerWaalsContact C-N 3.34Å; A106-L108 PolarHBondContact O-N 3.39Å; A106-M109 PolarHBondContact O-N 2.96Å; A106-L110 WeakPolarHBondContact O-CB 3.25Å; A106-L110 WeakPolarHBondContact O-CG 3.23Å; A106-L110 PolarHBondContact O-N 3.41Å; A106-L170 HydrophobicContact CB-CD1 4.43Å
107	T	71.2	Confident	66.9	Low	4 Å²	4	47.1 Å²	47.1	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-43.2	177.1	-52.3	0	0	0	0	111.3	I103 F104 K105 L110 T111 L146 V149	I103-T107 WeakPolarHBondContact O-CB 3.45Å; I103-T107 PolarHBondContact O-N 3.49Å; I103-T107 PolarHBondContact O-OG1 2.94Å; F104-T107 PolarHBondContact O-N 2.95Å; K105-T107 PolarHBondContact O-N 3.14Å; T107-L110 PolarHBondContact O-N 3.49Å; T107-T111 VanDerWaalsContact O-CB 3.31Å; T107-T111 WeakPolarHBondContact O-CB 3.32Å; T107-T111 PolarHBondContact O-N 3.34Å; T107-T111 PolarHBondContact O-OG1 2.71Å; T107-L146 HydrophobicContact CG2-CD2 4.04Å; T107-V149 HydrophobicContact CG2-CB 4.49Å; T107-V149 HydrophobicContact CG2-CG1 4.06Å
108	L	73.7	Confident	66.5	Low	102 Å²	102	44.2 Å²	44.2	53%	0.534	23%	0.233	S	C	.	.	H	α-helix	trans	-69	-37.2	179.8	-163.1	137.1	0	0	0	112.1	F104 K105 A106 S112	F104-L108 HydrophobicContact CE1-CD1 4.18Å; F104-L108 HydrophobicContact CZ-CD1 4.2Å; F104-L108 WeakPolarHBondContact O-CB 3.49Å; F104-L108 PolarHBondContact O-N 3.22Å; K105-L108 PolarHBondContact O-N 3.43Å; A106-L108 VanDerWaalsContact C-N 3.34Å; A106-L108 PolarHBondContact O-N 3.39Å; L108-S112 WeakPolarHBondContact O-CB 3.47Å; L108-S112 PolarHBondContact O-N 2.89Å; L108-S112 VanDerWaalsContact O-N 3.09Å; L108-S112 PolarHBondContact O-OG 3.03Å
109	M	69.1	Low	65.9	Low	14 Å²	14	49 Å²	49	7%	0.069	24%	0.244	C	C	.	.	H	α-helix	trans	-67.1	-43.5	174.1	-71	-155.1	-179.2	0	0	112.4	L19 I82 A83 K105 A106 S112 S113	L19-M109 HydrophobicContact CD2-CE 4.16Å; I82-M109 HydrophobicContact CB-SD 3.95Å; I82-M109 HydrophobicContact CG2-CE 3.81Å; I82-M109 HydrophobicContact CG2-SD 3.46Å; I82-M109 WeakPolarHBondContact CG2-SD 3.35Å; A83-M109 HydrophobicContact CB-CB 4.34Å; K105-M109 HydrophobicContact CG-CE 4.43Å; K105-M109 WeakPolarHBondContact O-CG 3.39Å; K105-M109 PolarHBondContact O-N 3.36Å; A106-M109 PolarHBondContact O-N 2.96Å; M109-S112 WeakPolarHBondContact CA-OG 3.41Å; M109-S112 PolarHBondContact O-N 3.32Å; M109-S112 PolarHBondContact O-OG 3.46Å; M109-S113 WeakPolarHBondContact O-CB 3.31Å; M109-S113 PolarHBondContact O-N 3.18Å
110	L	67.8	Low	65	Low	4 Å²	4	51 Å²	51	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-69.4	-39.1	178.5	-69	168.5	0	0	0	112	A83 A106 T107 S112 S113 L114 L146 L170 V173 L177	A83-L110 HydrophobicContact CB-CD1 4.5Å; A83-L110 HydrophobicContact CB-CD2 3.98Å; A83-L110 HydrophobicContact CB-CG 3.97Å; A106-L110 WeakPolarHBondContact O-CB 3.25Å; A106-L110 WeakPolarHBondContact O-CG 3.23Å; A106-L110 PolarHBondContact O-N 3.41Å; T107-L110 PolarHBondContact O-N 3.49Å; L110-S112 VanDerWaalsContact C-N 3.32Å; L110-S112 PolarHBondContact O-N 3.28Å; L110-S113 PolarHBondContact O-N 2.92Å; L110-L114 WeakPolarHBondContact O-CB 3.49Å; L110-L114 PolarHBondContact O-N 3.09Å; L110-L146 HydrophobicContact CB-CD2 4.07Å; L110-L170 HydrophobicContact CD1-CD2 3.68Å; L110-V173 HydrophobicContact CB-CG1 4.31Å; L110-V173 HydrophobicContact CD1-CG1 4.33Å; L110-L177 HydrophobicContact CD2-CD1 3.54Å
111	T	70.4	Confident	63.9	Low	53 Å²	53	50.5 Å²	50.5	33%	0.325	26%	0.261	S	S	.	.	H	α-helix	trans	-63.3	-39.7	175.5	-54.7	0	0	0	0	111.7	T107 L114 T115	T107-T111 VanDerWaalsContact O-CB 3.31Å; T107-T111 WeakPolarHBondContact O-CB 3.32Å; T107-T111 PolarHBondContact O-N 3.34Å; T107-T111 PolarHBondContact O-OG1 2.71Å; T111-L114 PolarHBondContact O-N 3.11Å; T111-T115 PolarHBondContact O-N 3.18Å; T111-T115 PolarHBondContact O-OG1 3.37Å
112	S	69	Low	62.9	Low	23 Å²	23	51.9 Å²	51.9	16%	0.161	26%	0.264	C	S	.	.	H	α-helix	trans	-75.4	-24.8	177.3	64.1	0	0	0	0	113.4	R79 L108 M109 L110 T115 S116	R79-S112 VanDerWaalsContact CD-OG 3.3Å; R79-S112 WeakPolarHBondContact CD-OG 2.89Å; R79-S112 PolarHBondContact NE-OG 2.93Å; R79-S112 VanDerWaalsContact NH1-CB 3.35Å; R79-S112 PolarHBondContact NH1-O 2.94Å; R79-S112 PolarHBondContact NH1-OG 3.23Å; L108-S112 WeakPolarHBondContact O-CB 3.47Å; L108-S112 PolarHBondContact O-N 2.89Å; L108-S112 VanDerWaalsContact O-N 3.09Å; L108-S112 PolarHBondContact O-OG 3.03Å; M109-S112 WeakPolarHBondContact CA-OG 3.41Å; M109-S112 PolarHBondContact O-N 3.32Å; M109-S112 PolarHBondContact O-OG 3.46Å; L110-S112 VanDerWaalsContact C-N 3.32Å; L110-S112 PolarHBondContact O-N 3.28Å; S112-T115 VanDerWaalsContact CA-OG1 3.31Å; S112-T115 WeakPolarHBondContact CA-OG1 3.25Å; S112-T115 PolarHBondContact O-OG1 3.46Å; S112-S116 PolarHBondContact O-N 3.23Å; S112-S116 PolarHBondContact O-OG 2.98Å
113	S	65.4	Low	61.8	Low	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-72.5	-45.1	167.9	-173.7	0	0	0	0	111.8	A76 M109 L110 T115 S116 M117	A76-S113 PolarHBondContact O-OG 3.37Å; M109-S113 WeakPolarHBondContact O-CB 3.31Å; M109-S113 PolarHBondContact O-N 3.18Å; L110-S113 PolarHBondContact O-N 2.92Å; S113-T115 VanDerWaalsContact C-N 3.34Å; S113-T115 PolarHBondContact O-N 3.46Å; S113-S116 WeakPolarHBondContact CA-OG 3.44Å; S113-S116 PolarHBondContact O-N 3.47Å; S113-S116 PolarHBondContact O-OG 3.39Å; S113-M117 VanDerWaalsContact O-CG 3.26Å; S113-M117 WeakPolarHBondContact O-CG 3.33Å; S113-M117 PolarHBondContact O-N 3.05Å
114	L	65.9	Low	60.5	Low	5 Å²	5	55.9 Å²	55.9	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-39.6	178.2	-138.2	105.4	0	0	0	112	L110 T111 M117 S118 Y139 A142 K143 L146 V173 L177	L110-L114 WeakPolarHBondContact O-CB 3.49Å; L110-L114 PolarHBondContact O-N 3.09Å; T111-L114 PolarHBondContact O-N 3.11Å; L114-M117 PolarHBondContact O-N 3.39Å; L114-S118 PolarHBondContact O-N 3.13Å; L114-Y139 HydrophobicContact CD2-CD2 4.1Å; L114-Y139 HydrophobicContact CD2-CE1 4.49Å; L114-Y139 HydrophobicContact CD2-CE2 3.65Å; L114-Y139 HydrophobicContact CG-CD2 4.26Å; L114-Y139 HydrophobicContact CG-CE2 3.82Å; L114-Y139 WeakPolarHBondContact O-CE2 3.19Å; L114-Y139 PolarHBondContact O-OH 2.68Å; L114-A142 HydrophobicContact CD1-CB 3.76Å; L114-K143 HydrophobicContact CD2-CB 3.82Å; L114-K143 HydrophobicContact CD2-CG 4.42Å; L114-L146 HydrophobicContact CB-CD1 4.38Å; L114-L146 HydrophobicContact CD1-CD1 4.22Å; L114-L146 HydrophobicContact CD2-CD1 4.43Å; L114-V173 HydrophobicContact CD1-CG1 4.41Å; L114-L177 HydrophobicContact CD1-CD1 4.39Å; L114-L177 HydrophobicContact CD1-CD2 3.86Å; L114-L177 HydrophobicContact CD1-CG 4.1Å
115	T	66.7	Low	59.2	Low	81 Å²	81	59 Å²	59	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-71.3	-32.7	178.4	38.7	0	0	0	0	113.5	T111 S112 S113 S118	T111-T115 PolarHBondContact O-N 3.18Å; T111-T115 PolarHBondContact O-OG1 3.37Å; S112-T115 VanDerWaalsContact CA-OG1 3.31Å; S112-T115 WeakPolarHBondContact CA-OG1 3.25Å; S112-T115 PolarHBondContact O-OG1 3.46Å; S113-T115 VanDerWaalsContact C-N 3.34Å; S113-T115 PolarHBondContact O-N 3.46Å; T115-S118 WeakPolarHBondContact O-CB 3.27Å; T115-S118 PolarHBondContact O-N 3.34Å; T115-S118 PolarHBondContact O-OG 2.74Å
116	S	61.3	Low	58.1	Low	27 Å²	27	61.1 Å²	61.1	19%	0.189	33%	0.327	C	S	.	.	H	α-helix	trans	-70.3	-35.7	172.9	42.9	0	0	0	0	111.8	A76 S112 S113 S118	A76-S116 WeakPolarHBondContact CB-OG 3.41Å; S112-S116 PolarHBondContact O-N 3.23Å; S112-S116 PolarHBondContact O-OG 2.98Å; S113-S116 WeakPolarHBondContact CA-OG 3.44Å; S113-S116 PolarHBondContact O-N 3.47Å; S113-S116 PolarHBondContact O-OG 3.39Å; S116-S118 VanDerWaalsContact C-N 3.27Å; S116-S118 PolarHBondContact O-N 3.43Å
117	M	55.5	Low	56.9	Low	23 Å²	23	63.1 Å²	63.1	11%	0.113	34%	0.341	C	S	.	.	H	α-helix	trans	-65.9	-22.5	173.6	-71.1	-94.7	-84.3	0	0	114.2	S113 L114 R119 V120 L177 L180 E181	S113-M117 VanDerWaalsContact O-CG 3.26Å; S113-M117 WeakPolarHBondContact O-CG 3.33Å; S113-M117 PolarHBondContact O-N 3.05Å; L114-M117 PolarHBondContact O-N 3.39Å; M117-R119 PolarHBondContact O-N 2.8Å; M117-V120 WeakPolarHBondContact O-CB 3.48Å; M117-V120 WeakPolarHBondContact O-CG2 3.48Å; M117-V120 PolarHBondContact O-N 2.89Å; M117-V120 VanDerWaalsContact O-N 3.09Å; M117-L177 HydrophobicContact CE-CD2 4.13Å; M117-L180 HydrophobicContact CE-CB 3.42Å; M117-L180 VanDerWaalsContact CE-CB 3.42Å; M117-L180 HydrophobicContact CE-CD1 4.42Å; M117-E181 HydrophobicContact CE-CG 4.26Å
118	S	52.2	Low	56	Low	55 Å²	55	67.1 Å²	67.1	39%	0.385	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-14.1	-179.7	77.2	0	0	0	0	115.2	L114 T115 S116 P121 Y139	L114-S118 PolarHBondContact O-N 3.13Å; T115-S118 WeakPolarHBondContact O-CB 3.27Å; T115-S118 PolarHBondContact O-N 3.34Å; T115-S118 PolarHBondContact O-OG 2.74Å; S116-S118 VanDerWaalsContact C-N 3.27Å; S116-S118 PolarHBondContact O-N 3.43Å; S118-P121 VanDerWaalsContact C-CD 3.46Å; S118-P121 WeakPolarHBondContact O-CD 3.25Å; S118-P121 WeakPolarHBondContact O-CG 3.5Å; S118-Y139 WeakPolarHBondContact CB-OH 3.42Å
119	R	50.4	Low	55.1	Low	163 Å²	163	66.9 Å²	66.9	62%	0.615	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-12.4	177.2	-67.8	-176.9	175.9	-172.2	0.3	114.2	M117	M117-R119 PolarHBondContact O-N 2.8Å
120	V	46.1	Very low	54.2	Low	50 Å²	50	74.6 Å²	74.6	30%	0.303	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-68.5	-15.2	174.9	-171.9	0	0	0	0	115.8	M117 K122 V123	M117-V120 WeakPolarHBondContact O-CB 3.48Å; M117-V120 WeakPolarHBondContact O-CG2 3.48Å; M117-V120 PolarHBondContact O-N 2.89Å; M117-V120 VanDerWaalsContact O-N 3.09Å; V120-K122 PolarHBondContact O-N 3.24Å; V120-V123 HydrophobicContact CG1-CB 4.41Å; V120-V123 HydrophobicContact CG1-CG2 4.35Å; V120-V123 PolarHBondContact O-N 3.45Å
121	P	43.7	Very low	53.6	Low	65 Å²	65	76.4 Å²	76.4	42%	0.422	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-59.3	-8.9	175.9	-24.2	33.4	0	0	0	115.4	S118 V123 A124	S118-P121 VanDerWaalsContact C-CD 3.46Å; S118-P121 WeakPolarHBondContact O-CD 3.25Å; S118-P121 WeakPolarHBondContact O-CG 3.5Å; P121-V123 VanDerWaalsContact C-N 3.29Å; P121-A124 PolarHBondContact O-N 3.03Å
122	K	48.2	Very low	52.8	Low	173 Å²	173	76.5 Å²	76.5	75%	0.752	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-66.9	-30.2	169.1	-70.6	-178.6	-179	175	0	112.5	V120	V120-K122 PolarHBondContact O-N 3.24Å
123	V	43.6	Very low	52.4	Low	104 Å²	104	81.8 Å²	81.8	63%	0.63	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-77.9	-31.6	175	-173.2	0	0	0	0	111	V120 P121 K125 V126	V120-V123 HydrophobicContact CG1-CB 4.41Å; V120-V123 HydrophobicContact CG1-CG2 4.35Å; V120-V123 PolarHBondContact O-N 3.45Å; P121-V123 VanDerWaalsContact C-N 3.29Å; V123-K125 PolarHBondContact O-N 3.49Å; V123-K125 VanDerWaalsContact O-N 3.1Å; V123-V126 PolarHBondContact O-N 3.49Å
124	A	39.8	Very low	51.9	Low	27 Å²	27	85.1 Å²	85.1	22%	0.223	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-68.1	-7.1	178.2	0	0	0	0	0	114.9	P121 V126 C127 Q132	P121-A124 PolarHBondContact O-N 3.03Å; A124-V126 PolarHBondContact O-N 3.28Å; A124-C127 PolarHBondContact O-N 3.11Å; A124-C127 VanDerWaalsContact O-N 3.15Å; A124-Q132 PolarHBondContact O-NE2 3.29Å
125	K	46	Very low	51.6	Low	176 Å²	176	87 Å²	87	77%	0.765	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-64.1	-16.5	172.5	-84.4	-175.3	174.1	-176.2	0	113.6	V123	V123-K125 PolarHBondContact O-N 3.49Å; V123-K125 VanDerWaalsContact O-N 3.1Å
126	V	46.3	Very low	51.4	Low	133 Å²	133	90.9 Å²	90.9	81%	0.806	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-87.4	-11.9	177.7	-172.8	0	0	0	0	112	V123 A124	V123-V126 PolarHBondContact O-N 3.49Å; A124-V126 PolarHBondContact O-N 3.28Å
127	C	43.8	Very low	51.6	Low	44 Å²	44	92.7 Å²	92.7	30%	0.297	48%	0.478	S	S	.	.	S	Bend	trans	-92.9	149.7	-175.5	-65.3	0	0	0	0	113.3	A124 F131 Q132	A124-C127 PolarHBondContact O-N 3.11Å; A124-C127 VanDerWaalsContact O-N 3.15Å; C127-F131 HydrophobicContact CB-CB 4.3Å; C127-F131 HydrophobicContact CB-CD1 4.44Å; C127-Q132 PolarHBondContact O-NE2 3.12Å
128	P	50.7	Low	52	Low	87 Å²	87	94.3 Å²	94.3	57%	0.565	49%	0.487	S	S	*	.			trans	-56.2	150.8	178.1	-21.7	31.1	0	0	0	113.1	K130 F131 Q132	P128-K130 VanDerWaalsContact C-N 3.3Å; P128-K130 PolarHBondContact O-N 3.26Å; P128-F131 VanDerWaalsContact O-CB 3.32Å; P128-F131 WeakPolarHBondContact O-CB 3.44Å; P128-F131 PolarHBondContact O-N 3.32Å; P128-Q132 PolarHBondContact O-N 3.03Å
129	P	54.5	Low	52.6	Low	98 Å²	98	94.4 Å²	94.4	64%	0.636	48%	0.479	S	S	*	.	H	α-helix	trans	-59.4	-34.3	-171.8	21.7	-33	0	0	0	114.1	F131 Q132 E133	P129-F131 VanDerWaalsContact C-N 3.28Å; P129-F131 PolarHBondContact O-N 2.95Å; P129-Q132 WeakPolarHBondContact O-CB 3.48Å; P129-Q132 PolarHBondContact O-N 3.48Å; P129-E133 PolarHBondContact O-N 3.23Å
130	K	51.9	Low	53.4	Low	176 Å²	176	89.4 Å²	89.4	77%	0.765	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-34.2	175.6	-69.2	-173.5	176.4	-176.2	0	112.8	P128 Q132 E133 T134	P128-K130 VanDerWaalsContact C-N 3.3Å; P128-K130 PolarHBondContact O-N 3.26Å; K130-Q132 VanDerWaalsContact C-N 3.33Å; K130-E133 PolarHBondContact O-N 3.11Å; K130-T134 PolarHBondContact O-N 3.47Å; K130-T134 PolarHBondContact O-OG1 2.99Å
131	F	53.5	Low	54.4	Low	42 Å²	42	90.9 Å²	90.9	18%	0.184	48%	0.482	C	S	.	.	H	α-helix	trans	-73	-29.7	179.6	-149.4	-87.4	0	0	0	111.9	C127 P128 P129 T134 F135 P183 M186	C127-F131 HydrophobicContact CB-CB 4.3Å; C127-F131 HydrophobicContact CB-CD1 4.44Å; P128-F131 VanDerWaalsContact O-CB 3.32Å; P128-F131 WeakPolarHBondContact O-CB 3.44Å; P128-F131 PolarHBondContact O-N 3.32Å; P129-F131 VanDerWaalsContact C-N 3.28Å; P129-F131 PolarHBondContact O-N 2.95Å; F131-T134 WeakPolarHBondContact CA-OG1 3.5Å; F131-T134 PolarHBondContact O-OG1 2.97Å; F131-T134 VanDerWaalsContact O-OG1 3.05Å; F131-F135 VanDerWaalsContact O-CB 3.23Å; F131-F135 WeakPolarHBondContact O-CB 3.28Å; F131-F135 PolarHBondContact O-N 3.26Å; F131-P183 HydrophobicContact CE1-CB 3.84Å; F131-P183 HydrophobicContact CZ-CB 4.13Å; F131-P183 WeakPolarHBondContact CZ-O 3.48Å; F131-M186 HydrophobicContact CD2-CE 4.23Å; F131-M186 HydrophobicContact CD2-SD 4.16Å; F131-M186 HydrophobicContact CE2-CB 3.57Å; F131-M186 HydrophobicContact CE2-CE 3.71Å; F131-M186 HydrophobicContact CE2-CG 3.85Å; F131-M186 HydrophobicContact CE2-SD 3.26Å; F131-M186 WeakPolarHBondContact CE2-SD 3.42Å; F131-M186 HydrophobicContact CZ-CB 3.87Å; F131-M186 HydrophobicContact CZ-CG 3.99Å; F131-M186 HydrophobicContact CZ-SD 3.62Å
132	Q	55.1	Low	55.5	Low	54 Å²	54	87.8 Å²	87.8	25%	0.252	46%	0.462	S	S	.	.	H	α-helix	trans	-69.2	-35.2	176.6	-61.7	-178.1	7.3	0	0	111.7	A124 C127 P128 P129 K130 R136	A124-Q132 PolarHBondContact O-NE2 3.29Å; C127-Q132 PolarHBondContact O-NE2 3.12Å; P128-Q132 PolarHBondContact O-N 3.03Å; P129-Q132 WeakPolarHBondContact O-CB 3.48Å; P129-Q132 PolarHBondContact O-N 3.48Å; K130-Q132 VanDerWaalsContact C-N 3.33Å; Q132-R136 WeakPolarHBondContact O-CB 3.39Å; Q132-R136 VanDerWaalsContact O-CG 3.25Å; Q132-R136 WeakPolarHBondContact O-CG 3.11Å; Q132-R136 PolarHBondContact O-N 2.97Å; Q132-R136 VanDerWaalsContact O-N 3.09Å
133	E	59.3	Low	56.5	Low	134 Å²	134	84.8 Å²	84.8	63%	0.626	45%	0.449	S	S	*	.	H	α-helix	trans	-70.9	-45.3	177.2	-72.5	179.7	174	0	0	112.1	P129 K130 F135 R136 S137	P129-E133 PolarHBondContact O-N 3.23Å; K130-E133 PolarHBondContact O-N 3.11Å; E133-F135 PolarHBondContact O-N 3.38Å; E133-R136 PolarHBondContact O-N 3.47Å; E133-S137 PolarHBondContact O-N 2.93Å
134	T	56	Low	57.8	Low	70 Å²	70	88.3 Å²	88.3	43%	0.429	45%	0.451	S	S	.	.	H	α-helix	trans	-64.4	-40	176.5	52.6	0	0	0	0	111.8	K130 F131 R136 S137 L138	K130-T134 PolarHBondContact O-N 3.47Å; K130-T134 PolarHBondContact O-OG1 2.99Å; F131-T134 WeakPolarHBondContact CA-OG1 3.5Å; F131-T134 PolarHBondContact O-OG1 2.97Å; F131-T134 VanDerWaalsContact O-OG1 3.05Å; T134-R136 PolarHBondContact O-N 3.16Å; T134-S137 PolarHBondContact O-N 2.98Å; T134-S137 PolarHBondContact O-OG 3.33Å; T134-S137 VanDerWaalsContact O-OG 3.14Å; T134-L138 WeakPolarHBondContact O-CB 3.46Å; T134-L138 PolarHBondContact O-N 3.36Å
135	F	59.9	Low	59.1	Low	45 Å²	45	87.4 Å²	87.4	20%	0.197	44%	0.443	C	S	.	.	H	α-helix	trans	-64	-40.6	176	-164.4	-87.5	0	0	0	111.7	F131 E133 Y139 L180	F131-F135 VanDerWaalsContact O-CB 3.23Å; F131-F135 WeakPolarHBondContact O-CB 3.28Å; F131-F135 PolarHBondContact O-N 3.26Å; E133-F135 PolarHBondContact O-N 3.38Å; F135-Y139 WeakPolarHBondContact O-CB 3.49Å; F135-Y139 PolarHBondContact O-N 3.22Å; F135-L180 HydrophobicContact CD1-CD2 4.05Å; F135-L180 HydrophobicContact CD2-CD2 3.51Å; F135-L180 HydrophobicContact CE1-CD2 3.82Å; F135-L180 HydrophobicContact CE2-CB 4.22Å; F135-L180 HydrophobicContact CE2-CD2 3.26Å; F135-L180 HydrophobicContact CE2-CG 4.33Å; F135-L180 HydrophobicContact CG-CD2 3.91Å; F135-L180 HydrophobicContact CZ-CB 4.34Å; F135-L180 HydrophobicContact CZ-CD2 3.43Å; F135-L180 VanDerWaalsContact CZ-CD2 3.43Å; F135-L180 HydrophobicContact CZ-CG 4.45Å
136	R	62	Low	60.2	Low	162 Å²	162	79.3 Å²	79.3	61%	0.611	41%	0.408	S	S	*	.	H	α-helix	trans	-66.1	-40.4	174.9	-77	177.3	-167.5	144.9	7.9	112.5	Q132 E133 T134 A140	Q132-R136 WeakPolarHBondContact O-CB 3.39Å; Q132-R136 VanDerWaalsContact O-CG 3.25Å; Q132-R136 WeakPolarHBondContact O-CG 3.11Å; Q132-R136 PolarHBondContact O-N 2.97Å; Q132-R136 VanDerWaalsContact O-N 3.09Å; E133-R136 PolarHBondContact O-N 3.47Å; T134-R136 PolarHBondContact O-N 3.16Å; R136-A140 VanDerWaalsContact O-CB 3.31Å; R136-A140 WeakPolarHBondContact O-CB 3.34Å; R136-A140 PolarHBondContact O-N 2.73Å
137	S	65.3	Low	61.5	Low	65 Å²	65	76.4 Å²	76.4	46%	0.455	39%	0.388	S	S	.	.	H	α-helix	trans	-69.1	-39.9	179.2	82.3	0	0	0	0	111.5	E133 T134 A140 T141	E133-S137 PolarHBondContact O-N 2.93Å; T134-S137 PolarHBondContact O-N 2.98Å; T134-S137 PolarHBondContact O-OG 3.33Å; T134-S137 VanDerWaalsContact O-OG 3.14Å; S137-A140 PolarHBondContact O-N 3.47Å; S137-T141 WeakPolarHBondContact O-CB 3.44Å; S137-T141 PolarHBondContact O-N 3.1Å; S137-T141 PolarHBondContact O-OG1 3.49Å
138	L	63	Low	62.7	Low	58 Å²	58	77.4 Å²	77.4	30%	0.304	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-45.1	177.2	-141.9	94.2	0	0	0	110.8	T134 A140 T141 A142 A176 F179 L180	T134-L138 WeakPolarHBondContact O-CB 3.46Å; T134-L138 PolarHBondContact O-N 3.36Å; L138-A140 PolarHBondContact O-N 3.2Å; L138-T141 PolarHBondContact O-N 3Å; L138-A142 WeakPolarHBondContact O-CB 3.36Å; L138-A142 PolarHBondContact O-N 3.24Å; L138-A176 HydrophobicContact CD2-CB 4.09Å; L138-A176 WeakPolarHBondContact CD2-O 3.13Å; L138-A176 HydrophobicContact CG-CB 4.32Å; L138-F179 HydrophobicContact CD2-CB 3.67Å; L138-L180 HydrophobicContact CB-CD2 4.48Å; L138-L180 HydrophobicContact CD2-CD2 4.23Å; L138-L180 HydrophobicContact CD2-CG 4.08Å
139	Y	65.3	Low	63.7	Low	57 Å²	57	73.4 Å²	73.4	22%	0.224	36%	0.364	C	S	.	.	H	α-helix	trans	-61.2	-43.8	175.1	-177.6	-91.3	0	0	0	112.2	L114 S118 F135 T141 A142 K143	L114-Y139 HydrophobicContact CD2-CD2 4.1Å; L114-Y139 HydrophobicContact CD2-CE1 4.49Å; L114-Y139 HydrophobicContact CD2-CE2 3.65Å; L114-Y139 HydrophobicContact CG-CD2 4.26Å; L114-Y139 HydrophobicContact CG-CE2 3.82Å; L114-Y139 WeakPolarHBondContact O-CE2 3.19Å; L114-Y139 PolarHBondContact O-OH 2.68Å; S118-Y139 WeakPolarHBondContact CB-OH 3.42Å; F135-Y139 WeakPolarHBondContact O-CB 3.49Å; F135-Y139 PolarHBondContact O-N 3.22Å; Y139-T141 VanDerWaalsContact C-N 3.31Å; Y139-T141 PolarHBondContact O-N 3.45Å; Y139-A142 PolarHBondContact O-N 2.89Å; Y139-K143 WeakPolarHBondContact O-CB 3.43Å; Y139-K143 PolarHBondContact O-N 3.29Å
140	A	67	Low	64.4	Low	57 Å²	57	73.4 Å²	73.4	47%	0.471	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-37	176.6	0	0	0	0	0	112.2	R136 S137 L138 R144	R136-A140 VanDerWaalsContact O-CB 3.31Å; R136-A140 WeakPolarHBondContact O-CB 3.34Å; R136-A140 PolarHBondContact O-N 2.73Å; S137-A140 PolarHBondContact O-N 3.47Å; L138-A140 PolarHBondContact O-N 3.2Å; A140-R144 WeakPolarHBondContact O-CB 3.3Å; A140-R144 PolarHBondContact O-N 3.07Å
141	T	66.9	Low	65.4	Low	82 Å²	82	70.8 Å²	70.8	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-69.7	-44.6	177.8	-53.4	0	0	0	0	111.1	S137 L138 Y139 K143 R144 A145	S137-T141 WeakPolarHBondContact O-CB 3.44Å; S137-T141 PolarHBondContact O-N 3.1Å; S137-T141 PolarHBondContact O-OG1 3.49Å; L138-T141 PolarHBondContact O-N 3Å; Y139-T141 VanDerWaalsContact C-N 3.31Å; Y139-T141 PolarHBondContact O-N 3.45Å; T141-K143 PolarHBondContact O-N 3.17Å; T141-R144 PolarHBondContact O-N 2.89Å; T141-A145 WeakPolarHBondContact O-CB 3.24Å; T141-A145 PolarHBondContact O-N 3.46Å
142	A	67	Low	66	Low	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63	-41.4	176.3	0	0	0	0	0	112	L114 L138 Y139 A145 L146 A176	L114-A142 HydrophobicContact CD1-CB 3.76Å; L138-A142 WeakPolarHBondContact O-CB 3.36Å; L138-A142 PolarHBondContact O-N 3.24Å; Y139-A142 PolarHBondContact O-N 2.89Å; A142-A145 PolarHBondContact O-N 3.07Å; A142-L146 PolarHBondContact O-N 2.92Å; A142-L146 VanDerWaalsContact O-N 3.11Å; A142-A176 HydrophobicContact CB-CB 3.79Å
143	K	70.2	Confident	66.4	Low	109 Å²	109	71.3 Å²	71.3	47%	0.474	35%	0.348	S	S	.	.	H	α-helix	trans	-62.9	-46	174.4	-171.3	179	177.6	-173.5	0	111.7	L114 Y139 T141 A145 L146 D147	L114-K143 HydrophobicContact CD2-CB 3.82Å; L114-K143 HydrophobicContact CD2-CG 4.42Å; Y139-K143 WeakPolarHBondContact O-CB 3.43Å; Y139-K143 PolarHBondContact O-N 3.29Å; T141-K143 PolarHBondContact O-N 3.17Å; K143-A145 VanDerWaalsContact C-N 3.3Å; K143-A145 PolarHBondContact O-N 3.43Å; K143-L146 WeakPolarHBondContact O-CB 3.35Å; K143-L146 PolarHBondContact O-N 3.41Å; K143-D147 VanDerWaalsContact O-CG 3.27Å; K143-D147 PolarHBondContact O-N 3.49Å
144	R	70.2	Confident	66.6	Low	179 Å²	179	71.9 Å²	71.9	68%	0.675	36%	0.355	S	S	*	.	H	α-helix	trans	-64.5	-35	178.7	-168.4	169.3	-170.2	154.4	2.7	112.5	A140 T141 D147 L148	A140-R144 WeakPolarHBondContact O-CB 3.3Å; A140-R144 PolarHBondContact O-N 3.07Å; T141-R144 PolarHBondContact O-N 2.89Å; R144-D147 PolarHBondContact O-N 3.16Å; R144-L148 VanDerWaalsContact O-CG 3.27Å; R144-L148 WeakPolarHBondContact O-CG 3.44Å; R144-L148 PolarHBondContact O-N 3.42Å
145	A	66.4	Low	66.9	Low	7 Å²	7	72.7 Å²	72.7	6%	0.058	36%	0.357	C	S	.	.	H	α-helix	trans	-65.8	-38.6	174.4	0	0	0	0	0	111.9	T141 A142 K143 L148 V149 L169 V173	T141-A145 WeakPolarHBondContact O-CB 3.24Å; T141-A145 PolarHBondContact O-N 3.46Å; A142-A145 PolarHBondContact O-N 3.07Å; K143-A145 VanDerWaalsContact C-N 3.3Å; K143-A145 PolarHBondContact O-N 3.43Å; A145-L148 PolarHBondContact O-N 3.15Å; A145-V149 WeakPolarHBondContact O-CG2 3.41Å; A145-V149 PolarHBondContact O-N 3.15Å; A145-V149 VanDerWaalsContact O-N 3.16Å; A145-L169 HydrophobicContact CB-CD2 4.26Å; A145-V173 HydrophobicContact CB-CG2 3.63Å
146	L	70.7	Confident	66.6	Low	7 Å²	7	77.1 Å²	77.1	4%	0.037	39%	0.39	C	S	.	.	H	α-helix	trans	-64.9	-44.1	172	-75.6	165.8	0	0	0	112.2	T107 L110 L114 A142 K143 L148 V149 E150 L170 V173	T107-L146 HydrophobicContact CG2-CD2 4.04Å; L110-L146 HydrophobicContact CB-CD2 4.07Å; L114-L146 HydrophobicContact CB-CD1 4.38Å; L114-L146 HydrophobicContact CD1-CD1 4.22Å; L114-L146 HydrophobicContact CD2-CD1 4.43Å; A142-L146 PolarHBondContact O-N 2.92Å; A142-L146 VanDerWaalsContact O-N 3.11Å; K143-L146 WeakPolarHBondContact O-CB 3.35Å; K143-L146 PolarHBondContact O-N 3.41Å; L146-L148 VanDerWaalsContact C-N 3.27Å; L146-L148 PolarHBondContact O-N 3.23Å; L146-V149 WeakPolarHBondContact O-CB 3.26Å; L146-V149 PolarHBondContact O-N 3.25Å; L146-V149 VanDerWaalsContact O-N 3.07Å; L146-E150 PolarHBondContact O-N 3.33Å; L146-L170 HydrophobicContact CD2-CD2 4.3Å; L146-V173 HydrophobicContact CD1-CG1 4.17Å; L146-V173 HydrophobicContact CD2-CG1 4.28Å; L146-V173 HydrophobicContact CD2-CG2 4.27Å; L146-V173 HydrophobicContact CG-CG1 4.09Å; L146-V173 HydrophobicContact CG-CG2 3.88Å
147	D	72.3	Confident	66.5	Low	71 Å²	71	71.4 Å²	71.4	38%	0.38	38%	0.377	S	S	.	.	H	α-helix	trans	-59.7	-40.2	177.1	-62.2	-26.9	0	0	0	110.6	K143 R144 V149 E150 E151	K143-D147 VanDerWaalsContact O-CG 3.27Å; K143-D147 PolarHBondContact O-N 3.49Å; R144-D147 PolarHBondContact O-N 3.16Å; D147-V149 VanDerWaalsContact C-N 3.34Å; D147-V149 PolarHBondContact O-N 3.21Å; D147-E150 PolarHBondContact O-N 3.4Å; D147-E150 VanDerWaalsContact O-N 3.12Å; D147-E151 WeakPolarHBondContact O-CG 3.45Å; D147-E151 PolarHBondContact O-N 3.13Å
148	L	70.4	Confident	66.3	Low	66 Å²	66	72.2 Å²	72.2	35%	0.346	38%	0.382	S	S	.	.	H	α-helix	trans	-65.3	-31.3	175	-73.1	170	0	0	0	113.4	R144 A145 L146 E150 N152 L169	R144-L148 VanDerWaalsContact O-CG 3.27Å; R144-L148 WeakPolarHBondContact O-CG 3.44Å; R144-L148 PolarHBondContact O-N 3.42Å; A145-L148 PolarHBondContact O-N 3.15Å; L146-L148 VanDerWaalsContact C-N 3.27Å; L146-L148 PolarHBondContact O-N 3.23Å; L148-E150 VanDerWaalsContact C-N 3.3Å; L148-N152 WeakPolarHBondContact O-CB 3.4Å; L148-N152 PolarHBondContact O-N 3.11Å; L148-N152 PolarHBondContact O-ND2 2.99Å; L148-N152 VanDerWaalsContact O-ND2 3.15Å; L148-L169 HydrophobicContact CB-CD1 3.88Å; L148-L169 HydrophobicContact CB-CD2 4.42Å; L148-L169 HydrophobicContact CD1-CD2 4.38Å
149	V	70.1	Confident	66.3	Low	2 Å²	2	74.1 Å²	74.1	1%	0.012	39%	0.389	C	S	.	.	H	α-helix	trans	-66.8	-34.2	172.7	175.2	0	0	0	0	110.9	I103 T107 A145 L146 D147 L169 L170	I103-V149 HydrophobicContact CG2-CG1 4.42Å; T107-V149 HydrophobicContact CG2-CB 4.49Å; T107-V149 HydrophobicContact CG2-CG1 4.06Å; A145-V149 WeakPolarHBondContact O-CG2 3.41Å; A145-V149 PolarHBondContact O-N 3.15Å; A145-V149 VanDerWaalsContact O-N 3.16Å; L146-V149 WeakPolarHBondContact O-CB 3.26Å; L146-V149 PolarHBondContact O-N 3.25Å; L146-V149 VanDerWaalsContact O-N 3.07Å; D147-V149 VanDerWaalsContact C-N 3.34Å; D147-V149 PolarHBondContact O-N 3.21Å; V149-L169 HydrophobicContact CG2-CB 3.42Å; V149-L169 VanDerWaalsContact CG2-CB 3.42Å; V149-L169 HydrophobicContact CG2-CD1 3.84Å; V149-L169 HydrophobicContact CG2-CG 4.29Å; V149-L170 HydrophobicContact CG2-CD2 4.44Å; V149-L170 HydrophobicContact CG2-CG 4.32Å
150	E	71.1	Confident	66.1	Low	99 Å²	99	78.3 Å²	78.3	46%	0.463	41%	0.409	S	S	.	.	H	α-helix	trans	-73.1	-43.2	174.4	-62.6	-157	139.6	0	0	112.3	L146 D147 L148 N152 K153	L146-E150 PolarHBondContact O-N 3.33Å; D147-E150 PolarHBondContact O-N 3.4Å; D147-E150 VanDerWaalsContact O-N 3.12Å; L148-E150 VanDerWaalsContact C-N 3.3Å; E150-N152 VanDerWaalsContact C-N 3.27Å; E150-N152 PolarHBondContact O-N 3.4Å; E150-K153 VanDerWaalsContact O-CB 3.32Å; E150-K153 WeakPolarHBondContact O-CB 3.36Å; E150-K153 WeakPolarHBondContact O-CG 3.35Å; E150-K153 PolarHBondContact O-N 3.04Å
151	E	71.9	Confident	65.9	Low	120 Å²	120	81.6 Å²	81.6	56%	0.561	41%	0.414	S	S	*	.	H	α-helix	trans	-63.6	-31.3	176.5	-70.2	177.8	-175.9	0	0	112.6	D147 K153 D154	D147-E151 WeakPolarHBondContact O-CG 3.45Å; D147-E151 PolarHBondContact O-N 3.13Å; E151-K153 PolarHBondContact O-N 2.96Å; E151-K153 VanDerWaalsContact O-N 3.09Å; E151-D154 PolarHBondContact O-N 3.17Å; E151-D154 VanDerWaalsContact O-N 3.15Å
152	N	65.9	Low	65.8	Low	13 Å²	13	80.7 Å²	80.7	7%	0.07	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-61.9	-16.8	176.6	-81.9	-27	0	0	0	114.3	L148 E150 D154 L155 R162 L169	L148-N152 WeakPolarHBondContact O-CB 3.4Å; L148-N152 PolarHBondContact O-N 3.11Å; L148-N152 PolarHBondContact O-ND2 2.99Å; L148-N152 VanDerWaalsContact O-ND2 3.15Å; E150-N152 VanDerWaalsContact C-N 3.27Å; E150-N152 PolarHBondContact O-N 3.4Å; N152-D154 PolarHBondContact O-N 3.41Å; N152-L155 VanDerWaalsContact OD1-CD1 3.25Å; N152-L155 WeakPolarHBondContact OD1-CD1 3.34Å; N152-R162 WeakPolarHBondContact O-CD 3.46Å; N152-L169 VanDerWaalsContact ND2-CD1 3.26Å; N152-L169 WeakPolarHBondContact ND2-CD1 3.06Å
153	K	64.8	Low	65.8	Low	94 Å²	94	82 Å²	82	41%	0.409	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-64.1	-32.4	175.9	-65.4	172.8	-175	163.4	0	111.9	E150 E151 R162	E150-K153 VanDerWaalsContact O-CB 3.32Å; E150-K153 WeakPolarHBondContact O-CB 3.36Å; E150-K153 WeakPolarHBondContact O-CG 3.35Å; E150-K153 PolarHBondContact O-N 3.04Å; E151-K153 PolarHBondContact O-N 2.96Å; E151-K153 VanDerWaalsContact O-N 3.09Å; K153-R162 PolarHBondContact O-NH1 2.86Å; K153-R162 VanDerWaalsContact O-NH1 3.13Å
154	D	63.1	Low	65.6	Low	146 Å²	146	81.6 Å²	81.6	78%	0.781	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-98.4	-2.1	-170.3	-61.3	-36	0	0	0	113.7	E151 N152	E151-D154 PolarHBondContact O-N 3.17Å; E151-D154 VanDerWaalsContact O-N 3.15Å; N152-D154 PolarHBondContact O-N 3.41Å
155	L	61	Low	65.5	Low	88 Å²	88	77 Å²	77	46%	0.461	40%	0.399	S	S	.	.	S	Bend	trans	-76.6	135.9	179.9	-78.9	166.2	0	0	0	112.5	N152 A157 R162	N152-L155 VanDerWaalsContact OD1-CD1 3.25Å; N152-L155 WeakPolarHBondContact OD1-CD1 3.34Å; L155-A157 VanDerWaalsContact C-N 3.27Å; L155-A157 PolarHBondContact O-N 3.42Å; L155-R162 WeakPolarHBondContact O-CD 3.47Å; L155-R162 PolarHBondContact O-NH1 2.61Å
156	P	54.7	Low	65.6	Low	137 Å²	137	77 Å²	77	89%	0.89	40%	0.399	S	S	*	.			trans	-81.2	70	176.9	34.2	-34.4	0	0	0	110.9
157	A	58.9	Low	65.4	Low	42 Å²	42	78.2 Å²	78.2	35%	0.347	41%	0.406	S	S	.	.	S	Bend	trans	-127.2	161.8	176.9	0	0	0	0	0	112.1	L155 E159 R162	L155-A157 VanDerWaalsContact C-N 3.27Å; L155-A157 PolarHBondContact O-N 3.42Å; A157-E159 PolarHBondContact O-N 2.96Å; A157-R162 HydrophobicContact CB-CG 3.93Å; A157-R162 PolarHBondContact O-NE 3.08Å; A157-R162 PolarHBondContact O-NH2 2.8Å
158	C	61.1	Low	65	Low	83 Å²	83	80 Å²	80	56%	0.561	41%	0.412	S	S	*	.			trans	-59.4	135.6	-179.5	-158.1	0	0	0	0	110.1	K160 E161 R162	C158-K160 PolarHBondContact O-N 3.21Å; C158-K160 VanDerWaalsContact O-N 3.07Å; C158-E161 PolarHBondContact O-N 3.15Å; C158-R162 PolarHBondContact O-N 3.09Å
159	E	63.9	Low	64.9	Low	97 Å²	97	78 Å²	78	45%	0.453	40%	0.402	S	S	.	.	H	α-helix	trans	-56.7	-31.6	-171.6	-65.7	-164	148.5	0	0	113.4	K100 A157 N163	K100-E159 IonicContact NZ-OE1 2.95Å; K100-E159 PolarHBondContact NZ-OE1 2.95Å; K100-E159 IonicContact NZ-OE2 2.87Å; K100-E159 PolarHBondContact NZ-OE2 3.12Å; A157-E159 PolarHBondContact O-N 2.96Å; E159-N163 WeakPolarHBondContact O-CB 3.39Å; E159-N163 PolarHBondContact O-N 3.09Å; E159-N163 VanDerWaalsContact O-N 3.1Å; E159-N163 PolarHBondContact O-ND2 3.37Å
160	K	60.1	Low	64.7	Low	145 Å²	145	77.9 Å²	77.9	63%	0.63	40%	0.401	S	S	*	.	H	α-helix	trans	-64.5	-43.6	176.1	-70.5	-174.9	175.4	-177	0	112.6	C158 N163 I164	C158-K160 PolarHBondContact O-N 3.21Å; C158-K160 VanDerWaalsContact O-N 3.07Å; K160-N163 PolarHBondContact O-N 3.37Å; K160-I164 WeakPolarHBondContact O-CD1 3.32Å; K160-I164 VanDerWaalsContact O-CG1 3.25Å; K160-I164 WeakPolarHBondContact O-CG1 3.34Å; K160-I164 PolarHBondContact O-N 2.96Å
161	E	62.8	Low	64.4	Low	127 Å²	127	76.4 Å²	76.4	59%	0.593	40%	0.396	S	S	*	.	H	α-helix	trans	-70.1	-39.4	-178.8	-66.2	174.2	164.8	0	0	111.2	C158 N163 I164 L165	C158-E161 PolarHBondContact O-N 3.15Å; E161-N163 VanDerWaalsContact C-N 3.35Å; E161-N163 PolarHBondContact O-N 3.07Å; E161-I164 PolarHBondContact O-N 3.3Å; E161-L165 WeakPolarHBondContact O-CB 3.17Å; E161-L165 PolarHBondContact O-N 3.38Å
162	R	65	Low	64.1	Low	62 Å²	62	74.9 Å²	74.9	23%	0.234	39%	0.391	C	S	.	.	H	α-helix	trans	-62	-41.1	174.5	-72.5	-169	-81.2	164.2	-0.6	112.6	N152 K153 L155 A157 C158 S166	N152-R162 WeakPolarHBondContact O-CD 3.46Å; K153-R162 PolarHBondContact O-NH1 2.86Å; K153-R162 VanDerWaalsContact O-NH1 3.13Å; L155-R162 WeakPolarHBondContact O-CD 3.47Å; L155-R162 PolarHBondContact O-NH1 2.61Å; A157-R162 HydrophobicContact CB-CG 3.93Å; A157-R162 PolarHBondContact O-NE 3.08Å; A157-R162 PolarHBondContact O-NH2 2.8Å; C158-R162 PolarHBondContact O-N 3.09Å; R162-S166 WeakPolarHBondContact O-CB 3.49Å; R162-S166 PolarHBondContact O-N 2.96Å; R162-S166 PolarHBondContact O-OG 3.21Å
163	N	66.6	Low	64.1	Low	29 Å²	29	74.3 Å²	74.3	16%	0.155	39%	0.388	C	S	.	.	H	α-helix	trans	-69.3	-40.2	178.8	-69.8	-17.7	0	0	0	111.8	L99 I103 E159 K160 E161 S166 V167	L99-N163 HydrophobicContact CD2-CB 3.79Å; I103-N163 HydrophobicContact CD1-CB 4.09Å; E159-N163 WeakPolarHBondContact O-CB 3.39Å; E159-N163 PolarHBondContact O-N 3.09Å; E159-N163 VanDerWaalsContact O-N 3.1Å; E159-N163 PolarHBondContact O-ND2 3.37Å; K160-N163 PolarHBondContact O-N 3.37Å; E161-N163 VanDerWaalsContact C-N 3.35Å; E161-N163 PolarHBondContact O-N 3.07Å; N163-S166 PolarHBondContact O-N 2.94Å; N163-V167 VanDerWaalsContact O-CG2 3.3Å; N163-V167 WeakPolarHBondContact O-CG2 3.49Å; N163-V167 PolarHBondContact O-N 3.08Å
164	I	67.4	Low	64	Low	100 Å²	100	71.8 Å²	71.8	51%	0.513	38%	0.378	S	S	.	.	H	α-helix	trans	-62.3	-48	175.1	-67.8	163.4	0	0	0	110.4	K160 E161 S166 V167 E168	K160-I164 WeakPolarHBondContact O-CD1 3.32Å; K160-I164 VanDerWaalsContact O-CG1 3.25Å; K160-I164 WeakPolarHBondContact O-CG1 3.34Å; K160-I164 PolarHBondContact O-N 2.96Å; E161-I164 PolarHBondContact O-N 3.3Å; I164-S166 VanDerWaalsContact C-N 3.27Å; I164-S166 PolarHBondContact O-N 3.02Å; I164-V167 PolarHBondContact O-N 2.9Å; I164-V167 VanDerWaalsContact O-N 3.16Å; I164-E168 WeakPolarHBondContact O-CG 3.44Å; I164-E168 PolarHBondContact O-N 2.91Å
165	L	66.9	Low	64	Low	81 Å²	81	71.3 Å²	71.3	42%	0.424	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-37.8	178.8	-150.1	84.2	0	0	0	111.9	E161 E168 L169	E161-L165 WeakPolarHBondContact O-CB 3.17Å; E161-L165 PolarHBondContact O-N 3.38Å; L165-E168 PolarHBondContact O-N 3.2Å; L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 VanDerWaalsContact O-CG 3.3Å; L165-L169 WeakPolarHBondContact O-CG 3.3Å; L165-L169 PolarHBondContact O-N 2.73Å
166	S	68.6	Low	64.1	Low	9 Å²	9	67.7 Å²	67.7	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-67.3	-39.2	176.9	-58.3	0	0	0	0	111.9	R162 N163 I164 L170	R162-S166 WeakPolarHBondContact O-CB 3.49Å; R162-S166 PolarHBondContact O-N 2.96Å; R162-S166 PolarHBondContact O-OG 3.21Å; N163-S166 PolarHBondContact O-N 2.94Å; I164-S166 VanDerWaalsContact C-N 3.27Å; I164-S166 PolarHBondContact O-N 3.02Å; S166-L170 WeakPolarHBondContact O-CD1 3.25Å; S166-L170 WeakPolarHBondContact O-CG 3.47Å; S166-L170 PolarHBondContact O-N 2.69Å
167	V	66.2	Low	64.5	Low	31 Å²	31	61.1 Å²	61.1	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-44.1	174.6	171.9	0	0	0	0	111	M90 N163 I164 L169 L170 L171	M90-V167 HydrophobicContact CE-CG2 3.77Å; N163-V167 VanDerWaalsContact O-CG2 3.3Å; N163-V167 WeakPolarHBondContact O-CG2 3.49Å; N163-V167 PolarHBondContact O-N 3.08Å; I164-V167 PolarHBondContact O-N 2.9Å; I164-V167 VanDerWaalsContact O-N 3.16Å; V167-L169 PolarHBondContact O-N 3.45Å; V167-L170 PolarHBondContact O-N 3.33Å; V167-L171 HydrophobicContact CG1-CD1 3.95Å; V167-L171 WeakPolarHBondContact O-CG 3.44Å; V167-L171 PolarHBondContact O-N 3.43Å
168	E	65.1	Low	64.6	Low	108 Å²	108	65 Å²	65	51%	0.505	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-42.2	176.8	-72.9	-176.1	168.4	0	0	112.4	I164 L165 L171 I172	I164-E168 WeakPolarHBondContact O-CG 3.44Å; I164-E168 PolarHBondContact O-N 2.91Å; L165-E168 PolarHBondContact O-N 3.2Å; E168-L171 WeakPolarHBondContact O-CB 3.38Å; E168-L171 PolarHBondContact O-N 3.1Å; E168-I172 WeakPolarHBondContact O-CG1 3.41Å; E168-I172 PolarHBondContact O-N 2.88Å; E168-I172 VanDerWaalsContact O-N 3.11Å
169	L	67.7	Low	64.4	Low	24 Å²	24	67 Å²	67	13%	0.126	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-40	175.5	-74.8	168.5	0	0	0	112	A145 L148 V149 N152 L165 V167 L171 I172 V173	A145-L169 HydrophobicContact CB-CD2 4.26Å; L148-L169 HydrophobicContact CB-CD1 3.88Å; L148-L169 HydrophobicContact CB-CD2 4.42Å; L148-L169 HydrophobicContact CD1-CD2 4.38Å; V149-L169 HydrophobicContact CG2-CB 3.42Å; V149-L169 VanDerWaalsContact CG2-CB 3.42Å; V149-L169 HydrophobicContact CG2-CD1 3.84Å; V149-L169 HydrophobicContact CG2-CG 4.29Å; N152-L169 VanDerWaalsContact ND2-CD1 3.26Å; N152-L169 WeakPolarHBondContact ND2-CD1 3.06Å; L165-L169 WeakPolarHBondContact O-CB 3.48Å; L165-L169 VanDerWaalsContact O-CG 3.3Å; L165-L169 WeakPolarHBondContact O-CG 3.3Å; L165-L169 PolarHBondContact O-N 2.73Å; V167-L169 PolarHBondContact O-N 3.45Å; L169-L171 VanDerWaalsContact C-N 3.34Å; L169-I172 PolarHBondContact O-N 2.86Å; L169-V173 WeakPolarHBondContact O-CG2 3.44Å; L169-V173 PolarHBondContact O-N 3.41Å; L169-V173 VanDerWaalsContact O-N 3.12Å
170	L	66.8	Low	64.3	Low	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66	-35.5	175.7	-68.3	167.4	0	0	0	112	M87 I103 A106 L110 L146 V149 S166 V167 I172 V173 E174	M87-L170 HydrophobicContact CE-CB 3.89Å; M87-L170 HydrophobicContact SD-CB 3.47Å; M87-L170 WeakPolarHBondContact SD-CB 3.44Å; M87-L170 HydrophobicContact SD-CD1 4.09Å; M87-L170 HydrophobicContact SD-CG 4.38Å; I103-L170 HydrophobicContact CG2-CD1 4.19Å; A106-L170 HydrophobicContact CB-CD1 4.43Å; L110-L170 HydrophobicContact CD1-CD2 3.68Å; L146-L170 HydrophobicContact CD2-CD2 4.3Å; V149-L170 HydrophobicContact CG2-CD2 4.44Å; V149-L170 HydrophobicContact CG2-CG 4.32Å; S166-L170 WeakPolarHBondContact O-CD1 3.25Å; S166-L170 WeakPolarHBondContact O-CG 3.47Å; S166-L170 PolarHBondContact O-N 2.69Å; V167-L170 PolarHBondContact O-N 3.33Å; L170-I172 VanDerWaalsContact C-N 3.32Å; L170-I172 PolarHBondContact O-N 3.39Å; L170-V173 WeakPolarHBondContact O-CB 3.43Å; L170-V173 PolarHBondContact O-N 3.24Å; L170-E174 PolarHBondContact O-N 3.34Å
171	L	64.6	Low	64.1	Low	68 Å²	68	58.4 Å²	58.4	36%	0.356	28%	0.281	S	S	.	.	H	α-helix	trans	-64.8	-34.3	173.7	-80.8	155.8	0	0	0	112.2	M87 V167 E168 L169 E174 K175	M87-L171 HydrophobicContact CE-CB 4.48Å; M87-L171 HydrophobicContact CE-CD2 4.14Å; M87-L171 HydrophobicContact CE-CG 3.89Å; V167-L171 HydrophobicContact CG1-CD1 3.95Å; V167-L171 WeakPolarHBondContact O-CG 3.44Å; V167-L171 PolarHBondContact O-N 3.43Å; E168-L171 WeakPolarHBondContact O-CB 3.38Å; E168-L171 PolarHBondContact O-N 3.1Å; L169-L171 VanDerWaalsContact C-N 3.34Å; L171-E174 WeakPolarHBondContact O-CB 3.35Å; L171-K175 PolarHBondContact O-N 3.05Å; L171-K175 VanDerWaalsContact O-N 3.11Å
172	I	64.5	Low	63.5	Low	89 Å²	89	56.9 Å²	56.9	46%	0.456	28%	0.277	S	S	.	.	H	α-helix	trans	-67.6	-41.1	174.1	-67.5	165.7	0	0	0	110.4	E168 L169 L170 K175 A176	E168-I172 WeakPolarHBondContact O-CG1 3.41Å; E168-I172 PolarHBondContact O-N 2.88Å; E168-I172 VanDerWaalsContact O-N 3.11Å; L169-I172 PolarHBondContact O-N 2.86Å; L170-I172 VanDerWaalsContact C-N 3.32Å; L170-I172 PolarHBondContact O-N 3.39Å; I172-K175 PolarHBondContact O-N 3.26Å; I172-A176 WeakPolarHBondContact O-CB 3.44Å; I172-A176 PolarHBondContact O-N 3.49Å
173	V	66.1	Low	62.6	Low	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.9	-40.9	176.7	176.5	0	0	0	0	111.1	L110 L114 A145 L146 L169 L170 A176 L177	L110-V173 HydrophobicContact CB-CG1 4.31Å; L110-V173 HydrophobicContact CD1-CG1 4.33Å; L114-V173 HydrophobicContact CD1-CG1 4.41Å; A145-V173 HydrophobicContact CB-CG2 3.63Å; L146-V173 HydrophobicContact CD1-CG1 4.17Å; L146-V173 HydrophobicContact CD2-CG1 4.28Å; L146-V173 HydrophobicContact CD2-CG2 4.27Å; L146-V173 HydrophobicContact CG-CG1 4.09Å; L146-V173 HydrophobicContact CG-CG2 3.88Å; L169-V173 WeakPolarHBondContact O-CG2 3.44Å; L169-V173 PolarHBondContact O-N 3.41Å; L169-V173 VanDerWaalsContact O-N 3.12Å; L170-V173 WeakPolarHBondContact O-CB 3.43Å; L170-V173 PolarHBondContact O-N 3.24Å; V173-A176 PolarHBondContact O-N 3.06Å; V173-L177 HydrophobicContact CG1-CD1 4.09Å; V173-L177 PolarHBondContact O-N 3.28Å
174	E	63.2	Low	61.4	Low	42 Å²	42	61.4 Å²	61.4	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-54.9	174	-179.9	-160.4	148.3	0	0	111.4	L84 M87 L170 L171 A176 L177 Q178	L84-E174 HydrophobicContact CD2-CG 3.52Å; L84-E174 WeakPolarHBondContact CD2-OE1 3.36Å; L84-E174 HydrophobicContact CG-CG 4.41Å; M87-E174 HydrophobicContact CE-CB 4.47Å; M87-E174 WeakPolarHBondContact CE-OE2 3.46Å; L170-E174 PolarHBondContact O-N 3.34Å; L171-E174 WeakPolarHBondContact O-CB 3.35Å; E174-A176 PolarHBondContact O-N 3.27Å; E174-L177 PolarHBondContact O-N 3.32Å; E174-L177 VanDerWaalsContact O-N 3.08Å; E174-Q178 PolarHBondContact O-N 3.39Å
175	K	62.2	Low	60.3	Low	136 Å²	136	60.5 Å²	60.5	59%	0.591	30%	0.301	S	S	*	.	H	α-helix	trans	-57.4	-42.2	178.2	-76.2	-177	177.3	178.3	0	111.2	L171 I172 L177 Q178 F179	L171-K175 PolarHBondContact O-N 3.05Å; L171-K175 VanDerWaalsContact O-N 3.11Å; I172-K175 PolarHBondContact O-N 3.26Å; K175-L177 PolarHBondContact O-N 3.33Å; K175-Q178 PolarHBondContact O-N 2.81Å; K175-F179 WeakPolarHBondContact O-CD2 3.28Å; K175-F179 PolarHBondContact O-N 3.29Å
176	A	63.3	Low	58.8	Low	11 Å²	11	60 Å²	60	9%	0.091	30%	0.297	C	S	.	.	H	α-helix	trans	-63.6	-40.1	177.9	0	0	0	0	0	112.5	L138 A142 I172 V173 E174 F179 L180	L138-A176 HydrophobicContact CD2-CB 4.09Å; L138-A176 WeakPolarHBondContact CD2-O 3.13Å; L138-A176 HydrophobicContact CG-CB 4.32Å; A142-A176 HydrophobicContact CB-CB 3.79Å; I172-A176 WeakPolarHBondContact O-CB 3.44Å; I172-A176 PolarHBondContact O-N 3.49Å; V173-A176 PolarHBondContact O-N 3.06Å; E174-A176 PolarHBondContact O-N 3.27Å; A176-F179 PolarHBondContact O-N 3.25Å; A176-L180 VanDerWaalsContact O-CG 3.24Å; A176-L180 WeakPolarHBondContact O-CG 3.34Å; A176-L180 PolarHBondContact O-N 2.75Å
177	L	64.2	Low	57.4	Low	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.9	-40.3	177.4	-81.2	169.6	0	0	0	112.7	L110 L114 M117 V173 E174 K175 F179 L180 E181	L110-L177 HydrophobicContact CD2-CD1 3.54Å; L114-L177 HydrophobicContact CD1-CD1 4.39Å; L114-L177 HydrophobicContact CD1-CD2 3.86Å; L114-L177 HydrophobicContact CD1-CG 4.1Å; M117-L177 HydrophobicContact CE-CD2 4.13Å; V173-L177 HydrophobicContact CG1-CD1 4.09Å; V173-L177 PolarHBondContact O-N 3.28Å; E174-L177 PolarHBondContact O-N 3.32Å; E174-L177 VanDerWaalsContact O-N 3.08Å; K175-L177 PolarHBondContact O-N 3.33Å; L177-F179 PolarHBondContact O-N 3.49Å; L177-L180 HydrophobicContact CD2-CD1 4.33Å; L177-L180 PolarHBondContact O-N 3.19Å; L177-E181 PolarHBondContact O-N 3.49Å
178	Q	61.1	Low	56	Low	122 Å²	122	70.8 Å²	70.8	57%	0.57	35%	0.349	S	S	*	.	H	α-helix	trans	-58	-38.2	174.8	-162.4	177	22.6	0	0	111.7	E174 K175	E174-Q178 PolarHBondContact O-N 3.39Å; K175-Q178 PolarHBondContact O-N 2.81Å
179	F	56.3	Low	54.7	Low	126 Å²	126	70.6 Å²	70.6	55%	0.553	35%	0.352	S	S	*	.	H	α-helix	trans	-72.1	-24.6	173.6	-81.8	-68.1	0	0	0	114.3	L138 K175 A176 L177	L138-F179 HydrophobicContact CD2-CB 3.67Å; K175-F179 WeakPolarHBondContact O-CD2 3.28Å; K175-F179 PolarHBondContact O-N 3.29Å; A176-F179 PolarHBondContact O-N 3.25Å; L177-F179 PolarHBondContact O-N 3.49Å
180	L	60.9	Low	53.5	Low	9 Å²	9	76 Å²	76	5%	0.047	38%	0.377	C	S	.	.	H	α-helix	trans	-84.3	-26.3	179.4	-67.2	167	0	0	0	112.5	M117 F135 L138 A176 L177	M117-L180 HydrophobicContact CE-CB 3.42Å; M117-L180 VanDerWaalsContact CE-CB 3.42Å; M117-L180 HydrophobicContact CE-CD1 4.42Å; F135-L180 HydrophobicContact CD1-CD2 4.05Å; F135-L180 HydrophobicContact CD2-CD2 3.51Å; F135-L180 HydrophobicContact CE1-CD2 3.82Å; F135-L180 HydrophobicContact CE2-CB 4.22Å; F135-L180 HydrophobicContact CE2-CD2 3.26Å; F135-L180 HydrophobicContact CE2-CG 4.33Å; F135-L180 HydrophobicContact CG-CD2 3.91Å; F135-L180 HydrophobicContact CZ-CB 4.34Å; F135-L180 HydrophobicContact CZ-CD2 3.43Å; F135-L180 VanDerWaalsContact CZ-CD2 3.43Å; F135-L180 HydrophobicContact CZ-CG 4.45Å; L138-L180 HydrophobicContact CB-CD2 4.48Å; L138-L180 HydrophobicContact CD2-CD2 4.23Å; L138-L180 HydrophobicContact CD2-CG 4.08Å; A176-L180 VanDerWaalsContact O-CG 3.24Å; A176-L180 WeakPolarHBondContact O-CG 3.34Å; A176-L180 PolarHBondContact O-N 2.75Å; L177-L180 HydrophobicContact CD2-CD1 4.33Å; L177-L180 PolarHBondContact O-N 3.19Å
181	E	56.2	Low	52.3	Low	53 Å²	53	80.3 Å²	80.3	25%	0.248	40%	0.403	C	S	.	.	H	α-helix	trans	-74.7	-34.1	-179.9	-74.8	-174.6	164.1	0	0	113.2	H80 M117 L177 P183	H80-E181 IonicContact ND1-OE1 2.87Å; H80-E181 IonicContact ND1-OE2 3.35Å; M117-E181 HydrophobicContact CE-CG 4.26Å; L177-E181 PolarHBondContact O-N 3.49Å; E181-P183 WeakPolarHBondContact O-CD 3.37Å
182	D	49.8	Very low	51.1	Low	94 Å²	94	82.3 Å²	82.3	50%	0.503	41%	0.409	S	S	.	.			trans	-120.9	79.5	179.2	-76.4	-35.7	0	0	0	112.6	F184 T185	D182-F184 PolarHBondContact O-N 3.04Å; D182-T185 HydrophobicContact CB-CG2 3.79Å; D182-T185 PolarHBondContact O-N 3.44Å; D182-T185 VanDerWaalsContact O-N 3.09Å; D182-T185 PolarHBondContact O-OG1 3.24Å
183	P	47.6	Very low	49.8	Very low	41 Å²	41	79.7 Å²	79.7	27%	0.266	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-62.5	-17.9	175.8	25.2	-33.2	0	0	0	112.8	F131 E181	F131-P183 HydrophobicContact CE1-CB 3.84Å; F131-P183 HydrophobicContact CZ-CB 4.13Å; F131-P183 WeakPolarHBondContact CZ-O 3.48Å; E181-P183 WeakPolarHBondContact O-CD 3.37Å
184	F	41.2	Very low	48.8	Very low	146 Å²	146	84.4 Å²	84.4	64%	0.64	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-84.2	-7.5	178	-73.6	-82.2	0	0	0	114.4	D182 M186 L187	D182-F184 PolarHBondContact O-N 3.04Å; F184-M186 PolarHBondContact O-N 3.02Å; F184-L187 HydrophobicContact CD1-CB 4.33Å; F184-L187 HydrophobicContact CD1-CD1 3.87Å; F184-L187 HydrophobicContact CD1-CD2 4.22Å; F184-L187 HydrophobicContact CD1-CG 4.36Å; F184-L187 HydrophobicContact CE1-CD1 4.21Å; F184-L187 WeakPolarHBondContact O-CA 3.07Å; F184-L187 VanDerWaalsContact O-CB 3.28Å; F184-L187 WeakPolarHBondContact O-CB 3.42Å; F184-L187 PolarHBondContact O-N 3.2Å
185	T	43.3	Very low	47.9	Very low	81 Å²	81	88.8 Å²	88.8	50%	0.497	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-67.7	-19.7	166.6	52.1	0	0	0	0	111.7	D182 L187	D182-T185 HydrophobicContact CB-CG2 3.79Å; D182-T185 PolarHBondContact O-N 3.44Å; D182-T185 VanDerWaalsContact O-N 3.09Å; D182-T185 PolarHBondContact O-OG1 3.24Å; T185-L187 VanDerWaalsContact C-N 3.25Å; T185-L187 PolarHBondContact O-N 3.02Å
186	M	36.6	Very low	46.7	Very low	70 Å²	70	84.5 Å²	84.5	35%	0.345	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-76.4	-5.7	165.5	-74.4	-158.2	56.5	0	0	114.3	F131 F184 M188 K192	F131-M186 HydrophobicContact CD2-CE 4.23Å; F131-M186 HydrophobicContact CD2-SD 4.16Å; F131-M186 HydrophobicContact CE2-CB 3.57Å; F131-M186 HydrophobicContact CE2-CE 3.71Å; F131-M186 HydrophobicContact CE2-CG 3.85Å; F131-M186 HydrophobicContact CE2-SD 3.26Å; F131-M186 WeakPolarHBondContact CE2-SD 3.42Å; F131-M186 HydrophobicContact CZ-CB 3.87Å; F131-M186 HydrophobicContact CZ-CG 3.99Å; F131-M186 HydrophobicContact CZ-SD 3.62Å; F184-M186 PolarHBondContact O-N 3.02Å; M186-M188 VanDerWaalsContact C-N 3.3Å; M186-K192 HydrophobicContact CE-CD 4.21Å
187	L	38.6	Very low	46	Very low	125 Å²	125	85 Å²	85	65%	0.654	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-87.6	0.7	173	-117.5	93.8	0	0	0	113.2	F184 T185 D189	F184-L187 HydrophobicContact CD1-CB 4.33Å; F184-L187 HydrophobicContact CD1-CD1 3.87Å; F184-L187 HydrophobicContact CD1-CD2 4.22Å; F184-L187 HydrophobicContact CD1-CG 4.36Å; F184-L187 HydrophobicContact CE1-CD1 4.21Å; F184-L187 WeakPolarHBondContact O-CA 3.07Å; F184-L187 VanDerWaalsContact O-CB 3.28Å; F184-L187 WeakPolarHBondContact O-CB 3.42Å; F184-L187 PolarHBondContact O-N 3.2Å; T185-L187 VanDerWaalsContact C-N 3.25Å; T185-L187 PolarHBondContact O-N 3.02Å; L187-D189 PolarHBondContact O-N 3.33Å
188	M	37.3	Very low	45.3	Very low	141 Å²	141	90.8 Å²	90.8	70%	0.695	46%	0.464	S	S	*	.			trans	-96.7	76.3	162.3	-69.4	-73.7	139.3	0	0	107.7	M186 E190	M186-M188 VanDerWaalsContact C-N 3.3Å; M188-E190 PolarHBondContact O-N 3.46Å
189	D	37.7	Very low	44.8	Very low	105 Å²	105	90.5 Å²	90.5	56%	0.561	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	54.2	176.2	-137.6	7.2	0	0	0	109.7	L187 A193	L187-D189 PolarHBondContact O-N 3.33Å; D189-A193 VanDerWaalsContact O-CB 3.26Å; D189-A193 WeakPolarHBondContact O-CB 3.45Å
190	E	41	Very low	44.6	Very low	138 Å²	138	90 Å²	90	65%	0.645	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-47.7	169.3	-72.1	-170.6	162.4	0	0	109.3	M188 E194	M188-E190 PolarHBondContact O-N 3.46Å; E190-E194 WeakPolarHBondContact O-CB 3.47Å; E190-E194 WeakPolarHBondContact O-CG 3.49Å; E190-E194 PolarHBondContact O-N 2.83Å
191	T	42.7	Very low	44.6	Very low	90 Å²	90	90.2 Å²	90.2	55%	0.552	47%	0.471	S	S	*	.	H	α-helix	trans	-80.5	-32.9	-174.3	56.3	0	0	0	0	115	E195	T191-E195 WeakPolarHBondContact O-CB 3.36Å; T191-E195 WeakPolarHBondContact O-CG 3.28Å; T191-E195 PolarHBondContact O-N 2.9Å
192	K	39	Very low	45	Very low	109 Å²	109	88.9 Å²	88.9	47%	0.474	47%	0.467	S	S	.	.	H	α-helix	trans	-81.2	-29.9	176.2	-73.5	-176.2	179.7	178.1	0	112.7	M186 A196	M186-K192 HydrophobicContact CE-CD 4.21Å; K192-A196 WeakPolarHBondContact O-CB 3.33Å; K192-A196 PolarHBondContact O-N 3.36Å
193	A	38.2	Very low	45.8	Very low	35 Å²	35	90.2 Å²	90.2	29%	0.289	47%	0.468	S	S	.	.	H	α-helix	trans	-69.8	-37.5	167.8	0	0	0	0	0	110.6	D189 A197	D189-A193 VanDerWaalsContact O-CB 3.26Å; D189-A193 WeakPolarHBondContact O-CB 3.45Å; A193-A197 WeakPolarHBondContact O-CA 3.46Å; A193-A197 WeakPolarHBondContact O-CB 3.31Å; A193-A197 PolarHBondContact O-N 3.09Å
194	E	44.4	Very low	46.8	Very low	99 Å²	99	92.9 Å²	92.9	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-68.6	-48.3	173.3	-78.5	172.1	168.8	0	0	112.5	E190 A197 E198	E190-E194 WeakPolarHBondContact O-CB 3.47Å; E190-E194 WeakPolarHBondContact O-CG 3.49Å; E190-E194 PolarHBondContact O-N 2.83Å; E194-A197 CarbonylContact O-C 3.58Å; E194-A197 PolarHBondContact O-N 3.01Å; E194-E198 VanDerWaalsContact O-CB 3.29Å; E194-E198 WeakPolarHBondContact O-CB 3.38Å; E194-E198 WeakPolarHBondContact O-CG 3.45Å; E194-E198 PolarHBondContact O-N 3.43Å
195	E	43.5	Very low	48.3	Very low	133 Å²	133	86.6 Å²	86.6	62%	0.621	45%	0.453	S	S	*	.	H	α-helix	trans	-66.5	-39.9	177.9	-77.1	179.8	169.6	0	0	112.1	T191 L199	T191-E195 WeakPolarHBondContact O-CB 3.36Å; T191-E195 WeakPolarHBondContact O-CG 3.28Å; T191-E195 PolarHBondContact O-N 2.9Å; E195-L199 WeakPolarHBondContact O-CB 3.36Å; E195-L199 PolarHBondContact O-N 3.17Å
196	A	38.5	Very low	49.7	Very low	46 Å²	46	86 Å²	86	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-71	-37.5	174	0	0	0	0	0	111.3	K192 I200	K192-A196 WeakPolarHBondContact O-CB 3.33Å; K192-A196 PolarHBondContact O-N 3.36Å; A196-I200 HydrophobicContact CB-CD1 4.38Å; A196-I200 WeakPolarHBondContact O-CB 3.44Å; A196-I200 VanDerWaalsContact O-CD1 3.25Å; A196-I200 WeakPolarHBondContact O-CD1 3.26Å; A196-I200 WeakPolarHBondContact O-CG1 3.34Å; A196-I200 PolarHBondContact O-N 2.95Å
197	A	48.6	Very low	51.5	Low	23 Å²	23	86.5 Å²	86.5	19%	0.19	45%	0.448	C	S	.	.	H	α-helix	trans	-67.5	-41.7	175.1	0	0	0	0	0	111.3	A193 E194 S201 M230	A193-A197 WeakPolarHBondContact O-CA 3.46Å; A193-A197 WeakPolarHBondContact O-CB 3.31Å; A193-A197 PolarHBondContact O-N 3.09Å; E194-A197 CarbonylContact O-C 3.58Å; E194-A197 PolarHBondContact O-N 3.01Å; A197-S201 WeakPolarHBondContact O-CA 3.41Å; A197-S201 WeakPolarHBondContact O-CB 3.31Å; A197-S201 PolarHBondContact O-N 3.49Å; A197-S201 PolarHBondContact O-OG 3.48Å; A197-M230 HydrophobicContact CB-CE 3.54Å; A197-M230 HydrophobicContact CB-SD 4.21Å
198	E	49.9	Very low	53.3	Low	120 Å²	120	83.6 Å²	83.6	56%	0.561	44%	0.436	S	S	*	.	H	α-helix	trans	-64.4	-45.8	175.3	-80.1	-174.2	155.2	0	0	111.3	E194 S201 C202	E194-E198 VanDerWaalsContact O-CB 3.29Å; E194-E198 WeakPolarHBondContact O-CB 3.38Å; E194-E198 WeakPolarHBondContact O-CG 3.45Å; E194-E198 PolarHBondContact O-N 3.43Å; E198-S201 PolarHBondContact O-N 2.91Å; E198-S201 PolarHBondContact O-OG 2.85Å; E198-C202 WeakPolarHBondContact O-CB 3.32Å; E198-C202 PolarHBondContact O-N 3.28Å; E198-C202 PolarHBondContact O-SG 3.05Å
199	L	49.2	Very low	55.4	Low	117 Å²	117	77.8 Å²	77.8	61%	0.613	41%	0.408	S	S	*	.	H	α-helix	trans	-70.4	-35.6	-179.9	-156.2	86.9	0	0	0	112.6	E195	E195-L199 WeakPolarHBondContact O-CB 3.36Å; E195-L199 PolarHBondContact O-N 3.17Å
200	I	52.6	Low	57.3	Low	115 Å²	115	78.4 Å²	78.4	59%	0.59	41%	0.411	S	S	*	.	H	α-helix	trans	-73.6	-43.1	175.3	-67.6	165.9	0	0	0	109.7	A196 K203 L204	A196-I200 HydrophobicContact CB-CD1 4.38Å; A196-I200 WeakPolarHBondContact O-CB 3.44Å; A196-I200 VanDerWaalsContact O-CD1 3.25Å; A196-I200 WeakPolarHBondContact O-CD1 3.26Å; A196-I200 WeakPolarHBondContact O-CG1 3.34Å; A196-I200 PolarHBondContact O-N 2.95Å; I200-K203 PolarHBondContact O-N 3.42Å; I200-L204 WeakPolarHBondContact O-CB 3.27Å; I200-L204 PolarHBondContact O-N 3.34Å
201	S	61.2	Low	59.1	Low	14 Å²	14	77.9 Å²	77.9	10%	0.098	41%	0.412	C	S	.	.	H	α-helix	trans	-75.2	-29.9	-176.5	59	0	0	0	0	113.3	A197 E198 L204 T205 T226	A197-S201 WeakPolarHBondContact O-CA 3.41Å; A197-S201 WeakPolarHBondContact O-CB 3.31Å; A197-S201 PolarHBondContact O-N 3.49Å; A197-S201 PolarHBondContact O-OG 3.48Å; E198-S201 PolarHBondContact O-N 2.91Å; E198-S201 PolarHBondContact O-OG 2.85Å; S201-L204 PolarHBondContact O-N 3.35Å; S201-T205 VanDerWaalsContact O-CB 3.26Å; S201-T205 WeakPolarHBondContact O-CB 3.36Å; S201-T205 PolarHBondContact O-N 3.4Å; S201-T205 PolarHBondContact O-OG1 3.23Å; S201-T226 PolarHBondContact O-OG1 3.42Å; S201-T226 WeakPolarHBondContact OG-CG2 3.49Å
202	C	63.3	Low	60.9	Low	24 Å²	24	79.1 Å²	79.1	16%	0.162	41%	0.414	C	S	.	.	H	α-helix	trans	-66	-44	171	-77.5	0	0	0	0	112.1	E198 T205 Q206 N223	E198-C202 WeakPolarHBondContact O-CB 3.32Å; E198-C202 PolarHBondContact O-N 3.28Å; E198-C202 PolarHBondContact O-SG 3.05Å; C202-T205 PolarHBondContact O-N 3.29Å; C202-Q206 WeakPolarHBondContact O-CG 3.38Å; C202-Q206 PolarHBondContact O-N 3.43Å; C202-N223 PolarHBondContact SG-OD1 3.5Å
203	K	67.1	Low	62.9	Low	122 Å²	122	76.6 Å²	76.6	53%	0.53	42%	0.42	S	S	.	.	H	α-helix	trans	-65.6	-39.8	174.3	-76.6	178.8	-179	172.5	0	112	I200 Q206 L207	I200-K203 PolarHBondContact O-N 3.42Å; K203-Q206 PolarHBondContact O-N 3.46Å; K203-L207 WeakPolarHBondContact O-CB 3.32Å; K203-L207 PolarHBondContact O-N 2.92Å
204	L	69.7	Low	64.8	Low	97 Å²	97	82.3 Å²	82.3	51%	0.508	44%	0.435	S	S	.	.	H	α-helix	trans	-65.5	-40.6	178.1	-169.6	42.3	0	0	0	110.6	I200 S201 L207 V208	I200-L204 WeakPolarHBondContact O-CB 3.27Å; I200-L204 PolarHBondContact O-N 3.34Å; S201-L204 PolarHBondContact O-N 3.35Å; L204-L207 PolarHBondContact O-N 3.37Å; L204-V208 HydrophobicContact CD2-CG2 4.45Å; L204-V208 VanDerWaalsContact O-CG2 3.29Å; L204-V208 WeakPolarHBondContact O-CG2 3.3Å; L204-V208 PolarHBondContact O-N 2.96Å
205	T	72.6	Confident	66.1	Low	15 Å²	15	86.3 Å²	86.3	9%	0.092	45%	0.453	C	S	.	.	H	α-helix	trans	-67.5	-42.2	175.8	-54.4	0	0	0	0	111.3	S201 C202 L207 V208 V209 I225 T226	S201-T205 VanDerWaalsContact O-CB 3.26Å; S201-T205 WeakPolarHBondContact O-CB 3.36Å; S201-T205 PolarHBondContact O-N 3.4Å; S201-T205 PolarHBondContact O-OG1 3.23Å; C202-T205 PolarHBondContact O-N 3.29Å; T205-L207 VanDerWaalsContact C-N 3.33Å; T205-L207 PolarHBondContact O-N 2.85Å; T205-V208 PolarHBondContact O-N 3.41Å; T205-V209 WeakPolarHBondContact O-CB 3.49Å; T205-V209 VanDerWaalsContact O-CG2 3.24Å; T205-V209 WeakPolarHBondContact O-CG2 3.45Å; T205-V209 PolarHBondContact O-N 2.69Å; T205-I225 HydrophobicContact CG2-CB 4.11Å; T205-I225 HydrophobicContact CG2-CG2 3.74Å; T205-T226 PolarHBondContact OG1-OG1 3.27Å
206	Q	73.1	Confident	67.4	Low	69 Å²	69	88 Å²	88	32%	0.322	47%	0.467	S	S	.	.	H	α-helix	trans	-59.1	-43.8	171.2	-76	175.4	-13.3	0	0	111.6	C202 K203 V208 V209 D210 C222	C202-Q206 WeakPolarHBondContact O-CG 3.38Å; C202-Q206 PolarHBondContact O-N 3.43Å; K203-Q206 PolarHBondContact O-N 3.46Å; Q206-V208 VanDerWaalsContact C-N 3.35Å; Q206-V208 PolarHBondContact O-N 2.93Å; Q206-V209 WeakPolarHBondContact O-CB 3.39Å; Q206-V209 PolarHBondContact O-N 2.89Å; Q206-D210 WeakPolarHBondContact O-CB 3.13Å; Q206-D210 VanDerWaalsContact O-CG 3.26Å; Q206-D210 PolarHBondContact O-N 3.42Å; Q206-C222 HydrophobicContact CG-CB 4.36Å
207	L	73.9	Confident	69	Low	79 Å²	79	88.6 Å²	88.6	41%	0.414	47%	0.465	S	S	.	.	H	α-helix	trans	-64.6	-38.2	178.6	-144.4	154.8	0	0	0	111.7	K203 L204 T205 D210 I211	K203-L207 WeakPolarHBondContact O-CB 3.32Å; K203-L207 PolarHBondContact O-N 2.92Å; L204-L207 PolarHBondContact O-N 3.37Å; T205-L207 VanDerWaalsContact C-N 3.33Å; T205-L207 PolarHBondContact O-N 2.85Å; L207-D210 PolarHBondContact O-N 3.03Å; L207-I211 HydrophobicContact CD2-CD1 3.62Å; L207-I211 HydrophobicContact CD2-CG1 4.2Å; L207-I211 WeakPolarHBondContact O-CD1 3.44Å; L207-I211 WeakPolarHBondContact O-CG1 3.42Å; L207-I211 PolarHBondContact O-N 3.31Å
208	V	76.4	Confident	70.4	Confident	65 Å²	65	91 Å²	91	39%	0.394	48%	0.481	S	S	.	.	H	α-helix	trans	-67.6	-40.8	173.9	171.5	0	0	0	0	111.5	L204 T205 Q206 D210 I211 L212	L204-V208 HydrophobicContact CD2-CG2 4.45Å; L204-V208 VanDerWaalsContact O-CG2 3.29Å; L204-V208 WeakPolarHBondContact O-CG2 3.3Å; L204-V208 PolarHBondContact O-N 2.96Å; T205-V208 PolarHBondContact O-N 3.41Å; Q206-V208 VanDerWaalsContact C-N 3.35Å; Q206-V208 PolarHBondContact O-N 2.93Å; V208-D210 VanDerWaalsContact C-N 3.32Å; V208-D210 PolarHBondContact O-N 3.31Å; V208-I211 PolarHBondContact O-N 3.01Å; V208-L212 HydrophobicContact CG1-CD1 3.93Å; V208-L212 HydrophobicContact CG1-CG 4.47Å; V208-L212 WeakPolarHBondContact O-CB 3.47Å; V208-L212 VanDerWaalsContact O-CG 3.31Å; V208-L212 WeakPolarHBondContact O-CG 3.43Å; V208-L212 PolarHBondContact O-N 3.44Å
209	V	80.2	Confident	71.7	Confident	19 Å²	19	91.9 Å²	91.9	12%	0.115	49%	0.485	C	S	.	.	H	α-helix	trans	-61	-42.9	174.8	165.8	0	0	0	0	110.9	T205 Q206 L212 G213 Y214 V217	T205-V209 WeakPolarHBondContact O-CB 3.49Å; T205-V209 VanDerWaalsContact O-CG2 3.24Å; T205-V209 WeakPolarHBondContact O-CG2 3.45Å; T205-V209 PolarHBondContact O-N 2.69Å; Q206-V209 WeakPolarHBondContact O-CB 3.39Å; Q206-V209 PolarHBondContact O-N 2.89Å; V209-L212 PolarHBondContact O-N 2.9Å; V209-G213 PolarHBondContact O-N 3.4Å; V209-Y214 PolarHBondContact O-N 2.98Å; V209-V217 HydrophobicContact CG1-CB 4.04Å; V209-V217 HydrophobicContact CG1-CG2 3.46Å; V209-V217 VanDerWaalsContact CG1-CG2 3.46Å
210	D	78.5	Confident	73.1	Confident	117 Å²	117	89.5 Å²	89.5	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-64.7	-42.2	176	-71.3	-18.4	0	0	0	111.6	Q206 L207 V208 L212 G213	Q206-D210 WeakPolarHBondContact O-CB 3.13Å; Q206-D210 VanDerWaalsContact O-CG 3.26Å; Q206-D210 PolarHBondContact O-N 3.42Å; L207-D210 PolarHBondContact O-N 3.03Å; V208-D210 VanDerWaalsContact C-N 3.32Å; V208-D210 PolarHBondContact O-N 3.31Å; D210-L212 VanDerWaalsContact C-N 3.33Å; D210-L212 PolarHBondContact O-N 3.49Å; D210-G213 PolarHBondContact O-N 3.44Å; D210-G213 VanDerWaalsContact O-N 3.13Å
211	I	78.4	Confident	74.4	Confident	128 Å²	128	85.8 Å²	85.8	66%	0.656	47%	0.469	S	S	*	.	H	α-helix	trans	-62.8	-39.7	176	-71.7	163.9	0	0	0	111.4	L207 V208 G213	L207-I211 HydrophobicContact CD2-CD1 3.62Å; L207-I211 HydrophobicContact CD2-CG1 4.2Å; L207-I211 WeakPolarHBondContact O-CD1 3.44Å; L207-I211 WeakPolarHBondContact O-CG1 3.42Å; L207-I211 PolarHBondContact O-N 3.31Å; V208-I211 PolarHBondContact O-N 3.01Å; I211-G213 PolarHBondContact O-N 2.95Å
212	L	81.7	Confident	75.3	Confident	115 Å²	115	85.2 Å²	85.2	60%	0.602	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-8.8	178	-69.5	169.5	0	0	0	113	V208 V209 D210 Y214	V208-L212 HydrophobicContact CG1-CD1 3.93Å; V208-L212 HydrophobicContact CG1-CG 4.47Å; V208-L212 WeakPolarHBondContact O-CB 3.47Å; V208-L212 VanDerWaalsContact O-CG 3.31Å; V208-L212 WeakPolarHBondContact O-CG 3.43Å; V208-L212 PolarHBondContact O-N 3.44Å; V209-L212 PolarHBondContact O-N 2.9Å; D210-L212 VanDerWaalsContact C-N 3.33Å; D210-L212 PolarHBondContact O-N 3.49Å; L212-Y214 HydrophobicContact CB-CD2 3.7Å; L212-Y214 HydrophobicContact CB-CE2 3.82Å; L212-Y214 HydrophobicContact CD1-CE2 4.38Å
213	G	79.6	Confident	76	Confident	57 Å²	57	88 Å²	88	59%	0.588	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	17.1	174.6	0	0	0	0	0	115	V209 D210 I211	V209-G213 PolarHBondContact O-N 3.4Å; D210-G213 PolarHBondContact O-N 3.44Å; D210-G213 VanDerWaalsContact O-N 3.13Å; I211-G213 PolarHBondContact O-N 2.95Å
214	Y	78.2	Confident	76.7	Confident	155 Å²	155	89.8 Å²	89.8	61%	0.608	49%	0.488	S	S	*	.			trans	-83.2	114.9	175.7	-67.4	-74.8	0	0	0	110.5	V209 L212	V209-Y214 PolarHBondContact O-N 2.98Å; L212-Y214 HydrophobicContact CB-CD2 3.7Å; L212-Y214 HydrophobicContact CB-CE2 3.82Å; L212-Y214 HydrophobicContact CD1-CE2 4.38Å
215	Q	73.2	Confident	77.3	Confident	182 Å²	182	89.1 Å²	89.1	85%	0.85	48%	0.484	S	S	*	.			trans	-92	140.4	174.8	-62.4	-173.2	-1.3	0	0	110.9
216	N	69	Low	77.6	Confident	169 Å²	169	88.6 Å²	88.6	90%	0.904	48%	0.481	S	S	*	.			trans	69.4	47.2	177.6	-63.9	-26.7	0	0	0	117.3
217	V	72	Confident	77.9	Confident	58 Å²	58	88 Å²	88	35%	0.352	49%	0.488	S	S	.	.			trans	-80.6	128.6	165.9	-175	0	0	0	0	109.7	V209 A221	V209-V217 HydrophobicContact CG1-CB 4.04Å; V209-V217 HydrophobicContact CG1-CG2 3.46Å; V209-V217 VanDerWaalsContact CG1-CG2 3.46Å; V217-A221 HydrophobicContact CG1-CB 4.01Å
218	S	79.7	Confident	78.4	Confident	74 Å²	74	92.2 Å²	92.2	52%	0.517	50%	0.5	S	S	.	.			trans	-64.6	140.4	177.8	69.4	0	0	0	0	111.1	A220 A221 C222	S218-A220 PolarHBondContact O-N 3.43Å; S218-A220 VanDerWaalsContact O-N 3.14Å; S218-A221 WeakPolarHBondContact O-CB 3.47Å; S218-A221 PolarHBondContact O-N 3.32Å; S218-A221 WeakPolarHBondContact OG-CB 3.25Å; S218-A221 PolarHBondContact OG-N 3.09Å; S218-C222 PolarHBondContact O-N 3.05Å
219	E	76.8	Confident	78.6	Confident	138 Å²	138	91.9 Å²	91.9	65%	0.645	50%	0.5	S	S	*	.	H	α-helix	trans	-55.3	-33.9	178.1	-68.5	-175.4	158.7	0	0	112.9	A221 C222 N223	E219-A221 VanDerWaalsContact C-N 3.33Å; E219-A221 PolarHBondContact O-N 3.28Å; E219-C222 PolarHBondContact O-N 3.36Å; E219-N223 PolarHBondContact O-N 3.04Å; E219-N223 PolarHBondContact O-OD1 2.86Å
220	A	78.9	Confident	78.6	Confident	67 Å²	67	93.3 Å²	93.3	55%	0.554	51%	0.506	S	S	*	.	H	α-helix	trans	-60.5	-39.3	175.5	0	0	0	0	0	113.1	S218 N223 E224	S218-A220 PolarHBondContact O-N 3.43Å; S218-A220 VanDerWaalsContact O-N 3.14Å; A220-N223 PolarHBondContact O-N 3.05Å; A220-E224 PolarHBondContact O-N 2.83Å; A220-E224 VanDerWaalsContact O-N 3.12Å
221	A	79.8	Confident	78.7	Confident	37 Å²	37	91.6 Å²	91.6	31%	0.306	50%	0.503	S	S	.	.	H	α-helix	trans	-69.8	-38.6	176.7	0	0	0	0	0	111.7	V217 S218 E219 N223 E224 I225	V217-A221 HydrophobicContact CG1-CB 4.01Å; S218-A221 WeakPolarHBondContact O-CB 3.47Å; S218-A221 PolarHBondContact O-N 3.32Å; S218-A221 WeakPolarHBondContact OG-CB 3.25Å; S218-A221 PolarHBondContact OG-N 3.09Å; E219-A221 VanDerWaalsContact C-N 3.33Å; E219-A221 PolarHBondContact O-N 3.28Å; A221-N223 VanDerWaalsContact C-N 3.29Å; A221-N223 PolarHBondContact O-N 3.33Å; A221-E224 PolarHBondContact O-N 3.33Å; A221-I225 VanDerWaalsContact O-CG1 3.3Å; A221-I225 WeakPolarHBondContact O-CG1 3.39Å; A221-I225 PolarHBondContact O-N 2.72Å
222	C	78.4	Confident	79	Confident	2 Å²	2	88.3 Å²	88.3	1%	0.014	49%	0.485	C	S	.	.	H	α-helix	trans	-61.8	-38.7	173.6	-67.8	0	0	0	0	111.7	Q206 S218 E219 T226	Q206-C222 HydrophobicContact CG-CB 4.36Å; S218-C222 PolarHBondContact O-N 3.05Å; E219-C222 PolarHBondContact O-N 3.36Å; C222-T226 WeakPolarHBondContact O-CB 3.46Å; C222-T226 PolarHBondContact O-N 2.84Å; C222-T226 PolarHBondContact O-OG1 2.99Å
223	N	78.3	Confident	79.1	Confident	84 Å²	84	85 Å²	85	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-66.7	-40.6	177.5	-64.5	-7.6	0	0	0	112.1	C202 E219 A220 A221 T226 A227	C202-N223 PolarHBondContact SG-OD1 3.5Å; E219-N223 PolarHBondContact O-N 3.04Å; E219-N223 PolarHBondContact O-OD1 2.86Å; A220-N223 PolarHBondContact O-N 3.05Å; A221-N223 VanDerWaalsContact C-N 3.29Å; A221-N223 PolarHBondContact O-N 3.33Å; N223-T226 WeakPolarHBondContact O-CB 3.16Å; N223-T226 PolarHBondContact O-N 2.68Å; N223-A227 WeakPolarHBondContact O-CB 3.35Å; N223-A227 PolarHBondContact O-N 3.19Å
224	E	81.9	Confident	79.4	Confident	158 Å²	158	87.9 Å²	87.9	74%	0.738	47%	0.468	S	S	*	.	H	α-helix	trans	-68.2	-42.9	176.2	-76.3	-145.9	158.4	0	0	113	A220 A221 T226 A227 Y228	A220-E224 PolarHBondContact O-N 2.83Å; A220-E224 VanDerWaalsContact O-N 3.12Å; A221-E224 PolarHBondContact O-N 3.33Å; E224-T226 VanDerWaalsContact C-N 3.25Å; E224-T226 PolarHBondContact O-N 3.32Å; E224-A227 PolarHBondContact O-N 3.09Å; E224-Y228 PolarHBondContact O-N 3.23Å
225	I	82.2	Confident	79.9	Confident	83 Å²	83	82.7 Å²	82.7	43%	0.426	45%	0.454	S	S	.	.	H	α-helix	trans	-60.2	-43	175.9	-67.5	166.2	0	0	0	109.9	T205 A221 Y228 S229	T205-I225 HydrophobicContact CG2-CB 4.11Å; T205-I225 HydrophobicContact CG2-CG2 3.74Å; A221-I225 VanDerWaalsContact O-CG1 3.3Å; A221-I225 WeakPolarHBondContact O-CG1 3.39Å; A221-I225 PolarHBondContact O-N 2.72Å; I225-Y228 PolarHBondContact O-N 3.43Å; I225-S229 WeakPolarHBondContact O-CB 3.41Å; I225-S229 PolarHBondContact O-N 3.17Å; I225-S229 PolarHBondContact O-OG 2.95Å
226	T	80.3	Confident	80.7	Confident	4 Å²	4	75 Å²	75	3%	0.025	42%	0.419	C	S	.	.	H	α-helix	trans	-57.3	-52.9	175.8	-72.7	0	0	0	0	111.6	S201 T205 C222 N223 E224 Y228 S229 M230	S201-T226 PolarHBondContact O-OG1 3.42Å; S201-T226 WeakPolarHBondContact OG-CG2 3.49Å; T205-T226 PolarHBondContact OG1-OG1 3.27Å; C222-T226 WeakPolarHBondContact O-CB 3.46Å; C222-T226 PolarHBondContact O-N 2.84Å; C222-T226 PolarHBondContact O-OG1 2.99Å; N223-T226 WeakPolarHBondContact O-CB 3.16Å; N223-T226 PolarHBondContact O-N 2.68Å; E224-T226 VanDerWaalsContact C-N 3.25Å; E224-T226 PolarHBondContact O-N 3.32Å; T226-Y228 VanDerWaalsContact C-N 3.32Å; T226-Y228 PolarHBondContact O-N 3.04Å; T226-S229 PolarHBondContact O-N 2.9Å; T226-M230 WeakPolarHBondContact O-CG 3.4Å; T226-M230 PolarHBondContact O-N 3.48Å
227	A	79.5	Confident	81.7	Confident	57 Å²	57	70.6 Å²	70.6	47%	0.471	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-42.1	-179.6	0	0	0	0	0	112	N223 E224 S231	N223-A227 WeakPolarHBondContact O-CB 3.35Å; N223-A227 PolarHBondContact O-N 3.19Å; E224-A227 PolarHBondContact O-N 3.09Å; A227-S231 WeakPolarHBondContact O-CB 3.42Å; A227-S231 PolarHBondContact O-N 2.77Å
228	Y	83	Confident	82.6	Confident	168 Å²	168	73.2 Å²	73.2	66%	0.659	41%	0.406	S	S	*	.	H	α-helix	trans	-62.1	-47.1	175.3	-178.9	-97.2	0	0	0	112	E224 I225 T226 M230 S231 H232	E224-Y228 PolarHBondContact O-N 3.23Å; I225-Y228 PolarHBondContact O-N 3.43Å; T226-Y228 VanDerWaalsContact C-N 3.32Å; T226-Y228 PolarHBondContact O-N 3.04Å; Y228-M230 PolarHBondContact O-N 3.28Å; Y228-S231 PolarHBondContact O-N 3.26Å; Y228-H232 WeakPolarHBondContact O-CB 3.43Å; Y228-H232 PolarHBondContact O-N 3.01Å
229	S	81.8	Confident	83.1	Confident	57 Å²	57	71.6 Å²	71.6	40%	0.399	39%	0.39	S	S	.	.	H	α-helix	trans	-61.5	-43.7	-179.1	-53.9	0	0	0	0	111.8	I225 T226 H232 A233	I225-S229 WeakPolarHBondContact O-CB 3.41Å; I225-S229 PolarHBondContact O-N 3.17Å; I225-S229 PolarHBondContact O-OG 2.95Å; T226-S229 PolarHBondContact O-N 2.9Å; S229-H232 PolarHBondContact O-N 3.26Å; S229-A233 WeakPolarHBondContact O-CB 3.44Å; S229-A233 PolarHBondContact O-N 3.45Å
230	M	79.6	Confident	83.8	Confident	50 Å²	50	65 Å²	65	25%	0.246	36%	0.36	C	S	.	.	H	α-helix	trans	-64.9	-46.6	177.3	-77.1	-60.7	-55.9	0	0	111.8	A197 T226 Y228 H232 A233 Y234	A197-M230 HydrophobicContact CB-CE 3.54Å; A197-M230 HydrophobicContact CB-SD 4.21Å; T226-M230 WeakPolarHBondContact O-CG 3.4Å; T226-M230 PolarHBondContact O-N 3.48Å; Y228-M230 PolarHBondContact O-N 3.28Å; M230-H232 VanDerWaalsContact C-N 3.28Å; M230-H232 PolarHBondContact O-N 3.48Å; M230-A233 PolarHBondContact O-N 2.8Å; M230-Y234 HydrophobicContact CE-CD2 4.16Å; M230-Y234 HydrophobicContact CE-CE2 3.45Å; M230-Y234 VanDerWaalsContact CE-CE2 3.45Å; M230-Y234 WeakPolarHBondContact O-CD2 3.3Å; M230-Y234 PolarHBondContact O-N 3.39Å
231	S	80.7	Confident	84.4	Confident	80 Å²	80	68.2 Å²	68.2	56%	0.559	36%	0.361	S	S	*	.	H	α-helix	trans	-58.5	-41.7	176.6	-171.6	0	0	0	0	111.8	A227 Y228 Y234 S235	A227-S231 WeakPolarHBondContact O-CB 3.42Å; A227-S231 PolarHBondContact O-N 2.77Å; Y228-S231 PolarHBondContact O-N 3.26Å; S231-Y234 PolarHBondContact O-N 2.96Å; S231-S235 WeakPolarHBondContact O-CB 3.33Å; S231-S235 PolarHBondContact O-N 3.41Å
232	H	85	Confident	84.9	Confident	60 Å²	60	72.9 Å²	72.9	28%	0.278	37%	0.371	S	S	.	.	H	α-helix	trans	-64.7	-45.3	176.7	-168.1	63	0	0	0	112.3	Y228 S229 M230 Y234 S235 I236 E266	Y228-H232 WeakPolarHBondContact O-CB 3.43Å; Y228-H232 PolarHBondContact O-N 3.01Å; S229-H232 PolarHBondContact O-N 3.26Å; M230-H232 VanDerWaalsContact C-N 3.28Å; M230-H232 PolarHBondContact O-N 3.48Å; H232-Y234 PolarHBondContact O-N 2.92Å; H232-S235 WeakPolarHBondContact O-CB 3.39Å; H232-S235 PolarHBondContact O-N 2.86Å; H232-I236 WeakPolarHBondContact O-CG1 3.46Å; H232-I236 PolarHBondContact O-N 3.07Å; H232-E266 IonicContact CE1-OE1 3.94Å; H232-E266 PolarHBondContact CE1-OE1 2.93Å; H232-E266 VanDerWaalsContact NE2-CD 3.31Å; H232-E266 IonicContact NE2-OE1 3.83Å; H232-E266 PolarHBondContact NE2-OE1 3.1Å; H232-E266 IonicContact NE2-OE2 2.66Å; H232-E266 PolarHBondContact NE2-OE2 3.2Å; H232-E266 VanDerWaalsContact NE2-OE2 3.16Å
233	A	84.4	Confident	85.5	Confident	44 Å²	44	73.7 Å²	73.7	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-45.3	176.4	0	0	0	0	0	112.2	S229 M230 S235 I236 V237	S229-A233 WeakPolarHBondContact O-CB 3.44Å; S229-A233 PolarHBondContact O-N 3.45Å; M230-A233 PolarHBondContact O-N 2.8Å; A233-S235 VanDerWaalsContact C-N 3.3Å; A233-S235 PolarHBondContact O-N 2.94Å; A233-I236 PolarHBondContact O-N 3Å; A233-V237 WeakPolarHBondContact O-CG2 3.5Å; A233-V237 PolarHBondContact O-N 3.5Å
234	Y	85.2	Confident	86.1	Confident	119 Å²	119	70.9 Å²	70.9	47%	0.467	36%	0.36	S	S	.	.	H	α-helix	trans	-58.8	-42.6	175.1	-83.5	-62.2	0	0	0	112.1	M230 S231 H232 I236 V237 Q238	M230-Y234 HydrophobicContact CE-CD2 4.16Å; M230-Y234 HydrophobicContact CE-CE2 3.45Å; M230-Y234 VanDerWaalsContact CE-CE2 3.45Å; M230-Y234 WeakPolarHBondContact O-CD2 3.3Å; M230-Y234 PolarHBondContact O-N 3.39Å; S231-Y234 PolarHBondContact O-N 2.96Å; H232-Y234 PolarHBondContact O-N 2.92Å; Y234-I236 PolarHBondContact O-N 3.27Å; Y234-V237 PolarHBondContact O-N 2.66Å; Y234-Q238 WeakPolarHBondContact O-CB 3.45Å; Y234-Q238 PolarHBondContact O-N 3.12Å
235	S	89.5	Confident	86.5	Confident	46 Å²	46	68 Å²	68	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-43.2	177.5	-172.6	0	0	0	0	112.1	S231 H232 A233 E239 R264	S231-S235 WeakPolarHBondContact O-CB 3.33Å; S231-S235 PolarHBondContact O-N 3.41Å; H232-S235 WeakPolarHBondContact O-CB 3.39Å; H232-S235 PolarHBondContact O-N 2.86Å; A233-S235 VanDerWaalsContact C-N 3.3Å; A233-S235 PolarHBondContact O-N 2.94Å; S235-E239 PolarHBondContact O-N 3.18Å; S235-E239 VanDerWaalsContact O-N 3.13Å; S235-R264 PolarHBondContact O-NH2 3.4Å; S235-R264 PolarHBondContact OG-NH1 3.46Å; S235-R264 PolarHBondContact OG-NH2 2.9Å
236	I	89.3	Confident	86.8	Confident	21 Å²	21	72.8 Å²	72.8	11%	0.108	37%	0.366	C	S	.	.	H	α-helix	trans	-63.8	-48.2	175.9	-67.3	165	0	0	0	110.8	H232 A233 Y234 Q238 E239 A240 L257 V260 L261	H232-I236 WeakPolarHBondContact O-CG1 3.46Å; H232-I236 PolarHBondContact O-N 3.07Å; A233-I236 PolarHBondContact O-N 3Å; Y234-I236 PolarHBondContact O-N 3.27Å; I236-Q238 VanDerWaalsContact C-N 3.32Å; I236-Q238 PolarHBondContact O-N 3.33Å; I236-E239 PolarHBondContact O-N 3.01Å; I236-A240 WeakPolarHBondContact O-CB 3.26Å; I236-A240 PolarHBondContact O-N 3Å; I236-L257 HydrophobicContact CG2-CD2 4.02Å; I236-V260 HydrophobicContact CG2-CG1 4.07Å; I236-L261 HydrophobicContact CD1-CD2 3.91Å; I236-L261 HydrophobicContact CG2-CD2 4.4Å
237	V	89.6	Confident	87	Confident	76 Å²	76	75.3 Å²	75.3	46%	0.461	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-40.1	-179	173.1	0	0	0	0	111.3	A233 Y234 E239 A240 K241	A233-V237 WeakPolarHBondContact O-CG2 3.5Å; A233-V237 PolarHBondContact O-N 3.5Å; Y234-V237 PolarHBondContact O-N 2.66Å; V237-E239 VanDerWaalsContact C-N 3.34Å; V237-E239 PolarHBondContact O-N 3.5Å; V237-A240 PolarHBondContact O-N 3.49Å; V237-K241 WeakPolarHBondContact O-CB 3.3Å; V237-K241 PolarHBondContact O-N 3.15Å
238	Q	90	Very high	87.1	Confident	112 Å²	112	76 Å²	76	52%	0.523	40%	0.396	S	S	.	.	H	α-helix	trans	-65.2	-39.1	178	-162.9	-177.5	22.1	0	0	111.7	Y234 I236 R242	Y234-Q238 WeakPolarHBondContact O-CB 3.45Å; Y234-Q238 PolarHBondContact O-N 3.12Å; I236-Q238 VanDerWaalsContact C-N 3.32Å; I236-Q238 PolarHBondContact O-N 3.33Å; Q238-R242 WeakPolarHBondContact O-CG 3.33Å; Q238-R242 PolarHBondContact O-N 3Å
239	E	91.3	Very high	87.1	Confident	40 Å²	40	74.4 Å²	74.4	19%	0.187	39%	0.389	C	S	.	.	H	α-helix	trans	-71.3	-36.4	175.7	-166.3	174.4	174.9	0	0	112.2	S235 I236 V237 K241 R242 T243 V260 R263 R264	S235-E239 PolarHBondContact O-N 3.18Å; S235-E239 VanDerWaalsContact O-N 3.13Å; I236-E239 PolarHBondContact O-N 3.01Å; V237-E239 VanDerWaalsContact C-N 3.34Å; V237-E239 PolarHBondContact O-N 3.5Å; E239-K241 VanDerWaalsContact C-N 3.34Å; E239-R242 WeakPolarHBondContact O-CB 3.48Å; E239-R242 PolarHBondContact O-N 3.44Å; E239-T243 PolarHBondContact O-N 3.06Å; E239-T243 PolarHBondContact O-OG1 2.91Å; E239-T243 VanDerWaalsContact O-OG1 3.07Å; E239-V260 HydrophobicContact CB-CG1 3.93Å; E239-V260 HydrophobicContact CB-CG2 4.25Å; E239-V260 HydrophobicContact CG-CG1 4.04Å; E239-V260 HydrophobicContact CG-CG2 4.01Å; E239-R263 IonicContact OE1-NH1 3.05Å; E239-R264 IonicContact OE2-CZ 2.98Å; E239-R264 IonicContact OE2-NE 2.82Å; E239-R264 PolarHBondContact OE2-NE 3.45Å; E239-R264 IonicContact OE2-NH2 3.16Å; E239-R264 PolarHBondContact OE2-NH2 3.46Å
240	A	91.2	Very high	87.3	Confident	0 Å²	0	81.5 Å²	81.5	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-64.8	-40.4	175.1	0	0	0	0	0	110.8	I236 V237 R242 T243 M244 L252 L257 V260	I236-A240 WeakPolarHBondContact O-CB 3.26Å; I236-A240 PolarHBondContact O-N 3Å; V237-A240 PolarHBondContact O-N 3.49Å; A240-R242 VanDerWaalsContact C-N 3.34Å; A240-R242 PolarHBondContact O-N 3.4Å; A240-T243 CarbonylContact O-C 3.57Å; A240-T243 PolarHBondContact O-N 3.07Å; A240-T243 VanDerWaalsContact O-N 3.12Å; A240-M244 WeakPolarHBondContact O-CB 3.2Å; A240-M244 PolarHBondContact O-N 2.84Å; A240-L252 HydrophobicContact CB-CD1 3.88Å; A240-L257 HydrophobicContact CB-CD2 3.66Å; A240-L257 HydrophobicContact CB-CG 4.14Å; A240-V260 HydrophobicContact CB-CG2 4.12Å
241	K	91.4	Very high	87.6	Confident	135 Å²	135	89.4 Å²	89.4	59%	0.587	44%	0.44	S	S	*	.	H	α-helix	trans	-58.7	-42.2	171.6	-176.4	179.4	179.6	177.7	0	112.3	V237 E239 T243 M244 V245	V237-K241 WeakPolarHBondContact O-CB 3.3Å; V237-K241 PolarHBondContact O-N 3.15Å; E239-K241 VanDerWaalsContact C-N 3.34Å; K241-T243 VanDerWaalsContact C-N 3.31Å; K241-T243 PolarHBondContact O-N 3.44Å; K241-M244 HydrophobicContact CG-CE 4.43Å; K241-M244 WeakPolarHBondContact O-CB 3.3Å; K241-M244 PolarHBondContact O-N 3.42Å; K241-V245 WeakPolarHBondContact O-CG2 3.33Å; K241-V245 PolarHBondContact O-N 3.13Å; K241-V245 VanDerWaalsContact O-N 3.1Å
242	R	91	Very high	87.9	Confident	134 Å²	134	89.2 Å²	89.2	51%	0.506	43%	0.432	S	S	.	.	H	α-helix	trans	-63.7	-39.3	175.2	-67.7	174.7	-169.4	153.9	4.6	111.3	Q238 E239 A240 R246	Q238-R242 WeakPolarHBondContact O-CG 3.33Å; Q238-R242 PolarHBondContact O-N 3Å; E239-R242 WeakPolarHBondContact O-CB 3.48Å; E239-R242 PolarHBondContact O-N 3.44Å; A240-R242 VanDerWaalsContact C-N 3.34Å; A240-R242 PolarHBondContact O-N 3.4Å; R242-R246 WeakPolarHBondContact O-CG 3.43Å; R242-R246 PolarHBondContact O-N 3.02Å; R242-R246 VanDerWaalsContact O-N 3.16Å
243	T	90.1	Very high	87.9	Confident	19 Å²	19	88.1 Å²	88.1	12%	0.117	43%	0.431	C	S	.	.	H	α-helix	trans	-68.4	-37.7	177.1	-55.6	0	0	0	0	111.7	E239 A240 K241 R246 S247 E256	E239-T243 PolarHBondContact O-N 3.06Å; E239-T243 PolarHBondContact O-OG1 2.91Å; E239-T243 VanDerWaalsContact O-OG1 3.07Å; A240-T243 CarbonylContact O-C 3.57Å; A240-T243 PolarHBondContact O-N 3.07Å; A240-T243 VanDerWaalsContact O-N 3.12Å; K241-T243 VanDerWaalsContact C-N 3.31Å; K241-T243 PolarHBondContact O-N 3.44Å; T243-R246 PolarHBondContact O-N 3.09Å; T243-S247 PolarHBondContact O-N 3.01Å; T243-E256 HydrophobicContact CG2-CB 4.43Å; T243-E256 HydrophobicContact CG2-CG 4.4Å
244	M	91.9	Very high	88	Confident	25 Å²	25	88.7 Å²	88.7	12%	0.123	43%	0.432	C	S	.	.	H	α-helix	trans	-59	-49.5	173.3	-178.5	-160.2	72.9	0	0	111.7	A240 K241 R246 S247 G248 R249 L252 E256	A240-M244 WeakPolarHBondContact O-CB 3.2Å; A240-M244 PolarHBondContact O-N 2.84Å; K241-M244 HydrophobicContact CG-CE 4.43Å; K241-M244 WeakPolarHBondContact O-CB 3.3Å; K241-M244 PolarHBondContact O-N 3.42Å; M244-R246 VanDerWaalsContact C-N 3.29Å; M244-R246 PolarHBondContact O-N 2.94Å; M244-S247 WeakPolarHBondContact O-CB 3.31Å; M244-S247 PolarHBondContact O-N 3.44Å; M244-S247 PolarHBondContact O-OG 3.04Å; M244-G248 PolarHBondContact O-N 3.5Å; M244-R249 HydrophobicContact CG-CB 4.3Å; M244-R249 WeakPolarHBondContact CG-O 3.41Å; M244-R249 PolarHBondContact O-N 3Å; M244-L252 HydrophobicContact CB-CD1 3.91Å; M244-L252 HydrophobicContact CG-CD1 4.43Å; M244-L252 HydrophobicContact SD-CB 3.94Å; M244-L252 HydrophobicContact SD-CD1 4.43Å; M244-L252 PolarHBondContact SD-N 3.48Å; M244-E256 HydrophobicContact CB-CG 4.48Å
245	V	89.6	Confident	88.1	Confident	99 Å²	99	86 Å²	86	60%	0.6	43%	0.434	S	S	*	.	H	α-helix	trans	-61.1	-40.6	177.9	175.4	0	0	0	0	111	K241 S247 G248	K241-V245 WeakPolarHBondContact O-CG2 3.33Å; K241-V245 PolarHBondContact O-N 3.13Å; K241-V245 VanDerWaalsContact O-N 3.1Å; V245-S247 VanDerWaalsContact C-N 3.27Å; V245-S247 PolarHBondContact O-N 3.36Å; V245-G248 PolarHBondContact O-N 3.27Å; V245-G248 VanDerWaalsContact O-N 3.11Å
246	R	88.5	Confident	88.1	Confident	183 Å²	183	84.2 Å²	84.2	69%	0.691	42%	0.42	S	S	*	.	H	α-helix	trans	-64.3	-30.2	175.2	-72.4	177.8	-176.7	133.2	-4	113.3	R242 T243 M244 G248	R242-R246 WeakPolarHBondContact O-CG 3.43Å; R242-R246 PolarHBondContact O-N 3.02Å; R242-R246 VanDerWaalsContact O-N 3.16Å; T243-R246 PolarHBondContact O-N 3.09Å; M244-R246 VanDerWaalsContact C-N 3.29Å; M244-R246 PolarHBondContact O-N 2.94Å; R246-G248 PolarHBondContact O-N 3.44Å
247	S	84.6	Confident	88.1	Confident	57 Å²	57	85.4 Å²	85.4	40%	0.399	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.3	175.6	77.5	0	0	0	0	113.8	T243 M244 V245 R249	T243-S247 PolarHBondContact O-N 3.01Å; M244-S247 WeakPolarHBondContact O-CB 3.31Å; M244-S247 PolarHBondContact O-N 3.44Å; M244-S247 PolarHBondContact O-OG 3.04Å; V245-S247 VanDerWaalsContact C-N 3.27Å; V245-S247 PolarHBondContact O-N 3.36Å; S247-R249 PolarHBondContact O-N 2.84Å; S247-R249 WeakPolarHBondContact OG-CB 3.23Å; S247-R249 WeakPolarHBondContact OG-CG 3.1Å
248	G	82.3	Confident	88.1	Confident	70 Å²	70	83.1 Å²	83.1	72%	0.722	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	10.9	-176.4	0	0	0	0	0	114.1	M244 V245 R246	M244-G248 PolarHBondContact O-N 3.5Å; V245-G248 PolarHBondContact O-N 3.27Å; V245-G248 VanDerWaalsContact O-N 3.11Å; R246-G248 PolarHBondContact O-N 3.44Å
249	R	81.9	Confident	88	Confident	135 Å²	135	79.4 Å²	79.4	51%	0.509	40%	0.401	S	S	.	.			trans	-94.3	148.3	179.9	-64.3	176.1	179.5	176.2	-2.7	110.8	M244 S247 S253 E256	M244-R249 HydrophobicContact CG-CB 4.3Å; M244-R249 WeakPolarHBondContact CG-O 3.41Å; M244-R249 PolarHBondContact O-N 3Å; S247-R249 PolarHBondContact O-N 2.84Å; S247-R249 WeakPolarHBondContact OG-CB 3.23Å; S247-R249 WeakPolarHBondContact OG-CG 3.1Å; R249-S253 PolarHBondContact NH1-OG 2.78Å; R249-E256 WeakPolarHBondContact CD-OE1 3.47Å; R249-E256 IonicContact CZ-OE1 2.62Å; R249-E256 IonicContact NH1-OE1 2.78Å; R249-E256 PolarHBondContact NH1-OE1 3.44Å
250	K	85.8	Confident	88	Confident	206 Å²	206	77.5 Å²	77.5	90%	0.896	39%	0.392	S	S	*	.	S	Bend	trans	-95.4	-11	173.5	-64.5	-174.4	179.8	-178.8	0	113.5
251	R	87	Confident	88	Confident	217 Å²	217	78.5 Å²	78.5	82%	0.819	40%	0.397	S	S	*	.	S	Bend	trans	-118.2	131.5	-178.6	-67.7	-172.1	176.6	-167	-0.8	109.5
252	L	85.6	Confident	88	Confident	75 Å²	75	78 Å²	78	39%	0.393	40%	0.396	S	S	.	.			trans	-74.6	124.5	176.1	-172.1	71.8	0	0	0	108.8	A240 M244 E256 L257	A240-L252 HydrophobicContact CB-CD1 3.88Å; M244-L252 HydrophobicContact CB-CD1 3.91Å; M244-L252 HydrophobicContact CG-CD1 4.43Å; M244-L252 HydrophobicContact SD-CB 3.94Å; M244-L252 HydrophobicContact SD-CD1 4.43Å; M244-L252 PolarHBondContact SD-N 3.48Å; L252-E256 WeakPolarHBondContact CA-OE2 3.36Å; L252-E256 HydrophobicContact CD1-CB 4.09Å; L252-L257 HydrophobicContact CD2-CG 4.5Å
253	S	85.8	Confident	87.9	Confident	37 Å²	37	78.5 Å²	78.5	26%	0.259	40%	0.398	S	S	.	.			trans	-110.4	158	177.1	79.3	0	0	0	0	111.2	R249 A255 E256 L257	R249-S253 PolarHBondContact NH1-OG 2.78Å; S253-A255 PolarHBondContact O-N 2.98Å; S253-A255 VanDerWaalsContact O-N 3.14Å; S253-E256 PolarHBondContact N-OE2 3.31Å; S253-E256 PolarHBondContact O-N 3.49Å; S253-E256 PolarHBondContact OG-OE1 3.46Å; S253-E256 PolarHBondContact OG-OE2 3.27Å; S253-L257 PolarHBondContact O-N 3.44Å
254	C	86.8	Confident	87.8	Confident	56 Å²	56	81.2 Å²	81.2	38%	0.378	41%	0.407	S	S	.	.	H	α-helix	trans	-55.7	-28.9	175.2	-62.4	0	0	0	0	113	E256 L257 N258 Y272	C254-E256 VanDerWaalsContact C-N 3.34Å; C254-E256 PolarHBondContact O-N 2.68Å; C254-L257 PolarHBondContact O-N 3.42Å; C254-N258 PolarHBondContact O-N 3Å; C254-Y272 HydrophobicContact CB-CD1 4.19Å; C254-Y272 HydrophobicContact CB-CD2 3.98Å; C254-Y272 HydrophobicContact CB-CE1 3.85Å; C254-Y272 HydrophobicContact CB-CE2 3.6Å; C254-Y272 HydrophobicContact CB-CG 4.23Å; C254-Y272 PolarHBondContact O-OH 2.96Å
255	A	86.5	Confident	87.6	Confident	62 Å²	62	83.5 Å²	83.5	51%	0.512	44%	0.436	S	S	.	.	H	α-helix	trans	-65.1	-36.8	177.5	0	0	0	0	0	112.4	S253 A259	S253-A255 PolarHBondContact O-N 2.98Å; S253-A255 VanDerWaalsContact O-N 3.14Å; A255-A259 WeakPolarHBondContact O-CB 3.33Å; A255-A259 PolarHBondContact O-N 3.19Å
256	E	89.1	Confident	87.5	Confident	9 Å²	9	81.7 Å²	81.7	4%	0.042	42%	0.421	C	S	.	.	H	α-helix	trans	-72.7	-31.9	176.8	-65.7	111.9	-139.6	0	0	111.7	T243 M244 R249 L252 S253 C254 V260	T243-E256 HydrophobicContact CG2-CB 4.43Å; T243-E256 HydrophobicContact CG2-CG 4.4Å; M244-E256 HydrophobicContact CB-CG 4.48Å; R249-E256 WeakPolarHBondContact CD-OE1 3.47Å; R249-E256 IonicContact CZ-OE1 2.62Å; R249-E256 IonicContact NH1-OE1 2.78Å; R249-E256 PolarHBondContact NH1-OE1 3.44Å; L252-E256 WeakPolarHBondContact CA-OE2 3.36Å; L252-E256 HydrophobicContact CD1-CB 4.09Å; S253-E256 PolarHBondContact N-OE2 3.31Å; S253-E256 PolarHBondContact O-N 3.49Å; S253-E256 PolarHBondContact OG-OE1 3.46Å; S253-E256 PolarHBondContact OG-OE2 3.27Å; C254-E256 VanDerWaalsContact C-N 3.34Å; C254-E256 PolarHBondContact O-N 2.68Å; E256-V260 WeakPolarHBondContact O-CG2 3.32Å; E256-V260 PolarHBondContact O-N 3.46Å
257	L	89.3	Confident	87.4	Confident	47 Å²	47	80.9 Å²	80.9	25%	0.246	43%	0.425	C	S	.	.	H	α-helix	trans	-67.4	-48.9	172.9	-79	165.2	0	0	0	111.6	I236 A240 L252 S253 C254 A259 V260 L261	I236-L257 HydrophobicContact CG2-CD2 4.02Å; A240-L257 HydrophobicContact CB-CD2 3.66Å; A240-L257 HydrophobicContact CB-CG 4.14Å; L252-L257 HydrophobicContact CD2-CG 4.5Å; S253-L257 PolarHBondContact O-N 3.44Å; C254-L257 PolarHBondContact O-N 3.42Å; L257-A259 VanDerWaalsContact C-N 3.31Å; L257-A259 PolarHBondContact O-N 3.01Å; L257-V260 WeakPolarHBondContact O-CB 3.32Å; L257-V260 PolarHBondContact O-N 3.03Å; L257-L261 PolarHBondContact O-N 3.29Å
258	N	90.2	Very high	87.3	Confident	28 Å²	28	80 Å²	80	15%	0.15	42%	0.418	C	S	.	.	H	α-helix	trans	-61.1	-39.7	176.9	-86.2	-6.9	0	0	0	112.3	C254 V260 L261 E262 P268 V269 Y272	C254-N258 PolarHBondContact O-N 3Å; N258-V260 PolarHBondContact O-N 3.14Å; N258-L261 PolarHBondContact O-N 3.41Å; N258-E262 WeakPolarHBondContact O-CB 3.45Å; N258-E262 VanDerWaalsContact O-CG 3.31Å; N258-E262 WeakPolarHBondContact O-CG 3.37Å; N258-E262 PolarHBondContact O-N 2.86Å; N258-P268 HydrophobicContact CB-CB 4.36Å; N258-V269 PolarHBondContact ND2-O 3.36Å; N258-V269 PolarHBondContact OD1-N 2.97Å; N258-V269 PolarHBondContact OD1-O 3.14Å; N258-Y272 PolarHBondContact ND2-OH 2.98Å; N258-Y272 PolarHBondContact OD1-OH 3.38Å
259	A	88.5	Confident	87.1	Confident	34 Å²	34	80 Å²	80	28%	0.281	40%	0.404	S	S	.	.	H	α-helix	trans	-62.2	-28.8	175.5	0	0	0	0	0	113.2	A255 L257 R263	A255-A259 WeakPolarHBondContact O-CB 3.33Å; A255-A259 PolarHBondContact O-N 3.19Å; L257-A259 VanDerWaalsContact C-N 3.31Å; L257-A259 PolarHBondContact O-N 3.01Å; A259-R263 WeakPolarHBondContact O-CB 2.98Å; A259-R263 PolarHBondContact O-N 3.37Å
260	V	91.3	Very high	86.7	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-77.4	-44.5	174.3	169.9	0	0	0	0	111.2	I236 E239 A240 E256 L257 N258 E262 R263 R264	I236-V260 HydrophobicContact CG2-CG1 4.07Å; E239-V260 HydrophobicContact CB-CG1 3.93Å; E239-V260 HydrophobicContact CB-CG2 4.25Å; E239-V260 HydrophobicContact CG-CG1 4.04Å; E239-V260 HydrophobicContact CG-CG2 4.01Å; A240-V260 HydrophobicContact CB-CG2 4.12Å; E256-V260 WeakPolarHBondContact O-CG2 3.32Å; E256-V260 PolarHBondContact O-N 3.46Å; L257-V260 WeakPolarHBondContact O-CB 3.32Å; L257-V260 PolarHBondContact O-N 3.03Å; N258-V260 PolarHBondContact O-N 3.14Å; V260-E262 PolarHBondContact O-N 3.23Å; V260-R263 PolarHBondContact O-N 3Å; V260-R264 PolarHBondContact O-N 3.17Å
261	L	90.4	Very high	85.9	Confident	20 Å²	20	78.4 Å²	78.4	11%	0.105	41%	0.407	C	S	.	.	H	α-helix	trans	-58.8	-47.8	176.4	-69.4	171.8	0	0	0	111.2	I236 L257 N258 R263 R264 G265 E266 V269	I236-L261 HydrophobicContact CD1-CD2 3.91Å; I236-L261 HydrophobicContact CG2-CD2 4.4Å; L257-L261 PolarHBondContact O-N 3.29Å; N258-L261 PolarHBondContact O-N 3.41Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.45Å; L261-R264 PolarHBondContact O-N 3.15Å; L261-R264 VanDerWaalsContact O-N 3.11Å; L261-G265 PolarHBondContact O-N 3.22Å; L261-G265 VanDerWaalsContact O-N 3.14Å; L261-E266 HydrophobicContact CB-CB 4.37Å; L261-E266 HydrophobicContact CD2-CB 4.04Å; L261-E266 WeakPolarHBondContact CD2-OE2 3.49Å; L261-E266 PolarHBondContact O-N 3.08Å; L261-V269 HydrophobicContact CD1-CG2 4.15Å
262	E	90.7	Very high	85.1	Confident	124 Å²	124	72.9 Å²	72.9	58%	0.579	39%	0.386	S	S	*	.	H	α-helix	trans	-58.8	-39.4	176.3	-73.7	174.4	-175.6	0	0	112	N258 V260 R264 G265 P268	N258-E262 WeakPolarHBondContact O-CB 3.45Å; N258-E262 VanDerWaalsContact O-CG 3.31Å; N258-E262 WeakPolarHBondContact O-CG 3.37Å; N258-E262 PolarHBondContact O-N 2.86Å; V260-E262 PolarHBondContact O-N 3.23Å; E262-R264 VanDerWaalsContact C-N 3.34Å; E262-R264 PolarHBondContact O-N 3.21Å; E262-G265 PolarHBondContact O-N 2.88Å; E262-P268 HydrophobicContact CG-CB 4.19Å; E262-P268 HydrophobicContact CG-CG 4.28Å
263	R	89.2	Confident	84.1	Confident	145 Å²	145	71.7 Å²	71.7	55%	0.547	39%	0.393	S	S	.	.	H	α-helix	trans	-70	-31.5	178.7	-165.4	-175	-64.7	151.4	3.5	112.5	E239 A259 V260 L261	E239-R263 IonicContact OE1-NH1 3.05Å; A259-R263 WeakPolarHBondContact O-CB 2.98Å; A259-R263 PolarHBondContact O-N 3.37Å; V260-R263 PolarHBondContact O-N 3Å; L261-R263 VanDerWaalsContact C-N 3.28Å; L261-R263 PolarHBondContact O-N 3.45Å
264	R	88.5	Confident	83	Confident	77 Å²	77	75.7 Å²	75.7	29%	0.291	42%	0.42	S	S	.	.	H	α-helix	trans	-77.4	-9.1	173.9	-71.5	-171.6	177	-155.4	-2.2	113.3	S235 E239 V260 L261 E262 E266	S235-R264 PolarHBondContact O-NH2 3.4Å; S235-R264 PolarHBondContact OG-NH1 3.46Å; S235-R264 PolarHBondContact OG-NH2 2.9Å; E239-R264 IonicContact OE2-CZ 2.98Å; E239-R264 IonicContact OE2-NE 2.82Å; E239-R264 PolarHBondContact OE2-NE 3.45Å; E239-R264 IonicContact OE2-NH2 3.16Å; E239-R264 PolarHBondContact OE2-NH2 3.46Å; V260-R264 PolarHBondContact O-N 3.17Å; L261-R264 PolarHBondContact O-N 3.15Å; L261-R264 VanDerWaalsContact O-N 3.11Å; E262-R264 VanDerWaalsContact C-N 3.34Å; E262-R264 PolarHBondContact O-N 3.21Å; R264-E266 VanDerWaalsContact C-N 3.28Å; R264-E266 HydrophobicContact CB-CG 4.17Å
265	G	88.1	Confident	82	Confident	72 Å²	72	77.9 Å²	77.9	74%	0.742	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	18.5	-173.1	0	0	0	0	0	113.1	L261 E262	L261-G265 PolarHBondContact O-N 3.22Å; L261-G265 VanDerWaalsContact O-N 3.14Å; E262-G265 PolarHBondContact O-N 2.88Å
266	E	87.9	Confident	80.9	Confident	61 Å²	61	77.7 Å²	77.7	29%	0.285	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-89.5	155.5	175.2	-68.3	175.9	-141.4	0	0	110.5	H232 L261 R264 P268	H232-E266 IonicContact CE1-OE1 3.94Å; H232-E266 PolarHBondContact CE1-OE1 2.93Å; H232-E266 VanDerWaalsContact NE2-CD 3.31Å; H232-E266 IonicContact NE2-OE1 3.83Å; H232-E266 PolarHBondContact NE2-OE1 3.1Å; H232-E266 IonicContact NE2-OE2 2.66Å; H232-E266 PolarHBondContact NE2-OE2 3.2Å; H232-E266 VanDerWaalsContact NE2-OE2 3.16Å; L261-E266 HydrophobicContact CB-CB 4.37Å; L261-E266 HydrophobicContact CD2-CB 4.04Å; L261-E266 WeakPolarHBondContact CD2-OE2 3.49Å; L261-E266 PolarHBondContact O-N 3.08Å; R264-E266 VanDerWaalsContact C-N 3.28Å; R264-E266 HydrophobicContact CB-CG 4.17Å; E266-P268 WeakPolarHBondContact O-CD 3.45Å
267	Q	84.9	Confident	80	Confident	166 Å²	166	84.5 Å²	84.5	78%	0.776	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-68.6	123.9	-179.8	-171	174.2	4.4	0	0	110.2
268	P	82.8	Confident	79.2	Confident	39 Å²	39	85.2 Å²	85.2	25%	0.253	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-68.4	148.9	177.4	27.4	-33.4	0	0	0	111	N258 E262 E266 L270	N258-P268 HydrophobicContact CB-CB 4.36Å; E262-P268 HydrophobicContact CG-CB 4.19Å; E262-P268 HydrophobicContact CG-CG 4.28Å; E266-P268 WeakPolarHBondContact O-CD 3.45Å; P268-L270 PolarHBondContact O-N 3.41Å
269	V	79.7	Confident	78.2	Confident	71 Å²	71	87.8 Å²	87.8	43%	0.43	48%	0.475	S	S	.	.			trans	-81.4	113.9	176.5	-176.6	0	0	0	0	108.1	N258 L261 Y272	N258-V269 PolarHBondContact ND2-O 3.36Å; N258-V269 PolarHBondContact OD1-N 2.97Å; N258-V269 PolarHBondContact OD1-O 3.14Å; L261-V269 HydrophobicContact CD1-CG2 4.15Å; V269-Y272 HydrophobicContact CB-CE1 3.92Å; V269-Y272 HydrophobicContact CG1-CD1 4.26Å; V269-Y272 HydrophobicContact CG1-CE1 3.8Å; V269-Y272 VanDerWaalsContact O-CE2 3.31Å; V269-Y272 WeakPolarHBondContact O-CE2 3.26Å; V269-Y272 VanDerWaalsContact O-CZ 3.27Å; V269-Y272 PolarHBondContact O-OH 3.44Å
270	L	73.6	Confident	77.2	Confident	125 Å²	125	88.4 Å²	88.4	65%	0.654	48%	0.477	S	S	*	.			trans	-84.3	-32.2	-173	-70.1	165	0	0	0	113.2	P268	P268-L270 PolarHBondContact O-N 3.41Å
271	F	68.5	Low	75.8	Confident	182 Å²	182	98.7 Å²	98.7	80%	0.798	52%	0.521	S	S	*	.			trans	-116.3	118.2	-174.5	-58.5	-77	0	0	0	109.7
272	Y	70.2	Confident	74.2	Confident	100 Å²	100	101.7 Å²	101.7	39%	0.392	56%	0.558	S	S	.	*			trans	-110.1	120.9	173.1	-61	-73.3	0	0	0	108.7	C254 N258 V269 S274	C254-Y272 HydrophobicContact CB-CD1 4.19Å; C254-Y272 HydrophobicContact CB-CD2 3.98Å; C254-Y272 HydrophobicContact CB-CE1 3.85Å; C254-Y272 HydrophobicContact CB-CE2 3.6Å; C254-Y272 HydrophobicContact CB-CG 4.23Å; C254-Y272 PolarHBondContact O-OH 2.96Å; N258-Y272 PolarHBondContact ND2-OH 2.98Å; N258-Y272 PolarHBondContact OD1-OH 3.38Å; V269-Y272 HydrophobicContact CB-CE1 3.92Å; V269-Y272 HydrophobicContact CG1-CD1 4.26Å; V269-Y272 HydrophobicContact CG1-CE1 3.8Å; V269-Y272 VanDerWaalsContact O-CE2 3.31Å; V269-Y272 WeakPolarHBondContact O-CE2 3.26Å; V269-Y272 VanDerWaalsContact O-CZ 3.27Å; V269-Y272 PolarHBondContact O-OH 3.44Å; Y272-S274 PolarHBondContact O-N 2.92Å
273	G	63.1	Low	72.6	Confident	51 Å²	51	97.7 Å²	97.7	53%	0.526	55%	0.546	S	S	.	.			trans	-61.6	130.2	173.7	0	0	0	0	0	111.8	Y290	G273-Y290 VanDerWaalsContact CA-CZ 3.41Å; G273-Y290 WeakPolarHBondContact CA-OH 3.46Å
274	S	64.1	Low	70.8	Confident	120 Å²	120	99.9 Å²	99.9	84%	0.839	56%	0.559	S	S	*	*	S	Bend	trans	-84.9	-24.2	174.9	66.9	0	0	0	0	113	Y272 Y290	Y272-S274 PolarHBondContact O-N 2.92Å; S274-Y290 PolarHBondContact N-OH 3.41Å; S274-Y290 VanDerWaalsContact N-OH 3.11Å
275	K	65.3	Low	69.3	Low	102 Å²	102	104.6 Å²	104.6	44%	0.443	59%	0.585	S	S	.	*	S	Bend	trans	-87.9	159.9	177.3	-62.4	-177.5	178.5	179.4	0	111.4	Y290 E293	K275-Y290 PolarHBondContact N-OH 3.39Å; K275-Y290 VanDerWaalsContact O-CE2 3.25Å; K275-Y290 WeakPolarHBondContact O-CE2 3.43Å; K275-Y290 PolarHBondContact O-OH 2.62Å; K275-E293 VanDerWaalsContact NZ-CD 3.32Å; K275-E293 IonicContact NZ-OE2 3.82Å; K275-E293 PolarHBondContact NZ-OE2 2.82Å
276	G	63.3	Low	68.2	Low	59 Å²	59	106 Å²	106	61%	0.608	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-82.9	160.4	170.7	0	0	0	0	0	112
277	F	71.2	Confident	67.2	Low	151 Å²	151	106.8 Å²	106.8	66%	0.662	59%	0.585	S	S	*	*	P	Polyproline II helix	trans	-67.8	137	175.9	-65.9	-86.8	0	0	0	111.7	Y288 Y290	F277-Y288 HydrophobicContact CB-CD1 4.44Å; F277-Y290 AromaticContact CD1-CD2 3.98Å; F277-Y290 HydrophobicContact CD1-CD2 3.98Å; F277-Y290 AromaticContact CE1-CD2 3.91Å; F277-Y290 HydrophobicContact CE1-CD2 3.91Å; F277-Y290 HydrophobicContact CE1-CG 4.43Å; F277-Y290 HydrophobicContact CZ-CD2 4.38Å
278	T	71.2	Confident	66.6	Low	63 Å²	63	105.6 Å²	105.6	39%	0.387	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.3	140.9	177.4	56.9	0	0	0	0	110.7	Y288 V289 D291	T278-Y288 WeakPolarHBondContact O-CA 3.49Å; T278-V289 PolarHBondContact N-O 2.88Å; T278-V289 PolarHBondContact O-N 3.17Å; T278-V289 PolarHBondContact OG1-O 3.47Å; T278-D291 HydrophobicContact CG2-CB 4.31Å; T278-D291 WeakPolarHBondContact OG1-CB 3.39Å
279	H	70.9	Confident	66	Low	82 Å²	82	106.9 Å²	106.9	38%	0.38	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.4	128	178.4	179.9	-80.4	0	0	0	110.5	K281 Y288	H279-K281 PolarHBondContact O-N 3.29Å; H279-Y288 HydrophobicContact CB-CD1 4.18Å; H279-Y288 HydrophobicContact CB-CE1 3.92Å; H279-Y288 AromaticContact CD2-CZ 3.96Å
280	C	66.2	Low	65.8	Low	46 Å²	46	106.3 Å²	106.3	31%	0.311	57%	0.572	S	S	.	*			trans	-71.1	118.6	178	-79.7	0	0	0	0	111.7	G282 A283 L287 V289	C280-G282 PolarHBondContact O-N 3.48Å; C280-A283 HydrophobicContact CB-CB 4.49Å; C280-L287 PolarHBondContact N-O 2.88Å; C280-V289 WeakPolarHBondContact SG-CG2 3.28Å
281	K	61.2	Low	65.6	Low	216 Å²	216	104.7 Å²	104.7	94%	0.939	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	95.2	175	-66.9	-176.5	-179.2	177.7	0	109.8	H279	H279-K281 PolarHBondContact O-N 3.29Å
282	G	57.6	Low	65.6	Low	84 Å²	84	103 Å²	103	87%	0.866	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	140.5	-11.6	174.6	0	0	0	0	0	115.7	C280	C280-G282 PolarHBondContact O-N 3.48Å
283	A	56.2	Low	65.7	Low	40 Å²	40	104.7 Å²	104.7	33%	0.331	57%	0.569	S	S	.	*	S	Bend	trans	-93.1	156	172	0	0	0	0	0	111	C280 E285 L287	C280-A283 HydrophobicContact CB-CB 4.49Å; A283-E285 PolarHBondContact O-N 3.35Å; A283-L287 HydrophobicContact CB-CB 3.91Å; A283-L287 HydrophobicContact CB-CD1 3.78Å; A283-L287 HydrophobicContact CB-CG 4.5Å
284	K	53.1	Low	66.3	Low	191 Å²	191	111.7 Å²	111.7	83%	0.83	59%	0.588	S	S	*	*			trans	-49.5	141.6	168.8	-77.2	-179.6	175.9	177	0	108.8	T286	K284-T286 PolarHBondContact O-N 2.93Å
285	E	57.2	Low	66.8	Low	176 Å²	176	110.6 Å²	110.6	82%	0.822	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.4	15	-164.5	-65.6	178.7	142.6	0	0	119.7	A283	A283-E285 PolarHBondContact O-N 3.35Å
286	T	63.3	Low	67.6	Low	102 Å²	102	110.3 Å²	110.3	63%	0.626	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.3	-1.2	-169.6	52.8	0	0	0	0	114.7	K284	K284-T286 PolarHBondContact O-N 2.93Å
287	L	67	Low	68.6	Low	77 Å²	77	114 Å²	114	40%	0.403	59%	0.589	S	S	.	*			trans	-97.2	113.1	-179.2	-93.1	160.2	0	0	0	112.1	C280 A283	C280-L287 PolarHBondContact N-O 2.88Å; A283-L287 HydrophobicContact CB-CB 3.91Å; A283-L287 HydrophobicContact CB-CD1 3.78Å; A283-L287 HydrophobicContact CB-CG 4.5Å
288	Y	72.3	Confident	69.3	Low	140 Å²	140	109.7 Å²	109.7	55%	0.549	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	130.2	173.8	-69.4	-93.1	0	0	0	109	F277 T278 H279	F277-Y288 HydrophobicContact CB-CD1 4.44Å; T278-Y288 WeakPolarHBondContact O-CA 3.49Å; H279-Y288 HydrophobicContact CB-CD1 4.18Å; H279-Y288 HydrophobicContact CB-CE1 3.92Å; H279-Y288 AromaticContact CD2-CZ 3.96Å
289	V	71.7	Confident	69.8	Low	66 Å²	66	110.9 Å²	110.9	40%	0.4	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	144.6	178.6	172.7	0	0	0	0	108.7	T278 C280 D291	T278-V289 PolarHBondContact N-O 2.88Å; T278-V289 PolarHBondContact O-N 3.17Å; T278-V289 PolarHBondContact OG1-O 3.47Å; C280-V289 WeakPolarHBondContact SG-CG2 3.28Å; V289-D291 PolarHBondContact O-N 2.95Å
290	Y	74	Confident	70.3	Confident	60 Å²	60	114 Å²	114	24%	0.235	59%	0.592	C	S	.	*			trans	-82.3	104.5	169.3	-161.9	-106.9	0	0	0	107.7	G273 S274 K275 F277 E292	G273-Y290 VanDerWaalsContact CA-CZ 3.41Å; G273-Y290 WeakPolarHBondContact CA-OH 3.46Å; S274-Y290 PolarHBondContact N-OH 3.41Å; S274-Y290 VanDerWaalsContact N-OH 3.11Å; K275-Y290 PolarHBondContact N-OH 3.39Å; K275-Y290 VanDerWaalsContact O-CE2 3.25Å; K275-Y290 WeakPolarHBondContact O-CE2 3.43Å; K275-Y290 PolarHBondContact O-OH 2.62Å; F277-Y290 AromaticContact CD1-CD2 3.98Å; F277-Y290 HydrophobicContact CD1-CD2 3.98Å; F277-Y290 AromaticContact CE1-CD2 3.91Å; F277-Y290 HydrophobicContact CE1-CD2 3.91Å; F277-Y290 HydrophobicContact CE1-CG 4.43Å; F277-Y290 HydrophobicContact CZ-CD2 4.38Å; Y290-E292 HydrophobicContact CD1-CG 3.39Å; Y290-E292 WeakPolarHBondContact CD1-OE1 3.45Å; Y290-E292 HydrophobicContact CE1-CG 3.65Å; Y290-E292 PolarHBondContact O-N 2.97Å
291	D	69.7	Low	71.2	Confident	91 Å²	91	118.7 Å²	118.7	49%	0.487	61%	0.613	S	S	.	*			trans	-78.1	90.3	-178.2	-162.3	10.4	0	0	0	109.6	T278 V289 E293	T278-D291 HydrophobicContact CG2-CB 4.31Å; T278-D291 WeakPolarHBondContact OG1-CB 3.39Å; V289-D291 PolarHBondContact O-N 2.95Å; D291-E293 PolarHBondContact O-N 3.44Å
292	E	69.4	Low	72.4	Confident	147 Å²	147	117.2 Å²	117.2	69%	0.687	60%	0.602	S	S	*	*			trans	-82.5	103.6	172.4	-66.4	-169.7	169	0	0	109.3	Y290 E294	Y290-E292 HydrophobicContact CD1-CG 3.39Å; Y290-E292 WeakPolarHBondContact CD1-OE1 3.45Å; Y290-E292 HydrophobicContact CE1-CG 3.65Å; Y290-E292 PolarHBondContact O-N 2.97Å; E292-E294 PolarHBondContact O-N 3.5Å; E292-E294 VanDerWaalsContact O-N 3.08Å
293	E	72.1	Confident	73.7	Confident	134 Å²	134	118.7 Å²	118.7	63%	0.626	59%	0.589	S	S	*	*			trans	-68.7	104.5	166	-75.2	174.5	162.4	0	0	108.6	K275 D291 S295	K275-E293 VanDerWaalsContact NZ-CD 3.32Å; K275-E293 IonicContact NZ-OE2 3.82Å; K275-E293 PolarHBondContact NZ-OE2 2.82Å; D291-E293 PolarHBondContact O-N 3.44Å; E293-S295 PolarHBondContact O-N 3.26Å; E293-S295 VanDerWaalsContact O-N 3.09Å; E293-S295 PolarHBondContact O-OG 3.48Å
294	E	74.5	Confident	75	Confident	198 Å²	198	122.3 Å²	122.3	93%	0.925	61%	0.61	S	S	*	*			trans	-57.7	114.6	170.5	-66.5	-175.1	172.6	0	0	109.1	E292	E292-E294 PolarHBondContact O-N 3.5Å; E292-E294 VanDerWaalsContact O-N 3.08Å
295	S	74.8	Confident	76.2	Confident	98 Å²	98	121.6 Å²	121.6	69%	0.685	61%	0.611	S	S	*	*			trans	-100.7	137.6	179.4	-56.5	0	0	0	0	109.5	E293	E293-S295 PolarHBondContact O-N 3.26Å; E293-S295 VanDerWaalsContact O-N 3.09Å; E293-S295 PolarHBondContact O-OG 3.48Å
296	D	82.3	Confident	77.2	Confident	96 Å²	96	118.7 Å²	118.7	51%	0.513	61%	0.607	S	S	.	*			trans	-66.2	136.3	177.3	-170.4	18.4	0	0	0	110.6	T298 D299 F300	D296-T298 PolarHBondContact O-N 3.17Å; D296-T298 VanDerWaalsContact O-N 3.12Å; D296-T298 WeakPolarHBondContact OD2-CB 3.47Å; D296-T298 PolarHBondContact OD2-OG1 2.91Å; D296-D299 PolarHBondContact O-N 2.79Å; D296-F300 PolarHBondContact O-N 3.06Å
297	L	84.3	Confident	77.8	Confident	135 Å²	135	125.7 Å²	125.7	71%	0.707	62%	0.623	S	S	*	*	H	α-helix	trans	-57.6	-31.2	179.7	-99.9	85.2	0	0	0	111.3	D299 F300 L301	L297-D299 VanDerWaalsContact C-N 3.27Å; L297-D299 PolarHBondContact O-N 3.2Å; L297-F300 PolarHBondContact O-N 3.36Å; L297-L301 WeakPolarHBondContact O-CG 3.42Å; L297-L301 PolarHBondContact O-N 3.09Å; L297-L301 VanDerWaalsContact O-N 3.09Å
298	T	86.1	Confident	78.2	Confident	61 Å²	61	128.3 Å²	128.3	37%	0.374	64%	0.641	S	S	.	*	H	α-helix	trans	-61.2	-37.1	178.1	-35.3	0	0	0	0	112	D296 R302	D296-T298 PolarHBondContact O-N 3.17Å; D296-T298 VanDerWaalsContact O-N 3.12Å; D296-T298 WeakPolarHBondContact OD2-CB 3.47Å; D296-T298 PolarHBondContact OD2-OG1 2.91Å; T298-R302 WeakPolarHBondContact O-CG 3.28Å; T298-R302 PolarHBondContact O-N 3.22Å
299	D	82.5	Confident	78	Confident	88 Å²	88	126.9 Å²	126.9	47%	0.471	65%	0.649	S	S	.	*	H	α-helix	trans	-76.7	-34.9	179.9	-69.3	-26.7	0	0	0	111.3	D296 L297 L301 R302 L303	D296-D299 PolarHBondContact O-N 2.79Å; L297-D299 VanDerWaalsContact C-N 3.27Å; L297-D299 PolarHBondContact O-N 3.2Å; D299-L301 PolarHBondContact O-N 3.43Å; D299-R302 PolarHBondContact O-N 3.38Å; D299-R302 IonicContact OD1-NH1 3.83Å; D299-L303 PolarHBondContact O-N 3.13Å
300	F	81.5	Confident	77.7	Confident	149 Å²	149	131.2 Å²	131.2	65%	0.654	67%	0.669	S	S	*	*	H	α-helix	trans	-61.4	-42.5	172.6	-175.5	-97.4	0	0	0	112.1	D296 L297 R302 L303	D296-F300 PolarHBondContact O-N 3.06Å; L297-F300 PolarHBondContact O-N 3.36Å; F300-R302 PolarHBondContact O-N 3.22Å; F300-L303 HydrophobicContact CD2-CD1 3.91Å; F300-L303 HydrophobicContact CE2-CD1 4.42Å; F300-L303 WeakPolarHBondContact O-CB 3.43Å; F300-L303 PolarHBondContact O-N 3.32Å
301	L	85	Confident	76.7	Confident	143 Å²	143	130.4 Å²	130.4	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-66	-21	178	-69.7	172.2	0	0	0	113.5	L297 D299	L297-L301 WeakPolarHBondContact O-CG 3.42Å; L297-L301 PolarHBondContact O-N 3.09Å; L297-L301 VanDerWaalsContact O-N 3.09Å; D299-L301 PolarHBondContact O-N 3.43Å
302	R	86.3	Confident	75.7	Confident	186 Å²	186	130.3 Å²	130.3	70%	0.702	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-8.3	178.5	-70.6	171	179.5	174.6	0.7	113.4	T298 D299 F300	T298-R302 WeakPolarHBondContact O-CG 3.28Å; T298-R302 PolarHBondContact O-N 3.22Å; D299-R302 PolarHBondContact O-N 3.38Å; D299-R302 IonicContact OD1-NH1 3.83Å; F300-R302 PolarHBondContact O-N 3.22Å
303	L	83.6	Confident	74.5	Confident	115 Å²	115	127 Å²	127	60%	0.602	67%	0.674	S	S	*	*	S	Bend	trans	-66.3	133.9	-179	-71.5	168.6	0	0	0	111.1	D299 F300	D299-L303 PolarHBondContact O-N 3.13Å; F300-L303 HydrophobicContact CD2-CD1 3.91Å; F300-L303 HydrophobicContact CE2-CD1 4.42Å; F300-L303 WeakPolarHBondContact O-CB 3.43Å; F300-L303 PolarHBondContact O-N 3.32Å
304	P	83.5	Confident	72.8	Confident	116 Å²	116	128.1 Å²	128.1	75%	0.753	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-67.5	145.4	176.4	28.1	-33.7	0	0	0	110.9
305	M	78.1	Confident	71	Confident	176 Å²	176	123 Å²	123	87%	0.867	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-58.7	137.2	178.8	-68.1	-162.6	-66.6	0	0	111.5
306	P	79.9	Confident	69.3	Low	114 Å²	114	122.1 Å²	122.1	74%	0.74	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-64.8	147.4	177.8	26.3	-33	0	0	0	111	V308	P306-V308 PolarHBondContact O-N 2.9Å
307	R	75.9	Confident	67.1	Low	250 Å²	250	123.3 Å²	123.3	94%	0.943	69%	0.687	S	S	*	*			trans	-70.5	115.8	177.5	-65.5	-176.7	-177	-178.5	1.3	109.5
308	V	73.8	Confident	64.6	Low	132 Å²	132	122.1 Å²	122.1	80%	0.8	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-73.3	129.3	175.4	-171.5	0	0	0	0	108.8	P306	P306-V308 PolarHBondContact O-N 2.9Å
309	P	70.1	Confident	62.3	Low	109 Å²	109	126.4 Å²	126.4	71%	0.708	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-62.5	149.7	171.7	25.9	-32.4	0	0	0	110.3	G311	P309-G311 PolarHBondContact O-N 3.43Å
310	L	65.3	Low	60.1	Low	157 Å²	157	124.3 Å²	124.3	82%	0.822	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55	116.3	175.4	-78.6	136.3	0	0	0	109.6
311	G	52.3	Low	58.1	Low	44 Å²	44	126.2 Å²	126.2	45%	0.454	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-68.8	158	-174.2	0	0	0	0	0	113.6	P309 T313	P309-G311 PolarHBondContact O-N 3.43Å; G311-T313 PolarHBondContact O-N 2.78Å; G311-T313 PolarHBondContact O-OG1 2.87Å
312	P	49.2	Very low	56	Low	89 Å²	89	126.6 Å²	126.6	58%	0.578	70%	0.697	S	S	*	*			trans	-70	92.6	173.4	29.4	-32.7	0	0	0	110.1	I314 I320	P312-I314 PolarHBondContact O-N 3.12Å; P312-I320 HydrophobicContact CB-CB 4.43Å; P312-I320 HydrophobicContact CB-CD1 3.62Å; P312-I320 HydrophobicContact CB-CG1 3.81Å; P312-I320 HydrophobicContact CB-CG2 3.79Å
313	T	42.6	Very low	54	Low	78 Å²	78	122.1 Å²	122.1	48%	0.479	69%	0.694	S	S	.	*			trans	-82.1	109	176.9	-48.7	0	0	0	0	109.4	G311 T315 I320	G311-T313 PolarHBondContact O-N 2.78Å; G311-T313 PolarHBondContact O-OG1 2.87Å; T313-T315 VanDerWaalsContact C-N 3.31Å; T313-T315 HydrophobicContact CG2-CG2 3.66Å; T313-T315 WeakPolarHBondContact CG2-OG1 3.5Å; T313-T315 PolarHBondContact O-N 2.98Å; T313-I320 WeakPolarHBondContact O-CG1 3.49Å; T313-I320 PolarHBondContact O-N 3.35Å
314	I	38.1	Very low	52.2	Low	156 Å²	156	122.1 Å²	122.1	80%	0.8	70%	0.702	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.8	77.7	167.5	-54.3	172.4	0	0	0	107.1	P312 I320	P312-I314 PolarHBondContact O-N 3.12Å; I314-I320 HydrophobicContact CG1-CD1 4.26Å
315	T	36.7	Very low	50.9	Low	92 Å²	92	122.2 Å²	122.2	56%	0.564	70%	0.696	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.3	93.8	168.4	40.9	0	0	0	0	108.9	T313 S317 V318	T313-T315 VanDerWaalsContact C-N 3.31Å; T313-T315 HydrophobicContact CG2-CG2 3.66Å; T313-T315 WeakPolarHBondContact CG2-OG1 3.5Å; T313-T315 PolarHBondContact O-N 2.98Å; T315-S317 PolarHBondContact O-N 3.44Å; T315-V318 PolarHBondContact O-N 3.03Å; T315-V318 VanDerWaalsContact O-N 3.13Å
316	G	38	Very low	50.3	Low	78 Å²	78	117.9 Å²	117.9	80%	0.804	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.4	-15.8	143	0	0	0	0	0	122.7
317	S	36.2	Very low	49.9	Very low	122 Å²	122	116.3 Å²	116.3	85%	0.853	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.3	-1.1	179.8	-78.2	0	0	0	0	113.5	T315	T315-S317 PolarHBondContact O-N 3.44Å
318	V	31.1	Very low	49.8	Very low	110 Å²	110	112.3 Å²	112.3	67%	0.667	66%	0.664	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-134.4	100.4	174.3	-177.5	0	0	0	0	107.5	T315 I320	T315-V318 PolarHBondContact O-N 3.03Å; T315-V318 VanDerWaalsContact O-N 3.13Å; V318-I320 PolarHBondContact O-N 3.48Å
319	L	38.9	Very low	50.1	Low	151 Å²	151	111.4 Å²	111.4	79%	0.791	65%	0.654	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-53.9	120.1	169.3	-96	114	0	0	0	108.4
320	I	36.7	Very low	50.4	Low	44 Å²	44	108.3 Å²	108.3	23%	0.226	64%	0.638	C	S	.	*			trans	17.3	114.8	143.7	-57.3	167.6	0	0	0	113.9	P312 T313 I314 V318 F322	P312-I320 HydrophobicContact CB-CB 4.43Å; P312-I320 HydrophobicContact CB-CD1 3.62Å; P312-I320 HydrophobicContact CB-CG1 3.81Å; P312-I320 HydrophobicContact CB-CG2 3.79Å; T313-I320 WeakPolarHBondContact O-CG1 3.49Å; T313-I320 PolarHBondContact O-N 3.35Å; I314-I320 HydrophobicContact CG1-CD1 4.26Å; V318-I320 PolarHBondContact O-N 3.48Å; I320-F322 HydrophobicContact CG2-CB 4.26Å; I320-F322 HydrophobicContact CG2-CD2 3.6Å; I320-F322 HydrophobicContact CG2-CE2 4.48Å; I320-F322 HydrophobicContact CG2-CG 4.4Å; I320-F322 CarbonylContact O-C 3.59Å; I320-F322 PolarHBondContact O-N 2.8Å
321	K	38.5	Very low	50.8	Low	189 Å²	189	102.9 Å²	102.9	82%	0.822	61%	0.609	S	S	*	*	S	Bend	trans	-70.3	40.7	172.8	-125.1	-179.5	-172.2	179.6	0	113.4
322	F	41.9	Very low	51.6	Low	151 Å²	151	105.2 Å²	105.2	66%	0.662	61%	0.611	S	S	*	*	S	Bend	trans	-79	101.7	131.3	-76.2	-80.1	0	0	0	102.4	I320 C324	I320-F322 HydrophobicContact CG2-CB 4.26Å; I320-F322 HydrophobicContact CG2-CD2 3.6Å; I320-F322 HydrophobicContact CG2-CE2 4.48Å; I320-F322 HydrophobicContact CG2-CG 4.4Å; I320-F322 CarbonylContact O-C 3.59Å; I320-F322 PolarHBondContact O-N 2.8Å; F322-C324 PolarHBondContact O-N 3.27Å
323	S	44.6	Very low	52.6	Low	91 Å²	91	108.7 Å²	108.7	64%	0.636	63%	0.625	S	S	*	*			trans	-65.9	78.2	-174.3	70.3	0	0	0	0	110.3	L325	S323-L325 PolarHBondContact O-N 3.28Å
324	C	44.1	Very low	54.1	Low	115 Å²	115	109.3 Å²	109.3	78%	0.777	63%	0.628	S	S	*	*			trans	-72	65.1	160.6	-63	0	0	0	0	105.9	F322 G326	F322-C324 PolarHBondContact O-N 3.27Å; C324-G326 VanDerWaalsContact C-N 3.34Å; C324-G326 PolarHBondContact O-N 3.5Å
325	L	57.2	Low	55.8	Low	119 Å²	119	106.1 Å²	106.1	62%	0.623	61%	0.611	S	S	*	*			trans	-66.7	101.7	165.7	-73	162.9	0	0	0	104.7	S323 H327	S323-L325 PolarHBondContact O-N 3.28Å; L325-H327 PolarHBondContact O-N 2.91Å; L325-H327 VanDerWaalsContact O-N 3.09Å; L325-H327 PolarHBondContact O-ND1 3.43Å
326	G	64.5	Low	57.5	Low	84 Å²	84	102.6 Å²	102.6	87%	0.866	59%	0.59	S	S	*	*			trans	-57.4	116.3	172.6	0	0	0	0	0	108.3	C324	C324-G326 VanDerWaalsContact C-N 3.34Å; C324-G326 PolarHBondContact O-N 3.5Å
327	H	72.1	Confident	59.3	Low	82 Å²	82	107.3 Å²	107.3	38%	0.38	59%	0.591	S	S	.	*			trans	-120.5	160.7	172.8	63.1	-88.1	0	0	0	108.9	L325 L329 E340 N341	L325-H327 PolarHBondContact O-N 2.91Å; L325-H327 VanDerWaalsContact O-N 3.09Å; L325-H327 PolarHBondContact O-ND1 3.43Å; H327-L329 PolarHBondContact O-N 3Å; H327-E340 HydrophobicContact CB-CB 4.44Å; H327-N341 PolarHBondContact CD2-OD1 3.45Å; H327-N341 PolarHBondContact NE2-OD1 3.47Å; H327-N341 VanDerWaalsContact NE2-OD1 3.12Å
328	W	73.5	Confident	61.1	Low	165 Å²	165	104.4 Å²	104.4	63%	0.625	57%	0.565	S	S	*	*			trans	-76	107.2	176.4	-70.7	95.8	0	0	0	109.7	I331 P336 N341	W328-I331 HydrophobicContact CB-CG1 4.35Å; W328-I331 HydrophobicContact CE3-CG1 4.36Å; W328-P336 HydrophobicContact CB-CG 4.13Å; W328-P336 WeakPolarHBondContact O-CD 3.3Å; W328-P336 WeakPolarHBondContact O-CG 3.38Å; W328-N341 PolarHBondContact O-ND2 3.09Å
329	L	80	Confident	63.1	Low	113 Å²	113	105.3 Å²	105.3	59%	0.592	57%	0.573	S	S	*	*	S	Bend	trans	-69.1	-38.7	173.2	-178	66.5	0	0	0	111.4	H327 M335 P336	H327-L329 PolarHBondContact O-N 3Å; L329-M335 HydrophobicContact CD1-CE 4.3Å; L329-M335 WeakPolarHBondContact O-CA 3.49Å; L329-M335 WeakPolarHBondContact O-CG 3.16Å; L329-P336 WeakPolarHBondContact O-CD 3.36Å
330	A	76.4	Confident	64.8	Low	45 Å²	45	103 Å²	103	37%	0.372	56%	0.558	S	S	.	*			trans	-150.8	144.7	177.4	0	0	0	0	0	111.4	V334	A330-V334 CarbonylContact C-O 3.38Å; A330-V334 WeakPolarHBondContact CA-O 3.42Å
331	I	74.3	Confident	66.9	Low	42 Å²	42	101.2 Å²	101.2	22%	0.215	55%	0.549	C	S	.	.	B	Isolated β-bridge	trans	-119.5	118.9	168.4	-61.9	168.7	0	0	0	106.3	W328 N333 V334 P336 L464	W328-I331 HydrophobicContact CB-CG1 4.35Å; W328-I331 HydrophobicContact CE3-CG1 4.36Å; I331-N333 VanDerWaalsContact C-N 3.29Å; I331-N333 PolarHBondContact O-N 3.24Å; I331-V334 PolarHBondContact N-O 3.28Å; I331-V334 WeakPolarHBondContact O-CB 3.46Å; I331-V334 PolarHBondContact O-N 3.19Å; I331-P336 HydrophobicContact CD1-CG 4.49Å; I331-L464 HydrophobicContact CG2-CD1 3.62Å; I331-L464 HydrophobicContact CG2-CD2 3.75Å; I331-L464 HydrophobicContact CG2-CG 4.34Å
332	D	69.6	Low	68.3	Low	93 Å²	93	100.4 Å²	100.4	50%	0.497	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	47.7	-174.8	-63.4	-25.6	0	0	0	113.3	V334	D332-V334 PolarHBondContact O-N 2.72Å
333	N	70.3	Confident	69.2	Low	163 Å²	163	99 Å²	99	87%	0.872	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	9.1	-176.9	-50.1	-58.2	0	0	0	115.5	I331	I331-N333 VanDerWaalsContact C-N 3.29Å; I331-N333 PolarHBondContact O-N 3.24Å
334	V	73.4	Confident	69.8	Low	91 Å²	91	100.4 Å²	100.4	55%	0.552	55%	0.554	S	S	*	*	B	Isolated β-bridge	trans	-105.8	122	174.2	-176.7	0	0	0	0	109.7	A330 I331 D332 P336	A330-V334 CarbonylContact C-O 3.38Å; A330-V334 WeakPolarHBondContact CA-O 3.42Å; I331-V334 PolarHBondContact N-O 3.28Å; I331-V334 WeakPolarHBondContact O-CB 3.46Å; I331-V334 PolarHBondContact O-N 3.19Å; D332-V334 PolarHBondContact O-N 2.72Å; V334-P336 WeakPolarHBondContact O-CD 3.49Å
335	M	74	Confident	70.2	Confident	88 Å²	88	98.4 Å²	98.4	43%	0.433	54%	0.541	S	S	.	.			trans	-70.7	115.7	176.8	-176.1	169.8	-176.9	0	0	110	L329 N341	L329-M335 HydrophobicContact CD1-CE 4.3Å; L329-M335 WeakPolarHBondContact O-CA 3.49Å; L329-M335 WeakPolarHBondContact O-CG 3.16Å; M335-N341 HydrophobicContact CE-CB 3.29Å; M335-N341 HydrophobicContact CG-CB 4.09Å; M335-N341 HydrophobicContact SD-CB 4.48Å
336	P	72.5	Confident	70	Confident	19 Å²	19	102 Å²	102	12%	0.123	55%	0.552	C	S	.	*			trans	-69.9	143.4	177.4	30.4	-33.7	0	0	0	109.8	W328 L329 I331 V334 I338 N341	W328-P336 HydrophobicContact CB-CG 4.13Å; W328-P336 WeakPolarHBondContact O-CD 3.3Å; W328-P336 WeakPolarHBondContact O-CG 3.38Å; L329-P336 WeakPolarHBondContact O-CD 3.36Å; I331-P336 HydrophobicContact CD1-CG 4.49Å; V334-P336 WeakPolarHBondContact O-CD 3.49Å; P336-I338 VanDerWaalsContact C-N 3.27Å; P336-I338 HydrophobicContact CB-CD1 4.02Å; P336-I338 HydrophobicContact CB-CG1 3.93Å; P336-I338 HydrophobicContact CG-CD1 3.75Å; P336-I338 HydrophobicContact CG-CG1 4.05Å; P336-I338 PolarHBondContact O-N 2.99Å; P336-N341 WeakPolarHBondContact O-CB 3.45Å; P336-N341 PolarHBondContact O-ND2 3.5Å
337	Q	75.6	Confident	69.1	Low	177 Å²	177	102 Å²	102	83%	0.827	54%	0.544	S	S	*	.			trans	-81.4	73.9	-179.3	-65.3	-169.4	-25	0	0	110.8	L343	Q337-L343 HydrophobicContact CG-CD2 4.42Å
338	I	74.4	Confident	68	Low	61 Å²	61	104.1 Å²	104.1	31%	0.313	56%	0.558	S	S	.	*			trans	-106.4	145.7	177.2	-46.2	178.4	0	0	0	107.5	P336 E340 N341	P336-I338 VanDerWaalsContact C-N 3.27Å; P336-I338 HydrophobicContact CB-CD1 4.02Å; P336-I338 HydrophobicContact CB-CG1 3.93Å; P336-I338 HydrophobicContact CG-CD1 3.75Å; P336-I338 HydrophobicContact CG-CG1 4.05Å; P336-I338 PolarHBondContact O-N 2.99Å; I338-E340 WeakPolarHBondContact CG2-OE2 3.34Å; I338-E340 PolarHBondContact O-N 2.85Å; I338-N341 WeakPolarHBondContact O-CB 3.49Å; I338-N341 PolarHBondContact O-N 3.26Å
339	P	71.4	Confident	66.6	Low	128 Å²	128	100 Å²	100	83%	0.831	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.2	-31.2	-177.1	-32.3	36.9	0	0	0	116.5	N341	P339-N341 VanDerWaalsContact C-N 3.32Å
340	E	75.8	Confident	64.9	Low	102 Å²	102	102.9 Å²	102.9	48%	0.477	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.1	-23.3	177.7	-65.6	81.8	174.1	0	0	113.3	H327 I338 E342	H327-E340 HydrophobicContact CB-CB 4.44Å; I338-E340 WeakPolarHBondContact CG2-OE2 3.34Å; I338-E340 PolarHBondContact O-N 2.85Å; E340-E342 PolarHBondContact O-N 2.97Å
341	N	81.4	Confident	63.2	Low	7 Å²	7	108.4 Å²	108.4	4%	0.037	59%	0.585	C	S	.	*	S	Bend	trans	-87.5	102.6	176.6	-87.7	-10.7	0	0	0	108.3	H327 W328 M335 P336 I338 P339 L343	H327-N341 PolarHBondContact CD2-OD1 3.45Å; H327-N341 PolarHBondContact NE2-OD1 3.47Å; H327-N341 VanDerWaalsContact NE2-OD1 3.12Å; W328-N341 PolarHBondContact O-ND2 3.09Å; M335-N341 HydrophobicContact CE-CB 3.29Å; M335-N341 HydrophobicContact CG-CB 4.09Å; M335-N341 HydrophobicContact SD-CB 4.48Å; P336-N341 WeakPolarHBondContact O-CB 3.45Å; P336-N341 PolarHBondContact O-ND2 3.5Å; I338-N341 WeakPolarHBondContact O-CB 3.49Å; I338-N341 PolarHBondContact O-N 3.26Å; P339-N341 VanDerWaalsContact C-N 3.32Å; N341-L343 PolarHBondContact O-N 3.1Å; N341-L343 VanDerWaalsContact O-N 3.09Å
342	E	67.4	Low	61.5	Low	173 Å²	173	114.9 Å²	114.9	81%	0.808	61%	0.611	S	S	*	*			trans	-52.7	118.4	179.9	-65.8	-173.7	177.8	0	0	110.7	E340	E340-E342 PolarHBondContact O-N 2.97Å
343	L	60.7	Low	59.7	Low	122 Å²	122	118.5 Å²	118.5	64%	0.639	62%	0.622	S	S	*	*			trans	-60.3	133.7	170.4	-70.8	164.7	0	0	0	107.5	Q337 N341 S345	Q337-L343 HydrophobicContact CG-CD2 4.42Å; N341-L343 PolarHBondContact O-N 3.1Å; N341-L343 VanDerWaalsContact O-N 3.09Å; L343-S345 PolarHBondContact O-N 2.97Å
344	P	57.1	Low	57.8	Low	119 Å²	119	118.6 Å²	118.6	77%	0.773	62%	0.623	S	S	*	*			trans	-53.1	111.2	179.9	19.6	-30.4	0	0	0	108.6
345	S	52.2	Low	56	Low	73 Å²	73	119 Å²	119	51%	0.51	64%	0.636	S	S	.	*			trans	-61.8	141	-177.8	78.5	0	0	0	0	108.2	L343 A347 D348	L343-S345 PolarHBondContact O-N 2.97Å; S345-A347 PolarHBondContact O-N 2.99Å; S345-D348 PolarHBondContact O-N 3.19Å
346	K	52.9	Low	54.1	Low	196 Å²	196	119.5 Å²	119.5	85%	0.852	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-60.5	-3.4	-177.5	-66	178.7	177.7	177.8	0	114	T349	K346-T349 PolarHBondContact O-OG1 2.9Å
347	A	46.7	Very low	52	Low	84 Å²	84	124.1 Å²	124.1	69%	0.694	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-74.9	-23.5	-178.7	0	0	0	0	0	114.1	S345 T349	S345-A347 PolarHBondContact O-N 2.99Å; A347-T349 VanDerWaalsContact C-N 3.33Å; A347-T349 PolarHBondContact O-N 3.23Å
348	D	47.7	Very low	50.1	Low	126 Å²	126	122.7 Å²	122.7	67%	0.674	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-90.3	5.7	179	-67.4	-27.4	0	0	0	113.5	S345 E350	S345-D348 PolarHBondContact O-N 3.19Å; D348-E350 VanDerWaalsContact C-N 3.32Å; D348-E350 PolarHBondContact O-N 3.16Å
349	T	45.7	Very low	48.2	Very low	77 Å²	77	124 Å²	124	47%	0.472	69%	0.691	S	S	.	*	G	3₁₀ helix	trans	-83.6	-2.3	-174.1	-17.4	0	0	0	0	114.4	K346 A347 K353	K346-T349 PolarHBondContact O-OG1 2.9Å; A347-T349 VanDerWaalsContact C-N 3.33Å; A347-T349 PolarHBondContact O-N 3.23Å; T349-K353 WeakPolarHBondContact O-CE 3.34Å
350	E	43.6	Very low	46.1	Very low	175 Å²	175	124 Å²	124	82%	0.818	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-26.1	178.8	-61.7	-159.7	152.9	0	0	113.3	D348	D348-E350 VanDerWaalsContact C-N 3.32Å; D348-E350 PolarHBondContact O-N 3.16Å
351	D	40.5	Very low	44	Very low	161 Å²	161	123.5 Å²	123.5	86%	0.861	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	2.3	-174.8	-74	-32.7	0	0	0	116.4
352	K	38.6	Very low	41.7	Very low	178 Å²	178	129.4 Å²	129.4	77%	0.774	74%	0.743	S	S	*	*			trans	-137.5	44.7	178.7	-70.6	-173.6	-179.3	172.4	0	115.2	N354	K352-N354 PolarHBondContact O-N 3.28Å
353	K	31.8	Very low	39.8	Very low	168 Å²	168	128.3 Å²	128.3	73%	0.73	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	5.2	175.1	-85.8	-178.4	179.5	169.2	0	116.4	T349	T349-K353 WeakPolarHBondContact O-CE 3.34Å
354	N	30.7	Very low	38.4	Very low	166 Å²	166	129 Å²	129	89%	0.888	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	17.1	-175.2	-70.9	-5.5	0	0	0	116.5	K352	K352-N354 PolarHBondContact O-N 3.28Å
355	A	36	Very low	37.1	Very low	99 Å²	99	130.8 Å²	130.8	82%	0.818	75%	0.745	S	S	*	*	S	Bend	trans	-137.4	3.7	178.7	0	0	0	0	0	117
356	A	33.1	Very low	35.9	Very low	99 Å²	99	132.5 Å²	132.5	82%	0.818	76%	0.757	S	S	*	*			trans	-141.8	68.2	178.8	0	0	0	0	0	111.9
357	S	29.1	Very low	34.8	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	75%	0.754	S	S	*	*			trans	-103.7	104.3	158.8	-167	0	0	0	0	107.1
358	I	35.4	Very low	34.1	Very low	147 Å²	147	134.7 Å²	134.7	75%	0.754	76%	0.758	S	S	*	*	S	Bend	trans	169.1	113.4	150.7	-84.5	154.3	0	0	0	106
359	N	34.2	Very low	33.5	Very low	89 Å²	89	138.2 Å²	138.2	48%	0.476	77%	0.77	S	S	.	*			trans	102.3	69.1	168.8	-48	-41.1	0	0	0	118	R374 Q377	N359-R374 PolarHBondContact ND2-NH1 2.95Å; N359-Q377 PolarHBondContact ND2-NE2 2.96Å
360	S	27.8	Very low	33	Very low	126 Å²	126	141.8 Å²	141.8	88%	0.881	78%	0.781	S	S	*	*			trans	-98.8	108.3	144.5	42.2	0	0	0	0	108.8
361	A	31.8	Very low	33	Very low	92 Å²	92	138.5 Å²	138.5	76%	0.76	77%	0.768	S	S	*	*			trans	-136.8	101.6	167.8	0	0	0	0	0	110.7
362	V	32	Very low	32.8	Very low	132 Å²	132	136.3 Å²	136.3	80%	0.8	76%	0.764	S	S	*	*			trans	53.4	102.3	134.4	-168.2	0	0	0	0	119.1
363	H	27.7	Very low	32.9	Very low	149 Å²	149	133.8 Å²	133.8	69%	0.69	75%	0.751	S	S	*	*			trans	-3.5	111	135.4	-163.1	71.3	0	0	0	117.9
364	V	32.6	Very low	33.3	Very low	137 Å²	137	132.1 Å²	132.1	83%	0.83	74%	0.74	S	S	*	*			trans	-140.7	118.1	146.5	179.9	0	0	0	0	109.2
365	Q	29.2	Very low	33.6	Very low	156 Å²	156	128.2 Å²	128.2	73%	0.729	73%	0.731	S	S	*	*			trans	-69.4	134.5	169.6	-68.3	170.7	-27.8	0	0	110.6
366	S	28.1	Very low	34	Very low	109 Å²	109	129.2 Å²	129.2	76%	0.762	73%	0.729	S	S	*	*			trans	161.2	109	145	163.2	0	0	0	0	111.5
367	N	28	Very low	34.4	Very low	147 Å²	147	128.7 Å²	128.7	79%	0.786	71%	0.709	S	S	*	*			trans	33.2	124.1	145.5	-75.7	-16.6	0	0	0	120.8
368	K	31.8	Very low	35.3	Very low	180 Å²	180	131.5 Å²	131.5	78%	0.783	71%	0.709	S	S	*	*	S	Bend	trans	98.8	134	173.7	-65.3	178.1	175.6	177	0	113.5	H370	K368-H370 PolarHBondContact O-CD2 3.33Å; K368-H370 VanDerWaalsContact O-CD2 3.3Å; K368-H370 PolarHBondContact O-N 3.41Å
369	E	35.8	Very low	36.1	Very low	200 Å²	200	130 Å²	130	94%	0.935	70%	0.699	S	S	*	*			trans	-54.8	61.3	178.1	-59.9	165	-177.2	0	0	112.4	I371	E369-I371 PolarHBondContact O-N 2.85Å
370	H	35.9	Very low	37.2	Very low	152 Å²	152	134.9 Å²	134.9	70%	0.704	72%	0.719	S	S	*	*			trans	-83.2	95.5	169.3	-70.7	-75.1	0	0	0	106.2	K368 C372	K368-H370 PolarHBondContact O-CD2 3.33Å; K368-H370 VanDerWaalsContact O-CD2 3.3Å; K368-H370 PolarHBondContact O-N 3.41Å; H370-C372 VanDerWaalsContact C-N 3.33Å; H370-C372 PolarHBondContact O-N 2.93Å
371	I	43.4	Very low	39	Very low	105 Å²	105	129.9 Å²	129.9	54%	0.538	68%	0.683	S	S	.	*			trans	-39.1	109.1	150.7	-63.9	163.1	0	0	0	105.2	E369 Y373	E369-I371 PolarHBondContact O-N 2.85Å; I371-Y373 HydrophobicContact CB-CD2 4.46Å; I371-Y373 HydrophobicContact CB-CE2 4.29Å; I371-Y373 HydrophobicContact CG2-CD2 4.18Å; I371-Y373 HydrophobicContact CG2-CE2 4.06Å; I371-Y373 WeakPolarHBondContact O-CD2 3.48Å; I371-Y373 PolarHBondContact O-N 3.29Å
372	C	36.2	Very low	41.2	Very low	115 Å²	115	129.2 Å²	129.2	78%	0.777	67%	0.671	S	S	*	*			trans	-69.2	87.1	178.6	-164.5	0	0	0	0	106	H370 R374	H370-C372 VanDerWaalsContact C-N 3.33Å; H370-C372 PolarHBondContact O-N 2.93Å; C372-R374 PolarHBondContact O-N 3.19Å
373	Y	41.2	Very low	43.7	Very low	125 Å²	125	128.8 Å²	128.8	49%	0.49	66%	0.664	S	S	.	*			trans	-59.8	95.9	158.4	-75.2	-88.7	0	0	0	104.7	I371 A375 L464 H467	I371-Y373 HydrophobicContact CB-CD2 4.46Å; I371-Y373 HydrophobicContact CB-CE2 4.29Å; I371-Y373 HydrophobicContact CG2-CD2 4.18Å; I371-Y373 HydrophobicContact CG2-CE2 4.06Å; I371-Y373 WeakPolarHBondContact O-CD2 3.48Å; I371-Y373 PolarHBondContact O-N 3.29Å; Y373-A375 PolarHBondContact O-N 2.87Å; Y373-A375 VanDerWaalsContact O-N 3.07Å; Y373-L464 PolarHBondContact OH-O 2.94Å; Y373-H467 AromaticContact CE1-CE1 3.97Å; Y373-H467 AromaticContact CZ-CE1 3.77Å
374	R	38.4	Very low	46.5	Very low	134 Å²	134	129.3 Å²	129.3	51%	0.506	67%	0.667	S	S	.	*			trans	-49.3	124.5	161.5	-96.6	-169.1	177.2	154	6.9	105.3	N359 C372 Q377	N359-R374 PolarHBondContact ND2-NH1 2.95Å; C372-R374 PolarHBondContact O-N 3.19Å; R374-Q377 VanDerWaalsContact NH1-NE2 3.17Å
375	A	38.7	Very low	49	Very low	84 Å²	84	124.9 Å²	124.9	69%	0.694	64%	0.638	S	S	*	*	S	Bend	trans	-39.3	129.9	164.4	0	0	0	0	0	107.2	Y373 Q377	Y373-A375 PolarHBondContact O-N 2.87Å; Y373-A375 VanDerWaalsContact O-N 3.07Å; A375-Q377 VanDerWaalsContact C-N 3.35Å; A375-Q377 PolarHBondContact O-N 2.93Å
376	P	42.8	Very low	51.7	Low	120 Å²	120	123 Å²	123	78%	0.779	63%	0.629	S	S	*	*			trans	-47.8	103.1	-164.3	16.4	-30.7	0	0	0	108.3	E378	P376-E378 PolarHBondContact O-N 3.3Å; P376-E378 VanDerWaalsContact O-N 3.08Å
377	Q	42.1	Very low	54.6	Low	88 Å²	88	122.5 Å²	122.5	41%	0.411	62%	0.617	S	S	.	*			trans	-54.8	125.9	169.1	-82.6	-173	-31.2	0	0	103.2	N359 R374 A375 H379	N359-Q377 PolarHBondContact ND2-NE2 2.96Å; R374-Q377 VanDerWaalsContact NH1-NE2 3.17Å; A375-Q377 VanDerWaalsContact C-N 3.35Å; A375-Q377 PolarHBondContact O-N 2.93Å; Q377-H379 PolarHBondContact O-N 3.44Å; Q377-H379 PolarHBondContact O-ND1 2.97Å
378	E	47.5	Very low	57.5	Low	174 Å²	174	118 Å²	118	81%	0.813	59%	0.59	S	S	*	*			trans	-58.4	80.6	173.3	-63.5	-178.2	167.4	0	0	106.6	P376 Q380	P376-E378 PolarHBondContact O-N 3.3Å; P376-E378 VanDerWaalsContact O-N 3.08Å; E378-Q380 PolarHBondContact O-N 3.49Å
379	H	52.2	Low	60.2	Low	115 Å²	115	111.5 Å²	111.5	53%	0.532	56%	0.561	S	S	.	*			trans	-50	121	164	-89.9	71.8	0	0	0	102.9	Q377 V381 R423	Q377-H379 PolarHBondContact O-N 3.44Å; Q377-H379 PolarHBondContact O-ND1 2.97Å; H379-V381 WeakPolarHBondContact O-CG2 3.45Å; H379-V381 PolarHBondContact O-N 3.19Å; H379-R423 PolarHBondContact O-NH2 2.72Å
380	Q	57.1	Low	62.8	Low	193 Å²	193	107.4 Å²	107.4	90%	0.902	54%	0.541	S	S	*	.			trans	-61.7	87	176.3	-70.1	-179.2	1.5	0	0	106.1	E378 P382	E378-Q380 PolarHBondContact O-N 3.49Å; Q380-P382 WeakPolarHBondContact O-CD 3.4Å
381	V	67.4	Low	65.3	Low	20 Å²	20	106.6 Å²	106.6	12%	0.121	54%	0.537	C	S	.	.			trans	-67.9	124.2	176.6	173.6	0	0	0	0	104.5	H379 L383 L385 Q386 V419 L420	H379-V381 WeakPolarHBondContact O-CG2 3.45Å; H379-V381 PolarHBondContact O-N 3.19Å; V381-L383 PolarHBondContact O-N 2.97Å; V381-L385 HydrophobicContact CG1-CB 3.59Å; V381-L385 HydrophobicContact CG1-CD2 4.28Å; V381-L385 HydrophobicContact CG1-CG 4.45Å; V381-Q386 HydrophobicContact CG1-CB 4.34Å; V381-V419 HydrophobicContact CG2-CG1 4.39Å; V381-L420 HydrophobicContact CG1-CD2 3.98Å; V381-L420 HydrophobicContact CG2-CD2 4.49Å
382	P	78.1	Confident	67.5	Low	79 Å²	79	101.8 Å²	101.8	51%	0.513	51%	0.512	S	S	.	.			trans	-50.9	142.1	176.5	-25.7	33.3	0	0	0	110.4	Q380 E384 L385 Q386	Q380-P382 WeakPolarHBondContact O-CD 3.4Å; P382-E384 PolarHBondContact O-N 3.2Å; P382-E384 VanDerWaalsContact O-N 3.08Å; P382-L385 PolarHBondContact O-N 3.49Å; P382-Q386 PolarHBondContact O-N 3.17Å; P382-Q386 VanDerWaalsContact O-N 3.07Å
383	L	83.7	Confident	70	Confident	122 Å²	122	97.1 Å²	97.1	64%	0.639	48%	0.48	S	S	*	.	H	α-helix	trans	-51.3	-39.4	-175.9	-179.6	63.4	0	0	0	111.9	V381 L385 Q386 L387	V381-L383 PolarHBondContact O-N 2.97Å; L383-L385 PolarHBondContact O-N 3.45Å; L383-Q386 PolarHBondContact O-N 3.14Å; L383-L387 HydrophobicContact CD1-CG 4.49Å; L383-L387 HydrophobicContact CG-CD1 4.22Å; L383-L387 WeakPolarHBondContact O-CG 3.4Å; L383-L387 PolarHBondContact O-N 3.46Å
384	E	85.8	Confident	72.3	Confident	161 Å²	161	96.1 Å²	96.1	75%	0.752	48%	0.48	S	S	*	.	H	α-helix	trans	-58.7	-43.5	176.7	-62.3	179.4	177.1	0	0	112.7	P382 Q386 L387 Y388	P382-E384 PolarHBondContact O-N 3.2Å; P382-E384 VanDerWaalsContact O-N 3.08Å; E384-Q386 VanDerWaalsContact C-N 3.35Å; E384-L387 PolarHBondContact O-N 2.83Å; E384-Y388 WeakPolarHBondContact O-CB 3.2Å; E384-Y388 PolarHBondContact O-N 2.94Å
385	L	85.6	Confident	74.6	Confident	44 Å²	44	90.2 Å²	90.2	23%	0.23	46%	0.46	C	S	.	.	H	α-helix	trans	-74	-29.8	-179.6	-133.1	68.8	0	0	0	111.4	V381 P382 L383 F389 V419 L420	V381-L385 HydrophobicContact CG1-CB 3.59Å; V381-L385 HydrophobicContact CG1-CD2 4.28Å; V381-L385 HydrophobicContact CG1-CG 4.45Å; P382-L385 PolarHBondContact O-N 3.49Å; L383-L385 PolarHBondContact O-N 3.45Å; L385-F389 WeakPolarHBondContact O-CB 3.36Å; L385-F389 PolarHBondContact O-N 3.19Å; L385-V419 HydrophobicContact CD2-CB 4.46Å; L385-L420 HydrophobicContact CD2-CD1 4.18Å; L385-L420 HydrophobicContact CD2-CD2 4.46Å; L385-L420 HydrophobicContact CD2-CG 3.89Å; L385-L420 HydrophobicContact CG-CD1 3.75Å; L385-L420 HydrophobicContact CG-CG 4Å
386	Q	86.3	Confident	76.6	Confident	116 Å²	116	86.5 Å²	86.5	54%	0.542	43%	0.428	S	S	.	.	H	α-helix	trans	-70	-41.1	172.2	-172.6	178	4.7	0	0	111.6	V381 P382 L383 E384 F389 K390	V381-Q386 HydrophobicContact CG1-CB 4.34Å; P382-Q386 PolarHBondContact O-N 3.17Å; P382-Q386 VanDerWaalsContact O-N 3.07Å; L383-Q386 PolarHBondContact O-N 3.14Å; E384-Q386 VanDerWaalsContact C-N 3.35Å; Q386-F389 PolarHBondContact O-N 3.47Å; Q386-K390 WeakPolarHBondContact O-CB 3.33Å; Q386-K390 PolarHBondContact O-N 3.09Å
387	L	87.7	Confident	78.4	Confident	99 Å²	99	86.8 Å²	86.8	52%	0.518	42%	0.421	S	S	.	.	H	α-helix	trans	-63	-44	173.5	-70.7	172.3	0	0	0	110.8	L383 E384 F389 K390 E391	L383-L387 HydrophobicContact CD1-CG 4.49Å; L383-L387 HydrophobicContact CG-CD1 4.22Å; L383-L387 WeakPolarHBondContact O-CG 3.4Å; L383-L387 PolarHBondContact O-N 3.46Å; E384-L387 PolarHBondContact O-N 2.83Å; L387-F389 PolarHBondContact O-N 2.87Å; L387-K390 WeakPolarHBondContact O-CB 3.49Å; L387-K390 PolarHBondContact O-N 3.28Å; L387-E391 WeakPolarHBondContact O-CB 3.48Å; L387-E391 PolarHBondContact O-N 3.49Å
388	Y	89.3	Confident	80.1	Confident	53 Å²	53	84.2 Å²	84.2	21%	0.208	41%	0.413	C	S	.	.	H	α-helix	trans	-57.7	-49.2	172.7	176.9	-93.9	0	0	0	111.6	E384 K390 E391 V392 S410 D414 L417 L420 F424	E384-Y388 WeakPolarHBondContact O-CB 3.2Å; E384-Y388 PolarHBondContact O-N 2.94Å; Y388-K390 VanDerWaalsContact C-N 3.29Å; Y388-K390 PolarHBondContact O-N 3.36Å; Y388-E391 PolarHBondContact O-N 3.13Å; Y388-V392 HydrophobicContact CD1-CG2 4.04Å; Y388-V392 HydrophobicContact CD2-CG2 4.41Å; Y388-V392 HydrophobicContact CE1-CG2 3.61Å; Y388-V392 HydrophobicContact CE2-CG2 4.06Å; Y388-V392 HydrophobicContact CG-CG2 4.41Å; Y388-V392 WeakPolarHBondContact O-CB 3.38Å; Y388-V392 VanDerWaalsContact O-CG2 3.26Å; Y388-V392 WeakPolarHBondContact O-CG2 3.45Å; Y388-V392 PolarHBondContact O-N 3.04Å; Y388-S410 PolarHBondContact OH-OG 2.85Å; Y388-D414 PolarHBondContact OH-OD2 2.91Å; Y388-D414 VanDerWaalsContact OH-OD2 3.04Å; Y388-L417 HydrophobicContact CD1-CD2 3.9Å; Y388-L417 HydrophobicContact CE1-CD1 4.12Å; Y388-L417 HydrophobicContact CE1-CD2 3.38Å; Y388-L417 HydrophobicContact CE1-CG 4.41Å; Y388-L420 HydrophobicContact CD1-CD1 3.94Å; Y388-L420 HydrophobicContact CE1-CD1 4.49Å; Y388-F424 HydrophobicContact CE1-CZ 4.28Å
389	F	89.3	Confident	81.6	Confident	42 Å²	42	83.1 Å²	83.1	18%	0.184	41%	0.411	C	S	.	.	H	α-helix	trans	-57.3	-43.9	177.2	178.5	-97.1	0	0	0	111.7	L385 Q386 L387 V392 T393 L420 R423 F424 F427	L385-F389 WeakPolarHBondContact O-CB 3.36Å; L385-F389 PolarHBondContact O-N 3.19Å; Q386-F389 PolarHBondContact O-N 3.47Å; L387-F389 PolarHBondContact O-N 2.87Å; F389-V392 PolarHBondContact O-N 3.32Å; F389-T393 HydrophobicContact CD1-CG2 4.31Å; F389-T393 HydrophobicContact CE1-CG2 3.87Å; F389-T393 HydrophobicContact CE2-CG2 4.14Å; F389-T393 HydrophobicContact CZ-CG2 3.77Å; F389-T393 WeakPolarHBondContact O-CG2 3.5Å; F389-T393 PolarHBondContact O-N 3.28Å; F389-T393 PolarHBondContact O-OG1 2.92Å; F389-L420 HydrophobicContact CB-CD1 4.16Å; F389-L420 HydrophobicContact CB-CD2 4.16Å; F389-L420 HydrophobicContact CD2-CD2 4.38Å; F389-L420 HydrophobicContact CG-CD2 4.5Å; F389-R423 HydrophobicContact CD2-CB 4.32Å; F389-R423 HydrophobicContact CE2-CB 3.78Å; F389-R423 HydrophobicContact CZ-CB 4.09Å; F389-F424 AromaticContact CD2-CD1 3.78Å; F389-F424 HydrophobicContact CD2-CD1 3.78Å; F389-F424 AromaticContact CD2-CE1 3.38Å; F389-F424 HydrophobicContact CD2-CE1 3.38Å; F389-F424 AromaticContact CD2-CZ 3.85Å; F389-F424 HydrophobicContact CD2-CZ 3.85Å; F389-F424 AromaticContact CE2-CD1 3.53Å; F389-F424 HydrophobicContact CE2-CD1 3.53Å; F389-F424 AromaticContact CE2-CE1 3.62Å; F389-F424 HydrophobicContact CE2-CE1 3.62Å; F389-F424 HydrophobicContact CE2-CG 4.29Å; F389-F424 HydrophobicContact CE2-CZ 4.44Å; F389-F427 HydrophobicContact CZ-CB 4.36Å
390	K	89.8	Confident	83.1	Confident	115 Å²	115	82 Å²	82	50%	0.5	41%	0.409	S	S	.	.	H	α-helix	trans	-61.4	-50.3	177.3	-176	179.3	171.4	-176.9	0	111.2	Q386 L387 Y388 V392 T393 E394	Q386-K390 WeakPolarHBondContact O-CB 3.33Å; Q386-K390 PolarHBondContact O-N 3.09Å; L387-K390 WeakPolarHBondContact O-CB 3.49Å; L387-K390 PolarHBondContact O-N 3.28Å; Y388-K390 VanDerWaalsContact C-N 3.29Å; Y388-K390 PolarHBondContact O-N 3.36Å; K390-V392 VanDerWaalsContact C-N 3.32Å; K390-V392 PolarHBondContact O-N 2.97Å; K390-T393 PolarHBondContact O-N 2.91Å; K390-T393 VanDerWaalsContact O-N 3.15Å; K390-T393 PolarHBondContact O-OG1 3.49Å; K390-E394 WeakPolarHBondContact CE-OE1 3.37Å; K390-E394 HydrophobicContact CG-CG 4.43Å; K390-E394 IonicContact NZ-OE1 3.83Å; K390-E394 WeakPolarHBondContact O-CB 3.42Å; K390-E394 WeakPolarHBondContact O-CG 3.42Å; K390-E394 PolarHBondContact O-N 3.09Å
391	E	89.6	Confident	84.5	Confident	135 Å²	135	77.7 Å²	77.7	63%	0.631	39%	0.389	S	S	*	.	H	α-helix	trans	-60.7	-41	-179.9	-171.7	170.1	-167.2	0	0	112	L387 Y388 E394 A395	L387-E391 WeakPolarHBondContact O-CB 3.48Å; L387-E391 PolarHBondContact O-N 3.49Å; Y388-E391 PolarHBondContact O-N 3.13Å; E391-E394 PolarHBondContact O-N 3.5Å; E391-A395 VanDerWaalsContact O-CB 3.26Å; E391-A395 WeakPolarHBondContact O-CB 3.42Å; E391-A395 PolarHBondContact O-N 2.79Å
392	V	89.4	Confident	85.4	Confident	3 Å²	3	82.8 Å²	82.8	2%	0.018	42%	0.415	C	S	.	.	H	α-helix	trans	-59.2	-51.3	173	167.6	0	0	0	0	110.7	Y388 F389 K390 E394 A395 F396 V407 L411 F424 M450	Y388-V392 HydrophobicContact CD1-CG2 4.04Å; Y388-V392 HydrophobicContact CD2-CG2 4.41Å; Y388-V392 HydrophobicContact CE1-CG2 3.61Å; Y388-V392 HydrophobicContact CE2-CG2 4.06Å; Y388-V392 HydrophobicContact CG-CG2 4.41Å; Y388-V392 WeakPolarHBondContact O-CB 3.38Å; Y388-V392 VanDerWaalsContact O-CG2 3.26Å; Y388-V392 WeakPolarHBondContact O-CG2 3.45Å; Y388-V392 PolarHBondContact O-N 3.04Å; F389-V392 PolarHBondContact O-N 3.32Å; K390-V392 VanDerWaalsContact C-N 3.32Å; K390-V392 PolarHBondContact O-N 2.97Å; V392-E394 PolarHBondContact O-N 3.19Å; V392-A395 PolarHBondContact O-N 3.18Å; V392-F396 HydrophobicContact CG1-CD2 3.96Å; V392-F396 HydrophobicContact CG1-CE2 3.69Å; V392-F396 WeakPolarHBondContact O-CD2 3.48Å; V392-F396 PolarHBondContact O-N 3.49Å; V392-F396 VanDerWaalsContact O-N 3.14Å; V392-V407 HydrophobicContact CB-CG1 4.1Å; V392-V407 HydrophobicContact CG1-CG1 3.65Å; V392-V407 HydrophobicContact CG2-CG1 3.97Å; V392-L411 HydrophobicContact CG1-CD1 4.14Å; V392-L411 HydrophobicContact CG1-CD2 4.41Å; V392-F424 HydrophobicContact CB-CE1 4.43Å; V392-F424 HydrophobicContact CG1-CE1 3.76Å; V392-F424 HydrophobicContact CG1-CZ 4.27Å; V392-M450 HydrophobicContact CG1-CE 4.21Å
393	T	88.7	Confident	85.8	Confident	17 Å²	17	85.1 Å²	85.1	10%	0.104	42%	0.417	C	S	.	.	H	α-helix	trans	-64.6	-38.5	-179.3	56.6	0	0	0	0	113	F389 K390 F396 M397 F427	F389-T393 HydrophobicContact CD1-CG2 4.31Å; F389-T393 HydrophobicContact CE1-CG2 3.87Å; F389-T393 HydrophobicContact CE2-CG2 4.14Å; F389-T393 HydrophobicContact CZ-CG2 3.77Å; F389-T393 WeakPolarHBondContact O-CG2 3.5Å; F389-T393 PolarHBondContact O-N 3.28Å; F389-T393 PolarHBondContact O-OG1 2.92Å; K390-T393 PolarHBondContact O-N 2.91Å; K390-T393 VanDerWaalsContact O-N 3.15Å; K390-T393 PolarHBondContact O-OG1 3.49Å; T393-F396 PolarHBondContact O-N 3.36Å; T393-M397 WeakPolarHBondContact O-CG 3.46Å; T393-M397 PolarHBondContact O-N 3.42Å; T393-F427 HydrophobicContact CG2-CD1 4.29Å; T393-F427 HydrophobicContact CG2-CD2 4.16Å; T393-F427 HydrophobicContact CG2-CE1 4.11Å; T393-F427 HydrophobicContact CG2-CE2 3.98Å; T393-F427 HydrophobicContact CG2-CG 4.31Å; T393-F427 HydrophobicContact CG2-CZ 3.95Å
394	E	88.1	Confident	86	Confident	105 Å²	105	80.5 Å²	80.5	49%	0.491	39%	0.391	S	S	.	.	H	α-helix	trans	-68.1	-40.4	176.2	-75.5	-178	-179.7	0	0	111.6	K390 E391 V392 F396 M397 S398	K390-E394 WeakPolarHBondContact CE-OE1 3.37Å; K390-E394 HydrophobicContact CG-CG 4.43Å; K390-E394 IonicContact NZ-OE1 3.83Å; K390-E394 WeakPolarHBondContact O-CB 3.42Å; K390-E394 WeakPolarHBondContact O-CG 3.42Å; K390-E394 PolarHBondContact O-N 3.09Å; E391-E394 PolarHBondContact O-N 3.5Å; V392-E394 PolarHBondContact O-N 3.19Å; E394-F396 VanDerWaalsContact C-N 3.27Å; E394-F396 PolarHBondContact O-N 3.43Å; E394-M397 CarbonylContact O-C 3.37Å; E394-M397 PolarHBondContact O-N 3.34Å; E394-M397 VanDerWaalsContact O-N 3.09Å; E394-S398 WeakPolarHBondContact O-CB 3.22Å; E394-S398 PolarHBondContact O-N 3.08Å
395	A	87.2	Confident	86.2	Confident	9 Å²	9	78.2 Å²	78.2	7%	0.074	38%	0.379	C	S	.	.	H	α-helix	trans	-60.2	-38.7	175.7	0	0	0	0	0	111.7	E391 V392 M397 S398 R404 V407	E391-A395 VanDerWaalsContact O-CB 3.26Å; E391-A395 WeakPolarHBondContact O-CB 3.42Å; E391-A395 PolarHBondContact O-N 2.79Å; V392-A395 PolarHBondContact O-N 3.18Å; A395-M397 VanDerWaalsContact C-N 3.34Å; A395-S398 PolarHBondContact O-N 2.85Å; A395-S398 PolarHBondContact O-OG 3.11Å; A395-R404 VanDerWaalsContact O-CG 3.23Å; A395-R404 WeakPolarHBondContact O-CG 3.47Å; A395-V407 HydrophobicContact CB-CB 4.44Å; A395-V407 HydrophobicContact CB-CG2 3.68Å
396	F	81.6	Confident	86.3	Confident	6 Å²	6	81.8 Å²	81.8	3%	0.026	40%	0.397	C	S	.	.	H	α-helix	trans	-64.2	-37.3	174	-80.9	-66	0	0	0	112.9	V392 T393 E394 R404 V407 L408 L411 M450	V392-F396 HydrophobicContact CG1-CD2 3.96Å; V392-F396 HydrophobicContact CG1-CE2 3.69Å; V392-F396 WeakPolarHBondContact O-CD2 3.48Å; V392-F396 PolarHBondContact O-N 3.49Å; V392-F396 VanDerWaalsContact O-N 3.14Å; T393-F396 PolarHBondContact O-N 3.36Å; E394-F396 VanDerWaalsContact C-N 3.27Å; E394-F396 PolarHBondContact O-N 3.43Å; F396-R404 PolarHBondContact O-NE 2.88Å; F396-V407 HydrophobicContact CD2-CG1 4.22Å; F396-V407 HydrophobicContact CE2-CG1 3.54Å; F396-V407 HydrophobicContact CZ-CG1 3.9Å; F396-L408 HydrophobicContact CE1-CD1 4.45Å; F396-L408 HydrophobicContact CE1-CD2 3.7Å; F396-L408 HydrophobicContact CE1-CG 3.85Å; F396-L408 HydrophobicContact CZ-CD2 3.63Å; F396-L408 HydrophobicContact CZ-CG 3.94Å; F396-L411 HydrophobicContact CE2-CD1 3.84Å; F396-L411 HydrophobicContact CZ-CD1 3.97Å; F396-M450 HydrophobicContact CD2-CE 4.16Å; F396-M450 HydrophobicContact CD2-SD 3.8Å; F396-M450 HydrophobicContact CE1-CB 3.94Å; F396-M450 HydrophobicContact CE1-CG 4.27Å; F396-M450 HydrophobicContact CE2-CB 4.34Å; F396-M450 HydrophobicContact CE2-CE 3.76Å; F396-M450 HydrophobicContact CE2-CG 3.77Å; F396-M450 HydrophobicContact CE2-SD 3.56Å; F396-M450 VanDerWaalsContact CE2-SD 3.56Å; F396-M450 HydrophobicContact CG-SD 4.43Å; F396-M450 HydrophobicContact CZ-CB 3.77Å; F396-M450 HydrophobicContact CZ-CG 3.62Å; F396-M450 HydrophobicContact CZ-SD 3.98Å
397	M	79.4	Confident	86.5	Confident	126 Å²	126	77 Å²	77	62%	0.621	38%	0.376	S	S	*	.	H	α-helix	trans	-77.9	-24	176.1	-63.6	179.3	74.4	0	0	113	T393 E394 A395 M443	T393-M397 WeakPolarHBondContact O-CG 3.46Å; T393-M397 PolarHBondContact O-N 3.42Å; E394-M397 CarbonylContact O-C 3.37Å; E394-M397 PolarHBondContact O-N 3.34Å; E394-M397 VanDerWaalsContact O-N 3.09Å; A395-M397 VanDerWaalsContact C-N 3.34Å; M397-M443 HydrophobicContact CB-CE 4.42Å; M397-M443 HydrophobicContact CG-CE 3.86Å
398	S	78.4	Confident	86.6	Confident	35 Å²	35	73.5 Å²	73.5	25%	0.245	36%	0.358	C	S	.	.	S	Bend	trans	-69.5	153.1	-178.8	84.2	0	0	0	0	112.2	E394 A395 N400 R404	E394-S398 WeakPolarHBondContact O-CB 3.22Å; E394-S398 PolarHBondContact O-N 3.08Å; A395-S398 PolarHBondContact O-N 2.85Å; A395-S398 PolarHBondContact O-OG 3.11Å; S398-N400 VanDerWaalsContact C-N 3.29Å; S398-N400 PolarHBondContact O-N 2.98Å; S398-R404 PolarHBondContact O-NE 3.46Å; S398-R404 PolarHBondContact O-NH2 2.84Å
399	I	80	Confident	86.7	Confident	151 Å²	151	77.4 Å²	77.4	77%	0.774	38%	0.378	S	S	*	.	S	Bend	trans	-75.2	-18.3	-177.4	-58.3	156.3	0	0	0	112.3	E401	I399-E401 PolarHBondContact O-N 3.44Å
400	N	83.8	Confident	86.6	Confident	91 Å²	91	76.9 Å²	76.9	49%	0.487	38%	0.379	S	S	.	.			trans	-75.3	110.4	-170.8	-66.2	-10.4	0	0	0	112.1	S398 D402 K403 R404	S398-N400 VanDerWaalsContact C-N 3.29Å; S398-N400 PolarHBondContact O-N 2.98Å; N400-D402 VanDerWaalsContact C-N 3.34Å; N400-D402 PolarHBondContact O-N 3.26Å; N400-K403 HydrophobicContact CB-CB 4.25Å; N400-K403 HydrophobicContact CB-CD 4.33Å; N400-K403 HydrophobicContact CB-CG 4.16Å; N400-K403 PolarHBondContact O-N 3.06Å; N400-R404 PolarHBondContact O-N 2.67Å
401	E	84.7	Confident	86.5	Confident	103 Å²	103	71.4 Å²	71.4	48%	0.481	36%	0.356	S	S	.	.	H	α-helix	trans	-61.9	-36.5	-179.7	-73	-157.9	165.5	0	0	113.8	I399 R404 K405	I399-E401 PolarHBondContact O-N 3.44Å; E401-R404 WeakPolarHBondContact O-CB 3.22Å; E401-R404 PolarHBondContact O-N 3Å; E401-K405 WeakPolarHBondContact O-CG 3.44Å; E401-K405 PolarHBondContact O-N 2.79Å; E401-K405 IonicContact OE2-NZ 3.45Å; E401-K405 PolarHBondContact OE2-NZ 2.92Å
402	D	87.8	Confident	86.4	Confident	126 Å²	126	67 Å²	67	67%	0.674	34%	0.339	S	S	*	.	H	α-helix	trans	-68	-40.7	-176.5	-59.9	-39.1	0	0	0	111.6	N400 R404 K405 L406	N400-D402 VanDerWaalsContact C-N 3.34Å; N400-D402 PolarHBondContact O-N 3.26Å; D402-R404 VanDerWaalsContact C-N 3.32Å; D402-R404 PolarHBondContact O-N 3.3Å; D402-K405 PolarHBondContact O-N 3.25Å; D402-L406 WeakPolarHBondContact O-CB 3.46Å; D402-L406 PolarHBondContact O-N 3.47Å
403	K	86.3	Confident	86.3	Confident	129 Å²	129	71.1 Å²	71.1	56%	0.561	36%	0.364	S	S	*	.	H	α-helix	trans	-61.2	-42.3	173.2	-68.6	-167.4	176.6	-171.1	0	111	N400 L406 V407	N400-K403 HydrophobicContact CB-CB 4.25Å; N400-K403 HydrophobicContact CB-CD 4.33Å; N400-K403 HydrophobicContact CB-CG 4.16Å; N400-K403 PolarHBondContact O-N 3.06Å; K403-L406 PolarHBondContact O-N 2.88Å; K403-V407 WeakPolarHBondContact O-CB 2.93Å; K403-V407 WeakPolarHBondContact O-CG2 3.33Å; K403-V407 PolarHBondContact O-N 3.49Å
404	R	87.8	Confident	86.2	Confident	25 Å²	25	72.6 Å²	72.6	9%	0.094	37%	0.372	C	S	.	.	H	α-helix	trans	-62.6	-44.1	176.2	-69.1	178.7	-177.9	146.4	-7.6	112.4	A395 F396 S398 N400 E401 D402 V407 L408 Y446	A395-R404 VanDerWaalsContact O-CG 3.23Å; A395-R404 WeakPolarHBondContact O-CG 3.47Å; F396-R404 PolarHBondContact O-NE 2.88Å; S398-R404 PolarHBondContact O-NE 3.46Å; S398-R404 PolarHBondContact O-NH2 2.84Å; N400-R404 PolarHBondContact O-N 2.67Å; E401-R404 WeakPolarHBondContact O-CB 3.22Å; E401-R404 PolarHBondContact O-N 3Å; D402-R404 VanDerWaalsContact C-N 3.32Å; D402-R404 PolarHBondContact O-N 3.3Å; R404-V407 PolarHBondContact O-N 2.95Å; R404-L408 WeakPolarHBondContact O-CB 3.2Å; R404-L408 WeakPolarHBondContact O-CG 3.4Å; R404-L408 PolarHBondContact O-N 3.29Å; R404-Y446 VanDerWaalsContact NH1-CE2 3.32Å; R404-Y446 PolarHBondContact NH1-OH 2.84Å
405	K	88.9	Confident	85.9	Confident	112 Å²	112	72.5 Å²	72.5	49%	0.487	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-43.2	179.1	-73.8	172.3	-171.2	158	0	111.4	E401 D402 L408 Q409	E401-K405 WeakPolarHBondContact O-CG 3.44Å; E401-K405 PolarHBondContact O-N 2.79Å; E401-K405 IonicContact OE2-NZ 3.45Å; E401-K405 PolarHBondContact OE2-NZ 2.92Å; D402-K405 PolarHBondContact O-N 3.25Å; K405-L408 PolarHBondContact O-N 3.01Å; K405-Q409 PolarHBondContact O-N 3.18Å
406	L	88.8	Confident	85.5	Confident	119 Å²	119	74.6 Å²	74.6	62%	0.623	40%	0.401	S	S	*	.	H	α-helix	trans	-62.4	-44.9	177.9	-174.1	139.1	0	0	0	111.6	D402 K403 Q409 S410	D402-L406 WeakPolarHBondContact O-CB 3.46Å; D402-L406 PolarHBondContact O-N 3.47Å; K403-L406 PolarHBondContact O-N 2.88Å; L406-Q409 PolarHBondContact O-N 3.07Å; L406-S410 PolarHBondContact O-N 3.43Å
407	V	90.5	Very high	85.6	Confident	15 Å²	15	74.6 Å²	74.6	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-63.7	-41.7	176.3	166.3	0	0	0	0	112.1	V392 A395 F396 K403 R404 Q409 S410 L411	V392-V407 HydrophobicContact CB-CG1 4.1Å; V392-V407 HydrophobicContact CG1-CG1 3.65Å; V392-V407 HydrophobicContact CG2-CG1 3.97Å; A395-V407 HydrophobicContact CB-CB 4.44Å; A395-V407 HydrophobicContact CB-CG2 3.68Å; F396-V407 HydrophobicContact CD2-CG1 4.22Å; F396-V407 HydrophobicContact CE2-CG1 3.54Å; F396-V407 HydrophobicContact CZ-CG1 3.9Å; K403-V407 WeakPolarHBondContact O-CB 2.93Å; K403-V407 WeakPolarHBondContact O-CG2 3.33Å; K403-V407 PolarHBondContact O-N 3.49Å; R404-V407 PolarHBondContact O-N 2.95Å; V407-Q409 VanDerWaalsContact C-N 3.3Å; V407-Q409 PolarHBondContact O-N 3.41Å; V407-S410 WeakPolarHBondContact O-CB 3.45Å; V407-S410 PolarHBondContact O-N 3.08Å; V407-L411 HydrophobicContact CG1-CD1 4.32Å; V407-L411 WeakPolarHBondContact O-CG 3.28Å; V407-L411 PolarHBondContact O-N 3.24Å
408	L	90	Very high	85.6	Confident	26 Å²	26	74.3 Å²	74.3	14%	0.136	40%	0.398	C	S	.	.	H	α-helix	trans	-60.7	-40.1	174.8	-77.2	168	0	0	0	112	F396 R404 K405 C412 R449 M450 A453	F396-L408 HydrophobicContact CE1-CD1 4.45Å; F396-L408 HydrophobicContact CE1-CD2 3.7Å; F396-L408 HydrophobicContact CE1-CG 3.85Å; F396-L408 HydrophobicContact CZ-CD2 3.63Å; F396-L408 HydrophobicContact CZ-CG 3.94Å; R404-L408 WeakPolarHBondContact O-CB 3.2Å; R404-L408 WeakPolarHBondContact O-CG 3.4Å; R404-L408 PolarHBondContact O-N 3.29Å; K405-L408 PolarHBondContact O-N 3.01Å; L408-C412 PolarHBondContact O-N 2.9Å; L408-C412 PolarHBondContact O-SG 2.8Å; L408-R449 HydrophobicContact CD1-CB 4.19Å; L408-R449 HydrophobicContact CD2-CB 4.23Å; L408-M450 HydrophobicContact CD2-CB 4.39Å; L408-A453 HydrophobicContact CD2-CB 3.88Å
409	Q	90	Very high	85.8	Confident	135 Å²	135	76.1 Å²	76.1	63%	0.631	41%	0.408	S	S	*	.	H	α-helix	trans	-65.5	-45	176.3	-174	175.6	-1.7	0	0	111.4	K405 L406 V407 L411 C412 T413	K405-Q409 PolarHBondContact O-N 3.18Å; L406-Q409 PolarHBondContact O-N 3.07Å; V407-Q409 VanDerWaalsContact C-N 3.3Å; V407-Q409 PolarHBondContact O-N 3.41Å; Q409-L411 PolarHBondContact O-N 3.35Å; Q409-C412 WeakPolarHBondContact O-CB 3.42Å; Q409-C412 PolarHBondContact O-N 3.17Å; Q409-C412 VanDerWaalsContact O-N 3.11Å; Q409-T413 PolarHBondContact O-N 2.59Å; Q409-T413 PolarHBondContact O-OG1 3.41Å; Q409-T413 VanDerWaalsContact O-OG1 3.12Å
410	S	88.1	Confident	86	Confident	31 Å²	31	69 Å²	69	22%	0.217	37%	0.371	C	S	.	.	H	α-helix	trans	-54.5	-50.9	175.7	-157.3	0	0	0	0	111.1	Y388 L406 V407 C412 T413 D414	Y388-S410 PolarHBondContact OH-OG 2.85Å; L406-S410 PolarHBondContact O-N 3.43Å; V407-S410 WeakPolarHBondContact O-CB 3.45Å; V407-S410 PolarHBondContact O-N 3.08Å; S410-C412 PolarHBondContact O-N 3.36Å; S410-C412 VanDerWaalsContact O-N 3.16Å; S410-T413 PolarHBondContact O-N 3.25Å; S410-T413 PolarHBondContact O-OG1 2.64Å; S410-D414 VanDerWaalsContact C-OD2 3.29Å; S410-D414 WeakPolarHBondContact CB-OD2 3.32Å; S410-D414 WeakPolarHBondContact O-CB 3.41Å; S410-D414 PolarHBondContact O-N 3.34Å; S410-D414 PolarHBondContact OG-OD2 3.32Å
411	L	88.2	Confident	86.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-60.1	-29.6	179.1	-71.1	176.2	0	0	0	113.6	V392 F396 V407 Q409 L417 F424 M450 A453 N457	V392-L411 HydrophobicContact CG1-CD1 4.14Å; V392-L411 HydrophobicContact CG1-CD2 4.41Å; F396-L411 HydrophobicContact CE2-CD1 3.84Å; F396-L411 HydrophobicContact CZ-CD1 3.97Å; V407-L411 HydrophobicContact CG1-CD1 4.32Å; V407-L411 WeakPolarHBondContact O-CG 3.28Å; V407-L411 PolarHBondContact O-N 3.24Å; Q409-L411 PolarHBondContact O-N 3.35Å; L411-L417 HydrophobicContact CD2-CD1 3.74Å; L411-F424 HydrophobicContact CD2-CE1 4.27Å; L411-F424 HydrophobicContact CD2-CE2 3.9Å; L411-F424 HydrophobicContact CD2-CZ 3.73Å; L411-M450 HydrophobicContact CD1-CE 4.05Å; L411-M450 HydrophobicContact CD1-CG 4.05Å; L411-A453 HydrophobicContact CB-CB 4.27Å; L411-N457 PolarHBondContact O-ND2 3.34Å
412	C	87.2	Confident	86.1	Confident	43 Å²	43	61.7 Å²	61.7	29%	0.291	34%	0.338	S	S	.	.	H	α-helix	trans	-74.8	-31.3	176.6	-65.7	0	0	0	0	112.8	L408 Q409 S410 A453 N457	L408-C412 PolarHBondContact O-N 2.9Å; L408-C412 PolarHBondContact O-SG 2.8Å; Q409-C412 WeakPolarHBondContact O-CB 3.42Å; Q409-C412 PolarHBondContact O-N 3.17Å; Q409-C412 VanDerWaalsContact O-N 3.11Å; S410-C412 PolarHBondContact O-N 3.36Å; S410-C412 VanDerWaalsContact O-N 3.16Å; C412-A453 VanDerWaalsContact SG-CA 3.52Å; C412-A453 WeakPolarHBondContact SG-CB 3.39Å; C412-N457 WeakPolarHBondContact O-CB 3.38Å; C412-N457 VanDerWaalsContact O-CG 3.31Å
413	T	85.9	Confident	86	Confident	89 Å²	89	60.4 Å²	60.4	55%	0.546	32%	0.324	S	S	.	.	H	α-helix	trans	-103.2	-26.5	-169.3	52.9	0	0	0	0	114.4	Q409 S410	Q409-T413 PolarHBondContact O-N 2.59Å; Q409-T413 PolarHBondContact O-OG1 3.41Å; Q409-T413 VanDerWaalsContact O-OG1 3.12Å; S410-T413 PolarHBondContact O-N 3.25Å; S410-T413 PolarHBondContact O-OG1 2.64Å
414	D	86.8	Confident	86.2	Confident	49 Å²	49	54.3 Å²	54.3	26%	0.262	30%	0.297	S	S	.	.			trans	-75.7	131.9	-169.1	-64.9	-26.9	0	0	0	112.5	Y388 S410 L417 N457 T459	Y388-D414 PolarHBondContact OH-OD2 2.91Å; Y388-D414 VanDerWaalsContact OH-OD2 3.04Å; S410-D414 VanDerWaalsContact C-OD2 3.29Å; S410-D414 WeakPolarHBondContact CB-OD2 3.32Å; S410-D414 WeakPolarHBondContact O-CB 3.41Å; S410-D414 PolarHBondContact O-N 3.34Å; S410-D414 PolarHBondContact OG-OD2 3.32Å; D414-L417 HydrophobicContact CB-CD1 3.64Å; D414-L417 HydrophobicContact CB-CG 3.81Å; D414-N457 PolarHBondContact O-ND2 2.93Å; D414-T459 PolarHBondContact O-OG1 3.16Å
415	T	82.3	Confident	86.3	Confident	102 Å²	102	53.2 Å²	53.2	63%	0.626	29%	0.293	S	S	*	.	S	Bend	trans	-93.7	-18.2	-172.1	59.9	0	0	0	0	113.9	T459	T415-T459 HydrophobicContact CG2-CG2 3.8Å
416	G	79.7	Confident	86.3	Confident	53 Å²	53	50.2 Å²	50.2	55%	0.546	28%	0.282	S	S	.	.	S	Bend	trans	-90.4	5.7	-176.8	0	0	0	0	0	115.4	Q418	G416-Q418 VanDerWaalsContact C-N 3.34Å; G416-Q418 PolarHBondContact O-N 3.32Å
417	L	82.9	Confident	86.3	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	27%	0.265	C	S	.	.			trans	-87.9	3.6	-171	-60.5	-179.1	0	0	0	114.4	Y388 L411 D414 V419 L420 T421 L460	Y388-L417 HydrophobicContact CD1-CD2 3.9Å; Y388-L417 HydrophobicContact CE1-CD1 4.12Å; Y388-L417 HydrophobicContact CE1-CD2 3.38Å; Y388-L417 HydrophobicContact CE1-CG 4.41Å; L411-L417 HydrophobicContact CD2-CD1 3.74Å; D414-L417 HydrophobicContact CB-CD1 3.64Å; D414-L417 HydrophobicContact CB-CG 3.81Å; L417-V419 VanDerWaalsContact C-N 3.25Å; L417-V419 PolarHBondContact O-N 3.49Å; L417-L420 HydrophobicContact CD2-CD1 4.06Å; L417-L420 PolarHBondContact O-N 3.01Å; L417-T421 PolarHBondContact O-N 2.88Å; L417-T421 VanDerWaalsContact O-N 3.14Å; L417-T421 PolarHBondContact O-OG1 3.39Å; L417-L460 HydrophobicContact CB-CD2 3.97Å
418	Q	80.3	Confident	86.4	Confident	119 Å²	119	46.6 Å²	46.6	56%	0.556	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-54.1	-41.7	-176.9	-71.5	-175.6	-9.2	0	0	112.5	G416 L420 T421 T459 L460	G416-Q418 VanDerWaalsContact C-N 3.34Å; G416-Q418 PolarHBondContact O-N 3.32Å; Q418-L420 VanDerWaalsContact C-N 3.28Å; Q418-L420 PolarHBondContact O-N 3.49Å; Q418-T421 WeakPolarHBondContact CA-OG1 3.26Å; Q418-T421 VanDerWaalsContact O-CB 3.25Å; Q418-T421 WeakPolarHBondContact O-CB 3.09Å; Q418-T421 PolarHBondContact O-N 3.28Å; Q418-T421 PolarHBondContact O-OG1 3.46Å; Q418-T459 WeakPolarHBondContact CG-O 3.38Å; Q418-T459 PolarHBondContact NE2-O 3.22Å; Q418-L460 HydrophobicContact CG-CD2 4.12Å
419	V	81.9	Confident	86.4	Confident	74 Å²	74	49.2 Å²	49.2	45%	0.448	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-65.2	-29.9	178.3	-175.6	0	0	0	0	112.6	V381 L385 L417	V381-V419 HydrophobicContact CG2-CG1 4.39Å; L385-V419 HydrophobicContact CD2-CB 4.46Å; L417-V419 VanDerWaalsContact C-N 3.25Å; L417-V419 PolarHBondContact O-N 3.49Å
420	L	84.9	Confident	86.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-86	-13.6	178.4	-71.1	-179.6	0	0	0	113.4	V381 L385 Y388 F389 L417 Q418 R423 F424	V381-L420 HydrophobicContact CG1-CD2 3.98Å; V381-L420 HydrophobicContact CG2-CD2 4.49Å; L385-L420 HydrophobicContact CD2-CD1 4.18Å; L385-L420 HydrophobicContact CD2-CD2 4.46Å; L385-L420 HydrophobicContact CD2-CG 3.89Å; L385-L420 HydrophobicContact CG-CD1 3.75Å; L385-L420 HydrophobicContact CG-CG 4Å; Y388-L420 HydrophobicContact CD1-CD1 3.94Å; Y388-L420 HydrophobicContact CE1-CD1 4.49Å; F389-L420 HydrophobicContact CB-CD1 4.16Å; F389-L420 HydrophobicContact CB-CD2 4.16Å; F389-L420 HydrophobicContact CD2-CD2 4.38Å; F389-L420 HydrophobicContact CG-CD2 4.5Å; L417-L420 HydrophobicContact CD2-CD1 4.06Å; L417-L420 PolarHBondContact O-N 3.01Å; Q418-L420 VanDerWaalsContact C-N 3.28Å; Q418-L420 PolarHBondContact O-N 3.49Å; L420-R423 WeakPolarHBondContact O-CA 3.28Å; L420-R423 WeakPolarHBondContact O-CB 3.25Å; L420-R423 PolarHBondContact O-N 3.39Å; L420-F424 HydrophobicContact CB-CD2 3.87Å; L420-F424 HydrophobicContact CB-CE2 3.53Å; L420-F424 HydrophobicContact CB-CZ 4.28Å; L420-F424 HydrophobicContact CD1-CE2 4.05Å; L420-F424 HydrophobicContact CD1-CZ 4.11Å; L420-F424 HydrophobicContact CG-CE2 4.46Å; L420-F424 WeakPolarHBondContact O-CD2 3.4Å; L420-F424 PolarHBondContact O-N 2.79Å
421	T	84.7	Confident	86.4	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-46.1	-52.2	179.2	-46.8	0	0	0	0	113.9	L417 Q418 R423 F424 V425 A462 Y465	L417-T421 PolarHBondContact O-N 2.88Å; L417-T421 VanDerWaalsContact O-N 3.14Å; L417-T421 PolarHBondContact O-OG1 3.39Å; Q418-T421 WeakPolarHBondContact CA-OG1 3.26Å; Q418-T421 VanDerWaalsContact O-CB 3.25Å; Q418-T421 WeakPolarHBondContact O-CB 3.09Å; Q418-T421 PolarHBondContact O-N 3.28Å; Q418-T421 PolarHBondContact O-OG1 3.46Å; T421-R423 VanDerWaalsContact C-N 3.27Å; T421-R423 PolarHBondContact O-N 3.13Å; T421-F424 PolarHBondContact O-N 3.49Å; T421-V425 HydrophobicContact CG2-CG2 4.41Å; T421-V425 WeakPolarHBondContact O-CG2 3.48Å; T421-V425 PolarHBondContact O-N 3.21Å; T421-A462 HydrophobicContact CG2-CB 4.42Å; T421-Y465 HydrophobicContact CG2-CD2 4.16Å; T421-Y465 HydrophobicContact CG2-CE2 4.29Å
422	P	84.6	Confident	86.4	Confident	37 Å²	37	49.3 Å²	49.3	24%	0.24	26%	0.263	C	S	.	.	H	α-helix	trans	-59.1	-37.7	177.8	18	-30.4	0	0	0	112.9	V425 N426 Y465	P422-V425 PolarHBondContact O-N 3.42Å; P422-N426 VanDerWaalsContact O-CB 3.29Å; P422-N426 WeakPolarHBondContact O-CB 3.42Å; P422-N426 PolarHBondContact O-N 2.81Å; P422-Y465 HydrophobicContact CB-CE1 3.88Å; P422-Y465 HydrophobicContact CB-CE2 3.95Å; P422-Y465 HydrophobicContact CG-CE2 4.3Å
423	R	87.1	Confident	86.5	Confident	99 Å²	99	53.9 Å²	53.9	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-69.1	-39.8	179.6	-61.9	-177.4	-175.3	-94.8	4.4	111.1	H379 F389 L420 T421 F427	H379-R423 PolarHBondContact O-NH2 2.72Å; F389-R423 HydrophobicContact CD2-CB 4.32Å; F389-R423 HydrophobicContact CE2-CB 3.78Å; F389-R423 HydrophobicContact CZ-CB 4.09Å; L420-R423 WeakPolarHBondContact O-CA 3.28Å; L420-R423 WeakPolarHBondContact O-CB 3.25Å; L420-R423 PolarHBondContact O-N 3.39Å; T421-R423 VanDerWaalsContact C-N 3.27Å; T421-R423 PolarHBondContact O-N 3.13Å; R423-F427 WeakPolarHBondContact O-CB 3.39Å; R423-F427 PolarHBondContact O-N 3.05Å
424	F	89	Confident	86.5	Confident	1 Å²	1	53.2 Å²	53.2	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-65.7	-45.6	174.2	-70.9	-51.5	0	0	0	112.2	Y388 F389 V392 L411 L420 T421 F427 I428 M450	Y388-F424 HydrophobicContact CE1-CZ 4.28Å; F389-F424 AromaticContact CD2-CD1 3.78Å; F389-F424 HydrophobicContact CD2-CD1 3.78Å; F389-F424 AromaticContact CD2-CE1 3.38Å; F389-F424 HydrophobicContact CD2-CE1 3.38Å; F389-F424 AromaticContact CD2-CZ 3.85Å; F389-F424 HydrophobicContact CD2-CZ 3.85Å; F389-F424 AromaticContact CE2-CD1 3.53Å; F389-F424 HydrophobicContact CE2-CD1 3.53Å; F389-F424 AromaticContact CE2-CE1 3.62Å; F389-F424 HydrophobicContact CE2-CE1 3.62Å; F389-F424 HydrophobicContact CE2-CG 4.29Å; F389-F424 HydrophobicContact CE2-CZ 4.44Å; V392-F424 HydrophobicContact CB-CE1 4.43Å; V392-F424 HydrophobicContact CG1-CE1 3.76Å; V392-F424 HydrophobicContact CG1-CZ 4.27Å; L411-F424 HydrophobicContact CD2-CE1 4.27Å; L411-F424 HydrophobicContact CD2-CE2 3.9Å; L411-F424 HydrophobicContact CD2-CZ 3.73Å; L420-F424 HydrophobicContact CB-CD2 3.87Å; L420-F424 HydrophobicContact CB-CE2 3.53Å; L420-F424 HydrophobicContact CB-CZ 4.28Å; L420-F424 HydrophobicContact CD1-CE2 4.05Å; L420-F424 HydrophobicContact CD1-CZ 4.11Å; L420-F424 HydrophobicContact CG-CE2 4.46Å; L420-F424 WeakPolarHBondContact O-CD2 3.4Å; L420-F424 PolarHBondContact O-N 2.79Å; T421-F424 PolarHBondContact O-N 3.49Å; F424-F427 PolarHBondContact O-N 3.46Å; F424-I428 WeakPolarHBondContact O-CD1 3.46Å; F424-I428 VanDerWaalsContact O-CG1 3.24Å; F424-I428 WeakPolarHBondContact O-CG1 3.41Å; F424-I428 PolarHBondContact O-N 3.24Å; F424-M450 HydrophobicContact CB-CE 4.44Å; F424-M450 HydrophobicContact CD1-CE 3.31Å; F424-M450 HydrophobicContact CE1-CE 3.8Å; F424-M450 HydrophobicContact CG-CE 4.15Å
425	V	90	Very high	86.4	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-43.6	178.6	176.5	0	0	0	0	111	T421 P422 I428 W429 E468 L469	T421-V425 HydrophobicContact CG2-CG2 4.41Å; T421-V425 WeakPolarHBondContact O-CG2 3.48Å; T421-V425 PolarHBondContact O-N 3.21Å; P422-V425 PolarHBondContact O-N 3.42Å; V425-I428 PolarHBondContact O-N 3.04Å; V425-W429 WeakPolarHBondContact O-CB 3.21Å; V425-W429 PolarHBondContact O-N 3.45Å; V425-E468 HydrophobicContact CG1-CB 4.3Å; V425-L469 HydrophobicContact CG1-CB 4.04Å
426	N	89.8	Confident	86.4	Confident	50 Å²	50	48.6 Å²	48.6	27%	0.267	25%	0.247	S	C	.	.	H	α-helix	trans	-65.1	-40.4	176.4	-171.1	-100.9	0	0	0	112.2	P422 I428 W429 R430 E468	P422-N426 VanDerWaalsContact O-CB 3.29Å; P422-N426 WeakPolarHBondContact O-CB 3.42Å; P422-N426 PolarHBondContact O-N 2.81Å; N426-I428 VanDerWaalsContact C-N 3.35Å; N426-I428 PolarHBondContact O-N 2.86Å; N426-W429 PolarHBondContact O-N 3.46Å; N426-R430 WeakPolarHBondContact O-CB 3.27Å; N426-R430 PolarHBondContact O-N 3.36Å; N426-E468 PolarHBondContact ND2-OE1 2.94Å
427	F	89.4	Confident	86.5	Confident	57 Å²	57	49.8 Å²	49.8	25%	0.25	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-43.2	174.6	177.9	-100.8	0	0	0	111.6	F389 T393 R423 F424 G431 L447 M450	F389-F427 HydrophobicContact CZ-CB 4.36Å; T393-F427 HydrophobicContact CG2-CD1 4.29Å; T393-F427 HydrophobicContact CG2-CD2 4.16Å; T393-F427 HydrophobicContact CG2-CE1 4.11Å; T393-F427 HydrophobicContact CG2-CE2 3.98Å; T393-F427 HydrophobicContact CG2-CG 4.31Å; T393-F427 HydrophobicContact CG2-CZ 3.95Å; R423-F427 WeakPolarHBondContact O-CB 3.39Å; R423-F427 PolarHBondContact O-N 3.05Å; F424-F427 PolarHBondContact O-N 3.46Å; F427-G431 WeakPolarHBondContact O-CA 3.44Å; F427-G431 PolarHBondContact O-N 2.83Å; F427-L447 HydrophobicContact CD1-CD2 4.41Å; F427-L447 HydrophobicContact CE1-CD2 4.02Å; F427-M450 HydrophobicContact CD1-CE 4.4Å; F427-M450 HydrophobicContact CD1-SD 4.22Å; F427-M450 HydrophobicContact CE1-SD 4.31Å
428	I	90.9	Very high	86.3	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-63.7	-48.2	175.4	-67.5	162.6	0	0	0	110.1	F424 V425 N426 G431 V432 M448 M450 A451 L469	F424-I428 WeakPolarHBondContact O-CD1 3.46Å; F424-I428 VanDerWaalsContact O-CG1 3.24Å; F424-I428 WeakPolarHBondContact O-CG1 3.41Å; F424-I428 PolarHBondContact O-N 3.24Å; V425-I428 PolarHBondContact O-N 3.04Å; N426-I428 VanDerWaalsContact C-N 3.35Å; N426-I428 PolarHBondContact O-N 2.86Å; I428-G431 PolarHBondContact O-N 3.47Å; I428-V432 HydrophobicContact CG2-CG2 4.27Å; I428-V432 WeakPolarHBondContact O-CB 3.41Å; I428-V432 WeakPolarHBondContact O-CG2 3.44Å; I428-V432 PolarHBondContact O-N 3.39Å; I428-M448 HydrophobicContact CG2-CE 4.49Å; I428-M450 HydrophobicContact CD1-CG 4.18Å; I428-M450 HydrophobicContact CD1-SD 4.34Å; I428-M450 HydrophobicContact CG1-CG 4.44Å; I428-M450 HydrophobicContact CG1-SD 4.05Å; I428-A451 HydrophobicContact CD1-CB 4.17Å; I428-A451 HydrophobicContact CG2-CB 4.32Å; I428-L469 HydrophobicContact CG2-CD1 4.09Å
429	W	90.5	Very high	86.3	Confident	80 Å²	80	52.4 Å²	52.4	30%	0.303	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-50.2	-178.7	173.2	82.1	0	0	0	112.7	V425 N426 V432 K433 E468 A472	V425-W429 WeakPolarHBondContact O-CB 3.21Å; V425-W429 PolarHBondContact O-N 3.45Å; N426-W429 PolarHBondContact O-N 3.46Å; W429-V432 PolarHBondContact O-N 3.16Å; W429-K433 WeakPolarHBondContact O-CB 3.37Å; W429-K433 PolarHBondContact O-N 2.95Å; W429-E468 HydrophobicContact CB-CG 3.69Å; W429-E468 VanDerWaalsContact CD1-O 3.25Å; W429-E468 HydrophobicContact CD2-CG 3.82Å; W429-E468 HydrophobicContact CE3-CG 4.41Å; W429-E468 HydrophobicContact CG-CG 3.45Å; W429-E468 VanDerWaalsContact CG-CG 3.45Å; W429-A472 HydrophobicContact CB-CB 4.48Å
430	R	89	Confident	86.4	Confident	155 Å²	155	52.2 Å²	52.2	59%	0.585	27%	0.265	S	S	*	.	H	α-helix	trans	-62.8	-45	174.3	-94.9	171.5	158.3	169.5	-9.9	111.7	N426 V432 K433 C434	N426-R430 WeakPolarHBondContact O-CB 3.27Å; N426-R430 PolarHBondContact O-N 3.36Å; R430-V432 VanDerWaalsContact C-N 3.33Å; R430-V432 PolarHBondContact O-N 3.34Å; R430-K433 PolarHBondContact O-N 3.23Å; R430-C434 WeakPolarHBondContact O-CB 3.49Å; R430-C434 PolarHBondContact O-N 3.47Å; R430-C434 PolarHBondContact O-SG 2.84Å
431	G	88.3	Confident	86.3	Confident	12 Å²	12	53 Å²	53	12%	0.124	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-45.5	179.6	0	0	0	0	0	111.6	F427 I428 N435 L447	F427-G431 WeakPolarHBondContact O-CA 3.44Å; F427-G431 PolarHBondContact O-N 2.83Å; I428-G431 PolarHBondContact O-N 3.47Å; G431-N435 VanDerWaalsContact O-CB 3.29Å; G431-N435 WeakPolarHBondContact O-CB 3.37Å; G431-N435 PolarHBondContact O-N 3.38Å; G431-N435 PolarHBondContact O-ND2 3.11Å; G431-L447 VanDerWaalsContact C-CD1 3.47Å
432	V	90	Very high	86.3	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-47.9	176.4	168.4	0	0	0	0	110.5	I428 W429 R430 C434 N435 I436 L444 L447 M448 A472 C476	I428-V432 HydrophobicContact CG2-CG2 4.27Å; I428-V432 WeakPolarHBondContact O-CB 3.41Å; I428-V432 WeakPolarHBondContact O-CG2 3.44Å; I428-V432 PolarHBondContact O-N 3.39Å; W429-V432 PolarHBondContact O-N 3.16Å; R430-V432 VanDerWaalsContact C-N 3.33Å; R430-V432 PolarHBondContact O-N 3.34Å; V432-C434 VanDerWaalsContact C-N 3.35Å; V432-C434 PolarHBondContact O-N 3.18Å; V432-N435 PolarHBondContact O-N 3.37Å; V432-I436 HydrophobicContact CG1-CD1 3.56Å; V432-I436 HydrophobicContact CG1-CG1 4.25Å; V432-I436 WeakPolarHBondContact O-CB 3.5Å; V432-I436 WeakPolarHBondContact O-CD1 3.14Å; V432-I436 WeakPolarHBondContact O-CG1 3.22Å; V432-I436 PolarHBondContact O-N 3.35Å; V432-L444 HydrophobicContact CG1-CD2 4.33Å; V432-L444 HydrophobicContact CG2-CD2 4.43Å; V432-L447 HydrophobicContact CG2-CB 4.24Å; V432-L447 HydrophobicContact CG2-CD1 4.09Å; V432-M448 HydrophobicContact CG2-CE 3.45Å; V432-M448 VanDerWaalsContact CG2-CE 3.45Å; V432-A472 HydrophobicContact CB-CB 4.35Å; V432-A472 HydrophobicContact CG1-CB 4.35Å; V432-A472 HydrophobicContact CG2-CB 4.49Å; V432-C476 WeakPolarHBondContact CG1-SG 3.46Å
433	K	87.4	Confident	86.4	Confident	138 Å²	138	55.2 Å²	55.2	60%	0.6	29%	0.285	S	S	*	.	H	α-helix	trans	-58.6	-44.7	-179.8	-170.4	178.1	-179.5	-179.2	0	112.4	W429 R430	W429-K433 WeakPolarHBondContact O-CB 3.37Å; W429-K433 PolarHBondContact O-N 2.95Å; R430-K433 PolarHBondContact O-N 3.23Å
434	C	86.5	Confident	86.4	Confident	76 Å²	76	50.5 Å²	50.5	51%	0.514	27%	0.267	S	S	.	.	H	α-helix	trans	-70.1	-44.5	178.2	-68.9	0	0	0	0	112.3	R430 V432 I436 A437 L438	R430-C434 WeakPolarHBondContact O-CB 3.49Å; R430-C434 PolarHBondContact O-N 3.47Å; R430-C434 PolarHBondContact O-SG 2.84Å; V432-C434 VanDerWaalsContact C-N 3.35Å; V432-C434 PolarHBondContact O-N 3.18Å; C434-I436 VanDerWaalsContact C-N 3.32Å; C434-I436 PolarHBondContact O-N 3.14Å; C434-A437 WeakPolarHBondContact O-CB 3.21Å; C434-A437 PolarHBondContact O-N 2.95Å; C434-A437 VanDerWaalsContact O-N 3.14Å; C434-L438 WeakPolarHBondContact O-CG 3.33Å; C434-L438 PolarHBondContact O-N 3.49Å; C434-L438 VanDerWaalsContact O-N 3.13Å
435	N	84.1	Confident	86.4	Confident	21 Å²	21	52.5 Å²	52.5	11%	0.112	28%	0.278	C	S	.	.	H	α-helix	trans	-72.8	-23.9	-177.3	-75.8	-71	0	0	0	113.5	G431 V432 A437 L438 N439 N440 L444	G431-N435 VanDerWaalsContact O-CB 3.29Å; G431-N435 WeakPolarHBondContact O-CB 3.37Å; G431-N435 PolarHBondContact O-N 3.38Å; G431-N435 PolarHBondContact O-ND2 3.11Å; V432-N435 PolarHBondContact O-N 3.37Å; N435-A437 VanDerWaalsContact C-N 3.32Å; N435-L438 PolarHBondContact O-N 2.88Å; N435-N439 PolarHBondContact O-N 3.27Å; N435-N440 PolarHBondContact O-N 3.48Å; N435-L444 HydrophobicContact CB-CD2 3.89Å; N435-L444 HydrophobicContact CB-CG 4.12Å
436	I	83.8	Confident	86.4	Confident	32 Å²	32	53.9 Å²	53.9	16%	0.164	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-42.9	168.1	-72	166.2	0	0	0	110.3	V432 C434 L438 N439 L444	V432-I436 HydrophobicContact CG1-CD1 3.56Å; V432-I436 HydrophobicContact CG1-CG1 4.25Å; V432-I436 WeakPolarHBondContact O-CB 3.5Å; V432-I436 WeakPolarHBondContact O-CD1 3.14Å; V432-I436 WeakPolarHBondContact O-CG1 3.22Å; V432-I436 PolarHBondContact O-N 3.35Å; C434-I436 VanDerWaalsContact C-N 3.32Å; C434-I436 PolarHBondContact O-N 3.14Å; I436-L438 VanDerWaalsContact C-N 3.34Å; I436-L438 PolarHBondContact O-N 2.99Å; I436-N439 PolarHBondContact O-N 3.05Å; I436-L444 HydrophobicContact CG1-CD1 4.41Å; I436-L444 HydrophobicContact CG1-CD2 4.18Å
437	A	80.5	Confident	86.4	Confident	78 Å²	78	52 Å²	52	65%	0.645	27%	0.273	S	S	*	.	H	α-helix	trans	-67.8	-34.9	177.6	0	0	0	0	0	112.5	C434 N435 N439	C434-A437 WeakPolarHBondContact O-CB 3.21Å; C434-A437 PolarHBondContact O-N 2.95Å; C434-A437 VanDerWaalsContact O-N 3.14Å; N435-A437 VanDerWaalsContact C-N 3.32Å; A437-N439 VanDerWaalsContact C-N 3.33Å
438	L	80	Confident	86.5	Confident	129 Å²	129	49.2 Å²	49.2	68%	0.675	26%	0.261	S	S	*	.	H	α-helix	trans	-81.2	-8.2	178.7	-63.3	175.2	0	0	0	114	C434 N435 I436 N440	C434-L438 WeakPolarHBondContact O-CG 3.33Å; C434-L438 PolarHBondContact O-N 3.49Å; C434-L438 VanDerWaalsContact O-N 3.13Å; N435-L438 PolarHBondContact O-N 2.88Å; I436-L438 VanDerWaalsContact C-N 3.34Å; I436-L438 PolarHBondContact O-N 2.99Å; L438-N440 PolarHBondContact O-N 2.76Å
439	N	79.8	Confident	86.5	Confident	53 Å²	53	54.8 Å²	54.8	28%	0.283	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	30.5	-176.7	-70	-55.2	0	0	0	114.2	N435 I436 A437 L441 K481	N435-N439 PolarHBondContact O-N 3.27Å; I436-N439 PolarHBondContact O-N 3.05Å; A437-N439 VanDerWaalsContact C-N 3.33Å; N439-L441 PolarHBondContact O-N 3.33Å; N439-K481 PolarHBondContact OD1-O 2.91Å
440	N	83.3	Confident	86.5	Confident	69 Å²	69	51 Å²	51	37%	0.369	27%	0.267	S	S	.	.			trans	-90.1	95.7	179.1	-171.3	-21.3	0	0	0	111.2	N435 L438 A442 M443 L444	N435-N440 PolarHBondContact O-N 3.48Å; L438-N440 PolarHBondContact O-N 2.76Å; N440-A442 PolarHBondContact O-N 3.31Å; N440-A442 PolarHBondContact OD1-N 2.93Å; N440-M443 HydrophobicContact CB-CB 4.46Å; N440-M443 WeakPolarHBondContact ND2-CG 3.38Å; N440-M443 PolarHBondContact OD1-N 3.06Å; N440-L444 PolarHBondContact O-N 3.12Å
441	L	83.6	Confident	86.6	Confident	18 Å²	18	43.6 Å²	43.6	9%	0.094	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-40.7	-178.5	-177.4	58.2	0	0	0	113.7	N439 M443 L444 I445 H491 L494	N439-L441 PolarHBondContact O-N 3.33Å; L441-M443 VanDerWaalsContact C-N 3.32Å; L441-M443 PolarHBondContact O-N 3.21Å; L441-L444 PolarHBondContact O-N 3.34Å; L441-I445 HydrophobicContact CD1-CD1 4.27Å; L441-I445 HydrophobicContact CD1-CG1 4.28Å; L441-I445 HydrophobicContact CD2-CD1 4.46Å; L441-I445 HydrophobicContact CG-CD1 3.94Å; L441-I445 HydrophobicContact CG-CG1 4.4Å; L441-I445 WeakPolarHBondContact O-CG1 3.4Å; L441-I445 PolarHBondContact O-N 2.92Å; L441-H491 VanDerWaalsContact CD1-CE1 3.47Å; L441-H491 WeakPolarHBondContact CD1-CE1 3.33Å; L441-H491 WeakPolarHBondContact CD1-ND1 3.32Å; L441-H491 WeakPolarHBondContact CD2-CE1 3.41Å; L441-H491 WeakPolarHBondContact CD2-NE2 3.34Å; L441-L494 HydrophobicContact CD1-CB 4.23Å; L441-L494 HydrophobicContact CD1-CD2 3.44Å; L441-L494 VanDerWaalsContact CD1-CD2 3.44Å; L441-L494 HydrophobicContact CD1-CG 4.46Å
442	A	84.3	Confident	86.8	Confident	51 Å²	51	43.8 Å²	43.8	42%	0.421	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-46.1	-176.4	0	0	0	0	0	110.4	N440 L444 I445 Y446	N440-A442 PolarHBondContact O-N 3.31Å; N440-A442 PolarHBondContact OD1-N 2.93Å; A442-L444 VanDerWaalsContact C-N 3.34Å; A442-L444 PolarHBondContact O-N 3.2Å; A442-I445 PolarHBondContact O-N 3.43Å; A442-Y446 WeakPolarHBondContact O-CD2 3.44Å; A442-Y446 PolarHBondContact O-N 3.44Å; A442-Y446 VanDerWaalsContact O-N 3.14Å
443	M	86.9	Confident	86.8	Confident	37 Å²	37	43.9 Å²	43.9	18%	0.182	24%	0.241	C	C	.	.	H	α-helix	trans	-63.3	-39	177.3	-68.7	-58.3	-86.4	0	0	112.4	M397 N440 L441 I445 Y446 L447	M397-M443 HydrophobicContact CB-CE 4.42Å; M397-M443 HydrophobicContact CG-CE 3.86Å; N440-M443 HydrophobicContact CB-CB 4.46Å; N440-M443 WeakPolarHBondContact ND2-CG 3.38Å; N440-M443 PolarHBondContact OD1-N 3.06Å; L441-M443 VanDerWaalsContact C-N 3.32Å; L441-M443 PolarHBondContact O-N 3.21Å; M443-I445 PolarHBondContact O-N 3.13Å; M443-Y446 PolarHBondContact O-N 3.08Å; M443-L447 WeakPolarHBondContact O-CB 3.46Å; M443-L447 VanDerWaalsContact O-CG 3.29Å; M443-L447 WeakPolarHBondContact O-CG 3.47Å; M443-L447 PolarHBondContact O-N 3.48Å
444	L	88.2	Confident	86.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-41.1	175.8	-69.2	172.5	0	0	0	112.3	V432 N435 I436 N440 L441 A442 Y446 L447 M448 L482 L494	V432-L444 HydrophobicContact CG1-CD2 4.33Å; V432-L444 HydrophobicContact CG2-CD2 4.43Å; N435-L444 HydrophobicContact CB-CD2 3.89Å; N435-L444 HydrophobicContact CB-CG 4.12Å; I436-L444 HydrophobicContact CG1-CD1 4.41Å; I436-L444 HydrophobicContact CG1-CD2 4.18Å; N440-L444 PolarHBondContact O-N 3.12Å; L441-L444 PolarHBondContact O-N 3.34Å; A442-L444 VanDerWaalsContact C-N 3.34Å; A442-L444 PolarHBondContact O-N 3.2Å; L444-Y446 VanDerWaalsContact C-N 3.32Å; L444-Y446 PolarHBondContact O-N 3.38Å; L444-L447 PolarHBondContact O-N 3.5Å; L444-M448 WeakPolarHBondContact O-CG 3.36Å; L444-M448 PolarHBondContact O-N 2.89Å; L444-L482 HydrophobicContact CD1-CD2 4.4Å; L444-L494 HydrophobicContact CB-CD2 3.75Å; L444-L494 HydrophobicContact CD1-CD2 4.38Å
445	I	88.6	Confident	86.9	Confident	42 Å²	42	33.9 Å²	33.9	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-60.4	-44.4	175.8	-67.4	166.9	0	0	0	110.4	L441 A442 M443 M448 R449 L494	L441-I445 HydrophobicContact CD1-CD1 4.27Å; L441-I445 HydrophobicContact CD1-CG1 4.28Å; L441-I445 HydrophobicContact CD2-CD1 4.46Å; L441-I445 HydrophobicContact CG-CD1 3.94Å; L441-I445 HydrophobicContact CG-CG1 4.4Å; L441-I445 WeakPolarHBondContact O-CG1 3.4Å; L441-I445 PolarHBondContact O-N 2.92Å; A442-I445 PolarHBondContact O-N 3.43Å; M443-I445 PolarHBondContact O-N 3.13Å; I445-M448 PolarHBondContact O-N 3.07Å; I445-R449 WeakPolarHBondContact O-CG 3.45Å; I445-R449 PolarHBondContact O-N 3Å; I445-L494 HydrophobicContact CG1-CB 4.39Å; I445-L494 HydrophobicContact CG1-CD1 4Å; I445-L494 HydrophobicContact CG1-CD2 4.46Å
446	Y	88.7	Confident	87.1	Confident	31 Å²	31	35.9 Å²	35.9	12%	0.122	20%	0.2	C	C	.	.	H	α-helix	trans	-69	-39.8	179.2	-69.7	-62.3	0	0	0	112.9	R404 A442 M443 L444 M448 R449 M450	R404-Y446 VanDerWaalsContact NH1-CE2 3.32Å; R404-Y446 PolarHBondContact NH1-OH 2.84Å; A442-Y446 WeakPolarHBondContact O-CD2 3.44Å; A442-Y446 PolarHBondContact O-N 3.44Å; A442-Y446 VanDerWaalsContact O-N 3.14Å; M443-Y446 PolarHBondContact O-N 3.08Å; L444-Y446 VanDerWaalsContact C-N 3.32Å; L444-Y446 PolarHBondContact O-N 3.38Å; Y446-M448 VanDerWaalsContact C-N 3.32Å; Y446-M448 PolarHBondContact O-N 3.29Å; Y446-R449 PolarHBondContact O-N 3.41Å; Y446-M450 WeakPolarHBondContact O-CB 3.48Å; Y446-M450 PolarHBondContact O-N 2.88Å
447	L	91.3	Very high	87.2	Confident	9 Å²	9	34.4 Å²	34.4	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-38.8	174.6	-72.5	170.3	0	0	0	111.9	F427 G431 V432 M443 L444 M450 A451	F427-L447 HydrophobicContact CD1-CD2 4.41Å; F427-L447 HydrophobicContact CE1-CD2 4.02Å; G431-L447 VanDerWaalsContact C-CD1 3.47Å; V432-L447 HydrophobicContact CG2-CB 4.24Å; V432-L447 HydrophobicContact CG2-CD1 4.09Å; M443-L447 WeakPolarHBondContact O-CB 3.46Å; M443-L447 VanDerWaalsContact O-CG 3.29Å; M443-L447 WeakPolarHBondContact O-CG 3.47Å; M443-L447 PolarHBondContact O-N 3.48Å; L444-L447 PolarHBondContact O-N 3.5Å; L447-M450 WeakPolarHBondContact O-CB 3.3Å; L447-M450 PolarHBondContact O-N 3.03Å; L447-A451 WeakPolarHBondContact O-CB 3.36Å; L447-A451 PolarHBondContact O-N 3.25Å
448	M	91.3	Very high	87.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.1	-37.6	174.7	-68.4	-59.2	100	0	0	111.9	I428 V432 L444 I445 Y446 M450 A451 A452 V473 C476 L494 F497 L501	I428-M448 HydrophobicContact CG2-CE 4.49Å; V432-M448 HydrophobicContact CG2-CE 3.45Å; V432-M448 VanDerWaalsContact CG2-CE 3.45Å; L444-M448 WeakPolarHBondContact O-CG 3.36Å; L444-M448 PolarHBondContact O-N 2.89Å; I445-M448 PolarHBondContact O-N 3.07Å; Y446-M448 VanDerWaalsContact C-N 3.32Å; Y446-M448 PolarHBondContact O-N 3.29Å; M448-M450 VanDerWaalsContact C-N 3.32Å; M448-A451 PolarHBondContact O-N 2.65Å; M448-A452 PolarHBondContact O-N 3.33Å; M448-V473 HydrophobicContact SD-CG2 4.27Å; M448-C476 HydrophobicContact SD-CB 4.23Å; M448-L494 HydrophobicContact CB-CD1 4.21Å; M448-L494 HydrophobicContact CG-CD1 3.78Å; M448-F497 HydrophobicContact CB-CD1 3.79Å; M448-F497 HydrophobicContact CB-CE1 3.72Å; M448-L501 HydrophobicContact SD-CD2 4.41Å
449	R	90.9	Very high	87.3	Confident	117 Å²	117	31 Å²	31	44%	0.442	17%	0.171	S	C	.	.	H	α-helix	trans	-64.1	-38.5	172.7	-75	178.8	174.7	-178.8	0.2	111.9	L408 I445 Y446 A452 A453 F497	L408-R449 HydrophobicContact CD1-CB 4.19Å; L408-R449 HydrophobicContact CD2-CB 4.23Å; I445-R449 WeakPolarHBondContact O-CG 3.45Å; I445-R449 PolarHBondContact O-N 3Å; Y446-R449 PolarHBondContact O-N 3.41Å; R449-A452 WeakPolarHBondContact O-CB 3.42Å; R449-A452 PolarHBondContact O-N 3.38Å; R449-A453 PolarHBondContact O-N 3.13Å; R449-F497 HydrophobicContact CG-CE1 4.35Å; R449-F497 HydrophobicContact CG-CZ 4.12Å
450	M	90.4	Very high	87.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.7	-45.2	173.6	-172.9	-177.2	-175	0	0	111	V392 F396 L408 L411 F424 F427 I428 Y446 L447 M448 A452 A453 V454	V392-M450 HydrophobicContact CG1-CE 4.21Å; F396-M450 HydrophobicContact CD2-CE 4.16Å; F396-M450 HydrophobicContact CD2-SD 3.8Å; F396-M450 HydrophobicContact CE1-CB 3.94Å; F396-M450 HydrophobicContact CE1-CG 4.27Å; F396-M450 HydrophobicContact CE2-CB 4.34Å; F396-M450 HydrophobicContact CE2-CE 3.76Å; F396-M450 HydrophobicContact CE2-CG 3.77Å; F396-M450 HydrophobicContact CE2-SD 3.56Å; F396-M450 VanDerWaalsContact CE2-SD 3.56Å; F396-M450 HydrophobicContact CG-SD 4.43Å; F396-M450 HydrophobicContact CZ-CB 3.77Å; F396-M450 HydrophobicContact CZ-CG 3.62Å; F396-M450 HydrophobicContact CZ-SD 3.98Å; L408-M450 HydrophobicContact CD2-CB 4.39Å; L411-M450 HydrophobicContact CD1-CE 4.05Å; L411-M450 HydrophobicContact CD1-CG 4.05Å; F424-M450 HydrophobicContact CB-CE 4.44Å; F424-M450 HydrophobicContact CD1-CE 3.31Å; F424-M450 HydrophobicContact CE1-CE 3.8Å; F424-M450 HydrophobicContact CG-CE 4.15Å; F427-M450 HydrophobicContact CD1-CE 4.4Å; F427-M450 HydrophobicContact CD1-SD 4.22Å; F427-M450 HydrophobicContact CE1-SD 4.31Å; I428-M450 HydrophobicContact CD1-CG 4.18Å; I428-M450 HydrophobicContact CD1-SD 4.34Å; I428-M450 HydrophobicContact CG1-CG 4.44Å; I428-M450 HydrophobicContact CG1-SD 4.05Å; Y446-M450 WeakPolarHBondContact O-CB 3.48Å; Y446-M450 PolarHBondContact O-N 2.88Å; L447-M450 WeakPolarHBondContact O-CB 3.3Å; L447-M450 PolarHBondContact O-N 3.03Å; M448-M450 VanDerWaalsContact C-N 3.32Å; M450-A452 VanDerWaalsContact C-N 3.29Å; M450-A452 PolarHBondContact O-N 2.75Å; M450-A453 WeakPolarHBondContact O-CB 3.44Å; M450-A453 PolarHBondContact O-N 2.91Å; M450-A453 VanDerWaalsContact O-N 3.16Å; M450-V454 WeakPolarHBondContact O-CG2 3.34Å; M450-V454 PolarHBondContact O-N 3.3Å
451	A	91.2	Very high	86.6	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-41.1	174	0	0	0	0	0	111.7	I428 L447 M448 V454 V455 L469 L501	I428-A451 HydrophobicContact CD1-CB 4.17Å; I428-A451 HydrophobicContact CG2-CB 4.32Å; L447-A451 WeakPolarHBondContact O-CB 3.36Å; L447-A451 PolarHBondContact O-N 3.25Å; M448-A451 PolarHBondContact O-N 2.65Å; A451-V454 PolarHBondContact O-N 3.28Å; A451-V455 WeakPolarHBondContact O-CB 3.48Å; A451-V455 WeakPolarHBondContact O-CG2 3.39Å; A451-V455 PolarHBondContact O-N 2.88Å; A451-L469 HydrophobicContact CB-CD1 4.31Å; A451-L501 HydrophobicContact CB-CD2 3.82Å
452	A	91.3	Very high	86.1	Confident	15 Å²	15	28.4 Å²	28.4	12%	0.124	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-43.8	174	0	0	0	0	0	112.4	M448 R449 M450 V454 V455 D456 F497 L501	M448-A452 PolarHBondContact O-N 3.33Å; R449-A452 WeakPolarHBondContact O-CB 3.42Å; R449-A452 PolarHBondContact O-N 3.38Å; M450-A452 VanDerWaalsContact C-N 3.29Å; M450-A452 PolarHBondContact O-N 2.75Å; A452-V454 PolarHBondContact O-N 2.86Å; A452-V455 PolarHBondContact O-N 2.89Å; A452-D456 WeakPolarHBondContact O-CB 3.45Å; A452-D456 PolarHBondContact O-N 2.98Å; A452-F497 HydrophobicContact CB-CE1 4.39Å; A452-F497 HydrophobicContact CB-CZ 3.88Å; A452-L501 HydrophobicContact CB-CD1 3.85Å; A452-L501 HydrophobicContact CB-CD2 4.48Å
453	A	89.7	Confident	85.7	Confident	5 Å²	5	27.3 Å²	27.3	4%	0.041	15%	0.146	C	C	.	.	H	α-helix	trans	-60.6	-42.9	176.8	0	0	0	0	0	112.5	L408 L411 C412 R449 M450 V455 D456 N457	L408-A453 HydrophobicContact CD2-CB 3.88Å; L411-A453 HydrophobicContact CB-CB 4.27Å; C412-A453 VanDerWaalsContact SG-CA 3.52Å; C412-A453 WeakPolarHBondContact SG-CB 3.39Å; R449-A453 PolarHBondContact O-N 3.13Å; M450-A453 WeakPolarHBondContact O-CB 3.44Å; M450-A453 PolarHBondContact O-N 2.91Å; M450-A453 VanDerWaalsContact O-N 3.16Å; A453-V455 VanDerWaalsContact C-N 3.32Å; A453-V455 PolarHBondContact O-N 2.83Å; A453-D456 PolarHBondContact O-N 3Å; A453-N457 PolarHBondContact O-N 3.49Å
454	V	88.5	Confident	85.2	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.012	15%	0.148	C	C	.	.	H	α-helix	trans	-64	-37.8	176.4	173.3	0	0	0	0	111.5	M450 A451 A452 L460	M450-V454 WeakPolarHBondContact O-CG2 3.34Å; M450-V454 PolarHBondContact O-N 3.3Å; A451-V454 PolarHBondContact O-N 3.28Å; A452-V454 PolarHBondContact O-N 2.86Å; V454-L460 HydrophobicContact CG1-CD1 4.32Å
455	V	88.1	Confident	85	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-75	-26.7	179.2	173.1	0	0	0	0	112.5	A451 A452 A453 L469 L501 L505 R508	A451-V455 WeakPolarHBondContact O-CB 3.48Å; A451-V455 WeakPolarHBondContact O-CG2 3.39Å; A451-V455 PolarHBondContact O-N 2.88Å; A452-V455 PolarHBondContact O-N 2.89Å; A453-V455 VanDerWaalsContact C-N 3.32Å; A453-V455 PolarHBondContact O-N 2.83Å; V455-L469 HydrophobicContact CG2-CD2 4.27Å; V455-L501 HydrophobicContact CB-CD1 4.43Å; V455-L501 HydrophobicContact CG2-CD1 4.42Å; V455-L505 HydrophobicContact CB-CD2 4.26Å; V455-L505 HydrophobicContact CG1-CD2 3.88Å; V455-L505 HydrophobicContact CG1-CG 4.12Å; V455-L505 HydrophobicContact CG2-CD1 4.43Å; V455-L505 HydrophobicContact CG2-CD2 3.27Å; V455-L505 HydrophobicContact CG2-CG 3.83Å; V455-R508 WeakPolarHBondContact O-CD 3.32Å; V455-R508 VanDerWaalsContact O-CZ 3.26Å; V455-R508 PolarHBondContact O-NH1 3.17Å
456	D	88	Confident	84.8	Confident	64 Å²	64	27.8 Å²	27.8	34%	0.342	15%	0.147	S	C	.	.	H	α-helix	trans	-79.4	-29	-178.7	-73.7	4.1	0	0	0	111.8	A452 A453 P458 K504 R508	A452-D456 WeakPolarHBondContact O-CB 3.45Å; A452-D456 PolarHBondContact O-N 2.98Å; A453-D456 PolarHBondContact O-N 3Å; D456-P458 WeakPolarHBondContact O-CD 3.47Å; D456-K504 WeakPolarHBondContact OD1-CE 3.48Å; D456-K504 IonicContact OD1-NZ 3.2Å; D456-K504 PolarHBondContact OD1-NZ 3.28Å; D456-K504 IonicContact OD2-NZ 2.85Å; D456-K504 PolarHBondContact OD2-NZ 2.94Å; D456-R508 PolarHBondContact O-NH1 3.08Å
457	N	86.9	Confident	84.6	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.165	C	C	.	.			trans	-64	117.2	178.6	-169.3	-28.4	0	0	0	111.4	L411 C412 D414 A453 T459 L460 R508	L411-N457 PolarHBondContact O-ND2 3.34Å; C412-N457 WeakPolarHBondContact O-CB 3.38Å; C412-N457 VanDerWaalsContact O-CG 3.31Å; D414-N457 PolarHBondContact O-ND2 2.93Å; A453-N457 PolarHBondContact O-N 3.49Å; N457-T459 PolarHBondContact O-N 3.12Å; N457-T459 WeakPolarHBondContact OD1-CB 3.46Å; N457-T459 PolarHBondContact OD1-N 3.02Å; N457-T459 PolarHBondContact OD1-OG1 3.45Å; N457-L460 HydrophobicContact CB-CB 4.27Å; N457-L460 HydrophobicContact CB-CD1 3.88Å; N457-L460 HydrophobicContact CB-CG 3.94Å; N457-L460 PolarHBondContact O-N 3.37Å; N457-R508 PolarHBondContact O-NH1 2.89Å; N457-R508 PolarHBondContact O-NH2 3.27Å
458	P	82.9	Confident	84.4	Confident	98 Å²	98	32.7 Å²	32.7	64%	0.636	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.8	179.2	25	-32.9	0	0	0	113.3	D456 R508	D456-P458 WeakPolarHBondContact O-CD 3.47Å; P458-R508 VanDerWaalsContact CA-NH2 3.26Å; P458-R508 PolarHBondContact O-NH2 3.26Å
459	T	78.5	Confident	84.3	Confident	38 Å²	38	32.8 Å²	32.8	23%	0.233	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-14.8	-175.8	67.7	0	0	0	0	113.7	D414 T415 Q418 N457	D414-T459 PolarHBondContact O-OG1 3.16Å; T415-T459 HydrophobicContact CG2-CG2 3.8Å; Q418-T459 WeakPolarHBondContact CG-O 3.38Å; Q418-T459 PolarHBondContact NE2-O 3.22Å; N457-T459 PolarHBondContact O-N 3.12Å; N457-T459 WeakPolarHBondContact OD1-CB 3.46Å; N457-T459 PolarHBondContact OD1-N 3.02Å; N457-T459 PolarHBondContact OD1-OG1 3.45Å
460	L	77.6	Confident	84.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.154	C	C	.	.			trans	-97.4	101	179.1	-57.2	-179.3	0	0	0	110	L417 Q418 V454 N457 A462	L417-L460 HydrophobicContact CB-CD2 3.97Å; Q418-L460 HydrophobicContact CG-CD2 4.12Å; V454-L460 HydrophobicContact CG1-CD1 4.32Å; N457-L460 HydrophobicContact CB-CB 4.27Å; N457-L460 HydrophobicContact CB-CD1 3.88Å; N457-L460 HydrophobicContact CB-CG 3.94Å; N457-L460 PolarHBondContact O-N 3.37Å; L460-A462 PolarHBondContact O-N 3.31Å
461	D	72	Confident	84.3	Confident	84 Å²	84	30.8 Å²	30.8	45%	0.449	17%	0.172	S	C	.	.			trans	-85.1	87.6	170.7	-90.8	-27.7	0	0	0	110	S463 K512	D461-S463 PolarHBondContact O-N 3.45Å; D461-K512 IonicContact OD1-NZ 2.8Å; D461-K512 PolarHBondContact OD1-NZ 3.14Å; D461-K512 IonicContact OD2-NZ 2.85Å; D461-K512 PolarHBondContact OD2-NZ 3.26Å
462	A	72.6	Confident	84.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-74.4	14.7	174.9	0	0	0	0	0	113.4	T421 L460 L464 Y465 L466 Y509	T421-A462 HydrophobicContact CG2-CB 4.42Å; L460-A462 PolarHBondContact O-N 3.31Å; A462-L464 PolarHBondContact O-N 2.89Å; A462-Y465 PolarHBondContact O-N 2.9Å; A462-L466 PolarHBondContact O-N 3.15Å; A462-Y509 WeakPolarHBondContact CA-OH 3.39Å; A462-Y509 WeakPolarHBondContact CB-OH 3.45Å; A462-Y509 PolarHBondContact N-OH 3.4Å
463	S	75.4	Confident	84.3	Confident	29 Å²	29	30.1 Å²	30.1	20%	0.203	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-58.2	-34.8	-174.4	43.6	0	0	0	0	113.2	D461 Y465	D461-S463 PolarHBondContact O-N 3.45Å; S463-Y465 VanDerWaalsContact C-N 3.34Å
464	L	77.4	Confident	84.3	Confident	41 Å²	41	30.5 Å²	30.5	22%	0.215	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-71.4	-29.1	179.8	-61.6	174.2	0	0	0	112.5	I331 Y373 A462 H467	I331-L464 HydrophobicContact CG2-CD1 3.62Å; I331-L464 HydrophobicContact CG2-CD2 3.75Å; I331-L464 HydrophobicContact CG2-CG 4.34Å; Y373-L464 PolarHBondContact OH-O 2.94Å; A462-L464 PolarHBondContact O-N 2.89Å; L464-H467 PolarHBondContact O-CE1 2.8Å; L464-H467 PolarHBondContact O-ND1 3.06Å
465	Y	83.1	Confident	84.3	Confident	38 Å²	38	33 Å²	33	15%	0.149	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-106.5	9.9	-173.7	-45	-65.9	0	0	0	113.4	T421 P422 A462 S463 H467 E468 L469	T421-Y465 HydrophobicContact CG2-CD2 4.16Å; T421-Y465 HydrophobicContact CG2-CE2 4.29Å; P422-Y465 HydrophobicContact CB-CE1 3.88Å; P422-Y465 HydrophobicContact CB-CE2 3.95Å; P422-Y465 HydrophobicContact CG-CE2 4.3Å; A462-Y465 PolarHBondContact O-N 2.9Å; S463-Y465 VanDerWaalsContact C-N 3.34Å; Y465-H467 PolarHBondContact O-N 3.1Å; Y465-E468 PolarHBondContact O-N 2.61Å; Y465-L469 PolarHBondContact O-N 3.47Å; Y465-L469 VanDerWaalsContact O-N 3.09Å
466	L	85	Confident	84.2	Confident	9 Å²	9	32.9 Å²	32.9	5%	0.047	19%	0.185	C	C	.	.	H	α-helix	trans	-55.5	-34.9	176.7	-77.9	169.9	0	0	0	112.6	A462 E468 L469 I470 L505 Y509 V513	A462-L466 PolarHBondContact O-N 3.15Å; L466-E468 PolarHBondContact O-N 2.9Å; L466-L469 PolarHBondContact O-N 3.33Å; L466-I470 HydrophobicContact CB-CD1 4.08Å; L466-I470 HydrophobicContact CD2-CD1 4.22Å; L466-I470 HydrophobicContact CD2-CG1 4.41Å; L466-I470 VanDerWaalsContact O-CB 3.26Å; L466-I470 WeakPolarHBondContact O-CB 3.29Å; L466-I470 WeakPolarHBondContact O-CG1 3.18Å; L466-I470 PolarHBondContact O-N 2.92Å; L466-L505 HydrophobicContact CD2-CD2 4.05Å; L466-Y509 HydrophobicContact CD1-CD1 3.91Å; L466-Y509 HydrophobicContact CD1-CD2 3.92Å; L466-Y509 HydrophobicContact CD1-CE1 4.47Å; L466-Y509 HydrophobicContact CD1-CE2 4.49Å; L466-Y509 HydrophobicContact CD1-CG 3.61Å; L466-Y509 HydrophobicContact CD2-CD2 3.59Å; L466-Y509 HydrophobicContact CD2-CE2 3.75Å; L466-Y509 HydrophobicContact CD2-CG 4.19Å; L466-Y509 HydrophobicContact CG-CD2 4.28Å; L466-Y509 HydrophobicContact CG-CE2 4.47Å; L466-Y509 HydrophobicContact CG-CG 4.42Å; L466-V513 HydrophobicContact CD1-CG2 4.37Å
467	H	84.4	Confident	84.2	Confident	107 Å²	107	29.9 Å²	29.9	50%	0.495	17%	0.168	S	C	.	.	H	α-helix	trans	-64.5	-21.8	179.7	67.7	-87.2	0	0	0	113.3	Y373 L464 Y465 P471	Y373-H467 AromaticContact CE1-CE1 3.97Å; Y373-H467 AromaticContact CZ-CE1 3.77Å; L464-H467 PolarHBondContact O-CE1 2.8Å; L464-H467 PolarHBondContact O-ND1 3.06Å; Y465-H467 PolarHBondContact O-N 3.1Å; H467-P471 WeakPolarHBondContact O-CD 3.48Å; H467-P471 WeakPolarHBondContact O-CG 3.49Å
468	E	87.7	Confident	84.1	Confident	36 Å²	36	31 Å²	31	17%	0.168	17%	0.174	C	C	.	.	H	α-helix	trans	-96.4	-38.9	176.1	-166.4	175.3	-178.2	0	0	111.2	V425 N426 W429 Y465 L466	V425-E468 HydrophobicContact CG1-CB 4.3Å; N426-E468 PolarHBondContact ND2-OE1 2.94Å; W429-E468 HydrophobicContact CB-CG 3.69Å; W429-E468 VanDerWaalsContact CD1-O 3.25Å; W429-E468 HydrophobicContact CD2-CG 3.82Å; W429-E468 HydrophobicContact CE3-CG 4.41Å; W429-E468 HydrophobicContact CG-CG 3.45Å; W429-E468 VanDerWaalsContact CG-CG 3.45Å; Y465-E468 PolarHBondContact O-N 2.61Å; L466-E468 PolarHBondContact O-N 2.9Å
469	L	89.5	Confident	84.1	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-70.4	-43	-179.5	-171.8	64.1	0	0	0	113	V425 I428 A451 V455 Y465 L466 A472 V473 L505	V425-L469 HydrophobicContact CG1-CB 4.04Å; I428-L469 HydrophobicContact CG2-CD1 4.09Å; A451-L469 HydrophobicContact CB-CD1 4.31Å; V455-L469 HydrophobicContact CG2-CD2 4.27Å; Y465-L469 PolarHBondContact O-N 3.47Å; Y465-L469 VanDerWaalsContact O-N 3.09Å; L466-L469 PolarHBondContact O-N 3.33Å; L469-A472 WeakPolarHBondContact O-CB 3.12Å; L469-A472 PolarHBondContact O-N 2.91Å; L469-A472 VanDerWaalsContact O-N 3.15Å; L469-V473 PolarHBondContact O-N 3.35Å; L469-V473 VanDerWaalsContact O-N 3.08Å; L469-L505 HydrophobicContact CD2-CD1 4.19Å; L469-L505 HydrophobicContact CD2-CD2 4.01Å
470	I	90.4	Very high	83.7	Confident	16 Å²	16	27.6 Å²	27.6	8%	0.082	15%	0.154	C	C	.	.	H	α-helix	trans	-62.1	-48	-176.1	-70.3	172.5	0	0	0	111.7	L466 A472 V473 M474 L502 L516 L520	L466-I470 HydrophobicContact CB-CD1 4.08Å; L466-I470 HydrophobicContact CD2-CD1 4.22Å; L466-I470 HydrophobicContact CD2-CG1 4.41Å; L466-I470 VanDerWaalsContact O-CB 3.26Å; L466-I470 WeakPolarHBondContact O-CB 3.29Å; L466-I470 WeakPolarHBondContact O-CG1 3.18Å; L466-I470 PolarHBondContact O-N 2.92Å; I470-A472 VanDerWaalsContact C-N 3.26Å; I470-A472 PolarHBondContact O-N 2.92Å; I470-V473 PolarHBondContact O-N 3.16Å; I470-M474 HydrophobicContact CG2-CG 4.16Å; I470-M474 WeakPolarHBondContact O-CB 3.34Å; I470-M474 VanDerWaalsContact O-CG 3.27Å; I470-M474 WeakPolarHBondContact O-CG 3.44Å; I470-M474 PolarHBondContact O-N 3.2Å; I470-L502 HydrophobicContact CG2-CD1 4.19Å; I470-L516 HydrophobicContact CD1-CD1 3.67Å; I470-L516 HydrophobicContact CD1-CD2 3.9Å; I470-L516 HydrophobicContact CD1-CG 4.25Å; I470-L520 HydrophobicContact CG2-CD1 4.46Å; I470-L520 HydrophobicContact CG2-CD2 3.79Å
471	P	90	Very high	83.2	Confident	59 Å²	59	34.2 Å²	34.2	38%	0.383	18%	0.183	S	C	.	.	H	α-helix	trans	-59.2	-34	174	-26.8	36.4	0	0	0	113.7	H467 S475	H467-P471 WeakPolarHBondContact O-CD 3.48Å; H467-P471 WeakPolarHBondContact O-CG 3.49Å; P471-S475 WeakPolarHBondContact O-CB 3.47Å; P471-S475 PolarHBondContact O-N 2.97Å; P471-S475 PolarHBondContact O-OG 3.35Å
472	A	90.3	Very high	82.6	Confident	2 Å²	2	30.2 Å²	30.2	2%	0.017	16%	0.162	C	C	.	.	H	α-helix	trans	-65	-47.1	176.8	0	0	0	0	0	111.6	W429 V432 L469 I470 S475 C476	W429-A472 HydrophobicContact CB-CB 4.48Å; V432-A472 HydrophobicContact CB-CB 4.35Å; V432-A472 HydrophobicContact CG1-CB 4.35Å; V432-A472 HydrophobicContact CG2-CB 4.49Å; L469-A472 WeakPolarHBondContact O-CB 3.12Å; L469-A472 PolarHBondContact O-N 2.91Å; L469-A472 VanDerWaalsContact O-N 3.15Å; I470-A472 VanDerWaalsContact C-N 3.26Å; I470-A472 PolarHBondContact O-N 2.92Å; A472-S475 PolarHBondContact O-N 3.45Å; A472-C476 PolarHBondContact O-N 3.19Å; A472-C476 PolarHBondContact O-SG 3.04Å; A472-C476 VanDerWaalsContact O-SG 3.4Å
473	V	92.2	Very high	82	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.7	-44	176.4	-179.7	0	0	0	0	110.7	M448 L469 I470 S475 C476 I477 S498 L501 L502 L505	M448-V473 HydrophobicContact SD-CG2 4.27Å; L469-V473 PolarHBondContact O-N 3.35Å; L469-V473 VanDerWaalsContact O-N 3.08Å; I470-V473 PolarHBondContact O-N 3.16Å; V473-S475 VanDerWaalsContact C-N 3.3Å; V473-S475 PolarHBondContact O-N 3.41Å; V473-C476 WeakPolarHBondContact O-CB 3.38Å; V473-C476 PolarHBondContact O-N 3.14Å; V473-C476 VanDerWaalsContact O-N 3.11Å; V473-I477 HydrophobicContact CG1-CD1 4.18Å; V473-I477 WeakPolarHBondContact O-CG1 3.42Å; V473-I477 PolarHBondContact O-N 3.32Å; V473-I477 VanDerWaalsContact O-N 3.13Å; V473-S498 WeakPolarHBondContact CG1-O 3.09Å; V473-L501 HydrophobicContact CG2-CD2 4.27Å; V473-L502 HydrophobicContact CG1-CB 4.09Å; V473-L502 HydrophobicContact CG1-CD1 4.36Å; V473-L505 HydrophobicContact CG2-CD1 4.3Å
474	M	89.3	Confident	80.8	Confident	13 Å²	13	34.8 Å²	34.8	6%	0.064	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-37.8	176.7	-75.6	-67.6	-73.5	0	0	112.7	I470 C476 I477 L478 L502 L520 Y523 L524	I470-M474 HydrophobicContact CG2-CG 4.16Å; I470-M474 WeakPolarHBondContact O-CB 3.34Å; I470-M474 VanDerWaalsContact O-CG 3.27Å; I470-M474 WeakPolarHBondContact O-CG 3.44Å; I470-M474 PolarHBondContact O-N 3.2Å; M474-C476 VanDerWaalsContact C-N 3.32Å; M474-C476 PolarHBondContact O-N 3.34Å; M474-I477 PolarHBondContact O-N 3.23Å; M474-I477 HydrophobicContact SD-CD1 4.27Å; M474-L478 HydrophobicContact CE-CD1 3.73Å; M474-L478 WeakPolarHBondContact O-CB 3.18Å; M474-L478 WeakPolarHBondContact O-CG 3.38Å; M474-L478 PolarHBondContact O-N 3.18Å; M474-L502 HydrophobicContact CG-CD1 4.38Å; M474-L502 HydrophobicContact CG-CD2 4.37Å; M474-L502 HydrophobicContact SD-CD1 4.44Å; M474-L502 HydrophobicContact SD-CD2 3.41Å; M474-L502 WeakPolarHBondContact SD-CD2 3.46Å; M474-L520 HydrophobicContact CE-CD2 4.38Å; M474-L520 HydrophobicContact CG-CD2 4.29Å; M474-L520 HydrophobicContact SD-CD2 4.21Å; M474-Y523 HydrophobicContact CE-CD1 3.48Å; M474-Y523 VanDerWaalsContact CE-CD1 3.48Å; M474-Y523 HydrophobicContact CE-CE1 3.67Å; M474-L524 HydrophobicContact CE-CD2 3.71Å; M474-L524 HydrophobicContact CE-CG 4.06Å; M474-L524 HydrophobicContact SD-CD2 4.47Å
475	S	89	Confident	79.5	Confident	54 Å²	54	43.3 Å²	43.3	38%	0.378	22%	0.223	S	C	.	.	H	α-helix	trans	-63.3	-39.2	175.5	-60.3	0	0	0	0	111.5	P471 A472 V473 I477 L478 C479	P471-S475 WeakPolarHBondContact O-CB 3.47Å; P471-S475 PolarHBondContact O-N 2.97Å; P471-S475 PolarHBondContact O-OG 3.35Å; A472-S475 PolarHBondContact O-N 3.45Å; V473-S475 VanDerWaalsContact C-N 3.3Å; V473-S475 PolarHBondContact O-N 3.41Å; S475-I477 VanDerWaalsContact C-N 3.29Å; S475-I477 PolarHBondContact O-N 2.81Å; S475-L478 PolarHBondContact O-N 2.9Å; S475-C479 WeakPolarHBondContact O-CB 3.5Å; S475-C479 PolarHBondContact O-N 2.92Å
476	C	86.5	Confident	77.8	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-31.5	174.9	-63.8	0	0	0	0	112.7	V432 M448 A472 V473 M474	V432-C476 WeakPolarHBondContact CG1-SG 3.46Å; M448-C476 HydrophobicContact SD-CB 4.23Å; A472-C476 PolarHBondContact O-N 3.19Å; A472-C476 PolarHBondContact O-SG 3.04Å; A472-C476 VanDerWaalsContact O-SG 3.4Å; V473-C476 WeakPolarHBondContact O-CB 3.38Å; V473-C476 PolarHBondContact O-N 3.14Å; V473-C476 VanDerWaalsContact O-N 3.11Å; M474-C476 VanDerWaalsContact C-N 3.32Å; M474-C476 PolarHBondContact O-N 3.34Å
477	I	88.3	Confident	76.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-75.3	-42.5	177.4	-63.4	165.6	0	0	0	111.5	V473 M474 S475 R495 L502 G540 T544	V473-I477 HydrophobicContact CG1-CD1 4.18Å; V473-I477 WeakPolarHBondContact O-CG1 3.42Å; V473-I477 PolarHBondContact O-N 3.32Å; V473-I477 VanDerWaalsContact O-N 3.13Å; M474-I477 PolarHBondContact O-N 3.23Å; M474-I477 HydrophobicContact SD-CD1 4.27Å; S475-I477 VanDerWaalsContact C-N 3.29Å; S475-I477 PolarHBondContact O-N 2.81Å; I477-R495 PolarHBondContact O-NH1 3.39Å; I477-L502 HydrophobicContact CD1-CB 4.21Å; I477-L502 HydrophobicContact CD1-CD2 4.03Å; I477-G540 WeakPolarHBondContact CG2-O 3.43Å; I477-T544 HydrophobicContact CD1-CG2 4.34Å
478	L	84.8	Confident	74.9	Confident	25 Å²	25	48.7 Å²	48.7	13%	0.131	28%	0.275	C	S	.	.	H	α-helix	trans	-102.6	-10.5	-165.8	-64.4	174.7	0	0	0	115.1	M474 S475 Y523 L524 L527 S537 A541	M474-L478 HydrophobicContact CE-CD1 3.73Å; M474-L478 WeakPolarHBondContact O-CB 3.18Å; M474-L478 WeakPolarHBondContact O-CG 3.38Å; M474-L478 PolarHBondContact O-N 3.18Å; S475-L478 PolarHBondContact O-N 2.9Å; L478-Y523 HydrophobicContact CD1-CE1 3.68Å; L478-L524 HydrophobicContact CD2-CD2 4.21Å; L478-L527 HydrophobicContact CD1-CD1 3.58Å; L478-L527 HydrophobicContact CD2-CD1 4.32Å; L478-S537 WeakPolarHBondContact O-CB 3.44Å; L478-S537 PolarHBondContact O-OG 3.47Å; L478-A541 HydrophobicContact CD2-CB 4.18Å
479	C	82.2	Confident	73.6	Confident	28 Å²	28	51.3 Å²	51.3	19%	0.189	29%	0.293	C	S	.	.			trans	-61.3	147.2	-175.7	-172.1	0	0	0	0	112.3	S475 L482 R495	S475-C479 WeakPolarHBondContact O-CB 3.5Å; S475-C479 PolarHBondContact O-N 2.92Å; C479-L482 HydrophobicContact CB-CD1 3.61Å; C479-L482 HydrophobicContact CB-CG 4.45Å; C479-L482 WeakPolarHBondContact O-CD1 3.25Å; C479-R495 PolarHBondContact O-NH1 3.28Å; C479-R495 PolarHBondContact O-NH2 3.31Å
480	S	70.7	Confident	72.8	Confident	36 Å²	36	53.2 Å²	53.2	25%	0.252	31%	0.307	S	S	.	.	S	Bend	trans	-80.6	-34.4	-172.2	58.9	0	0	0	0	114	Q536	S480-Q536 PolarHBondContact O-OE1 3.05Å
481	K	66.2	Low	72.3	Confident	139 Å²	139	53 Å²	53	60%	0.604	31%	0.305	S	S	*	.			trans	-135.7	110.2	177.3	-64.9	-175.7	-179.8	179.4	0	108	N439	N439-K481 PolarHBondContact OD1-O 2.91Å
482	L	60.8	Low	72	Confident	1 Å²	1	51 Å²	51	1%	0.005	29%	0.29	C	S	.	.	S	Bend	trans	-99.9	-16.8	173	-82.1	79.5	0	0	0	112.5	L444 C479 H491 L494	L444-L482 HydrophobicContact CD1-CD2 4.4Å; C479-L482 HydrophobicContact CB-CD1 3.61Å; C479-L482 HydrophobicContact CB-CG 4.45Å; C479-L482 WeakPolarHBondContact O-CD1 3.25Å; L482-H491 WeakPolarHBondContact CB-ND1 3.46Å; L482-H491 PolarHBondContact O-CE1 2.74Å; L482-L494 HydrophobicContact CD2-CD2 3.66Å
483	S	58.7	Low	72	Confident	35 Å²	35	54.2 Å²	54.2	25%	0.245	31%	0.31	C	S	.	.			trans	-142.5	152.9	164.8	60.4	0	0	0	0	111.8	H491	S483-H491 WeakPolarHBondContact CB-CE1 3.27Å; S483-H491 WeakPolarHBondContact CB-NE2 3.26Å; S483-H491 PolarHBondContact N-CE1 2.93Å; S483-H491 PolarHBondContact OG-CD2 2.88Å; S483-H491 VanDerWaalsContact OG-CD2 3.26Å; S483-H491 PolarHBondContact OG-CE1 3.22Å; S483-H491 VanDerWaalsContact OG-CE1 3.25Å; S483-H491 PolarHBondContact OG-NE2 3.3Å
484	S	51.5	Low	71.8	Confident	89 Å²	89	54.3 Å²	54.3	62%	0.622	31%	0.31	S	S	*	.	S	Bend	trans	-97.7	119.2	156.7	54.3	0	0	0	0	108.1
485	R	48.5	Very low	71.8	Confident	221 Å²	221	53.8 Å²	53.8	83%	0.834	31%	0.307	S	S	*	.	S	Bend	trans	80.6	117.1	175.9	-77.9	162.4	71.3	139.8	-3.4	117.9	D487	R485-D487 PolarHBondContact O-N 3.44Å; R485-D487 VanDerWaalsContact O-N 3.16Å
486	S	48.6	Very low	71.8	Confident	108 Å²	108	52.3 Å²	52.3	76%	0.755	30%	0.295	S	S	*	.	S	Bend	trans	67.7	-5.2	144.3	61.9	0	0	0	0	123.3	A488	S486-A488 PolarHBondContact O-N 2.89Å
487	D	52.9	Low	72.1	Confident	96 Å²	96	55.4 Å²	55.4	51%	0.513	31%	0.308	S	S	.	.			trans	-99.5	50.8	174.1	-70.5	-14.5	0	0	0	112.9	R485 V489 S490 H491	R485-D487 PolarHBondContact O-N 3.44Å; R485-D487 VanDerWaalsContact O-N 3.16Å; D487-V489 PolarHBondContact O-N 3.17Å; D487-S490 PolarHBondContact O-N 3.28Å; D487-S490 VanDerWaalsContact O-N 3.11Å; D487-H491 PolarHBondContact O-CD2 2.89Å; D487-H491 VanDerWaalsContact O-CD2 3.23Å
488	A	55.8	Low	72.3	Confident	62 Å²	62	55.4 Å²	55.4	51%	0.512	31%	0.308	S	S	.	.	H	α-helix	trans	-49.8	-36.3	-173.2	0	0	0	0	0	112.8	S486 W492	S486-A488 PolarHBondContact O-N 2.89Å; A488-W492 PolarHBondContact O-NE1 2.99Å
489	V	60.1	Low	72.5	Confident	91 Å²	91	54.2 Å²	54.2	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-68.3	-40.7	-175.8	-177.2	0	0	0	0	112.8	D487 H491 W492 T493	D487-V489 PolarHBondContact O-N 3.17Å; V489-H491 PolarHBondContact O-N 2.95Å; V489-W492 PolarHBondContact O-N 3.38Å; V489-T493 PolarHBondContact O-N 2.98Å
490	S	71.6	Confident	73	Confident	43 Å²	43	57.1 Å²	57.1	30%	0.301	31%	0.309	S	S	.	.	H	α-helix	trans	-72.8	-31.5	-169.5	-61.5	0	0	0	0	112.4	D487 W492 T493 L494	D487-S490 PolarHBondContact O-N 3.28Å; D487-S490 VanDerWaalsContact O-N 3.11Å; S490-W492 PolarHBondContact O-N 3.04Å; S490-T493 PolarHBondContact O-N 3.42Å; S490-T493 PolarHBondContact O-OG1 3.44Å; S490-L494 PolarHBondContact O-N 2.96Å
491	H	80.5	Confident	74	Confident	11 Å²	11	55.7 Å²	55.7	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-66.7	-36.6	177.4	-65	-71.7	0	0	0	113.7	L441 L482 S483 D487 V489 L494 R495	L441-H491 VanDerWaalsContact CD1-CE1 3.47Å; L441-H491 WeakPolarHBondContact CD1-CE1 3.33Å; L441-H491 WeakPolarHBondContact CD1-ND1 3.32Å; L441-H491 WeakPolarHBondContact CD2-CE1 3.41Å; L441-H491 WeakPolarHBondContact CD2-NE2 3.34Å; L482-H491 WeakPolarHBondContact CB-ND1 3.46Å; L482-H491 PolarHBondContact O-CE1 2.74Å; S483-H491 WeakPolarHBondContact CB-CE1 3.27Å; S483-H491 WeakPolarHBondContact CB-NE2 3.26Å; S483-H491 PolarHBondContact N-CE1 2.93Å; S483-H491 PolarHBondContact OG-CD2 2.88Å; S483-H491 VanDerWaalsContact OG-CD2 3.26Å; S483-H491 PolarHBondContact OG-CE1 3.22Å; S483-H491 VanDerWaalsContact OG-CE1 3.25Å; S483-H491 PolarHBondContact OG-NE2 3.3Å; D487-H491 PolarHBondContact O-CD2 2.89Å; D487-H491 VanDerWaalsContact O-CD2 3.23Å; V489-H491 PolarHBondContact O-N 2.95Å; H491-L494 PolarHBondContact O-N 3.24Å; H491-R495 WeakPolarHBondContact O-CG 3.35Å; H491-R495 PolarHBondContact O-N 3.31Å; H491-R495 VanDerWaalsContact O-N 3.11Å
492	W	84.3	Confident	75.2	Confident	16 Å²	16	49.1 Å²	49.1	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-45	175.5	-53.1	106.2	0	0	0	110.4	A488 V489 S490 L494 R495 E496 Q536 Y539 Q584	A488-W492 PolarHBondContact O-NE1 2.99Å; V489-W492 PolarHBondContact O-N 3.38Å; S490-W492 PolarHBondContact O-N 3.04Å; W492-L494 VanDerWaalsContact C-N 3.29Å; W492-L494 PolarHBondContact O-N 2.67Å; W492-R495 PolarHBondContact O-N 3.2Å; W492-R495 VanDerWaalsContact O-N 3.13Å; W492-E496 WeakPolarHBondContact O-CG 3.41Å; W492-E496 PolarHBondContact O-N 2.9Å; W492-Q536 HydrophobicContact CH2-CG 4.21Å; W492-Q536 HydrophobicContact CZ3-CB 4.49Å; W492-Y539 HydrophobicContact CB-CE1 4.32Å; W492-Y539 AromaticContact CE3-CD1 3.5Å; W492-Y539 HydrophobicContact CE3-CD1 3.5Å; W492-Y539 VanDerWaalsContact CE3-CD1 3.5Å; W492-Y539 AromaticContact CE3-CD2 3.7Å; W492-Y539 HydrophobicContact CE3-CD2 3.7Å; W492-Y539 AromaticContact CE3-CE1 3.72Å; W492-Y539 HydrophobicContact CE3-CE1 3.72Å; W492-Y539 AromaticContact CE3-CE2 3.86Å; W492-Y539 HydrophobicContact CE3-CE2 3.86Å; W492-Y539 AromaticContact CE3-CG 3.5Å; W492-Y539 HydrophobicContact CE3-CG 3.5Å; W492-Y539 AromaticContact CE3-CZ 3.91Å; W492-Y539 AromaticContact CZ3-CD1 3.91Å; W492-Y539 HydrophobicContact CZ3-CD1 3.91Å; W492-Y539 AromaticContact CZ3-CD2 3.64Å; W492-Y539 HydrophobicContact CZ3-CD2 3.64Å; W492-Y539 HydrophobicContact CZ3-CE2 4.22Å; W492-Y539 AromaticContact CZ3-CG 3.45Å; W492-Y539 HydrophobicContact CZ3-CG 3.45Å; W492-Y539 VanDerWaalsContact CZ3-CG 3.45Å; W492-Q584 HydrophobicContact CH2-CB 4.09Å; W492-Q584 HydrophobicContact CH2-CG 3.93Å; W492-Q584 HydrophobicContact CZ2-CB 4.37Å; W492-Q584 HydrophobicContact CZ2-CG 3.82Å
493	T	88.6	Confident	76.6	Confident	71 Å²	71	49.3 Å²	49.3	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-62.5	-35.7	178.8	64.5	0	0	0	0	112.7	V489 S490 E496 F497	V489-T493 PolarHBondContact O-N 2.98Å; S490-T493 PolarHBondContact O-N 3.42Å; S490-T493 PolarHBondContact O-OG1 3.44Å; T493-E496 PolarHBondContact O-N 2.93Å; T493-F497 WeakPolarHBondContact O-CB 3.42Å; T493-F497 PolarHBondContact O-N 3.09Å
494	L	88.8	Confident	78	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-66.5	-41.9	174.4	177.9	61.4	0	0	0	111.8	L441 L444 I445 M448 L482 S490 H491 W492 F497 S498	L441-L494 HydrophobicContact CD1-CB 4.23Å; L441-L494 HydrophobicContact CD1-CD2 3.44Å; L441-L494 VanDerWaalsContact CD1-CD2 3.44Å; L441-L494 HydrophobicContact CD1-CG 4.46Å; L444-L494 HydrophobicContact CB-CD2 3.75Å; L444-L494 HydrophobicContact CD1-CD2 4.38Å; I445-L494 HydrophobicContact CG1-CB 4.39Å; I445-L494 HydrophobicContact CG1-CD1 4Å; I445-L494 HydrophobicContact CG1-CD2 4.46Å; M448-L494 HydrophobicContact CB-CD1 4.21Å; M448-L494 HydrophobicContact CG-CD1 3.78Å; L482-L494 HydrophobicContact CD2-CD2 3.66Å; S490-L494 PolarHBondContact O-N 2.96Å; H491-L494 PolarHBondContact O-N 3.24Å; W492-L494 VanDerWaalsContact C-N 3.29Å; W492-L494 PolarHBondContact O-N 2.67Å; L494-F497 PolarHBondContact O-N 3.02Å; L494-S498 WeakPolarHBondContact O-CB 3.4Å; L494-S498 PolarHBondContact O-N 3.38Å; L494-S498 PolarHBondContact O-OG 2.87Å
495	R	89.2	Confident	79.8	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-42.9	176.2	-70	179.5	-165.2	-100.7	3.5	111.1	I477 C479 H491 W492 S498 G499 Q536	I477-R495 PolarHBondContact O-NH1 3.39Å; C479-R495 PolarHBondContact O-NH1 3.28Å; C479-R495 PolarHBondContact O-NH2 3.31Å; H491-R495 WeakPolarHBondContact O-CG 3.35Å; H491-R495 PolarHBondContact O-N 3.31Å; H491-R495 VanDerWaalsContact O-N 3.11Å; W492-R495 PolarHBondContact O-N 3.2Å; W492-R495 VanDerWaalsContact O-N 3.13Å; R495-S498 PolarHBondContact O-N 2.59Å; R495-G499 PolarHBondContact O-N 3.05Å; R495-Q536 VanDerWaalsContact CZ-CB 3.46Å; R495-Q536 PolarHBondContact NH1-O 3.12Å; R495-Q536 VanDerWaalsContact NH1-O 3.08Å
496	E	90.2	Very high	81.6	Confident	24 Å²	24	38.1 Å²	38.1	11%	0.112	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-46.6	175.3	-69	176.7	-164.3	0	0	112	W492 T493 S498 G499 R500 Y539 Y543	W492-E496 WeakPolarHBondContact O-CG 3.41Å; W492-E496 PolarHBondContact O-N 2.9Å; T493-E496 PolarHBondContact O-N 2.93Å; E496-S498 VanDerWaalsContact C-N 3.34Å; E496-S498 PolarHBondContact O-N 3.08Å; E496-G499 PolarHBondContact O-N 3.15Å; E496-R500 WeakPolarHBondContact O-CG 3.31Å; E496-R500 PolarHBondContact O-N 3.25Å; E496-R500 IonicContact OE2-NH2 2.73Å; E496-R500 PolarHBondContact OE2-NH2 3.26Å; E496-Y539 HydrophobicContact CG-CE1 4.17Å; E496-Y539 PolarHBondContact OE1-OH 3.39Å; E496-Y543 HydrophobicContact CB-CD1 4.25Å; E496-Y543 HydrophobicContact CB-CE1 3.84Å; E496-Y543 HydrophobicContact CB-CE2 4.26Å; E496-Y543 HydrophobicContact CG-CD1 4.2Å; E496-Y543 HydrophobicContact CG-CD2 3.88Å; E496-Y543 HydrophobicContact CG-CE1 4.09Å; E496-Y543 HydrophobicContact CG-CE2 3.73Å; E496-Y543 HydrophobicContact CG-CG 4.13Å; E496-Y543 WeakPolarHBondContact O-CE1 3.46Å
497	F	91.6	Very high	83.3	Confident	65 Å²	65	38.8 Å²	38.8	29%	0.285	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-43.4	177.8	-176.7	-96.3	0	0	0	111.7	M448 R449 A452 T493 L494 R500 L501	M448-F497 HydrophobicContact CB-CD1 3.79Å; M448-F497 HydrophobicContact CB-CE1 3.72Å; R449-F497 HydrophobicContact CG-CE1 4.35Å; R449-F497 HydrophobicContact CG-CZ 4.12Å; A452-F497 HydrophobicContact CB-CE1 4.39Å; A452-F497 HydrophobicContact CB-CZ 3.88Å; T493-F497 WeakPolarHBondContact O-CB 3.42Å; T493-F497 PolarHBondContact O-N 3.09Å; L494-F497 PolarHBondContact O-N 3.02Å; F497-R500 PolarHBondContact O-N 3.19Å; F497-L501 WeakPolarHBondContact O-CB 3.35Å; F497-L501 PolarHBondContact O-N 3Å
498	S	91.8	Very high	84.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-39.2	177.7	-54.1	0	0	0	0	111.7	V473 L494 R495 E496 L501 L502	V473-S498 WeakPolarHBondContact CG1-O 3.09Å; L494-S498 WeakPolarHBondContact O-CB 3.4Å; L494-S498 PolarHBondContact O-N 3.38Å; L494-S498 PolarHBondContact O-OG 2.87Å; R495-S498 PolarHBondContact O-N 2.59Å; E496-S498 VanDerWaalsContact C-N 3.34Å; E496-S498 PolarHBondContact O-N 3.08Å; S498-L501 PolarHBondContact O-N 3.27Å; S498-L502 WeakPolarHBondContact O-CB 2.8Å; S498-L502 PolarHBondContact O-N 3.05Å
499	G	90.5	Very high	85.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-46.3	174.4	0	0	0	0	0	112.3	R495 E496 L501 L502 V503 T544	R495-G499 PolarHBondContact O-N 3.05Å; E496-G499 PolarHBondContact O-N 3.15Å; G499-L501 VanDerWaalsContact C-N 3.35Å; G499-L501 PolarHBondContact O-N 2.7Å; G499-L502 PolarHBondContact O-N 2.93Å; G499-V503 PolarHBondContact O-N 3.05Å; G499-V503 VanDerWaalsContact O-N 3.11Å; G499-T544 WeakPolarHBondContact CA-OG1 3.17Å
500	R	92.5	Very high	86.4	Confident	89 Å²	89	37.5 Å²	37.5	34%	0.336	17%	0.172	S	C	.	.	H	α-helix	trans	-61.8	-42.4	174.3	-68.2	-179.5	-150.5	135.7	11.8	112	E496 F497 L502 V503 K504 Y543 E547	E496-R500 WeakPolarHBondContact O-CG 3.31Å; E496-R500 PolarHBondContact O-N 3.25Å; E496-R500 IonicContact OE2-NH2 2.73Å; E496-R500 PolarHBondContact OE2-NH2 3.26Å; F497-R500 PolarHBondContact O-N 3.19Å; R500-L502 VanDerWaalsContact C-N 3.35Å; R500-V503 PolarHBondContact O-N 3.04Å; R500-K504 WeakPolarHBondContact O-CB 3.42Å; R500-K504 PolarHBondContact O-N 3.42Å; R500-Y543 HydrophobicContact CG-CE1 4.14Å; R500-Y543 PolarHBondContact NE-OH 3.4Å; R500-Y543 PolarHBondContact NH2-OH 3.35Å; R500-Y543 VanDerWaalsContact NH2-OH 3.15Å; R500-E547 HydrophobicContact CG-CG 4.43Å
501	L	91.9	Very high	86.2	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-42.2	177.5	178.8	59.5	0	0	0	111.5	M448 A451 A452 V455 V473 F497 S498 G499 V503 K504 L505	M448-L501 HydrophobicContact SD-CD2 4.41Å; A451-L501 HydrophobicContact CB-CD2 3.82Å; A452-L501 HydrophobicContact CB-CD1 3.85Å; A452-L501 HydrophobicContact CB-CD2 4.48Å; V455-L501 HydrophobicContact CB-CD1 4.43Å; V455-L501 HydrophobicContact CG2-CD1 4.42Å; V473-L501 HydrophobicContact CG2-CD2 4.27Å; F497-L501 WeakPolarHBondContact O-CB 3.35Å; F497-L501 PolarHBondContact O-N 3Å; S498-L501 PolarHBondContact O-N 3.27Å; G499-L501 VanDerWaalsContact C-N 3.35Å; G499-L501 PolarHBondContact O-N 2.7Å; L501-V503 PolarHBondContact O-N 3.08Å; L501-K504 PolarHBondContact O-N 2.98Å; L501-L505 HydrophobicContact CG-CD1 4.34Å; L501-L505 WeakPolarHBondContact O-CB 3.48Å; L501-L505 WeakPolarHBondContact O-CG 3.4Å; L501-L505 PolarHBondContact O-N 3.28Å
502	L	90.7	Very high	85.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-43.3	177.3	-173	71.2	0	0	0	111.6	I470 V473 M474 I477 S498 G499 R500 L505 C506 L520 T544	I470-L502 HydrophobicContact CG2-CD1 4.19Å; V473-L502 HydrophobicContact CG1-CB 4.09Å; V473-L502 HydrophobicContact CG1-CD1 4.36Å; M474-L502 HydrophobicContact CG-CD1 4.38Å; M474-L502 HydrophobicContact CG-CD2 4.37Å; M474-L502 HydrophobicContact SD-CD1 4.44Å; M474-L502 HydrophobicContact SD-CD2 3.41Å; M474-L502 WeakPolarHBondContact SD-CD2 3.46Å; I477-L502 HydrophobicContact CD1-CB 4.21Å; I477-L502 HydrophobicContact CD1-CD2 4.03Å; S498-L502 WeakPolarHBondContact O-CB 2.8Å; S498-L502 PolarHBondContact O-N 3.05Å; G499-L502 PolarHBondContact O-N 2.93Å; R500-L502 VanDerWaalsContact C-N 3.35Å; L502-L505 WeakPolarHBondContact O-CB 3.43Å; L502-L505 PolarHBondContact O-N 3.11Å; L502-C506 PolarHBondContact O-N 3.23Å; L502-C506 PolarHBondContact O-SG 3.15Å; L502-L520 HydrophobicContact CD1-CD1 4.21Å; L502-L520 HydrophobicContact CD2-CD1 4.49Å; L502-L520 HydrophobicContact CG-CD1 4.43Å; L502-T544 HydrophobicContact CD2-CG2 3.66Å
503	V	89.4	Confident	84.5	Confident	6 Å²	6	48.3 Å²	48.3	4%	0.036	23%	0.23	C	C	.	.	H	α-helix	trans	-66.9	-39.5	176.9	173.3	0	0	0	0	111.3	G499 R500 L501 L505 C506 K507 E547 F548	G499-V503 PolarHBondContact O-N 3.05Å; G499-V503 VanDerWaalsContact O-N 3.11Å; R500-V503 PolarHBondContact O-N 3.04Å; L501-V503 PolarHBondContact O-N 3.08Å; V503-L505 VanDerWaalsContact C-N 3.35Å; V503-L505 PolarHBondContact O-N 3.44Å; V503-C506 PolarHBondContact O-N 2.99Å; V503-K507 HydrophobicContact CG1-CD 4.18Å; V503-K507 HydrophobicContact CG1-CG 4.43Å; V503-K507 WeakPolarHBondContact O-CG 3.42Å; V503-K507 PolarHBondContact O-N 3.23Å; V503-E547 HydrophobicContact CB-CB 4.32Å; V503-E547 WeakPolarHBondContact CG1-O 3.38Å; V503-E547 HydrophobicContact CG2-CB 3.65Å; V503-F548 HydrophobicContact CG2-CD1 4.15Å; V503-F548 HydrophobicContact CG2-CD2 3.96Å; V503-F548 HydrophobicContact CG2-CE1 4.25Å; V503-F548 HydrophobicContact CG2-CE2 4.08Å; V503-F548 HydrophobicContact CG2-CG 4Å; V503-F548 HydrophobicContact CG2-CZ 4.22Å
504	K	89.7	Confident	83.3	Confident	100 Å²	100	50.5 Å²	50.5	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-60.4	-44.8	174.7	-167.4	175.9	-168.5	175.6	0	111.5	D456 R500 L501 K507 R508	D456-K504 WeakPolarHBondContact OD1-CE 3.48Å; D456-K504 IonicContact OD1-NZ 3.2Å; D456-K504 PolarHBondContact OD1-NZ 3.28Å; D456-K504 IonicContact OD2-NZ 2.85Å; D456-K504 PolarHBondContact OD2-NZ 2.94Å; R500-K504 WeakPolarHBondContact O-CB 3.42Å; R500-K504 PolarHBondContact O-N 3.42Å; L501-K504 PolarHBondContact O-N 2.98Å; K504-K507 PolarHBondContact O-N 3.07Å; K504-R508 WeakPolarHBondContact O-CB 3.41Å; K504-R508 PolarHBondContact O-N 3.45Å
505	L	88.9	Confident	82.7	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-55.7	-50.4	172	-85.6	166.6	0	0	0	111.3	V455 L466 L469 V473 L501 L502 V503 K507 R508 Y509	V455-L505 HydrophobicContact CB-CD2 4.26Å; V455-L505 HydrophobicContact CG1-CD2 3.88Å; V455-L505 HydrophobicContact CG1-CG 4.12Å; V455-L505 HydrophobicContact CG2-CD1 4.43Å; V455-L505 HydrophobicContact CG2-CD2 3.27Å; V455-L505 HydrophobicContact CG2-CG 3.83Å; L466-L505 HydrophobicContact CD2-CD2 4.05Å; L469-L505 HydrophobicContact CD2-CD1 4.19Å; L469-L505 HydrophobicContact CD2-CD2 4.01Å; V473-L505 HydrophobicContact CG2-CD1 4.3Å; L501-L505 HydrophobicContact CG-CD1 4.34Å; L501-L505 WeakPolarHBondContact O-CB 3.48Å; L501-L505 WeakPolarHBondContact O-CG 3.4Å; L501-L505 PolarHBondContact O-N 3.28Å; L502-L505 WeakPolarHBondContact O-CB 3.43Å; L502-L505 PolarHBondContact O-N 3.11Å; V503-L505 VanDerWaalsContact C-N 3.35Å; V503-L505 PolarHBondContact O-N 3.44Å; L505-K507 PolarHBondContact O-N 2.99Å; L505-R508 PolarHBondContact O-N 3.44Å; L505-Y509 HydrophobicContact CD2-CD2 4.19Å; L505-Y509 HydrophobicContact CD2-CE2 3.86Å; L505-Y509 VanDerWaalsContact O-CD2 3.27Å; L505-Y509 WeakPolarHBondContact O-CD2 3.38Å; L505-Y509 PolarHBondContact O-N 2.67Å; L505-Y509 VanDerWaalsContact O-N 3.09Å
506	C	85.5	Confident	82.2	Confident	9 Å²	9	56.9 Å²	56.9	6%	0.061	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-42.7	-179.3	-65.7	0	0	0	0	112.4	L502 V503 R508 Y509 K510 L520 F548	L502-C506 PolarHBondContact O-N 3.23Å; L502-C506 PolarHBondContact O-SG 3.15Å; V503-C506 PolarHBondContact O-N 2.99Å; C506-R508 VanDerWaalsContact C-N 3.34Å; C506-R508 PolarHBondContact O-N 3.42Å; C506-Y509 PolarHBondContact O-N 2.55Å; C506-K510 WeakPolarHBondContact O-CB 3.49Å; C506-K510 PolarHBondContact O-N 3.04Å; C506-L520 WeakPolarHBondContact SG-CD1 3.47Å; C506-F548 HydrophobicContact CB-CE1 3.78Å; C506-F548 HydrophobicContact CB-CZ 4.42Å
507	K	84.9	Confident	81.9	Confident	121 Å²	121	58.7 Å²	58.7	53%	0.526	29%	0.285	S	S	.	.	H	α-helix	trans	-63.5	-39.7	178	-74.2	178.9	-179.6	175.5	0	112	V503 K504 L505	V503-K507 HydrophobicContact CG1-CD 4.18Å; V503-K507 HydrophobicContact CG1-CG 4.43Å; V503-K507 WeakPolarHBondContact O-CG 3.42Å; V503-K507 PolarHBondContact O-N 3.23Å; K504-K507 PolarHBondContact O-N 3.07Å; L505-K507 PolarHBondContact O-N 2.99Å
508	R	82.9	Confident	81.5	Confident	84 Å²	84	59.8 Å²	59.8	32%	0.317	29%	0.294	S	S	.	.	H	α-helix	trans	-68.3	-39.1	179.6	-176.1	168	176.6	135.3	-1	112.8	V455 D456 N457 P458 K504 L505 C506	V455-R508 WeakPolarHBondContact O-CD 3.32Å; V455-R508 VanDerWaalsContact O-CZ 3.26Å; V455-R508 PolarHBondContact O-NH1 3.17Å; D456-R508 PolarHBondContact O-NH1 3.08Å; N457-R508 PolarHBondContact O-NH1 2.89Å; N457-R508 PolarHBondContact O-NH2 3.27Å; P458-R508 VanDerWaalsContact CA-NH2 3.26Å; P458-R508 PolarHBondContact O-NH2 3.26Å; K504-R508 WeakPolarHBondContact O-CB 3.41Å; K504-R508 PolarHBondContact O-N 3.45Å; L505-R508 PolarHBondContact O-N 3.44Å; C506-R508 VanDerWaalsContact C-N 3.34Å; C506-R508 PolarHBondContact O-N 3.42Å
509	Y	79.5	Confident	81.2	Confident	2 Å²	2	69.2 Å²	69.2	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-100.3	4.6	-174.6	-65.3	-73.8	0	0	0	114.8	A462 L466 L505 C506 T511 K512 V513	A462-Y509 WeakPolarHBondContact CA-OH 3.39Å; A462-Y509 WeakPolarHBondContact CB-OH 3.45Å; A462-Y509 PolarHBondContact N-OH 3.4Å; L466-Y509 HydrophobicContact CD1-CD1 3.91Å; L466-Y509 HydrophobicContact CD1-CD2 3.92Å; L466-Y509 HydrophobicContact CD1-CE1 4.47Å; L466-Y509 HydrophobicContact CD1-CE2 4.49Å; L466-Y509 HydrophobicContact CD1-CG 3.61Å; L466-Y509 HydrophobicContact CD2-CD2 3.59Å; L466-Y509 HydrophobicContact CD2-CE2 3.75Å; L466-Y509 HydrophobicContact CD2-CG 4.19Å; L466-Y509 HydrophobicContact CG-CD2 4.28Å; L466-Y509 HydrophobicContact CG-CE2 4.47Å; L466-Y509 HydrophobicContact CG-CG 4.42Å; L505-Y509 HydrophobicContact CD2-CD2 4.19Å; L505-Y509 HydrophobicContact CD2-CE2 3.86Å; L505-Y509 VanDerWaalsContact O-CD2 3.27Å; L505-Y509 WeakPolarHBondContact O-CD2 3.38Å; L505-Y509 PolarHBondContact O-N 2.67Å; L505-Y509 VanDerWaalsContact O-N 3.09Å; C506-Y509 PolarHBondContact O-N 2.55Å; Y509-T511 PolarHBondContact O-N 2.91Å; Y509-T511 VanDerWaalsContact O-N 3.15Å; Y509-K512 HydrophobicContact CD1-CD 4.3Å; Y509-K512 PolarHBondContact O-N 3.39Å; Y509-V513 PolarHBondContact O-N 3.46Å; Y509-V513 VanDerWaalsContact O-N 3.1Å
510	K	72.5	Confident	81	Confident	136 Å²	136	69.8 Å²	69.8	59%	0.591	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-36.5	179.6	-174	172.8	179.4	171.8	0	113.4	C506	C506-K510 WeakPolarHBondContact O-CB 3.49Å; C506-K510 PolarHBondContact O-N 3.04Å
511	T	66.3	Low	80.6	Confident	136 Å²	136	66.1 Å²	66.1	83%	0.834	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-27.4	-179.9	-42.9	0	0	0	0	112.9	Y509	Y509-T511 PolarHBondContact O-N 2.91Å; Y509-T511 VanDerWaalsContact O-N 3.15Å
512	K	63.9	Low	80.3	Confident	105 Å²	105	69.6 Å²	69.6	46%	0.457	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-31.6	-172.9	-67.6	-174.4	176.3	-179.5	0	112.8	D461 Y509	D461-K512 IonicContact OD1-NZ 2.8Å; D461-K512 PolarHBondContact OD1-NZ 3.14Å; D461-K512 IonicContact OD2-NZ 2.85Å; D461-K512 PolarHBondContact OD2-NZ 3.26Å; Y509-K512 HydrophobicContact CD1-CD 4.3Å; Y509-K512 PolarHBondContact O-N 3.39Å
513	V	64.4	Low	80.1	Confident	57 Å²	57	75.9 Å²	75.9	35%	0.345	36%	0.363	S	S	.	.	S	Bend	trans	-125.4	100.9	-179.6	-174	0	0	0	0	109.3	L466 Y509 L516	L466-V513 HydrophobicContact CD1-CG2 4.37Å; Y509-V513 PolarHBondContact O-N 3.46Å; Y509-V513 VanDerWaalsContact O-N 3.1Å; V513-L516 HydrophobicContact CB-CB 4.21Å; V513-L516 HydrophobicContact CG1-CB 3.96Å
514	V	64.3	Low	79.8	Confident	117 Å²	117	75.6 Å²	75.6	71%	0.709	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	140.7	169.1	-167.3	0	0	0	0	107.5	L516	V514-L516 PolarHBondContact O-N 2.98Å
515	D	75.6	Confident	79.4	Confident	109 Å²	109	71 Å²	71	58%	0.583	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	0.8	179.3	-44.9	-32.6	0	0	0	118.1	Q517 D518 R519	D515-Q517 PolarHBondContact O-N 3.47Å; D515-D518 PolarHBondContact O-N 3.33Å; D515-R519 WeakPolarHBondContact O-CB 3.44Å; D515-R519 PolarHBondContact O-N 3.21Å
516	L	79.4	Confident	79.1	Confident	28 Å²	28	74.9 Å²	74.9	15%	0.147	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-45.6	179.5	-173.2	68	0	0	0	112.2	I470 V513 V514 L520	I470-L516 HydrophobicContact CD1-CD1 3.67Å; I470-L516 HydrophobicContact CD1-CD2 3.9Å; I470-L516 HydrophobicContact CD1-CG 4.25Å; V513-L516 HydrophobicContact CB-CB 4.21Å; V513-L516 HydrophobicContact CG1-CB 3.96Å; V514-L516 PolarHBondContact O-N 2.98Å; L516-L520 HydrophobicContact CG-CD1 4.29Å; L516-L520 WeakPolarHBondContact O-CG 3.42Å; L516-L520 PolarHBondContact O-N 3.3Å; L516-L520 VanDerWaalsContact O-N 3.13Å
517	Q	83.5	Confident	78.8	Confident	61 Å²	61	76 Å²	76	29%	0.285	37%	0.371	S	S	.	.	H	α-helix	trans	-62.9	-45.9	179.1	179.1	174.2	-3.1	0	0	110.9	D515 R519 L520 L521 F548	D515-Q517 PolarHBondContact O-N 3.47Å; Q517-R519 PolarHBondContact O-N 3.3Å; Q517-L520 PolarHBondContact O-N 2.89Å; Q517-L521 HydrophobicContact CG-CD1 3.81Å; Q517-L521 HydrophobicContact CG-CG 4.33Å; Q517-L521 WeakPolarHBondContact O-CB 3.49Å; Q517-L521 WeakPolarHBondContact O-CG 3.24Å; Q517-L521 PolarHBondContact O-N 3.39Å; Q517-F548 HydrophobicContact CG-CD1 4Å; Q517-F548 HydrophobicContact CG-CE1 4.01Å
518	D	83.2	Confident	78.5	Confident	88 Å²	88	70.5 Å²	70.5	47%	0.471	35%	0.348	S	S	.	.	H	α-helix	trans	-66.5	-39.7	-178.4	-65	-36.6	0	0	0	111.7	D515 L520 L521 N522	D515-D518 PolarHBondContact O-N 3.33Å; D518-L520 PolarHBondContact O-N 2.88Å; D518-L521 PolarHBondContact O-N 2.84Å; D518-N522 WeakPolarHBondContact O-CB 3.45Å; D518-N522 PolarHBondContact O-N 3.45Å; D518-N522 PolarHBondContact O-ND2 3.38Å; D518-N522 VanDerWaalsContact O-ND2 3.14Å
519	R	86.1	Confident	78.1	Confident	198 Å²	198	73.4 Å²	73.4	75%	0.747	36%	0.363	S	S	*	.	H	α-helix	trans	-61.9	-43	175.2	-172.3	174.3	178	-178.6	-0.6	111.8	D515 Q517 Y523	D515-R519 WeakPolarHBondContact O-CB 3.44Å; D515-R519 PolarHBondContact O-N 3.21Å; Q517-R519 PolarHBondContact O-N 3.3Å; R519-Y523 WeakPolarHBondContact O-CB 3.32Å; R519-Y523 PolarHBondContact O-N 2.98Å
520	L	86	Confident	77.9	Confident	13 Å²	13	79.7 Å²	79.7	7%	0.068	39%	0.39	C	S	.	.	H	α-helix	trans	-68.4	-44.9	177.8	-73.9	170.9	0	0	0	112.1	I470 M474 L502 C506 L516 Q517 D518 N522 Y523 L524 F548	I470-L520 HydrophobicContact CG2-CD1 4.46Å; I470-L520 HydrophobicContact CG2-CD2 3.79Å; M474-L520 HydrophobicContact CE-CD2 4.38Å; M474-L520 HydrophobicContact CG-CD2 4.29Å; M474-L520 HydrophobicContact SD-CD2 4.21Å; L502-L520 HydrophobicContact CD1-CD1 4.21Å; L502-L520 HydrophobicContact CD2-CD1 4.49Å; L502-L520 HydrophobicContact CG-CD1 4.43Å; C506-L520 WeakPolarHBondContact SG-CD1 3.47Å; L516-L520 HydrophobicContact CG-CD1 4.29Å; L516-L520 WeakPolarHBondContact O-CG 3.42Å; L516-L520 PolarHBondContact O-N 3.3Å; L516-L520 VanDerWaalsContact O-N 3.13Å; Q517-L520 PolarHBondContact O-N 2.89Å; D518-L520 PolarHBondContact O-N 2.88Å; L520-N522 VanDerWaalsContact C-N 3.34Å; L520-N522 PolarHBondContact O-N 3.33Å; L520-Y523 PolarHBondContact O-N 3.07Å; L520-L524 WeakPolarHBondContact O-CB 3.2Å; L520-L524 WeakPolarHBondContact O-CG 3.34Å; L520-L524 PolarHBondContact O-N 3.11Å; L520-F548 HydrophobicContact CB-CZ 4.38Å; L520-F548 HydrophobicContact CD1-CZ 4.41Å
521	L	84.6	Confident	77.3	Confident	11 Å²	11	77 Å²	77	6%	0.058	39%	0.388	C	S	.	.	H	α-helix	trans	-64.3	-38.5	177	-73.8	175.9	0	0	0	112.1	Q517 D518 G525 I545 F548 A552	Q517-L521 HydrophobicContact CG-CD1 3.81Å; Q517-L521 HydrophobicContact CG-CG 4.33Å; Q517-L521 WeakPolarHBondContact O-CB 3.49Å; Q517-L521 WeakPolarHBondContact O-CG 3.24Å; Q517-L521 PolarHBondContact O-N 3.39Å; D518-L521 PolarHBondContact O-N 2.84Å; L521-G525 PolarHBondContact O-N 3.1Å; L521-I545 HydrophobicContact CD2-CG1 4.39Å; L521-F548 HydrophobicContact CD2-CB 4.16Å; L521-F548 HydrophobicContact CD2-CD2 3.65Å; L521-F548 HydrophobicContact CD2-CE2 4.17Å; L521-F548 HydrophobicContact CD2-CG 3.92Å; L521-F548 HydrophobicContact CG-CD2 4.45Å; L521-A552 HydrophobicContact CD1-CB 3.92Å; L521-A552 HydrophobicContact CD2-CB 3.76Å
522	N	86.1	Confident	77.4	Confident	80 Å²	80	77.5 Å²	77.5	43%	0.428	39%	0.386	S	S	.	.	H	α-helix	trans	-66.8	-41.9	174.7	-74.6	-28.8	0	0	0	111.5	D518 L520 G525 T526 K556	D518-N522 WeakPolarHBondContact O-CB 3.45Å; D518-N522 PolarHBondContact O-N 3.45Å; D518-N522 PolarHBondContact O-ND2 3.38Å; D518-N522 VanDerWaalsContact O-ND2 3.14Å; L520-N522 VanDerWaalsContact C-N 3.34Å; L520-N522 PolarHBondContact O-N 3.33Å; N522-G525 PolarHBondContact O-N 3.36Å; N522-T526 WeakPolarHBondContact O-CB 3.46Å; N522-T526 PolarHBondContact O-N 2.73Å; N522-T526 PolarHBondContact O-OG1 3.32Å; N522-K556 WeakPolarHBondContact OD1-CE 3.48Å; N522-K556 PolarHBondContact OD1-NZ 2.9Å
523	Y	85.9	Confident	77.8	Confident	132 Å²	132	74.1 Å²	74.1	52%	0.518	37%	0.373	S	S	.	.	H	α-helix	trans	-63.7	-49.2	176.1	-178.4	-101.9	0	0	0	112	M474 L478 R519 L520 G525 T526 L527	M474-Y523 HydrophobicContact CE-CD1 3.48Å; M474-Y523 VanDerWaalsContact CE-CD1 3.48Å; M474-Y523 HydrophobicContact CE-CE1 3.67Å; L478-Y523 HydrophobicContact CD1-CE1 3.68Å; R519-Y523 WeakPolarHBondContact O-CB 3.32Å; R519-Y523 PolarHBondContact O-N 2.98Å; L520-Y523 PolarHBondContact O-N 3.07Å; Y523-G525 PolarHBondContact O-N 3.41Å; Y523-T526 PolarHBondContact O-N 3.49Å; Y523-L527 HydrophobicContact CD1-CD1 3.68Å; Y523-L527 HydrophobicContact CE1-CD1 3.22Å; Y523-L527 HydrophobicContact CE2-CD1 4.26Å; Y523-L527 HydrophobicContact CG-CD1 4.38Å; Y523-L527 PolarHBondContact O-N 2.89Å
524	L	83.6	Confident	78.5	Confident	0 Å²	0	78 Å²	78	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-62	-42.2	176.9	-71.7	171.6	0	0	0	111.9	M474 L478 L520 L527 L528 A541 T544 I545 F548	M474-L524 HydrophobicContact CE-CD2 3.71Å; M474-L524 HydrophobicContact CE-CG 4.06Å; M474-L524 HydrophobicContact SD-CD2 4.47Å; L478-L524 HydrophobicContact CD2-CD2 4.21Å; L520-L524 WeakPolarHBondContact O-CB 3.2Å; L520-L524 WeakPolarHBondContact O-CG 3.34Å; L520-L524 PolarHBondContact O-N 3.11Å; L524-L527 WeakPolarHBondContact O-CB 3.43Å; L524-L527 PolarHBondContact O-N 3.27Å; L524-L528 PolarHBondContact O-N 2.86Å; L524-A541 HydrophobicContact CD2-CB 4.04Å; L524-T544 HydrophobicContact CD1-CG2 3.92Å; L524-I545 HydrophobicContact CB-CD1 3.96Å; L524-I545 HydrophobicContact CB-CG1 4.05Å; L524-I545 HydrophobicContact CD1-CG1 4.07Å; L524-F548 HydrophobicContact CD1-CE2 4.27Å
525	G	80.5	Confident	79.2	Confident	4 Å²	4	72.6 Å²	72.6	4%	0.041	35%	0.35	C	S	.	.	H	α-helix	trans	-65.2	-37.6	176.3	0	0	0	0	0	113.1	L521 N522 Y523 L527 L528 K529	L521-G525 PolarHBondContact O-N 3.1Å; N522-G525 PolarHBondContact O-N 3.36Å; Y523-G525 PolarHBondContact O-N 3.41Å; G525-L527 VanDerWaalsContact C-N 3.33Å; G525-L528 PolarHBondContact O-N 2.87Å; G525-K529 PolarHBondContact O-N 2.95Å
526	T	83	Confident	79.5	Confident	81 Å²	81	69.2 Å²	69.2	50%	0.497	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-34.8	175.4	-50.6	0	0	0	0	111.3	N522 Y523	N522-T526 WeakPolarHBondContact O-CB 3.46Å; N522-T526 PolarHBondContact O-N 2.73Å; N522-T526 PolarHBondContact O-OG1 3.32Å; Y523-T526 PolarHBondContact O-N 3.49Å
527	L	79.6	Confident	79.7	Confident	32 Å²	32	68.1 Å²	68.1	17%	0.168	33%	0.325	C	S	.	.	H	α-helix	trans	-60.9	-49.9	170.4	-100	139.4	0	0	0	110.7	L478 Y523 L524 G525 K529 K530 I533	L478-L527 HydrophobicContact CD1-CD1 3.58Å; L478-L527 HydrophobicContact CD2-CD1 4.32Å; Y523-L527 HydrophobicContact CD1-CD1 3.68Å; Y523-L527 HydrophobicContact CE1-CD1 3.22Å; Y523-L527 HydrophobicContact CE2-CD1 4.26Å; Y523-L527 HydrophobicContact CG-CD1 4.38Å; Y523-L527 PolarHBondContact O-N 2.89Å; L524-L527 WeakPolarHBondContact O-CB 3.43Å; L524-L527 PolarHBondContact O-N 3.27Å; G525-L527 VanDerWaalsContact C-N 3.33Å; L527-K529 PolarHBondContact O-N 2.95Å; L527-K529 VanDerWaalsContact O-N 3.08Å; L527-K530 PolarHBondContact O-N 2.9Å; L527-I533 HydrophobicContact CB-CD1 4.36Å; L527-I533 HydrophobicContact CD2-CD1 3.75Å; L527-I533 HydrophobicContact CD2-CG1 4.45Å; L527-I533 HydrophobicContact CG-CD1 4.49Å; L527-I533 WeakPolarHBondContact O-CD1 3.41Å
528	L	77.2	Confident	79.8	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-56.8	-30.6	-178.2	-71.8	176.2	0	0	0	114.2	L524 G525 I538 A541 I542 I545 F564	L524-L528 PolarHBondContact O-N 2.86Å; G525-L528 PolarHBondContact O-N 2.87Å; L528-I538 HydrophobicContact CD2-CG2 4.36Å; L528-A541 HydrophobicContact CD2-CB 4.02Å; L528-A541 HydrophobicContact CG-CB 4.45Å; L528-I542 HydrophobicContact CD2-CD1 4.4Å; L528-I542 HydrophobicContact CD2-CG1 3.79Å; L528-I545 HydrophobicContact CD1-CD1 3.39Å; L528-I545 HydrophobicContact CG-CD1 4.32Å; L528-F564 HydrophobicContact CB-CE2 4.22Å; L528-F564 HydrophobicContact CB-CZ 4.29Å; L528-F564 HydrophobicContact CD2-CE2 4.04Å; L528-F564 HydrophobicContact CD2-CZ 3.72Å
529	K	75.3	Confident	79.9	Confident	146 Å²	146	62.1 Å²	62.1	64%	0.635	29%	0.294	S	S	*	.	H	α-helix	trans	-74.4	-22.5	179.5	-68.5	-176.3	178.3	-167	0	114.2	G525 L527	G525-K529 PolarHBondContact O-N 2.95Å; L527-K529 PolarHBondContact O-N 2.95Å; L527-K529 VanDerWaalsContact O-N 3.08Å
530	K	74.8	Confident	79.9	Confident	133 Å²	133	52.7 Å²	52.7	58%	0.578	26%	0.258	S	S	*	.			trans	-75.3	137.1	-178.3	-68.9	-179.6	178.2	-173.7	0	110.7	L527 I533 R567	L527-K530 PolarHBondContact O-N 2.9Å; K530-I533 HydrophobicContact CB-CD1 3.67Å; K530-I533 HydrophobicContact CB-CG1 4.22Å; K530-R567 PolarHBondContact O-NH1 3.43Å
531	S	60.8	Low	80	Confident	79 Å²	79	52.1 Å²	52.1	55%	0.552	26%	0.256	S	S	*	.	S	Bend	trans	-72.4	-27.9	-178.5	48.2	0	0	0	0	114.1	I533	S531-I533 PolarHBondContact O-N 2.94Å
532	D	66.9	Low	80.1	Confident	147 Å²	147	51.7 Å²	51.7	79%	0.786	25%	0.254	S	S	*	.	S	Bend	trans	-97.4	28.1	-161.4	-52.1	-15.8	0	0	0	113.7
533	I	73.6	Confident	80.2	Confident	35 Å²	35	48.4 Å²	48.4	18%	0.179	24%	0.235	C	C	.	.			trans	-103.1	139.2	-171.9	-62.1	162.1	0	0	0	111.5	L527 K530 S531 I538	L527-I533 HydrophobicContact CB-CD1 4.36Å; L527-I533 HydrophobicContact CD2-CD1 3.75Å; L527-I533 HydrophobicContact CD2-CG1 4.45Å; L527-I533 HydrophobicContact CG-CD1 4.49Å; L527-I533 WeakPolarHBondContact O-CD1 3.41Å; K530-I533 HydrophobicContact CB-CD1 3.67Å; K530-I533 HydrophobicContact CB-CG1 4.22Å; S531-I533 PolarHBondContact O-N 2.94Å; I533-I538 HydrophobicContact CB-CG1 4.4Å; I533-I538 HydrophobicContact CG2-CG1 4.08Å
534	Y	78.6	Confident	80.3	Confident	137 Å²	137	42.1 Å²	42.1	54%	0.537	21%	0.211	S	C	.	.			trans	-56.8	135.2	173.4	-59	-86.7	0	0	0	112	Q536 S537 I538	Y534-Q536 PolarHBondContact O-N 3.18Å; Y534-S537 WeakPolarHBondContact O-CB 3.36Å; Y534-S537 PolarHBondContact O-N 3.46Å; Y534-I538 PolarHBondContact O-N 3.38Å
535	S	78.7	Confident	80.4	Confident	5 Å²	5	42.1 Å²	42.1	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-53.1	-31	179.9	-49.7	0	0	0	0	113.5	I538 Y539 H581 V588	S535-I538 PolarHBondContact O-N 2.67Å; S535-Y539 PolarHBondContact O-N 3.36Å; S535-H581 PolarHBondContact OG-CE1 2.9Å; S535-H581 PolarHBondContact OG-ND1 3.02Å; S535-V588 WeakPolarHBondContact O-CG2 3.47Å
536	Q	82.1	Confident	80.7	Confident	38 Å²	38	43.1 Å²	43.1	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-70.2	-35.6	178.4	-48.5	177.6	9.3	0	0	112.8	S480 W492 R495 Y534 Y539 G540	S480-Q536 PolarHBondContact O-OE1 3.05Å; W492-Q536 HydrophobicContact CH2-CG 4.21Å; W492-Q536 HydrophobicContact CZ3-CB 4.49Å; R495-Q536 VanDerWaalsContact CZ-CB 3.46Å; R495-Q536 PolarHBondContact NH1-O 3.12Å; R495-Q536 VanDerWaalsContact NH1-O 3.08Å; Y534-Q536 PolarHBondContact O-N 3.18Å; Q536-Y539 WeakPolarHBondContact O-CB 3.38Å; Q536-Y539 PolarHBondContact O-N 3.47Å; Q536-G540 PolarHBondContact O-N 2.93Å; Q536-G540 VanDerWaalsContact O-N 3.15Å
537	S	84.2	Confident	80.8	Confident	5 Å²	5	42.4 Å²	42.4	4%	0.035	21%	0.21	C	C	.	.	H	α-helix	trans	-71.8	-36	176.8	-51.2	0	0	0	0	110.9	L478 Y534 G540 A541	L478-S537 WeakPolarHBondContact O-CB 3.44Å; L478-S537 PolarHBondContact O-OG 3.47Å; Y534-S537 WeakPolarHBondContact O-CB 3.36Å; Y534-S537 PolarHBondContact O-N 3.46Å; S537-G540 PolarHBondContact O-N 2.72Å; S537-A541 WeakPolarHBondContact O-CB 3.49Å; S537-A541 PolarHBondContact O-N 3.17Å
538	I	84.9	Confident	81	Confident	12 Å²	12	41.9 Å²	41.9	6%	0.062	21%	0.206	C	C	.	.	H	α-helix	trans	-60.6	-47.7	172.4	-66.8	164.5	0	0	0	110	L528 I533 Y534 S535 G540 A541 I542 F564 V588	L528-I538 HydrophobicContact CD2-CG2 4.36Å; I533-I538 HydrophobicContact CB-CG1 4.4Å; I533-I538 HydrophobicContact CG2-CG1 4.08Å; Y534-I538 PolarHBondContact O-N 3.38Å; S535-I538 PolarHBondContact O-N 2.67Å; I538-G540 VanDerWaalsContact C-N 3.35Å; I538-G540 PolarHBondContact O-N 3.15Å; I538-A541 PolarHBondContact O-N 3.13Å; I538-I542 HydrophobicContact CG2-CD1 3.59Å; I538-I542 HydrophobicContact CG2-CG1 4.28Å; I538-I542 VanDerWaalsContact O-CG1 3.32Å; I538-I542 WeakPolarHBondContact O-CG1 3.43Å; I538-I542 PolarHBondContact O-N 3.11Å; I538-F564 HydrophobicContact CD1-CE1 4.19Å; I538-F564 HydrophobicContact CG1-CE1 4.45Å; I538-F564 HydrophobicContact CG2-CD1 4.46Å; I538-F564 HydrophobicContact CG2-CE1 3.54Å; I538-F564 HydrophobicContact CG2-CZ 3.9Å; I538-V588 HydrophobicContact CG2-CG1 3.91Å
539	Y	86.5	Confident	81.2	Confident	10 Å²	10	42.4 Å²	42.4	4%	0.039	21%	0.213	C	C	.	.	H	α-helix	trans	-53.5	-51	175	-178.3	-85.2	0	0	0	112.3	W492 E496 S535 Q536 A541 I542 Y543 R587 V588 V591	W492-Y539 HydrophobicContact CB-CE1 4.32Å; W492-Y539 AromaticContact CE3-CD1 3.5Å; W492-Y539 HydrophobicContact CE3-CD1 3.5Å; W492-Y539 VanDerWaalsContact CE3-CD1 3.5Å; W492-Y539 AromaticContact CE3-CD2 3.7Å; W492-Y539 HydrophobicContact CE3-CD2 3.7Å; W492-Y539 AromaticContact CE3-CE1 3.72Å; W492-Y539 HydrophobicContact CE3-CE1 3.72Å; W492-Y539 AromaticContact CE3-CE2 3.86Å; W492-Y539 HydrophobicContact CE3-CE2 3.86Å; W492-Y539 AromaticContact CE3-CG 3.5Å; W492-Y539 HydrophobicContact CE3-CG 3.5Å; W492-Y539 AromaticContact CE3-CZ 3.91Å; W492-Y539 AromaticContact CZ3-CD1 3.91Å; W492-Y539 HydrophobicContact CZ3-CD1 3.91Å; W492-Y539 AromaticContact CZ3-CD2 3.64Å; W492-Y539 HydrophobicContact CZ3-CD2 3.64Å; W492-Y539 HydrophobicContact CZ3-CE2 4.22Å; W492-Y539 AromaticContact CZ3-CG 3.45Å; W492-Y539 HydrophobicContact CZ3-CG 3.45Å; W492-Y539 VanDerWaalsContact CZ3-CG 3.45Å; E496-Y539 HydrophobicContact CG-CE1 4.17Å; E496-Y539 PolarHBondContact OE1-OH 3.39Å; S535-Y539 PolarHBondContact O-N 3.36Å; Q536-Y539 WeakPolarHBondContact O-CB 3.38Å; Q536-Y539 PolarHBondContact O-N 3.47Å; Y539-A541 VanDerWaalsContact C-N 3.33Å; Y539-A541 PolarHBondContact O-N 3.47Å; Y539-I542 PolarHBondContact O-N 3.23Å; Y539-Y543 WeakPolarHBondContact O-CB 3.42Å; Y539-Y543 PolarHBondContact O-N 3.36Å; Y539-R587 HydrophobicContact CE2-CB 4.42Å; Y539-V588 HydrophobicContact CD2-CG2 4.31Å; Y539-V591 HydrophobicContact CD2-CB 4.29Å; Y539-V591 HydrophobicContact CD2-CG2 3.93Å; Y539-V591 HydrophobicContact CE2-CB 4Å; Y539-V591 HydrophobicContact CE2-CG2 3.17Å
540	G	85.8	Confident	81.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-40.9	-179.3	0	0	0	0	0	112.5	I477 Q536 S537 I538 T544	I477-G540 WeakPolarHBondContact CG2-O 3.43Å; Q536-G540 PolarHBondContact O-N 2.93Å; Q536-G540 VanDerWaalsContact O-N 3.15Å; S537-G540 PolarHBondContact O-N 2.72Å; I538-G540 VanDerWaalsContact C-N 3.35Å; I538-G540 PolarHBondContact O-N 3.15Å; G540-T544 WeakPolarHBondContact O-CB 3.43Å; G540-T544 PolarHBondContact O-N 2.86Å; G540-T544 PolarHBondContact O-OG1 3.43Å
541	A	87.6	Confident	81.4	Confident	2 Å²	2	37 Å²	37	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-65.8	-47.5	178.1	0	0	0	0	0	112.2	L478 L524 L528 S537 I538 Y539 T544 I545	L478-A541 HydrophobicContact CD2-CB 4.18Å; L524-A541 HydrophobicContact CD2-CB 4.04Å; L528-A541 HydrophobicContact CD2-CB 4.02Å; L528-A541 HydrophobicContact CG-CB 4.45Å; S537-A541 WeakPolarHBondContact O-CB 3.49Å; S537-A541 PolarHBondContact O-N 3.17Å; I538-A541 PolarHBondContact O-N 3.13Å; Y539-A541 VanDerWaalsContact C-N 3.33Å; Y539-A541 PolarHBondContact O-N 3.47Å; A541-T544 PolarHBondContact O-N 3.33Å; A541-I545 WeakPolarHBondContact O-CG1 3.29Å; A541-I545 PolarHBondContact O-N 3.08Å
542	I	86.6	Confident	82.3	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-62.8	-47	179.7	-66.8	174.2	0	0	0	110.6	L528 I538 Y539 T544 I545 A546 I557 V588 V591 I592	L528-I542 HydrophobicContact CD2-CD1 4.4Å; L528-I542 HydrophobicContact CD2-CG1 3.79Å; I538-I542 HydrophobicContact CG2-CD1 3.59Å; I538-I542 HydrophobicContact CG2-CG1 4.28Å; I538-I542 VanDerWaalsContact O-CG1 3.32Å; I538-I542 WeakPolarHBondContact O-CG1 3.43Å; I538-I542 PolarHBondContact O-N 3.11Å; Y539-I542 PolarHBondContact O-N 3.23Å; I542-T544 VanDerWaalsContact C-N 3.29Å; I542-T544 PolarHBondContact O-N 2.92Å; I542-I545 PolarHBondContact O-N 2.94Å; I542-A546 WeakPolarHBondContact O-CB 3.32Å; I542-A546 PolarHBondContact O-N 3.37Å; I542-I557 HydrophobicContact CG2-CD1 4.31Å; I542-V588 HydrophobicContact CD1-CG1 4.12Å; I542-V591 HydrophobicContact CG2-CG1 4.02Å; I542-I592 HydrophobicContact CD1-CD1 3.76Å; I542-I592 HydrophobicContact CD1-CG1 3.71Å; I542-I592 HydrophobicContact CG2-CG1 4.1Å
543	Y	88.3	Confident	83	Confident	11 Å²	11	26.6 Å²	26.6	4%	0.043	14%	0.137	C	C	.	.	H	α-helix	trans	-58.9	-43.1	177.4	-174.1	-86.5	0	0	0	111.4	E496 R500 Y539 A546 E547	E496-Y543 HydrophobicContact CB-CD1 4.25Å; E496-Y543 HydrophobicContact CB-CE1 3.84Å; E496-Y543 HydrophobicContact CB-CE2 4.26Å; E496-Y543 HydrophobicContact CG-CD1 4.2Å; E496-Y543 HydrophobicContact CG-CD2 3.88Å; E496-Y543 HydrophobicContact CG-CE1 4.09Å; E496-Y543 HydrophobicContact CG-CE2 3.73Å; E496-Y543 HydrophobicContact CG-CG 4.13Å; E496-Y543 WeakPolarHBondContact O-CE1 3.46Å; R500-Y543 HydrophobicContact CG-CE1 4.14Å; R500-Y543 PolarHBondContact NE-OH 3.4Å; R500-Y543 PolarHBondContact NH2-OH 3.35Å; R500-Y543 VanDerWaalsContact NH2-OH 3.15Å; Y539-Y543 WeakPolarHBondContact O-CB 3.42Å; Y539-Y543 PolarHBondContact O-N 3.36Å; Y543-A546 WeakPolarHBondContact O-CB 3.48Å; Y543-A546 PolarHBondContact O-N 3.29Å; Y543-E547 HydrophobicContact CD1-CG 4.16Å; Y543-E547 HydrophobicContact CE1-CG 3.65Å; Y543-E547 VanDerWaalsContact CZ-OE1 3.22Å; Y543-E547 WeakPolarHBondContact O-CG 3.37Å; Y543-E547 PolarHBondContact O-N 2.9Å; Y543-E547 PolarHBondContact OH-OE1 3.38Å
544	T	87	Confident	83.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-41	-180	-54.4	0	0	0	0	112.1	I477 G499 L502 L524 G540 A541 I542 A546 E547 F548	I477-T544 HydrophobicContact CD1-CG2 4.34Å; G499-T544 WeakPolarHBondContact CA-OG1 3.17Å; L502-T544 HydrophobicContact CD2-CG2 3.66Å; L524-T544 HydrophobicContact CD1-CG2 3.92Å; G540-T544 WeakPolarHBondContact O-CB 3.43Å; G540-T544 PolarHBondContact O-N 2.86Å; G540-T544 PolarHBondContact O-OG1 3.43Å; A541-T544 PolarHBondContact O-N 3.33Å; I542-T544 VanDerWaalsContact C-N 3.29Å; I542-T544 PolarHBondContact O-N 2.92Å; T544-A546 VanDerWaalsContact C-N 3.33Å; T544-E547 PolarHBondContact O-N 3.44Å; T544-F548 HydrophobicContact CG2-CD2 4.44Å; T544-F548 HydrophobicContact CG2-CE2 3.98Å; T544-F548 WeakPolarHBondContact O-CD2 3.43Å; T544-F548 PolarHBondContact O-N 3.25Å
545	I	86.6	Confident	83.3	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-39.7	175.6	-66.9	162.1	0	0	0	110.9	L521 L524 L528 A541 I542 E547 F548 A552 I557	L521-I545 HydrophobicContact CD2-CG1 4.39Å; L524-I545 HydrophobicContact CB-CD1 3.96Å; L524-I545 HydrophobicContact CB-CG1 4.05Å; L524-I545 HydrophobicContact CD1-CG1 4.07Å; L528-I545 HydrophobicContact CD1-CD1 3.39Å; L528-I545 HydrophobicContact CG-CD1 4.32Å; A541-I545 WeakPolarHBondContact O-CG1 3.29Å; A541-I545 PolarHBondContact O-N 3.08Å; I542-I545 PolarHBondContact O-N 2.94Å; I545-E547 VanDerWaalsContact C-N 3.28Å; I545-E547 PolarHBondContact O-N 2.99Å; I545-F548 WeakPolarHBondContact O-CB 3.45Å; I545-F548 PolarHBondContact O-N 2.7Å; I545-F548 VanDerWaalsContact O-N 3.16Å; I545-A552 HydrophobicContact CG2-CB 4.22Å; I545-I557 HydrophobicContact CB-CD1 4.09Å; I545-I557 HydrophobicContact CB-CG1 4.48Å; I545-I557 HydrophobicContact CG2-CD1 3.69Å; I545-I557 HydrophobicContact CG2-CG1 3.83Å
546	A	86.1	Confident	83.2	Confident	25 Å²	25	28.7 Å²	28.7	21%	0.207	16%	0.157	C	C	.	.	H	α-helix	trans	-60.8	-37.6	177.4	0	0	0	0	0	113	I542 Y543 T544 F548 V595	I542-A546 WeakPolarHBondContact O-CB 3.32Å; I542-A546 PolarHBondContact O-N 3.37Å; Y543-A546 WeakPolarHBondContact O-CB 3.48Å; Y543-A546 PolarHBondContact O-N 3.29Å; T544-A546 VanDerWaalsContact C-N 3.33Å; A546-F548 VanDerWaalsContact C-N 3.32Å; A546-F548 PolarHBondContact O-N 2.88Å; A546-V595 HydrophobicContact CB-CB 4.07Å; A546-V595 HydrophobicContact CB-CG1 3.52Å; A546-V595 HydrophobicContact CB-CG2 3.33Å
547	E	85.6	Confident	83	Confident	66 Å²	66	27.1 Å²	27.1	31%	0.308	15%	0.15	S	C	.	.	H	α-helix	trans	-71.4	-23.1	178.2	-69.3	-74.9	174.3	0	0	113	R500 V503 Y543 T544 I545 G549	R500-E547 HydrophobicContact CG-CG 4.43Å; V503-E547 HydrophobicContact CB-CB 4.32Å; V503-E547 WeakPolarHBondContact CG1-O 3.38Å; V503-E547 HydrophobicContact CG2-CB 3.65Å; Y543-E547 HydrophobicContact CD1-CG 4.16Å; Y543-E547 HydrophobicContact CE1-CG 3.65Å; Y543-E547 VanDerWaalsContact CZ-OE1 3.22Å; Y543-E547 WeakPolarHBondContact O-CG 3.37Å; Y543-E547 PolarHBondContact O-N 2.9Å; Y543-E547 PolarHBondContact OH-OE1 3.38Å; T544-E547 PolarHBondContact O-N 3.44Å; I545-E547 VanDerWaalsContact C-N 3.28Å; I545-E547 PolarHBondContact O-N 2.99Å; E547-G549 VanDerWaalsContact C-N 3.35Å; E547-G549 PolarHBondContact O-N 2.79Å
548	F	83.9	Confident	82.6	Confident	20 Å²	20	28.8 Å²	28.8	9%	0.088	16%	0.158	C	C	.	.	H	α-helix	trans	-67.4	-32.9	177.1	-86.9	-73.3	0	0	0	113	V503 C506 Q517 L520 L521 L524 T544 I545 A546 A552	V503-F548 HydrophobicContact CG2-CD1 4.15Å; V503-F548 HydrophobicContact CG2-CD2 3.96Å; V503-F548 HydrophobicContact CG2-CE1 4.25Å; V503-F548 HydrophobicContact CG2-CE2 4.08Å; V503-F548 HydrophobicContact CG2-CG 4Å; V503-F548 HydrophobicContact CG2-CZ 4.22Å; C506-F548 HydrophobicContact CB-CE1 3.78Å; C506-F548 HydrophobicContact CB-CZ 4.42Å; Q517-F548 HydrophobicContact CG-CD1 4Å; Q517-F548 HydrophobicContact CG-CE1 4.01Å; L520-F548 HydrophobicContact CB-CZ 4.38Å; L520-F548 HydrophobicContact CD1-CZ 4.41Å; L521-F548 HydrophobicContact CD2-CB 4.16Å; L521-F548 HydrophobicContact CD2-CD2 3.65Å; L521-F548 HydrophobicContact CD2-CE2 4.17Å; L521-F548 HydrophobicContact CD2-CG 3.92Å; L521-F548 HydrophobicContact CG-CD2 4.45Å; L524-F548 HydrophobicContact CD1-CE2 4.27Å; T544-F548 HydrophobicContact CG2-CD2 4.44Å; T544-F548 HydrophobicContact CG2-CE2 3.98Å; T544-F548 WeakPolarHBondContact O-CD2 3.43Å; T544-F548 PolarHBondContact O-N 3.25Å; I545-F548 WeakPolarHBondContact O-CB 3.45Å; I545-F548 PolarHBondContact O-N 2.7Å; I545-F548 VanDerWaalsContact O-N 3.16Å; A546-F548 VanDerWaalsContact C-N 3.32Å; A546-F548 PolarHBondContact O-N 2.88Å; F548-A552 HydrophobicContact CB-CB 3.86Å
549	G	81.4	Confident	82.1	Confident	17 Å²	17	32 Å²	32	18%	0.175	18%	0.18	C	C	.	.			trans	134.7	177.8	176	0	0	0	0	0	114.6	E547 D551 A552 V553	E547-G549 VanDerWaalsContact C-N 3.35Å; E547-G549 PolarHBondContact O-N 2.79Å; G549-D551 PolarHBondContact O-N 3.03Å; G549-A552 PolarHBondContact O-N 3.33Å; G549-V553 WeakPolarHBondContact O-CG2 3.42Å; G549-V553 PolarHBondContact O-N 3.28Å
550	V	77.7	Confident	81.4	Confident	35 Å²	35	31.8 Å²	31.8	21%	0.212	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-44.6	-174.1	-175.5	0	0	0	0	111.8	A552 V553 E554 Y599 F602 M665	V550-A552 VanDerWaalsContact C-N 3.3Å; V550-A552 PolarHBondContact O-N 3.35Å; V550-V553 WeakPolarHBondContact O-CB 3.33Å; V550-V553 PolarHBondContact O-N 3.3Å; V550-E554 PolarHBondContact O-N 3.39Å; V550-Y599 HydrophobicContact CB-CD2 4.41Å; V550-Y599 HydrophobicContact CB-CE2 4.43Å; V550-Y599 HydrophobicContact CG1-CD2 3.54Å; V550-Y599 HydrophobicContact CG1-CE2 3.31Å; V550-F602 HydrophobicContact CG2-CB 4.15Å; V550-M665 HydrophobicContact CG2-CE 3.6Å
551	D	77.4	Confident	80.5	Confident	130 Å²	130	32 Å²	32	70%	0.695	18%	0.181	S	C	*	.	H	α-helix	trans	-65.1	-32.4	-178.5	-50.7	-27.1	0	0	0	112.8	G549 S555	G549-D551 PolarHBondContact O-N 3.03Å; D551-S555 WeakPolarHBondContact O-CB 3.33Å; D551-S555 PolarHBondContact O-N 3.47Å; D551-S555 VanDerWaalsContact O-N 3.08Å; D551-S555 PolarHBondContact O-OG 3.47Å
552	A	79.4	Confident	79.6	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.033	21%	0.211	C	C	.	.	H	α-helix	trans	-72.8	-37	177.2	0	0	0	0	0	111.8	L521 I545 F548 G549 V550 S555 K556	L521-A552 HydrophobicContact CD1-CB 3.92Å; L521-A552 HydrophobicContact CD2-CB 3.76Å; I545-A552 HydrophobicContact CG2-CB 4.22Å; F548-A552 HydrophobicContact CB-CB 3.86Å; G549-A552 PolarHBondContact O-N 3.33Å; V550-A552 VanDerWaalsContact C-N 3.3Å; V550-A552 PolarHBondContact O-N 3.35Å; A552-S555 PolarHBondContact O-OG 2.97Å; A552-K556 PolarHBondContact O-N 3.34Å; A552-K556 VanDerWaalsContact O-N 3.16Å
553	V	80.5	Confident	78.7	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.03	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-44.9	174.3	174.9	0	0	0	0	110.1	G549 V550 I557 L558 V595 Y599	G549-V553 WeakPolarHBondContact O-CG2 3.42Å; G549-V553 PolarHBondContact O-N 3.28Å; V550-V553 WeakPolarHBondContact O-CB 3.33Å; V550-V553 PolarHBondContact O-N 3.3Å; V553-I557 HydrophobicContact CB-CD1 4.41Å; V553-I557 HydrophobicContact CG1-CB 4.15Å; V553-I557 HydrophobicContact CG1-CD1 4.17Å; V553-I557 HydrophobicContact CG2-CD1 4.13Å; V553-I557 WeakPolarHBondContact O-CA 3.33Å; V553-I557 WeakPolarHBondContact O-CB 3.44Å; V553-I557 PolarHBondContact O-N 2.92Å; V553-L558 PolarHBondContact O-N 2.97Å; V553-V595 HydrophobicContact CG1-CG1 4.35Å; V553-V595 HydrophobicContact CG2-CG1 4.16Å; V553-Y599 HydrophobicContact CB-CD2 4.1Å; V553-Y599 HydrophobicContact CG1-CD2 3.86Å; V553-Y599 HydrophobicContact CG1-CE2 4.44Å; V553-Y599 HydrophobicContact CG1-CG 4.25Å
554	E	78.1	Confident	77.7	Confident	100 Å²	100	42.3 Å²	42.3	47%	0.467	23%	0.232	S	C	.	.	H	α-helix	trans	-63.2	-44.5	180	-177.7	162.8	172.2	0	0	112.3	V550 L558 Y599	V550-E554 PolarHBondContact O-N 3.39Å; E554-L558 HydrophobicContact CB-CD1 4.06Å; E554-L558 HydrophobicContact CG-CD1 3.74Å; E554-Y599 HydrophobicContact CB-CE2 4.1Å; E554-Y599 PolarHBondContact OE2-OH 2.99Å
555	S	80	Confident	76.6	Confident	66 Å²	66	43 Å²	43	46%	0.462	24%	0.237	S	C	.	.	H	α-helix	trans	-75.2	-31.2	-177.1	58.9	0	0	0	0	114.8	D551 A552 P559	D551-S555 WeakPolarHBondContact O-CB 3.33Å; D551-S555 PolarHBondContact O-N 3.47Å; D551-S555 VanDerWaalsContact O-N 3.08Å; D551-S555 PolarHBondContact O-OG 3.47Å; A552-S555 PolarHBondContact O-OG 2.97Å; S555-P559 WeakPolarHBondContact O-CG 3.4Å
556	K	78.3	Confident	75.8	Confident	54 Å²	54	49.3 Å²	49.3	24%	0.235	27%	0.266	C	S	.	.	H	α-helix	trans	-116.5	-32.1	-171.4	-59.3	-55.9	-172.9	-171.8	0	115.3	N522 A552 C560	N522-K556 WeakPolarHBondContact OD1-CE 3.48Å; N522-K556 PolarHBondContact OD1-NZ 2.9Å; A552-K556 PolarHBondContact O-N 3.34Å; A552-K556 VanDerWaalsContact O-N 3.16Å; K556-C560 PolarHBondContact O-SG 3.46Å; K556-C560 VanDerWaalsContact O-SG 3.38Å
557	I	77.6	Confident	74.9	Confident	6 Å²	6	51.5 Å²	51.5	3%	0.031	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-46.2	-175.5	-60.1	-177.1	0	0	0	111	I542 I545 V553 C560 L561 V595	I542-I557 HydrophobicContact CG2-CD1 4.31Å; I545-I557 HydrophobicContact CB-CD1 4.09Å; I545-I557 HydrophobicContact CB-CG1 4.48Å; I545-I557 HydrophobicContact CG2-CD1 3.69Å; I545-I557 HydrophobicContact CG2-CG1 3.83Å; V553-I557 HydrophobicContact CB-CD1 4.41Å; V553-I557 HydrophobicContact CG1-CB 4.15Å; V553-I557 HydrophobicContact CG1-CD1 4.17Å; V553-I557 HydrophobicContact CG2-CD1 4.13Å; V553-I557 WeakPolarHBondContact O-CA 3.33Å; V553-I557 WeakPolarHBondContact O-CB 3.44Å; V553-I557 PolarHBondContact O-N 2.92Å; I557-C560 PolarHBondContact O-N 2.88Å; I557-C560 VanDerWaalsContact O-N 3.08Å; I557-L561 PolarHBondContact O-N 2.9Å; I557-L561 VanDerWaalsContact O-N 3.13Å; I557-V595 HydrophobicContact CD1-CG1 4.35Å
558	L	74.7	Confident	74	Confident	39 Å²	39	48.5 Å²	48.5	20%	0.204	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-51.8	-50.1	178.5	-74.4	173.9	0	0	0	113.7	V553 E554 C560 L561 F617	V553-L558 PolarHBondContact O-N 2.97Å; E554-L558 HydrophobicContact CB-CD1 4.06Å; E554-L558 HydrophobicContact CG-CD1 3.74Å; L558-C560 PolarHBondContact O-N 3.25Å; L558-L561 WeakPolarHBondContact O-CB 3.35Å; L558-L561 PolarHBondContact O-N 3.34Å; L558-L561 VanDerWaalsContact O-N 3.17Å; L558-F617 HydrophobicContact CD2-CD1 3.97Å; L558-F617 HydrophobicContact CD2-CE1 3.89Å
559	P	75.3	Confident	73.3	Confident	81 Å²	81	52 Å²	52	53%	0.526	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-68.1	-18.4	-178.4	25.6	-34.8	0	0	0	113.8	S555	S555-P559 WeakPolarHBondContact O-CG 3.4Å
560	C	71.1	Confident	72.6	Confident	4 Å²	4	58.8 Å²	58.8	3%	0.027	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-96.9	-3.8	179.1	-61	0	0	0	0	112.3	K556 I557 L558 E562 D563 F564	K556-C560 PolarHBondContact O-SG 3.46Å; K556-C560 VanDerWaalsContact O-SG 3.38Å; I557-C560 PolarHBondContact O-N 2.88Å; I557-C560 VanDerWaalsContact O-N 3.08Å; L558-C560 PolarHBondContact O-N 3.25Å; C560-E562 PolarHBondContact O-N 3.08Å; C560-D563 PolarHBondContact O-N 3.23Å; C560-F564 HydrophobicContact CB-CD2 3.96Å; C560-F564 HydrophobicContact CB-CE2 3.94Å; C560-F564 WeakPolarHBondContact O-CD2 3.32Å; C560-F564 PolarHBondContact O-N 3.49Å; C560-F564 VanDerWaalsContact O-N 3.07Å
561	L	67.8	Low	71.7	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	29%	0.286	C	S	.	.	H	α-helix	trans	-68.7	-34.1	-168.4	-170.8	62.8	0	0	0	112.7	I557 L558 F564 A565 I592 L596 F617 F621	I557-L561 PolarHBondContact O-N 2.9Å; I557-L561 VanDerWaalsContact O-N 3.13Å; L558-L561 WeakPolarHBondContact O-CB 3.35Å; L558-L561 PolarHBondContact O-N 3.34Å; L558-L561 VanDerWaalsContact O-N 3.17Å; L561-F564 PolarHBondContact O-N 3.38Å; L561-A565 WeakPolarHBondContact O-CB 3.43Å; L561-A565 PolarHBondContact O-N 3.34Å; L561-I592 HydrophobicContact CD1-CG2 3.77Å; L561-L596 HydrophobicContact CD1-CD1 3.86Å; L561-L596 HydrophobicContact CD2-CD1 3.83Å; L561-F617 HydrophobicContact CD2-CB 3.89Å; L561-F617 HydrophobicContact CD2-CD1 4.05Å; L561-F617 HydrophobicContact CD2-CG 4.49Å; L561-F617 WeakPolarHBondContact CD2-O 3Å; L561-F621 HydrophobicContact CD1-CD2 3.54Å; L561-F621 HydrophobicContact CD1-CE2 3.66Å; L561-F621 HydrophobicContact CD1-CG 4.13Å; L561-F621 HydrophobicContact CD1-CZ 4.35Å; L561-F621 HydrophobicContact CD2-CD2 4.45Å; L561-F621 HydrophobicContact CG-CD2 3.83Å; L561-F621 HydrophobicContact CG-CE2 4.25Å
562	E	67.3	Low	71	Confident	139 Å²	139	54 Å²	54	65%	0.65	27%	0.265	S	S	*	.	H	α-helix	trans	-65.5	-50	176.2	-65.7	-176.8	167.9	0	0	111.1	C560 F564 A565 E566	C560-E562 PolarHBondContact O-N 3.08Å; E562-F564 PolarHBondContact O-N 3.33Å; E562-A565 WeakPolarHBondContact O-CB 3.47Å; E562-A565 PolarHBondContact O-N 3.45Å; E562-E566 PolarHBondContact O-N 2.74Å
563	D	69.6	Low	70.3	Confident	83 Å²	83	58.1 Å²	58.1	44%	0.444	29%	0.294	S	S	.	.	H	α-helix	trans	-57.4	-38.7	175.1	-64.8	-21.9	0	0	0	112	C560 R567	C560-D563 PolarHBondContact O-N 3.23Å; D563-R567 VanDerWaalsContact O-CG 3.31Å; D563-R567 WeakPolarHBondContact O-CG 3.26Å; D563-R567 PolarHBondContact O-N 3.46Å; D563-R567 VanDerWaalsContact O-N 3.15Å
564	F	66.4	Low	69.3	Low	10 Å²	10	61.2 Å²	61.2	4%	0.044	31%	0.313	C	S	.	.	H	α-helix	trans	-70.1	-37.3	176.4	-84.8	-64.2	0	0	0	112.4	L528 I538 C560 L561 E562 R567 L568	L528-F564 HydrophobicContact CB-CE2 4.22Å; L528-F564 HydrophobicContact CB-CZ 4.29Å; L528-F564 HydrophobicContact CD2-CE2 4.04Å; L528-F564 HydrophobicContact CD2-CZ 3.72Å; I538-F564 HydrophobicContact CD1-CE1 4.19Å; I538-F564 HydrophobicContact CG1-CE1 4.45Å; I538-F564 HydrophobicContact CG2-CD1 4.46Å; I538-F564 HydrophobicContact CG2-CE1 3.54Å; I538-F564 HydrophobicContact CG2-CZ 3.9Å; C560-F564 HydrophobicContact CB-CD2 3.96Å; C560-F564 HydrophobicContact CB-CE2 3.94Å; C560-F564 WeakPolarHBondContact O-CD2 3.32Å; C560-F564 PolarHBondContact O-N 3.49Å; C560-F564 VanDerWaalsContact O-N 3.07Å; L561-F564 PolarHBondContact O-N 3.38Å; E562-F564 PolarHBondContact O-N 3.33Å; F564-R567 PolarHBondContact O-N 3.04Å; F564-L568 WeakPolarHBondContact O-CB 3.43Å; F564-L568 PolarHBondContact O-N 3.25Å
565	A	64.3	Low	68.3	Low	13 Å²	13	60.7 Å²	60.7	11%	0.107	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-44.7	177.3	0	0	0	0	0	111	L561 E562 L568 Q569 F621	L561-A565 WeakPolarHBondContact O-CB 3.43Å; L561-A565 PolarHBondContact O-N 3.34Å; E562-A565 WeakPolarHBondContact O-CB 3.47Å; E562-A565 PolarHBondContact O-N 3.45Å; A565-L568 PolarHBondContact O-N 2.99Å; A565-Q569 WeakPolarHBondContact O-CB 3.1Å; A565-Q569 WeakPolarHBondContact O-CG 3.37Å; A565-Q569 PolarHBondContact O-N 3.45Å; A565-F621 HydrophobicContact CB-CD2 4Å; A565-F621 HydrophobicContact CB-CE2 3.67Å
566	E	69.5	Low	67.1	Low	133 Å²	133	62 Å²	62	62%	0.621	32%	0.319	S	S	*	.	H	α-helix	trans	-62.4	-44	176.2	-67.8	-175.1	176.1	0	0	111.7	E562 L568 Q569 Y570	E562-E566 PolarHBondContact O-N 2.74Å; E566-L568 VanDerWaalsContact C-N 3.34Å; E566-L568 PolarHBondContact O-N 3.48Å; E566-Q569 PolarHBondContact O-N 2.95Å; E566-Y570 WeakPolarHBondContact O-CB 3.48Å; E566-Y570 PolarHBondContact O-N 3.28Å
567	R	67.6	Low	66.1	Low	71 Å²	71	63.8 Å²	63.8	27%	0.268	34%	0.338	S	S	.	.	H	α-helix	trans	-64	-37.4	176	-72.9	178.6	-168.6	-175.5	9.6	112.8	K530 D563 F564 A571 M585	K530-R567 PolarHBondContact O-NH1 3.43Å; D563-R567 VanDerWaalsContact O-CG 3.31Å; D563-R567 WeakPolarHBondContact O-CG 3.26Å; D563-R567 PolarHBondContact O-N 3.46Å; D563-R567 VanDerWaalsContact O-N 3.15Å; F564-R567 PolarHBondContact O-N 3.04Å; R567-A571 WeakPolarHBondContact O-CB 3.49Å; R567-A571 PolarHBondContact O-N 3.48Å; R567-M585 HydrophobicContact CB-CE 4.31Å
568	L	66.7	Low	64.9	Low	4 Å²	4	68 Å²	68	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-66.8	-46.3	177.5	-144.6	95.9	0	0	0	110.3	F564 A565 E566 A571 F572 M585 Y620 F621	F564-L568 WeakPolarHBondContact O-CB 3.43Å; F564-L568 PolarHBondContact O-N 3.25Å; A565-L568 PolarHBondContact O-N 2.99Å; E566-L568 VanDerWaalsContact C-N 3.34Å; E566-L568 PolarHBondContact O-N 3.48Å; L568-A571 PolarHBondContact O-N 3.15Å; L568-F572 HydrophobicContact CD2-CD2 4.32Å; L568-F572 HydrophobicContact CD2-CE2 3.49Å; L568-F572 VanDerWaalsContact CD2-CE2 3.49Å; L568-F572 HydrophobicContact CD2-CZ 4.29Å; L568-F572 HydrophobicContact CG-CD2 4.29Å; L568-F572 HydrophobicContact CG-CE2 3.7Å; L568-F572 HydrophobicContact CG-CZ 4.46Å; L568-F572 WeakPolarHBondContact O-CD2 3.4Å; L568-F572 PolarHBondContact O-N 2.97Å; L568-M585 HydrophobicContact CD1-CE 4.24Å; L568-Y620 HydrophobicContact CD2-CD1 4.37Å; L568-Y620 HydrophobicContact CD2-CE1 3.57Å; L568-F621 HydrophobicContact CD2-CZ 4.36Å
569	Q	68	Low	64.3	Low	94 Å²	94	67.3 Å²	67.3	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-38.9	177.1	-71.7	179.2	9.6	0	0	112.3	A565 E566 F572 S573 Y620	A565-Q569 WeakPolarHBondContact O-CB 3.1Å; A565-Q569 WeakPolarHBondContact O-CG 3.37Å; A565-Q569 PolarHBondContact O-N 3.45Å; E566-Q569 PolarHBondContact O-N 2.95Å; Q569-F572 PolarHBondContact O-N 2.89Å; Q569-S573 WeakPolarHBondContact O-CB 3.46Å; Q569-S573 PolarHBondContact O-N 2.92Å; Q569-S573 PolarHBondContact O-OG 3.39Å; Q569-Y620 HydrophobicContact CG-CD2 4.27Å
570	Y	67.1	Low	63.8	Low	158 Å²	158	70.5 Å²	70.5	62%	0.62	38%	0.378	S	S	*	.	H	α-helix	trans	-62.6	-44.7	173.4	-175.5	-98.9	0	0	0	111.4	E566 F572 S573 T574	E566-Y570 WeakPolarHBondContact O-CB 3.48Å; E566-Y570 PolarHBondContact O-N 3.28Å; Y570-F572 VanDerWaalsContact C-N 3.32Å; Y570-F572 PolarHBondContact O-N 3.46Å; Y570-S573 WeakPolarHBondContact CA-OG 3.42Å; Y570-S573 PolarHBondContact O-N 3.19Å; Y570-S573 PolarHBondContact O-OG 3.35Å; Y570-T574 HydrophobicContact CD2-CG2 4.25Å; Y570-T574 HydrophobicContact CE1-CG2 4.24Å; Y570-T574 HydrophobicContact CE2-CG2 3.72Å; Y570-T574 PolarHBondContact O-N 3.14Å; Y570-T574 PolarHBondContact O-OG1 3.45Å
571	A	60	Low	63.6	Low	8 Å²	8	74.6 Å²	74.6	7%	0.066	40%	0.397	C	S	.	.	H	α-helix	trans	-65.4	-32.5	178	0	0	0	0	0	113.2	R567 L568 M575 M585	R567-A571 WeakPolarHBondContact O-CB 3.49Å; R567-A571 PolarHBondContact O-N 3.48Å; L568-A571 PolarHBondContact O-N 3.15Å; A571-M575 WeakPolarHBondContact O-CB 3.45Å; A571-M585 HydrophobicContact CB-CB 4.43Å; A571-M585 HydrophobicContact CB-CE 4.42Å; A571-M585 HydrophobicContact CB-CG 4.28Å
572	F	62.9	Low	63.8	Low	56 Å²	56	77.7 Å²	77.7	25%	0.246	41%	0.408	C	S	.	.	H	α-helix	trans	-75	-31.5	175.3	-73.4	-55	0	0	0	113.6	L568 Q569 Y570 R582 E586	L568-F572 HydrophobicContact CD2-CD2 4.32Å; L568-F572 HydrophobicContact CD2-CE2 3.49Å; L568-F572 VanDerWaalsContact CD2-CE2 3.49Å; L568-F572 HydrophobicContact CD2-CZ 4.29Å; L568-F572 HydrophobicContact CG-CD2 4.29Å; L568-F572 HydrophobicContact CG-CE2 3.7Å; L568-F572 HydrophobicContact CG-CZ 4.46Å; L568-F572 WeakPolarHBondContact O-CD2 3.4Å; L568-F572 PolarHBondContact O-N 2.97Å; Q569-F572 PolarHBondContact O-N 2.89Å; Y570-F572 VanDerWaalsContact C-N 3.32Å; Y570-F572 PolarHBondContact O-N 3.46Å; F572-R582 HydrophobicContact CD1-CG 4.33Å; F572-R582 HydrophobicContact CE1-CG 4.44Å; F572-E586 HydrophobicContact CE1-CB 4.49Å; F572-E586 HydrophobicContact CZ-CB 4.48Å
573	S	64.3	Low	64.1	Low	92 Å²	92	78.4 Å²	78.4	64%	0.643	41%	0.405	S	S	*	.	H	α-helix	trans	-83.5	-34.3	-178.2	51.9	0	0	0	0	113.7	Q569 Y570	Q569-S573 WeakPolarHBondContact O-CB 3.46Å; Q569-S573 PolarHBondContact O-N 2.92Å; Q569-S573 PolarHBondContact O-OG 3.39Å; Y570-S573 WeakPolarHBondContact CA-OG 3.42Å; Y570-S573 PolarHBondContact O-N 3.19Å; Y570-S573 PolarHBondContact O-OG 3.35Å
574	T	59.6	Low	64.2	Low	69 Å²	69	76 Å²	76	42%	0.423	39%	0.391	S	S	.	.	H	α-helix	trans	-93.7	-14.8	-173.9	46.2	0	0	0	0	115.5	Y570	Y570-T574 HydrophobicContact CD2-CG2 4.25Å; Y570-T574 HydrophobicContact CE1-CG2 4.24Å; Y570-T574 HydrophobicContact CE2-CG2 3.72Å; Y570-T574 PolarHBondContact O-N 3.14Å; Y570-T574 PolarHBondContact O-OG1 3.45Å
575	M	56.3	Low	64.5	Low	89 Å²	89	76.2 Å²	76.2	44%	0.438	39%	0.392	S	S	.	.	S	Bend	trans	-120.7	135.3	-167.4	-63.3	-71.3	-155.2	0	0	114.4	A571 R582	A571-M575 WeakPolarHBondContact O-CB 3.45Å; M575-R582 PolarHBondContact O-NH1 3.13Å
576	P	55.4	Low	65.2	Low	94 Å²	94	80.1 Å²	80.1	61%	0.61	41%	0.408	S	S	*	.			trans	-63.3	148.6	178.8	24.5	-31.5	0	0	0	111.9	S578 G579	P576-S578 PolarHBondContact O-N 2.91Å; P576-G579 PolarHBondContact O-N 2.9Å
577	S	56.1	Low	65.5	Low	92 Å²	92	78.4 Å²	78.4	64%	0.643	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-15	-175.7	45.7	0	0	0	0	115.3
578	S	52.7	Low	66	Low	93 Å²	93	75.1 Å²	75.1	65%	0.65	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-7	179.4	-174.6	0	0	0	0	115	P576 E580	P576-S578 PolarHBondContact O-N 2.91Å; S578-E580 PolarHBondContact O-N 3.24Å
579	G	61.6	Low	66.5	Low	25 Å²	25	75.2 Å²	75.2	26%	0.258	39%	0.386	S	S	.	.			trans	-70.3	126.9	-176.6	0	0	0	0	0	112.5	P576 H581 R582 R583	P576-G579 PolarHBondContact O-N 2.9Å; G579-H581 PolarHBondContact O-N 3.2Å; G579-H581 VanDerWaalsContact O-N 3.1Å; G579-R582 WeakPolarHBondContact O-CB 3.47Å; G579-R582 PolarHBondContact O-N 3.49Å; G579-R583 PolarHBondContact O-N 3.11Å
580	E	65.9	Low	67.1	Low	149 Å²	149	74.8 Å²	74.8	70%	0.696	39%	0.387	S	S	*	.	H	α-helix	trans	-52.7	-33.6	174.3	-69.5	-171.4	154.1	0	0	112	S578 R583 Q584	S578-E580 PolarHBondContact O-N 3.24Å; E580-R583 PolarHBondContact O-N 3.3Å; E580-Q584 WeakPolarHBondContact O-CB 3.41Å; E580-Q584 WeakPolarHBondContact O-CG 3.29Å; E580-Q584 PolarHBondContact O-N 3.5Å
581	H	67	Low	67.7	Low	89 Å²	89	67.4 Å²	67.4	41%	0.412	36%	0.358	S	S	.	.	H	α-helix	trans	-65.6	-37.5	177.3	-166.5	68.1	0	0	0	113.1	S535 G579 Q584 M585	S535-H581 PolarHBondContact OG-CE1 2.9Å; S535-H581 PolarHBondContact OG-ND1 3.02Å; G579-H581 PolarHBondContact O-N 3.2Å; G579-H581 VanDerWaalsContact O-N 3.1Å; H581-Q584 PolarHBondContact O-N 2.86Å; H581-M585 PolarHBondContact O-N 3.23Å
582	R	71.7	Confident	68.7	Low	71 Å²	71	67.2 Å²	67.2	27%	0.268	36%	0.356	S	S	.	.	H	α-helix	trans	-67.3	-44.8	176.3	-177.4	174.1	169.8	166.2	1.4	111.1	F572 M575 G579 Q584 M585 E586	F572-R582 HydrophobicContact CD1-CG 4.33Å; F572-R582 HydrophobicContact CE1-CG 4.44Å; M575-R582 PolarHBondContact O-NH1 3.13Å; G579-R582 WeakPolarHBondContact O-CB 3.47Å; G579-R582 PolarHBondContact O-N 3.49Å; R582-Q584 VanDerWaalsContact C-N 3.28Å; R582-Q584 PolarHBondContact O-N 3.42Å; R582-M585 PolarHBondContact O-N 2.93Å; R582-E586 WeakPolarHBondContact O-CB 3.04Å; R582-E586 PolarHBondContact O-N 3.39Å
583	R	73.2	Confident	69.4	Low	154 Å²	154	65.2 Å²	65.2	58%	0.581	35%	0.348	S	S	*	.	H	α-helix	trans	-63	-34.2	174.4	-68.2	-176.6	-175.8	169	1	112.6	G579 E580 R587	G579-R583 PolarHBondContact O-N 3.11Å; E580-R583 PolarHBondContact O-N 3.3Å; R583-R587 WeakPolarHBondContact O-CG 3.45Å; R583-R587 PolarHBondContact O-N 2.74Å
584	Q	72.9	Confident	70.1	Confident	33 Å²	33	65.9 Å²	65.9	15%	0.154	34%	0.337	C	S	.	.	H	α-helix	trans	-68	-43	174.5	-73.4	168.8	27.5	0	0	111.5	W492 E580 H581 R582 R587 V588	W492-Q584 HydrophobicContact CH2-CB 4.09Å; W492-Q584 HydrophobicContact CH2-CG 3.93Å; W492-Q584 HydrophobicContact CZ2-CB 4.37Å; W492-Q584 HydrophobicContact CZ2-CG 3.82Å; E580-Q584 WeakPolarHBondContact O-CB 3.41Å; E580-Q584 WeakPolarHBondContact O-CG 3.29Å; E580-Q584 PolarHBondContact O-N 3.5Å; H581-Q584 PolarHBondContact O-N 2.86Å; R582-Q584 VanDerWaalsContact C-N 3.28Å; R582-Q584 PolarHBondContact O-N 3.42Å; Q584-R587 PolarHBondContact O-N 3.03Å; Q584-V588 WeakPolarHBondContact O-CG2 3.18Å; Q584-V588 PolarHBondContact O-N 3.23Å; Q584-V588 VanDerWaalsContact O-N 3.12Å
585	M	72.8	Confident	70.9	Confident	14 Å²	14	63.5 Å²	63.5	7%	0.069	32%	0.322	C	S	.	.	H	α-helix	trans	-69.2	-35.3	176.5	-79.1	-63.8	-90.1	0	0	112.9	R567 L568 A571 H581 R582 R587 V588 G589	R567-M585 HydrophobicContact CB-CE 4.31Å; L568-M585 HydrophobicContact CD1-CE 4.24Å; A571-M585 HydrophobicContact CB-CB 4.43Å; A571-M585 HydrophobicContact CB-CE 4.42Å; A571-M585 HydrophobicContact CB-CG 4.28Å; H581-M585 PolarHBondContact O-N 3.23Å; R582-M585 PolarHBondContact O-N 2.93Å; M585-R587 PolarHBondContact O-N 2.99Å; M585-V588 WeakPolarHBondContact O-CB 3.14Å; M585-V588 PolarHBondContact O-N 3.05Å; M585-G589 PolarHBondContact O-N 2.93Å
586	E	78.4	Confident	71.7	Confident	95 Å²	95	59.2 Å²	59.2	44%	0.444	30%	0.301	S	S	.	.	H	α-helix	trans	-60	-45.3	172.7	-169.6	174.2	-168.8	0	0	111.2	F572 R582 V588 G589 D590	F572-E586 HydrophobicContact CE1-CB 4.49Å; F572-E586 HydrophobicContact CZ-CB 4.48Å; R582-E586 WeakPolarHBondContact O-CB 3.04Å; R582-E586 PolarHBondContact O-N 3.39Å; E586-V588 VanDerWaalsContact C-N 3.31Å; E586-V588 PolarHBondContact O-N 3.47Å; E586-G589 CarbonylContact O-C 3.52Å; E586-G589 WeakPolarHBondContact O-CA 3.45Å; E586-G589 PolarHBondContact O-N 3.08Å; E586-G589 VanDerWaalsContact O-N 3.1Å; E586-D590 PolarHBondContact O-N 3.34Å
587	R	75.3	Confident	72.5	Confident	96 Å²	96	58.7 Å²	58.7	36%	0.362	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-33.2	174	-73.4	-172.8	-178.5	-135.8	-2	113.9	Y539 R583 Q584 M585 V591	Y539-R587 HydrophobicContact CE2-CB 4.42Å; R583-R587 WeakPolarHBondContact O-CG 3.45Å; R583-R587 PolarHBondContact O-N 2.74Å; Q584-R587 PolarHBondContact O-N 3.03Å; M585-R587 PolarHBondContact O-N 2.99Å; R587-V591 PolarHBondContact O-N 3.38Å; R587-V591 VanDerWaalsContact O-N 3.11Å
588	V	79.3	Confident	73.3	Confident	2 Å²	2	57 Å²	57	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-65.5	-45	172.5	171.9	0	0	0	0	109.8	S535 I538 Y539 I542 Q584 M585 E586 V591 I592	S535-V588 WeakPolarHBondContact O-CG2 3.47Å; I538-V588 HydrophobicContact CG2-CG1 3.91Å; Y539-V588 HydrophobicContact CD2-CG2 4.31Å; I542-V588 HydrophobicContact CD1-CG1 4.12Å; Q584-V588 WeakPolarHBondContact O-CG2 3.18Å; Q584-V588 PolarHBondContact O-N 3.23Å; Q584-V588 VanDerWaalsContact O-N 3.12Å; M585-V588 WeakPolarHBondContact O-CB 3.14Å; M585-V588 PolarHBondContact O-N 3.05Å; E586-V588 VanDerWaalsContact C-N 3.31Å; E586-V588 PolarHBondContact O-N 3.47Å; V588-V591 PolarHBondContact O-N 3.42Å; V588-I592 HydrophobicContact CG1-CD1 3.93Å; V588-I592 WeakPolarHBondContact O-CG1 3.45Å; V588-I592 PolarHBondContact O-N 2.82Å
589	G	76.5	Confident	74.1	Confident	7 Å²	7	53.2 Å²	53.2	7%	0.072	24%	0.244	C	C	.	.	H	α-helix	trans	-56.4	-48.7	173.7	0	0	0	0	0	112.3	M585 E586 V591 I592 V593	M585-G589 PolarHBondContact O-N 2.93Å; E586-G589 CarbonylContact O-C 3.52Å; E586-G589 WeakPolarHBondContact O-CA 3.45Å; E586-G589 PolarHBondContact O-N 3.08Å; E586-G589 VanDerWaalsContact O-N 3.1Å; G589-V591 VanDerWaalsContact C-N 3.3Å; G589-V591 PolarHBondContact O-N 3.49Å; G589-I592 PolarHBondContact O-N 3.36Å; G589-V593 WeakPolarHBondContact O-CG2 3.35Å; G589-V593 PolarHBondContact O-N 2.78Å
590	D	80.2	Confident	74.3	Confident	84 Å²	84	52.7 Å²	52.7	45%	0.449	24%	0.237	S	C	.	.	H	α-helix	trans	-58.9	-39.9	177.7	-71.5	-18.6	0	0	0	112.7	E586 R594	E586-D590 PolarHBondContact O-N 3.34Å; D590-R594 VanDerWaalsContact O-CB 3.29Å; D590-R594 WeakPolarHBondContact O-CB 3.32Å; D590-R594 PolarHBondContact O-N 2.92Å
591	V	80.6	Confident	74.4	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-69.7	-42.9	176.7	163.3	0	0	0	0	111.3	Y539 I542 R587 V588 G589 V593 R594 V595	Y539-V591 HydrophobicContact CD2-CB 4.29Å; Y539-V591 HydrophobicContact CD2-CG2 3.93Å; Y539-V591 HydrophobicContact CE2-CB 4Å; Y539-V591 HydrophobicContact CE2-CG2 3.17Å; I542-V591 HydrophobicContact CG2-CG1 4.02Å; R587-V591 PolarHBondContact O-N 3.38Å; R587-V591 VanDerWaalsContact O-N 3.11Å; V588-V591 PolarHBondContact O-N 3.42Å; G589-V591 VanDerWaalsContact C-N 3.3Å; G589-V591 PolarHBondContact O-N 3.49Å; V591-V593 VanDerWaalsContact C-N 3.32Å; V591-V593 PolarHBondContact O-N 3.43Å; V591-R594 PolarHBondContact O-N 2.86Å; V591-V595 HydrophobicContact CG1-CG2 4.07Å; V591-V595 WeakPolarHBondContact O-CB 3.39Å; V591-V595 WeakPolarHBondContact O-CG2 3.2Å; V591-V595 PolarHBondContact O-N 2.85Å
592	I	79.3	Confident	74.2	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-58.1	-48	175.1	-68.7	167.7	0	0	0	109.9	I542 L561 V588 G589 R594 V595 L596 F621	I542-I592 HydrophobicContact CD1-CD1 3.76Å; I542-I592 HydrophobicContact CD1-CG1 3.71Å; I542-I592 HydrophobicContact CG2-CG1 4.1Å; L561-I592 HydrophobicContact CD1-CG2 3.77Å; V588-I592 HydrophobicContact CG1-CD1 3.93Å; V588-I592 WeakPolarHBondContact O-CG1 3.45Å; V588-I592 PolarHBondContact O-N 2.82Å; G589-I592 PolarHBondContact O-N 3.36Å; I592-R594 VanDerWaalsContact C-N 3.32Å; I592-R594 PolarHBondContact O-N 3.05Å; I592-V595 PolarHBondContact O-N 2.87Å; I592-L596 HydrophobicContact CG2-CD1 3.61Å; I592-L596 HydrophobicContact CG2-CG 4.15Å; I592-L596 WeakPolarHBondContact O-CB 3.47Å; I592-L596 VanDerWaalsContact O-CG 3.25Å; I592-L596 WeakPolarHBondContact O-CG 3.47Å; I592-L596 PolarHBondContact O-N 3.38Å; I592-F621 HydrophobicContact CB-CE1 4.11Å; I592-F621 HydrophobicContact CD1-CZ 4.19Å; I592-F621 HydrophobicContact CG2-CD1 3.93Å; I592-F621 HydrophobicContact CG2-CE1 3.63Å; I592-F621 HydrophobicContact CG2-CZ 3.97Å
593	V	79.3	Confident	73.5	Confident	15 Å²	15	51.7 Å²	51.7	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-42.4	177.1	174	0	0	0	0	111	G589 V591 R597 F621 E624	G589-V593 WeakPolarHBondContact O-CG2 3.35Å; G589-V593 PolarHBondContact O-N 2.78Å; V591-V593 VanDerWaalsContact C-N 3.32Å; V591-V593 PolarHBondContact O-N 3.43Å; V593-R597 WeakPolarHBondContact O-CB 3.43Å; V593-R597 PolarHBondContact O-N 3Å; V593-F621 HydrophobicContact CG2-CD1 4.03Å; V593-F621 HydrophobicContact CG2-CE1 4.39Å; V593-E624 HydrophobicContact CG1-CG 4.39Å; V593-E624 HydrophobicContact CG2-CB 4.44Å; V593-E624 HydrophobicContact CG2-CG 3.96Å
594	R	79	Confident	72.5	Confident	106 Å²	106	50.5 Å²	50.5	40%	0.4	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-43.5	176.7	-169.4	-179.4	-59.2	128.1	9.4	112	D590 V591 I592 R597 V598 Y670	D590-R594 VanDerWaalsContact O-CB 3.29Å; D590-R594 WeakPolarHBondContact O-CB 3.32Å; D590-R594 PolarHBondContact O-N 2.92Å; V591-R594 PolarHBondContact O-N 2.86Å; I592-R594 VanDerWaalsContact C-N 3.32Å; I592-R594 PolarHBondContact O-N 3.05Å; R594-R597 PolarHBondContact O-N 3.28Å; R594-V598 WeakPolarHBondContact O-CG2 3.49Å; R594-V598 PolarHBondContact O-N 3.27Å; R594-V598 VanDerWaalsContact O-N 3.13Å; R594-Y670 WeakPolarHBondContact CD-OH 3.48Å; R594-Y670 PolarHBondContact NH1-OH 3.35Å; R594-Y670 VanDerWaalsContact NH1-OH 3.1Å
595	V	76.3	Confident	71.6	Confident	18 Å²	18	58 Å²	58	11%	0.109	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-46.8	179.2	170.2	0	0	0	0	110.6	A546 V553 I557 V591 I592 R597 V598 Y599	A546-V595 HydrophobicContact CB-CB 4.07Å; A546-V595 HydrophobicContact CB-CG1 3.52Å; A546-V595 HydrophobicContact CB-CG2 3.33Å; V553-V595 HydrophobicContact CG1-CG1 4.35Å; V553-V595 HydrophobicContact CG2-CG1 4.16Å; I557-V595 HydrophobicContact CD1-CG1 4.35Å; V591-V595 HydrophobicContact CG1-CG2 4.07Å; V591-V595 WeakPolarHBondContact O-CB 3.39Å; V591-V595 WeakPolarHBondContact O-CG2 3.2Å; V591-V595 PolarHBondContact O-N 2.85Å; I592-V595 PolarHBondContact O-N 2.87Å; V595-R597 VanDerWaalsContact C-N 3.33Å; V595-R597 PolarHBondContact O-N 3.4Å; V595-V598 PolarHBondContact O-N 3.02Å; V595-Y599 PolarHBondContact O-N 2.91Å
596	L	72.5	Confident	70.4	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-67.6	-33.1	178	-65.2	176.1	0	0	0	112	L561 I592 V598 Y599 A600 F617 F621 I625	L561-L596 HydrophobicContact CD1-CD1 3.86Å; L561-L596 HydrophobicContact CD2-CD1 3.83Å; I592-L596 HydrophobicContact CG2-CD1 3.61Å; I592-L596 HydrophobicContact CG2-CG 4.15Å; I592-L596 WeakPolarHBondContact O-CB 3.47Å; I592-L596 VanDerWaalsContact O-CG 3.25Å; I592-L596 WeakPolarHBondContact O-CG 3.47Å; I592-L596 PolarHBondContact O-N 3.38Å; L596-V598 VanDerWaalsContact C-N 3.34Å; L596-V598 PolarHBondContact O-N 2.98Å; L596-Y599 PolarHBondContact O-N 2.62Å; L596-A600 VanDerWaalsContact O-CB 3.28Å; L596-A600 WeakPolarHBondContact O-CB 3.23Å; L596-A600 PolarHBondContact O-N 2.67Å; L596-F617 HydrophobicContact CD1-CD1 4.11Å; L596-F617 HydrophobicContact CD2-CD1 3.8Å; L596-F617 HydrophobicContact CD2-CE1 3.8Å; L596-F617 HydrophobicContact CG-CD1 4.39Å; L596-F621 HydrophobicContact CD1-CB 4.28Å; L596-F621 HydrophobicContact CD1-CG 4.49Å; L596-I625 HydrophobicContact CB-CD1 3.54Å; L596-I625 HydrophobicContact CB-CG1 4.28Å; L596-I625 HydrophobicContact CD1-CD1 3.75Å; L596-I625 HydrophobicContact CG-CD1 4.29Å
597	R	72.2	Confident	69.3	Low	82 Å²	82	65.4 Å²	65.4	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-41.3	172.1	-170.1	-169.6	-63.1	-166.3	1.8	111.6	V593 R594 V595 K601 S628 I629	V593-R597 WeakPolarHBondContact O-CB 3.43Å; V593-R597 PolarHBondContact O-N 3Å; R594-R597 PolarHBondContact O-N 3.28Å; V595-R597 VanDerWaalsContact C-N 3.33Å; V595-R597 PolarHBondContact O-N 3.4Å; R597-K601 PolarHBondContact O-N 3.03Å; R597-S628 PolarHBondContact NH2-OG 3.25Å; R597-I629 HydrophobicContact CG-CG1 4.35Å
598	V	73.3	Confident	68.2	Low	57 Å²	57	65.6 Å²	65.6	35%	0.345	31%	0.311	S	S	.	.	H	α-helix	trans	-68.3	-44.2	175.5	175	0	0	0	0	110.2	R594 V595 L596 A600 K601 F602 M665	R594-V598 WeakPolarHBondContact O-CG2 3.49Å; R594-V598 PolarHBondContact O-N 3.27Å; R594-V598 VanDerWaalsContact O-N 3.13Å; V595-V598 PolarHBondContact O-N 3.02Å; L596-V598 VanDerWaalsContact C-N 3.34Å; L596-V598 PolarHBondContact O-N 2.98Å; V598-A600 PolarHBondContact O-N 3.44Å; V598-K601 PolarHBondContact O-N 3.47Å; V598-F602 HydrophobicContact CG1-CD2 4.3Å; V598-F602 HydrophobicContact CG1-CE2 4.45Å; V598-F602 WeakPolarHBondContact O-CD2 3.46Å; V598-F602 PolarHBondContact O-N 3.24Å; V598-M665 HydrophobicContact CG1-CE 3.7Å; V598-M665 HydrophobicContact CG1-SD 4.32Å
599	Y	68.9	Low	67.1	Low	14 Å²	14	70.2 Å²	70.2	6%	0.055	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-45.3	175.3	-178.8	-92.5	0	0	0	112.1	V550 V553 E554 V595 L596 K601 F602 C603 F617	V550-Y599 HydrophobicContact CB-CD2 4.41Å; V550-Y599 HydrophobicContact CB-CE2 4.43Å; V550-Y599 HydrophobicContact CG1-CD2 3.54Å; V550-Y599 HydrophobicContact CG1-CE2 3.31Å; V553-Y599 HydrophobicContact CB-CD2 4.1Å; V553-Y599 HydrophobicContact CG1-CD2 3.86Å; V553-Y599 HydrophobicContact CG1-CE2 4.44Å; V553-Y599 HydrophobicContact CG1-CG 4.25Å; E554-Y599 HydrophobicContact CB-CE2 4.1Å; E554-Y599 PolarHBondContact OE2-OH 2.99Å; V595-Y599 PolarHBondContact O-N 2.91Å; L596-Y599 PolarHBondContact O-N 2.62Å; Y599-K601 PolarHBondContact O-N 3.38Å; Y599-F602 CarbonylContact O-C 3.33Å; Y599-F602 PolarHBondContact O-N 3.25Å; Y599-C603 PolarHBondContact O-N 3.45Å; Y599-F617 AromaticContact CD1-CE1 4Å; Y599-F617 HydrophobicContact CD1-CE1 4Å; Y599-F617 AromaticContact CD1-CZ 3.96Å; Y599-F617 HydrophobicContact CD1-CZ 3.96Å; Y599-F617 HydrophobicContact CE1-CE1 4.28Å; Y599-F617 HydrophobicContact CE1-CZ 4.22Å
600	A	65.9	Low	66.1	Low	14 Å²	14	73 Å²	73	12%	0.116	35%	0.348	C	S	.	.	H	α-helix	trans	-61.1	-29	179.7	0	0	0	0	0	113.5	L596 V598 Y613 I629	L596-A600 VanDerWaalsContact O-CB 3.28Å; L596-A600 WeakPolarHBondContact O-CB 3.23Å; L596-A600 PolarHBondContact O-N 2.67Å; V598-A600 PolarHBondContact O-N 3.44Å; A600-Y613 HydrophobicContact CB-CE1 4.14Å; A600-I629 HydrophobicContact CB-CD1 4.18Å
601	K	67.7	Low	65.1	Low	151 Å²	151	73 Å²	73	66%	0.657	35%	0.351	S	S	*	.	H	α-helix	trans	-74.2	-28.1	174.8	-73.8	-175.5	177	-171.6	0	113.6	R597 V598 Y599	R597-K601 PolarHBondContact O-N 3.03Å; V598-K601 PolarHBondContact O-N 3.47Å; Y599-K601 PolarHBondContact O-N 3.38Å
602	F	62.3	Low	64.2	Low	109 Å²	109	75.7 Å²	75.7	48%	0.478	37%	0.365	S	S	.	.	H	α-helix	trans	-102.7	0.4	-176.9	-76.7	-82.3	0	0	0	113.4	V550 V598 Y599 M665	V550-F602 HydrophobicContact CG2-CB 4.15Å; V598-F602 HydrophobicContact CG1-CD2 4.3Å; V598-F602 HydrophobicContact CG1-CE2 4.45Å; V598-F602 WeakPolarHBondContact O-CD2 3.46Å; V598-F602 PolarHBondContact O-N 3.24Å; Y599-F602 CarbonylContact O-C 3.33Å; Y599-F602 PolarHBondContact O-N 3.25Å; F602-M665 HydrophobicContact CD2-CE 3.69Å; F602-M665 HydrophobicContact CD2-SD 3.74Å; F602-M665 HydrophobicContact CE1-SD 4.33Å; F602-M665 HydrophobicContact CE2-CE 4.05Å; F602-M665 HydrophobicContact CE2-SD 3.47Å; F602-M665 WeakPolarHBondContact CE2-SD 3.26Å; F602-M665 HydrophobicContact CG-CE 4.14Å; F602-M665 HydrophobicContact CG-SD 4.28Å; F602-M665 HydrophobicContact CZ-SD 3.8Å
603	C	58.7	Low	63.1	Low	27 Å²	27	76.5 Å²	76.5	18%	0.182	37%	0.368	C	S	.	.			trans	-70.1	131.5	179	-140	0	0	0	0	110.3	Y599 R605	Y599-C603 PolarHBondContact O-N 3.45Å; C603-R605 PolarHBondContact O-N 3.28Å
604	P	52.2	Low	62.3	Low	129 Å²	129	78.6 Å²	78.6	84%	0.838	38%	0.377	S	S	*	.	S	Bend	trans	-67.9	-14.1	-179.8	24.5	-32.2	0	0	0	113.5
605	R	52.6	Low	61.4	Low	190 Å²	190	79.4 Å²	79.4	72%	0.717	39%	0.389	S	S	*	.	S	Bend	trans	-92.4	115.4	172.2	-74.4	-178.5	167.7	172.2	-3.3	109.5	C603 L607	C603-R605 PolarHBondContact O-N 3.28Å; R605-L607 PolarHBondContact O-N 3.46Å
606	R	48.3	Very low	60.5	Low	241 Å²	241	82.4 Å²	82.4	91%	0.909	40%	0.404	S	S	*	.			trans	-65.5	100	167.5	-78	-171.8	-178.8	-168.2	0.8	108.5
607	L	54.6	Low	59.8	Low	25 Å²	25	82.6 Å²	82.6	13%	0.131	41%	0.405	C	S	.	.			trans	-79.4	116.8	173	-66.1	158.6	0	0	0	108	R605 D612 Y613 L616 F617	R605-L607 PolarHBondContact O-N 3.46Å; L607-D612 HydrophobicContact CD2-CB 3.45Å; L607-D612 VanDerWaalsContact CD2-CB 3.45Å; L607-Y613 HydrophobicContact CB-CD2 4.17Å; L607-Y613 HydrophobicContact CB-CE1 4.15Å; L607-Y613 HydrophobicContact CB-CE2 3.55Å; L607-Y613 HydrophobicContact CD1-CD1 4.38Å; L607-Y613 HydrophobicContact CD1-CE1 3.98Å; L607-L616 HydrophobicContact CD1-CD1 3.84Å; L607-L616 HydrophobicContact CD2-CD1 3.45Å; L607-L616 VanDerWaalsContact CD2-CD1 3.45Å; L607-L616 HydrophobicContact CG-CD1 4.25Å; L607-F617 HydrophobicContact CD1-CE2 4.23Å
608	T	52.3	Low	59.3	Low	100 Å²	100	79.6 Å²	79.6	61%	0.613	40%	0.4	S	S	*	.			trans	-105.9	-28.6	-177.7	42.1	0	0	0	0	113
609	D	55.6	Low	58.6	Low	98 Å²	98	84.5 Å²	84.5	52%	0.524	42%	0.419	S	S	.	.	S	Bend	trans	-113.5	145.9	-169.4	-64.7	-40.2	0	0	0	113.2	V611 D612 Y613	D609-V611 PolarHBondContact O-N 3.14Å; D609-V611 VanDerWaalsContact O-N 3.12Å; D609-D612 PolarHBondContact O-N 3.06Å; D609-Y613 WeakPolarHBondContact O-CD2 3.4Å; D609-Y613 PolarHBondContact O-N 2.88Å
610	L	56.6	Low	58.1	Low	66 Å²	66	87.7 Å²	87.7	35%	0.346	43%	0.431	S	S	.	.	H	α-helix	trans	-52.7	-33.9	177.9	-176.9	73.9	0	0	0	112.1	Y613 Q614 Y626	L610-Y613 PolarHBondContact O-N 3.34Å; L610-Q614 VanDerWaalsContact O-CG 3.3Å; L610-Q614 WeakPolarHBondContact O-CG 3.33Å; L610-Q614 PolarHBondContact O-N 3.39Å; L610-Y626 HydrophobicContact CB-CD2 4.33Å; L610-Y626 HydrophobicContact CB-CE2 4.36Å; L610-Y626 VanDerWaalsContact CD1-CB 3.49Å; L610-Y626 HydrophobicContact CD1-CD1 3.47Å; L610-Y626 VanDerWaalsContact CD1-CD1 3.47Å; L610-Y626 HydrophobicContact CD1-CD2 4Å; L610-Y626 HydrophobicContact CD1-CE1 4.15Å; L610-Y626 HydrophobicContact CD1-CG 3.37Å
611	V	59.5	Low	57.7	Low	84 Å²	84	87.1 Å²	87.1	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-68.9	-38.1	-179.6	-179.7	0	0	0	0	111.4	D609 Y613 Q614 N615	D609-V611 PolarHBondContact O-N 3.14Å; D609-V611 VanDerWaalsContact O-N 3.12Å; V611-Y613 VanDerWaalsContact C-N 3.33Å; V611-Y613 PolarHBondContact O-N 3.31Å; V611-Q614 PolarHBondContact O-N 3.36Å; V611-N615 WeakPolarHBondContact O-CB 3.4Å; V611-N615 PolarHBondContact O-N 2.81Å; V611-N615 PolarHBondContact O-ND2 3.09Å
612	D	60.5	Low	57.2	Low	61 Å²	61	79.9 Å²	79.9	33%	0.326	40%	0.395	S	S	.	.	H	α-helix	trans	-69.4	-35.2	178	-64	-28.2	0	0	0	111.5	L607 D609 N615 L616	L607-D612 HydrophobicContact CD2-CB 3.45Å; L607-D612 VanDerWaalsContact CD2-CB 3.45Å; D609-D612 PolarHBondContact O-N 3.06Å; D612-N615 PolarHBondContact O-N 2.78Å; D612-L616 WeakPolarHBondContact O-CB 2.99Å; D612-L616 PolarHBondContact O-N 3.47Å; D612-L616 VanDerWaalsContact O-N 3.1Å
613	Y	57.6	Low	57.2	Low	19 Å²	19	77.1 Å²	77.1	8%	0.075	39%	0.389	C	S	.	.	H	α-helix	trans	-67.4	-38.9	171.9	-78.3	-78.8	0	0	0	112.2	A600 L607 D609 L610 V611 F617 I625 Y626 I629	A600-Y613 HydrophobicContact CB-CE1 4.14Å; L607-Y613 HydrophobicContact CB-CD2 4.17Å; L607-Y613 HydrophobicContact CB-CE1 4.15Å; L607-Y613 HydrophobicContact CB-CE2 3.55Å; L607-Y613 HydrophobicContact CD1-CD1 4.38Å; L607-Y613 HydrophobicContact CD1-CE1 3.98Å; D609-Y613 WeakPolarHBondContact O-CD2 3.4Å; D609-Y613 PolarHBondContact O-N 2.88Å; L610-Y613 PolarHBondContact O-N 3.34Å; V611-Y613 VanDerWaalsContact C-N 3.33Å; V611-Y613 PolarHBondContact O-N 3.31Å; Y613-F617 AromaticContact CD1-CD2 3.86Å; Y613-F617 HydrophobicContact CD1-CD2 3.86Å; Y613-F617 AromaticContact CD1-CE2 3.73Å; Y613-F617 HydrophobicContact CD1-CE2 3.73Å; Y613-F617 HydrophobicContact CE1-CE2 4.17Å; Y613-F617 WeakPolarHBondContact O-CB 3.44Å; Y613-F617 WeakPolarHBondContact O-CD2 3.5Å; Y613-F617 PolarHBondContact O-N 2.87Å; Y613-I625 HydrophobicContact CD1-CG2 3.86Å; Y613-I625 HydrophobicContact CE1-CG2 3.91Å; Y613-Y626 HydrophobicContact CD2-CD2 4.26Å; Y613-I629 HydrophobicContact CE1-CD1 4.05Å
614	Q	61.4	Low	57.2	Low	60 Å²	60	79.6 Å²	79.6	28%	0.28	40%	0.398	S	S	.	.	H	α-helix	trans	-70.5	-33.3	176.1	-73.1	176.3	-0	0	0	112.5	L610 V611 G618	L610-Q614 VanDerWaalsContact O-CG 3.3Å; L610-Q614 WeakPolarHBondContact O-CG 3.33Å; L610-Q614 PolarHBondContact O-N 3.39Å; V611-Q614 PolarHBondContact O-N 3.36Å; Q614-G618 CarbonylContact O-C 3.57Å; Q614-G618 WeakPolarHBondContact O-CA 3.48Å; Q614-G618 PolarHBondContact O-N 3.34Å
615	N	60.1	Low	57.5	Low	122 Å²	122	73.5 Å²	73.5	65%	0.652	36%	0.358	S	S	*	.	H	α-helix	trans	-73.3	-32	178	-72	-21.7	0	0	0	112.9	V611 D612	V611-N615 WeakPolarHBondContact O-CB 3.4Å; V611-N615 PolarHBondContact O-N 2.81Å; V611-N615 PolarHBondContact O-ND2 3.09Å; D612-N615 PolarHBondContact O-N 2.78Å
616	L	58	Low	57.8	Low	81 Å²	81	69.3 Å²	69.3	42%	0.424	34%	0.343	S	S	.	.	H	α-helix	trans	-91.2	-31.1	179.8	-75.3	168.9	0	0	0	113.9	L607 D612	L607-L616 HydrophobicContact CD1-CD1 3.84Å; L607-L616 HydrophobicContact CD2-CD1 3.45Å; L607-L616 VanDerWaalsContact CD2-CD1 3.45Å; L607-L616 HydrophobicContact CG-CD1 4.25Å; D612-L616 WeakPolarHBondContact O-CB 2.99Å; D612-L616 PolarHBondContact O-N 3.47Å; D612-L616 VanDerWaalsContact O-N 3.1Å
617	F	57.4	Low	58.3	Low	4 Å²	4	65.5 Å²	65.5	2%	0.018	33%	0.329	C	S	.	.	H	α-helix	trans	-116.9	1	-173.1	-54.7	-69.8	0	0	0	114	L558 L561 L596 Y599 L607 Y613 F621 I625	L558-F617 HydrophobicContact CD2-CD1 3.97Å; L558-F617 HydrophobicContact CD2-CE1 3.89Å; L561-F617 HydrophobicContact CD2-CB 3.89Å; L561-F617 HydrophobicContact CD2-CD1 4.05Å; L561-F617 HydrophobicContact CD2-CG 4.49Å; L561-F617 WeakPolarHBondContact CD2-O 3Å; L596-F617 HydrophobicContact CD1-CD1 4.11Å; L596-F617 HydrophobicContact CD2-CD1 3.8Å; L596-F617 HydrophobicContact CD2-CE1 3.8Å; L596-F617 HydrophobicContact CG-CD1 4.39Å; Y599-F617 AromaticContact CD1-CE1 4Å; Y599-F617 HydrophobicContact CD1-CE1 4Å; Y599-F617 AromaticContact CD1-CZ 3.96Å; Y599-F617 HydrophobicContact CD1-CZ 3.96Å; Y599-F617 HydrophobicContact CE1-CE1 4.28Å; Y599-F617 HydrophobicContact CE1-CZ 4.22Å; L607-F617 HydrophobicContact CD1-CE2 4.23Å; Y613-F617 AromaticContact CD1-CD2 3.86Å; Y613-F617 HydrophobicContact CD1-CD2 3.86Å; Y613-F617 AromaticContact CD1-CE2 3.73Å; Y613-F617 HydrophobicContact CD1-CE2 3.73Å; Y613-F617 HydrophobicContact CE1-CE2 4.17Å; Y613-F617 WeakPolarHBondContact O-CB 3.44Å; Y613-F617 WeakPolarHBondContact O-CD2 3.5Å; Y613-F617 PolarHBondContact O-N 2.87Å; F617-F621 HydrophobicContact CB-CB 4.34Å; F617-I625 HydrophobicContact CB-CD1 4.02Å; F617-I625 HydrophobicContact CD1-CD1 4.34Å; F617-I625 HydrophobicContact CD2-CD1 4.07Å; F617-I625 HydrophobicContact CG-CD1 3.88Å
618	G	61.5	Low	58.2	Low	19 Å²	19	64.8 Å²	64.8	20%	0.196	33%	0.326	C	S	.	.	H	α-helix	trans	80.7	164.8	-173.3	0	0	0	0	0	113.3	Q614 Y620 G622	Q614-G618 CarbonylContact O-C 3.57Å; Q614-G618 WeakPolarHBondContact O-CA 3.48Å; Q614-G618 PolarHBondContact O-N 3.34Å; G618-Y620 PolarHBondContact O-N 3.11Å; G618-G622 WeakPolarHBondContact O-CA 3.45Å; G618-G622 PolarHBondContact O-N 2.98Å
619	Q	58.6	Low	58.4	Low	161 Å²	161	62.6 Å²	62.6	75%	0.752	31%	0.31	S	S	*	.	H	α-helix	trans	-60.6	-39.6	-173.2	-73.4	-179.7	2	0	0	113.6	S623	Q619-S623 PolarHBondContact O-N 3.43Å; Q619-S623 PolarHBondContact O-OG 3.44Å
620	Y	58.8	Low	58.4	Low	81 Å²	81	61.1 Å²	61.1	32%	0.318	31%	0.311	S	S	.	.	H	α-helix	trans	-77.5	-51.5	-175.6	-172.6	-95.9	0	0	0	112.7	L568 Q569 G618 S623 E624	L568-Y620 HydrophobicContact CD2-CD1 4.37Å; L568-Y620 HydrophobicContact CD2-CE1 3.57Å; Q569-Y620 HydrophobicContact CG-CD2 4.27Å; G618-Y620 PolarHBondContact O-N 3.11Å; Y620-S623 PolarHBondContact O-OG 3.47Å; Y620-E624 PolarHBondContact O-N 3.31Å
621	F	57.7	Low	58.1	Low	1 Å²	1	64.9 Å²	64.9	0%	0.004	33%	0.327	C	S	.	.	H	α-helix	trans	-74.4	-32.4	179.8	-66.6	-72.5	0	0	0	112.1	L561 A565 L568 I592 V593 L596 F617 S623 E624 I625	L561-F621 HydrophobicContact CD1-CD2 3.54Å; L561-F621 HydrophobicContact CD1-CE2 3.66Å; L561-F621 HydrophobicContact CD1-CG 4.13Å; L561-F621 HydrophobicContact CD1-CZ 4.35Å; L561-F621 HydrophobicContact CD2-CD2 4.45Å; L561-F621 HydrophobicContact CG-CD2 3.83Å; L561-F621 HydrophobicContact CG-CE2 4.25Å; A565-F621 HydrophobicContact CB-CD2 4Å; A565-F621 HydrophobicContact CB-CE2 3.67Å; L568-F621 HydrophobicContact CD2-CZ 4.36Å; I592-F621 HydrophobicContact CB-CE1 4.11Å; I592-F621 HydrophobicContact CD1-CZ 4.19Å; I592-F621 HydrophobicContact CG2-CD1 3.93Å; I592-F621 HydrophobicContact CG2-CE1 3.63Å; I592-F621 HydrophobicContact CG2-CZ 3.97Å; V593-F621 HydrophobicContact CG2-CD1 4.03Å; V593-F621 HydrophobicContact CG2-CE1 4.39Å; L596-F621 HydrophobicContact CD1-CB 4.28Å; L596-F621 HydrophobicContact CD1-CG 4.49Å; F617-F621 HydrophobicContact CB-CB 4.34Å; F621-S623 VanDerWaalsContact C-N 3.35Å; F621-S623 PolarHBondContact O-N 3.22Å; F621-E624 PolarHBondContact O-N 3.44Å; F621-I625 HydrophobicContact CB-CD1 4.28Å; F621-I625 VanDerWaalsContact O-CB 3.28Å; F621-I625 WeakPolarHBondContact O-CB 3.4Å; F621-I625 VanDerWaalsContact O-CD1 3.26Å; F621-I625 WeakPolarHBondContact O-CD1 3.24Å; F621-I625 WeakPolarHBondContact O-CG1 3.47Å; F621-I625 PolarHBondContact O-N 3.22Å
622	G	57.6	Low	57.4	Low	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.7	-38.4	176.9	0	0	0	0	0	113.4	G618 Y626	G618-G622 WeakPolarHBondContact O-CA 3.45Å; G618-G622 PolarHBondContact O-N 2.98Å; G622-Y626 VanDerWaalsContact O-CB 3.32Å; G622-Y626 WeakPolarHBondContact O-CB 3.18Å; G622-Y626 PolarHBondContact O-N 2.8Å
623	S	61.8	Low	56.1	Low	51 Å²	51	64.2 Å²	64.2	36%	0.357	34%	0.335	S	S	.	.	H	α-helix	trans	-72.1	-39.6	175.9	47.9	0	0	0	0	112.5	Q619 Y620 F621 R627	Q619-S623 PolarHBondContact O-N 3.43Å; Q619-S623 PolarHBondContact O-OG 3.44Å; Y620-S623 PolarHBondContact O-OG 3.47Å; F621-S623 VanDerWaalsContact C-N 3.35Å; F621-S623 PolarHBondContact O-N 3.22Å; S623-R627 WeakPolarHBondContact O-CB 3.46Å; S623-R627 PolarHBondContact O-N 3.23Å
624	E	58.9	Low	54.9	Low	79 Å²	79	68.6 Å²	68.6	37%	0.369	37%	0.366	S	S	.	.	H	α-helix	trans	-69.8	-36.6	177.4	-163.6	57.1	-143.5	0	0	112.6	V593 Y620 F621 S628	V593-E624 HydrophobicContact CG1-CG 4.39Å; V593-E624 HydrophobicContact CG2-CB 4.44Å; V593-E624 HydrophobicContact CG2-CG 3.96Å; Y620-E624 PolarHBondContact O-N 3.31Å; F621-E624 PolarHBondContact O-N 3.44Å; E624-S628 WeakPolarHBondContact O-CB 3.14Å; E624-S628 PolarHBondContact O-N 2.61Å; E624-S628 PolarHBondContact O-OG 3.41Å; E624-S628 VanDerWaalsContact O-OG 3.06Å
625	I	58.5	Low	53.3	Low	0 Å²	0	70.8 Å²	70.8	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-68.7	-44.8	174.9	-68.8	161.9	0	0	0	110.6	L596 Y613 F617 F621 R627 S628 I629	L596-I625 HydrophobicContact CB-CD1 3.54Å; L596-I625 HydrophobicContact CB-CG1 4.28Å; L596-I625 HydrophobicContact CD1-CD1 3.75Å; L596-I625 HydrophobicContact CG-CD1 4.29Å; Y613-I625 HydrophobicContact CD1-CG2 3.86Å; Y613-I625 HydrophobicContact CE1-CG2 3.91Å; F617-I625 HydrophobicContact CB-CD1 4.02Å; F617-I625 HydrophobicContact CD1-CD1 4.34Å; F617-I625 HydrophobicContact CD2-CD1 4.07Å; F617-I625 HydrophobicContact CG-CD1 3.88Å; F621-I625 HydrophobicContact CB-CD1 4.28Å; F621-I625 VanDerWaalsContact O-CB 3.28Å; F621-I625 WeakPolarHBondContact O-CB 3.4Å; F621-I625 VanDerWaalsContact O-CD1 3.26Å; F621-I625 WeakPolarHBondContact O-CD1 3.24Å; F621-I625 WeakPolarHBondContact O-CG1 3.47Å; F621-I625 PolarHBondContact O-N 3.22Å; I625-R627 VanDerWaalsContact C-N 3.35Å; I625-R627 PolarHBondContact O-N 3.26Å; I625-S628 WeakPolarHBondContact O-CB 3.46Å; I625-S628 PolarHBondContact O-N 2.86Å; I625-I629 HydrophobicContact CG2-CD1 3.54Å; I625-I629 HydrophobicContact CG2-CG1 4.29Å; I625-I629 WeakPolarHBondContact O-CB 3.29Å; I625-I629 VanDerWaalsContact O-CG1 3.28Å; I625-I629 WeakPolarHBondContact O-CG1 3.49Å; I625-I629 PolarHBondContact O-N 3.39Å
626	Y	58	Low	52	Low	103 Å²	103	70.5 Å²	70.5	40%	0.404	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-44.4	177.1	-177.2	-95.4	0	0	0	111.4	L610 Y613 G622 S628 I629 A630	L610-Y626 HydrophobicContact CB-CD2 4.33Å; L610-Y626 HydrophobicContact CB-CE2 4.36Å; L610-Y626 VanDerWaalsContact CD1-CB 3.49Å; L610-Y626 HydrophobicContact CD1-CD1 3.47Å; L610-Y626 VanDerWaalsContact CD1-CD1 3.47Å; L610-Y626 HydrophobicContact CD1-CD2 4Å; L610-Y626 HydrophobicContact CD1-CE1 4.15Å; L610-Y626 HydrophobicContact CD1-CG 3.37Å; Y613-Y626 HydrophobicContact CD2-CD2 4.26Å; G622-Y626 VanDerWaalsContact O-CB 3.32Å; G622-Y626 WeakPolarHBondContact O-CB 3.18Å; G622-Y626 PolarHBondContact O-N 2.8Å; Y626-S628 PolarHBondContact O-N 2.91Å; Y626-I629 PolarHBondContact O-N 3.33Å; Y626-A630 WeakPolarHBondContact O-CB 3.48Å; Y626-A630 PolarHBondContact O-N 3.32Å
627	R	59.9	Low	50.4	Low	161 Å²	161	74.7 Å²	74.7	61%	0.608	41%	0.414	S	S	*	.	H	α-helix	trans	-60.4	-46.2	174.5	-169.6	178.5	-172	139	3.5	112	S623 I625 I629 A630 E631	S623-R627 WeakPolarHBondContact O-CB 3.46Å; S623-R627 PolarHBondContact O-N 3.23Å; I625-R627 VanDerWaalsContact C-N 3.35Å; I625-R627 PolarHBondContact O-N 3.26Å; R627-I629 VanDerWaalsContact C-N 3.32Å; R627-I629 PolarHBondContact O-N 3.18Å; R627-A630 PolarHBondContact O-N 3.34Å; R627-E631 IonicContact NE-OE1 3.47Å; R627-E631 WeakPolarHBondContact O-CG 3.46Å; R627-E631 PolarHBondContact O-N 2.78Å; R627-E631 VanDerWaalsContact O-N 3.08Å
628	S	52.4	Low	48.9	Very low	10 Å²	10	82.5 Å²	82.5	7%	0.07	45%	0.45	C	S	.	.	H	α-helix	trans	-64.3	-28.9	177.8	-85.7	0	0	0	0	115.1	R597 E624 I625 Y626	R597-S628 PolarHBondContact NH2-OG 3.25Å; E624-S628 WeakPolarHBondContact O-CB 3.14Å; E624-S628 PolarHBondContact O-N 2.61Å; E624-S628 PolarHBondContact O-OG 3.41Å; E624-S628 VanDerWaalsContact O-OG 3.06Å; I625-S628 WeakPolarHBondContact O-CB 3.46Å; I625-S628 PolarHBondContact O-N 2.86Å; Y626-S628 PolarHBondContact O-N 2.91Å
629	I	56.1	Low	47.1	Very low	53 Å²	53	88.8 Å²	88.8	27%	0.272	48%	0.479	S	S	.	.	H	α-helix	trans	-87.4	-35.9	176.9	-67.7	171.2	0	0	0	110.2	R597 A600 Y613 I625 Y626 R627 E631 V632	R597-I629 HydrophobicContact CG-CG1 4.35Å; A600-I629 HydrophobicContact CB-CD1 4.18Å; Y613-I629 HydrophobicContact CE1-CD1 4.05Å; I625-I629 HydrophobicContact CG2-CD1 3.54Å; I625-I629 HydrophobicContact CG2-CG1 4.29Å; I625-I629 WeakPolarHBondContact O-CB 3.29Å; I625-I629 VanDerWaalsContact O-CG1 3.28Å; I625-I629 WeakPolarHBondContact O-CG1 3.49Å; I625-I629 PolarHBondContact O-N 3.39Å; Y626-I629 PolarHBondContact O-N 3.33Å; R627-I629 VanDerWaalsContact C-N 3.32Å; R627-I629 PolarHBondContact O-N 3.18Å; I629-E631 VanDerWaalsContact C-N 3.31Å; I629-E631 PolarHBondContact O-N 3.04Å; I629-V632 CarbonylContact O-C 3.6Å; I629-V632 PolarHBondContact O-N 3.34Å
630	A	54.8	Low	45.5	Very low	67 Å²	67	85.5 Å²	85.5	55%	0.554	47%	0.474	S	S	*	.	H	α-helix	trans	-64.8	-31.8	175.5	0	0	0	0	0	113	Y626 R627	Y626-A630 WeakPolarHBondContact O-CB 3.48Å; Y626-A630 PolarHBondContact O-N 3.32Å; R627-A630 PolarHBondContact O-N 3.34Å
631	E	51.8	Low	44.1	Very low	146 Å²	146	90.8 Å²	90.8	68%	0.682	50%	0.501	S	S	*	.	S	Bend	trans	-75.3	-23.1	174.1	-73.1	175.4	-173.2	0	0	113.2	R627 I629 G633	R627-E631 IonicContact NE-OE1 3.47Å; R627-E631 WeakPolarHBondContact O-CG 3.46Å; R627-E631 PolarHBondContact O-N 2.78Å; R627-E631 VanDerWaalsContact O-N 3.08Å; I629-E631 VanDerWaalsContact C-N 3.31Å; I629-E631 PolarHBondContact O-N 3.04Å; E631-G633 PolarHBondContact O-N 2.97Å
632	V	44.5	Very low	42.6	Very low	82 Å²	82	101 Å²	101	50%	0.497	55%	0.546	S	S	.	.	S	Bend	trans	-96.3	75.7	172.5	-174.3	0	0	0	0	107.7	I629	I629-V632 CarbonylContact O-C 3.6Å; I629-V632 PolarHBondContact O-N 3.34Å
633	G	32.6	Very low	41.1	Very low	49 Å²	49	104.6 Å²	104.6	51%	0.505	58%	0.583	S	S	.	*			trans	-47.6	152.8	177.6	0	0	0	0	0	112.7	E631 A635	E631-G633 PolarHBondContact O-N 2.97Å; G633-A635 PolarHBondContact O-N 3.46Å; G633-A635 VanDerWaalsContact O-N 3.13Å
634	P	31.9	Very low	39.7	Very low	111 Å²	111	107.8 Å²	107.8	72%	0.721	60%	0.602	S	S	*	*			trans	-66.8	121	-176.9	30.3	-32.1	0	0	0	108	V636	P634-V636 HydrophobicContact CB-CB 4.41Å; P634-V636 HydrophobicContact CB-CG2 3.75Å; P634-V636 HydrophobicContact CG-CG2 4.37Å; P634-V636 PolarHBondContact O-N 3.3Å
635	A	28	Very low	38.1	Very low	106 Å²	106	112.3 Å²	112.3	88%	0.876	62%	0.621	S	S	*	*			trans	-69.5	67.3	156.9	0	0	0	0	0	107.9	G633 Q637	G633-A635 PolarHBondContact O-N 3.46Å; G633-A635 VanDerWaalsContact O-N 3.13Å; A635-Q637 PolarHBondContact O-N 2.96Å
636	V	32.3	Very low	36.6	Very low	116 Å²	116	118.5 Å²	118.5	70%	0.703	65%	0.65	S	S	*	*			trans	-81.7	109.2	166.8	163.4	0	0	0	0	105.4	P634 H638	P634-V636 HydrophobicContact CB-CB 4.41Å; P634-V636 HydrophobicContact CB-CG2 3.75Å; P634-V636 HydrophobicContact CG-CG2 4.37Å; P634-V636 PolarHBondContact O-N 3.3Å; V636-H638 PolarHBondContact O-N 3.1Å
637	Q	26.2	Very low	35	Very low	169 Å²	169	121.5 Å²	121.5	79%	0.79	67%	0.665	S	S	*	*			trans	-49	124.9	162.2	-74.4	171.4	-34.9	0	0	108.5	A635 D639	A635-Q637 PolarHBondContact O-N 2.96Å; Q637-D639 PolarHBondContact O-N 3.26Å
638	H	24.3	Very low	33.3	Very low	168 Å²	168	124.5 Å²	124.5	78%	0.778	68%	0.676	S	S	*	*			trans	-79.4	67.7	178.7	-145.6	-70.4	0	0	0	108.6	V636 S640	V636-H638 PolarHBondContact O-N 3.1Å; H638-S640 PolarHBondContact O-N 3.33Å
639	D	25.5	Very low	32	Very low	151 Å²	151	133 Å²	133	81%	0.807	71%	0.713	S	S	*	*			trans	-89.7	86.4	166.4	-82.9	-17	0	0	0	108.9	Q637 E641	Q637-D639 PolarHBondContact O-N 3.26Å; D639-E641 PolarHBondContact O-N 3Å
640	S	23.7	Very low	30.4	Very low	91 Å²	91	135.2 Å²	135.2	64%	0.636	73%	0.732	S	S	*	*			trans	-73.7	98.7	162.7	49	0	0	0	0	109.6	H638	H638-S640 PolarHBondContact O-N 3.33Å
641	E	29.8	Very low	29	Very low	192 Å²	192	141.3 Å²	141.3	90%	0.897	75%	0.747	S	S	*	*			trans	-133.2	138.1	151.7	-76.9	-160.9	156.3	0	0	112.1	D639	D639-E641 PolarHBondContact O-N 3Å
642	K	25.4	Very low	27.6	Very low	217 Å²	217	140 Å²	140	94%	0.943	75%	0.753	S	S	*	*			trans	-84.3	148	-166.8	-62.7	165.7	172.7	173	0	110.5
643	G	27.3	Very low	26.6	Very low	75 Å²	75	139.8 Å²	139.8	77%	0.773	77%	0.768	S	S	*	*			trans	155.6	112.1	158.8	0	0	0	0	0	115.7
644	P	31.2	Very low	26.4	Very low	117 Å²	117	143.2 Å²	143.2	76%	0.76	78%	0.784	S	S	*	*			trans	-108.7	172.8	-170.3	37.7	-27.3	0	0	0	115.2
645	F	26.6	Very low	25.9	Very low	175 Å²	175	143.3 Å²	143.3	77%	0.768	79%	0.787	S	S	*	*			trans	100.8	108.5	158.1	-86.7	-95.6	0	0	0	122.3
646	Q	26.4	Very low	25.9	Very low	130 Å²	130	142.7 Å²	142.7	61%	0.607	78%	0.782	S	S	*	*				74	124.3	127	-88.6	-172.6	11	0	0	124.9
647	K	24.4	Very low	25.5	Very low	165 Å²	165	142.4 Å²	142.4	72%	0.717	78%	0.783	S	S	*	*			trans	72.8	143	142	-66.8	167.9	179.6	159.3	0	115.7
648	R	25.1	Very low	25.4	Very low	224 Å²	224	140.3 Å²	140.3	85%	0.845	78%	0.784	S	S	*	*			cis	-170.8	141.9	31.8	-146.4	173.6	-160.8	173.3	3.9	110.2
649	F	23.8	Very low	25.5	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.833	79%	0.787	S	S	*	*			trans	25.7	122.5	148	-75.3	-88.9	0	0	0	125.1
650	S	23.4	Very low	25.4	Very low	98 Å²	98	141.7 Å²	141.7	69%	0.685	79%	0.791	S	S	*	*				74.8	128.3	119.5	75.7	0	0	0	0	125.8
651	K	24.4	Very low	25.6	Very low	196 Å²	196	147.8 Å²	147.8	85%	0.852	80%	0.801	S	S	*	*			trans	94.8	112.9	134.2	-85.7	-177.7	-179.6	-177.7	0	122.3
652	S	22.9	Very low	25.4	Very low	117 Å²	117	144.2 Å²	144.2	82%	0.818	79%	0.794	S	S	*	*			trans	65.6	120.3	133.6	64.8	0	0	0	0	122.8
653	G	22.4	Very low	25.3	Very low	79 Å²	79	138.6 Å²	138.6	81%	0.814	79%	0.788	S	S	*	*			trans	115.5	100.7	130.5	0	0	0	0	0	116.9
654	S	28.4	Very low	25.3	Very low	121 Å²	121	140.4 Å²	140.4	85%	0.846	78%	0.784	S	S	*	*				179.9	145.2	129.7	-171	0	0	0	0	111.5
655	S	23.4	Very low	25.2	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	76%	0.761	S	S	*	*			trans	-64.9	135.4	-178.1	51.1	0	0	0	0	115.2
656	A	26	Very low	25.2	Very low	93 Å²	93	133.8 Å²	133.8	77%	0.769	76%	0.755	S	S	*	*			trans	-156	150.3	156.8	0	0	0	0	0	109.8
657	P	24.1	Very low	25.1	Very low	110 Å²	110	133 Å²	133	71%	0.714	76%	0.764	S	S	*	*			trans	-78	168.1	-153.2	33.6	-35.7	0	0	0	114.1	Q659	P657-Q659 PolarHBondContact O-N 3.38Å; P657-Q659 VanDerWaalsContact O-N 3.08Å
658	P	24.8	Very low	25.1	Very low	126 Å²	126	129.4 Å²	129.4	82%	0.818	76%	0.759	S	S	*	*			trans	-67.8	113.5	-176.4	29.1	-32.7	0	0	0	109.5	L660	P658-L660 PolarHBondContact O-N 3.43Å
659	Q	27.3	Very low	25.2	Very low	180 Å²	180	126.3 Å²	126.3	84%	0.841	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-68.2	122.6	172	-69.6	-157.8	-7.8	0	0	109.6	P657 Y661	P657-Q659 PolarHBondContact O-N 3.38Å; P657-Q659 VanDerWaalsContact O-N 3.08Å; Q659-Y661 PolarHBondContact O-N 2.93Å
660	L	22.9	Very low	25.3	Very low	168 Å²	168	123.4 Å²	123.4	88%	0.88	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-50.3	116.5	166.2	-78.3	140.3	0	0	0	110.2	P658	P658-L660 PolarHBondContact O-N 3.43Å
661	Y	26.9	Very low	25.4	Very low	218 Å²	218	122.7 Å²	122.7	86%	0.855	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-66.8	130.7	165.7	-73.6	-83.2	0	0	0	109.6	Q659 A663	Q659-Y661 PolarHBondContact O-N 2.93Å; Y661-A663 PolarHBondContact O-N 3.14Å
662	P	26.4	Very low	25.5	Very low	117 Å²	117	122.9 Å²	122.9	76%	0.76	74%	0.744	S	S	*	*			trans	-72.3	110.2	169	-5	20.6	0	0	0	109	V664	P662-V664 VanDerWaalsContact C-N 3.33Å; P662-V664 PolarHBondContact O-N 3.13Å
663	A	24.4	Very low	25.6	Very low	99 Å²	99	123.6 Å²	123.6	82%	0.818	75%	0.746	S	S	*	*			trans	-71.6	84.6	167.8	0	0	0	0	0	110.2	Y661	Y661-A663 PolarHBondContact O-N 3.14Å
664	V	26.5	Very low	25.8	Very low	113 Å²	113	124.9 Å²	124.9	69%	0.685	74%	0.742	S	S	*	*			trans	-140	95.1	167.2	-173	0	0	0	0	109.6	P662	P662-V664 VanDerWaalsContact C-N 3.33Å; P662-V664 PolarHBondContact O-N 3.13Å
665	M	28.8	Very low	25.7	Very low	57 Å²	57	124.7 Å²	124.7	28%	0.281	74%	0.739	S	S	.	*			trans	-65	126.2	152.6	-77.6	-71.4	-156.5	0	0	107.5	V550 V598 F602 S667	V550-M665 HydrophobicContact CG2-CE 3.6Å; V598-M665 HydrophobicContact CG1-CE 3.7Å; V598-M665 HydrophobicContact CG1-SD 4.32Å; F602-M665 HydrophobicContact CD2-CE 3.69Å; F602-M665 HydrophobicContact CD2-SD 3.74Å; F602-M665 HydrophobicContact CE1-SD 4.33Å; F602-M665 HydrophobicContact CE2-CE 4.05Å; F602-M665 HydrophobicContact CE2-SD 3.47Å; F602-M665 WeakPolarHBondContact CE2-SD 3.26Å; F602-M665 HydrophobicContact CG-CE 4.14Å; F602-M665 HydrophobicContact CG-SD 4.28Å; F602-M665 HydrophobicContact CZ-SD 3.8Å; M665-S667 PolarHBondContact O-N 3.42Å
666	P	25.6	Very low	25.8	Very low	97 Å²	97	125.3 Å²	125.3	63%	0.63	74%	0.74	S	S	*	*			trans	-65.1	114.2	177.6	24.5	-29.8	0	0	0	109.2	S668	P666-S668 VanDerWaalsContact C-N 3.27Å; P666-S668 PolarHBondContact O-N 2.64Å
667	S	24.7	Very low	25.8	Very low	113 Å²	113	125.6 Å²	125.6	79%	0.79	74%	0.742	S	S	*	*	S	Bend	trans	-70.9	79.2	174	-55.2	0	0	0	0	109.8	M665	M665-S667 PolarHBondContact O-N 3.42Å
668	S	25.3	Very low	26	Very low	90 Å²	90	126.7 Å²	126.7	63%	0.629	75%	0.747	S	S	*	*			trans	-179.9	88.1	165.1	167.4	0	0	0	0	111.2	P666	P666-S668 VanDerWaalsContact C-N 3.27Å; P666-S668 PolarHBondContact O-N 2.64Å
669	L	26.1	Very low	25.9	Very low	159 Å²	159	130 Å²	130	83%	0.832	75%	0.749	S	S	*	*			trans	-138.5	35.8	160.8	-76.4	-179.1	0	0	0	112.8
670	Y	27.6	Very low	26	Very low	128 Å²	128	132.6 Å²	132.6	50%	0.502	75%	0.752	S	S	.	*			trans	-133.9	67.4	165.1	-75.8	-79.1	0	0	0	110.3	R594	R594-Y670 WeakPolarHBondContact CD-OH 3.48Å; R594-Y670 PolarHBondContact NH1-OH 3.35Å; R594-Y670 VanDerWaalsContact NH1-OH 3.1Å
671	A	25.2	Very low	26	Very low	84 Å²	84	135 Å²	135	69%	0.694	75%	0.75	S	S	*	*			trans	-127	120.1	160.2	0	0	0	0	0	107.5
672	K	25.7	Very low	25.9	Very low	200 Å²	200	130.5 Å²	130.5	87%	0.87	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-59.8	142.5	165.8	-77.2	179.7	175.1	-179.8	0	108.4	S674	K672-S674 PolarHBondContact O-N 3.16Å
673	P	25.3	Very low	25.8	Very low	131 Å²	131	133.9 Å²	133.9	85%	0.851	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-73.3	116.8	-179.3	29.5	-31.8	0	0	0	110
674	S	25.8	Very low	26	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-83.5	145.3	153.3	44.2	0	0	0	0	108.9	K672	K672-S674 PolarHBondContact O-N 3.16Å
675	P	26.6	Very low	26	Very low	118 Å²	118	137.2 Å²	137.2	77%	0.766	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-71.8	160.3	-169.2	31	-35	0	0	0	112.3	A677	P675-A677 PolarHBondContact O-N 3.05Å
676	P	25.3	Very low	25.8	Very low	125 Å²	125	139.3 Å²	139.3	81%	0.812	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-76.5	121.7	-165	30.9	-32.2	0	0	0	111	T678	P676-T678 PolarHBondContact O-N 2.93Å
677	A	26.3	Very low	25.7	Very low	99 Å²	99	139.7 Å²	139.7	82%	0.818	78%	0.78	S	S	*	*			trans	-82	112.7	163.1	0	0	0	0	0	108.6	P675	P675-A677 PolarHBondContact O-N 3.05Å
678	T	29	Very low	25.8	Very low	133 Å²	133	138.2 Å²	138.2	82%	0.816	78%	0.782	S	S	*	*			trans	-53.7	134.6	172.5	32.2	0	0	0	0	112.6	P676 Y680	P676-T678 PolarHBondContact O-N 2.93Å; T678-Y680 PolarHBondContact O-N 3.44Å
679	F	23.3	Very low	25.7	Very low	194 Å²	194	145.7 Å²	145.7	85%	0.851	80%	0.796	S	S	*	*			trans	-49.6	125.5	162.1	-86.8	-99.2	0	0	0	111.3
680	Y	27.8	Very low	25.7	Very low	235 Å²	235	143.8 Å²	143.8	92%	0.922	80%	0.796	S	S	*	*			trans	-146.4	111.6	137.7	-96.2	-77	0	0	0	109.4	T678	T678-Y680 PolarHBondContact O-N 3.44Å
681	R	22.6	Very low	25.6	Very low	220 Å²	220	142.2 Å²	142.2	83%	0.83	80%	0.804	S	S	*	*			trans	-108.3	103.4	164.6	-175.9	-171.5	-176.5	171.8	5.4	106.6
682	N	25.1	Very low	25.7	Very low	122 Å²	122	143.6 Å²	143.6	65%	0.652	80%	0.804	S	S	*	*				170.8	126.7	116.6	-94.4	-32.6	0	0	0	114.2
683	K	25.1	Very low	25.9	Very low	189 Å²	189	144.2 Å²	144.2	82%	0.822	80%	0.802	S	S	*	*			trans	95.9	144.1	133.8	-76.5	-177.4	178.6	-177.1	0	119.9
684	P	27.7	Very low	26	Very low	110 Å²	110	141.9 Å²	141.9	71%	0.714	79%	0.794	S	S	*	*			trans	-107.4	166.5	-153.4	38.9	-26.3	0	0	0	112.1
685	I	27.6	Very low	26	Very low	172 Å²	172	144.7 Å²	144.7	88%	0.882	80%	0.801	S	S	*	*			trans	-168.6	147.1	145	-92.1	141.7	0	0	0	109.3
686	S	23.5	Very low	26	Very low	100 Å²	100	144.2 Å²	144.2	70%	0.699	80%	0.8	S	S	*	*			trans	-71.1	161.7	-176.2	59.2	0	0	0	0	116.6
687	A	24.8	Very low	26.2	Very low	106 Å²	106	142.5 Å²	142.5	88%	0.876	80%	0.797	S	S	*	*			trans	80.7	130.7	141.8	0	0	0	0	0	119.5
688	G	26.2	Very low	26.2	Very low	81 Å²	81	145.9 Å²	145.9	84%	0.835	80%	0.801	S	S	*	*			trans	154.2	99.4	159.6	0	0	0	0	0	114.9
689	R	23.8	Very low	26	Very low	247 Å²	247	144.2 Å²	144.2	93%	0.932	80%	0.795	S	S	*	*			trans	-60.9	148.3	172	-69.2	162	163.2	176	-6.4	112.5
690	S	26.4	Very low	26.2	Very low	119 Å²	119	144.5 Å²	144.5	83%	0.832	80%	0.799	S	S	*	*				165.2	140.2	102.3	62.1	0	0	0	0	113.3
691	S	24.1	Very low	26.2	Very low	96 Å²	96	138.6 Å²	138.6	67%	0.671	79%	0.787	S	S	*	*			trans	-71.4	160.9	177.2	52.7	0	0	0	0	115.6
692	T	27.6	Very low	26.6	Very low	112 Å²	112	133.9 Å²	133.9	69%	0.687	79%	0.785	S	S	*	*				166.7	155.5	100.1	40.6	0	0	0	0	114.8
693	Y	30.3	Very low	26.9	Very low	214 Å²	214	133.3 Å²	133.3	84%	0.839	79%	0.788	S	S	*	*			trans	78.6	107.8	166.5	-66.2	-79.7	0	0	0	117.9
694	A	26.4	Very low	27	Very low	82 Å²	82	131.4 Å²	131.4	68%	0.678	79%	0.792	S	S	*	*			cis	95.2	110.7	49.4	0	0	0	0	0	112.2
695	D	27.5	Very low	26.9	Very low	164 Å²	164	133.3 Å²	133.3	88%	0.877	80%	0.795	S	S	*	*				-175.3	164	113.2	-106.3	-22.7	0	0	0	112
696	S	25.6	Very low	26.9	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	79%	0.792	S	S	*	*			trans	-115.8	176.8	-143.4	-52.9	0	0	0	0	115
697	A	29.2	Very low	26.9	Very low	89 Å²	89	131 Å²	131	74%	0.736	80%	0.795	S	S	*	*			trans	84	130.8	161.6	0	0	0	0	0	116.3
698	D	26.5	Very low	26.8	Very low	169 Å²	169	129.8 Å²	129.8	90%	0.904	79%	0.785	S	S	*	*			cis	-137.5	155.2	34	-83.5	-46.9	0	0	0	114.9
699	S	25.6	Very low	26.9	Very low	98 Å²	98	132 Å²	132	69%	0.685	78%	0.783	S	S	*	*			trans	-121.1	136.4	-177.8	158.5	0	0	0	0	108.9
700	E	26.5	Very low	26.9	Very low	200 Å²	200	126.1 Å²	126.1	94%	0.935	77%	0.774	S	S	*	*			trans	-137.8	100.8	148.3	-77.6	-164.2	160.4	0	0	110.2
701	V	28.6	Very low	27	Very low	112 Å²	112	128.2 Å²	128.2	68%	0.679	77%	0.771	S	S	*	*			trans	-113.3	161.9	148.2	-159.6	0	0	0	0	104.4
702	P	30.4	Very low	27.1	Very low	120 Å²	120	131.1 Å²	131.1	78%	0.779	77%	0.774	S	S	*	*				-151.5	161.3	96.3	32.4	-11.7	0	0	0	117
703	P	32.8	Very low	27	Very low	111 Å²	111	130.6 Å²	130.6	72%	0.721	78%	0.775	S	S	*	*			trans	-92.7	169.3	176	38.8	-34.3	0	0	0	112.7
704	V	27.2	Very low	26.9	Very low	149 Å²	149	129.6 Å²	129.6	90%	0.903	78%	0.775	S	S	*	*			trans	-102.2	126.2	168.8	175.4	0	0	0	0	109.6
705	L	24.6	Very low	27	Very low	149 Å²	149	134.2 Å²	134.2	78%	0.78	78%	0.782	S	S	*	*			trans	-123	134.3	172.3	-159.5	99.8	0	0	0	108.2	T707	L705-T707 HydrophobicContact CD2-CG2 4.29Å
706	A	27.3	Very low	27	Very low	100 Å²	100	132.2 Å²	132.2	83%	0.826	78%	0.778	S	S	*	*			trans	-149.2	110.3	155	0	0	0	0	0	110.1
707	T	23.9	Very low	27.1	Very low	123 Å²	123	132.2 Å²	132.2	76%	0.755	79%	0.785	S	S	*	*			trans	-68	166.8	160.6	48.3	0	0	0	0	110.4	L705	L705-T707 HydrophobicContact CD2-CG2 4.29Å
708	A	23.2	Very low	27	Very low	82 Å²	82	137.3 Å²	137.3	68%	0.678	79%	0.79	S	S	*	*			cis	-164	159.6	11.8	0	0	0	0	0	106.7
709	T	27.5	Very low	26.8	Very low	128 Å²	128	135.2 Å²	135.2	79%	0.785	78%	0.783	S	S	*	*				-177.8	114.9	97.5	38.6	0	0	0	0	109.4
710	T	24	Very low	26.8	Very low	122 Å²	122	135.6 Å²	135.6	75%	0.748	78%	0.781	S	S	*	*				66.7	112.7	96.3	58.2	0	0	0	0	120.2
711	H	29.1	Very low	26.6	Very low	164 Å²	164	136.4 Å²	136.4	76%	0.759	78%	0.776	S	S	*	*			trans	144.4	141.2	144.5	-92.7	-87	0	0	0	108.3
712	E	26	Very low	26.4	Very low	156 Å²	156	140.3 Å²	140.3	73%	0.729	78%	0.784	S	S	*	*			cis	-173.2	138.9	-13.8	-141.9	178.2	172.4	0	0	108
713	S	25.2	Very low	26.1	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	79%	0.785	S	S	*	*			trans	63.4	113	152.4	78.7	0	0	0	0	123
714	K	28.6	Very low	25.9	Very low	193 Å²	193	140.9 Å²	140.9	84%	0.839	79%	0.788	S	S	*	*				153.9	118.7	110.5	-90.4	-175.3	176.6	178.2	0	114.1
715	E	27.5	Very low	25.8	Very low	179 Å²	179	138.3 Å²	138.3	84%	0.836	78%	0.782	S	S	*	*			trans	65	132.2	150.2	-63.1	-168.8	159.5	0	0	122.7
716	P	27.9	Very low	25.9	Very low	121 Å²	121	139 Å²	139	79%	0.786	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-89.5	132.4	170.3	35.1	-29.5	0	0	0	111.5	K718	P716-K718 PolarHBondContact O-N 3.27Å
717	A	27.6	Very low	25.9	Very low	109 Å²	109	143.2 Å²	143.2	90%	0.901	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70.7	122.6	175.7	0	0	0	0	0	111.5
718	K	26.5	Very low	26	Very low	196 Å²	196	145.8 Å²	145.8	85%	0.852	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-69.2	146.3	177.2	-78.3	167.5	174.5	168.8	0	112.4	P716	P716-K718 PolarHBondContact O-N 3.27Å
719	V	22.5	Very low	26	Very low	125 Å²	125	153.6 Å²	153.6	76%	0.758	80%	0.804	S	S	*	*			trans	-45.7	128.3	158.6	176.4	0	0	0	0	111.3	R721	V719-R721 HydrophobicContact CG1-CG 4.23Å
720	V	25.7	Very low	26	Very low	107 Å²	107	152.6 Å²	152.6	65%	0.648	80%	0.8	S	S	*	*			trans	-118.2	98.6	160.8	-176.2	0	0	0	0	107.9	F722	V720-F722 HydrophobicContact CG1-CD2 3.72Å; V720-F722 HydrophobicContact CG1-CE2 3.44Å; V720-F722 VanDerWaalsContact CG1-CE2 3.44Å; V720-F722 HydrophobicContact CG1-CG 4.44Å; V720-F722 HydrophobicContact CG1-CZ 3.94Å
721	R	22.1	Very low	26.3	Very low	217 Å²	217	156.1 Å²	156.1	82%	0.819	83%	0.83	S	S	*	*			trans	-81.9	113.9	161.4	-84.9	-180	174.4	153.8	-1.3	107.1	V719 T723	V719-R721 HydrophobicContact CG1-CG 4.23Å; R721-T723 PolarHBondContact O-N 3.24Å
722	F	24.7	Very low	26.2	Very low	193 Å²	193	155.8 Å²	155.8	85%	0.846	83%	0.833	S	S	*	*			trans	-81.4	101	163.2	-80	-81.1	0	0	0	108.8	V720	V720-F722 HydrophobicContact CG1-CD2 3.72Å; V720-F722 HydrophobicContact CG1-CE2 3.44Å; V720-F722 VanDerWaalsContact CG1-CE2 3.44Å; V720-F722 HydrophobicContact CG1-CG 4.44Å; V720-F722 HydrophobicContact CG1-CZ 3.94Å
723	T	23.8	Very low	26.2	Very low	129 Å²	129	155.7 Å²	155.7	79%	0.791	84%	0.839	S	S	*	*			trans	-87	105.1	159.3	48.2	0	0	0	0	107.6	R721	R721-T723 PolarHBondContact O-N 3.24Å
724	S	28.7	Very low	26.2	Very low	115 Å²	115	158.7 Å²	158.7	80%	0.804	85%	0.846	S	S	*	*			trans	-85.9	124.2	160.9	56	0	0	0	0	108.6	L726	S724-L726 PolarHBondContact O-N 3.37Å
725	A	25.5	Very low	26.1	Very low	94 Å²	94	156.7 Å²	156.7	78%	0.777	85%	0.846	S	S	*	*			trans	-65	122.8	180	0	0	0	0	0	110.8
726	L	26.2	Very low	26	Very low	164 Å²	164	155.3 Å²	155.3	86%	0.859	85%	0.847	S	S	*	*			trans	-94.9	98.4	154.5	-127.8	97.2	0	0	0	105.9	S724 Q728	S724-L726 PolarHBondContact O-N 3.37Å; L726-Q728 PolarHBondContact O-N 3.5Å
727	E	27.5	Very low	25.9	Very low	188 Å²	188	157.6 Å²	157.6	88%	0.879	85%	0.851	S	S	*	*			trans	-66	112	165.7	-84.7	-179.6	155	0	0	108.7
728	Q	27.2	Very low	25.8	Very low	178 Å²	178	161.1 Å²	161.1	83%	0.832	85%	0.847	S	S	*	*			trans	-72.2	120.1	162.2	-69.3	177.2	-16.7	0	0	108.2	L726 P730	L726-Q728 PolarHBondContact O-N 3.5Å; Q728-P730 WeakPolarHBondContact O-CD 2.86Å
729	R	21.2	Very low	25.7	Very low	245 Å²	245	158.4 Å²	158.4	93%	0.925	85%	0.847	S	S	*	*			trans	-73.4	130.4	154.1	-82.9	-176.7	175.6	177.4	-2.2	108.9
730	P	29.5	Very low	26	Very low	107 Å²	107	161.2 Å²	161.2	70%	0.695	85%	0.854	S	S	*	*			trans	-122.8	149.9	136.6	34.9	-24.7	0	0	0	110.3	Q728	Q728-P730 WeakPolarHBondContact O-CD 2.86Å
731	S	29.8	Very low	26	Very low	197 Å²	197	166.1 Å²	166.1	100%	1.378	87%	0.873	S	S	*	*			trans	69.3	0	-179.5	58.6	0	0	0	0	118.1

Retrieved 731 of 731 residues in 641.6 ms (Link to these results)

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