A0A096MDM6_POEFO Loading...

Sodium/potassium-transporting ATPase subunit beta-1-interacting protein

AlphaFold DB , UniProt , Accession A0A096MDM6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 209 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	47.2	Very low	71.8	Confident	236 Å²	236	65.3 Å²	65.3	100%	1.163	40%	0.401	S	S	*	.				0	-12.5	0	-83.4	171.6	160.9	0	0	114.5
2	G	49	Very low	73.2	Confident	46 Å²	46	71 Å²	71	47%	0.474	42%	0.416	S	S	.	.			trans	-77.5	-28.9	-178.9	0	0	0	0	0	116.9	C4 S5 G6	G2-C4 PolarHBondContact O-N 3.49Å; G2-S5 WeakPolarHBondContact O-CB 3.4Å; G2-S5 PolarHBondContact O-N 3.39Å; G2-G6 PolarHBondContact O-N 3.37Å
3	C	52.1	Low	74.5	Confident	41 Å²	41	66.5 Å²	66.5	28%	0.277	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-34.4	-174.8	-162.4	0	0	0	0	113.2	S5	C3-S5 VanDerWaalsContact C-N 3.34Å; C3-S5 PolarHBondContact O-N 3.5Å
4	C	59.7	Low	75.5	Confident	98 Å²	98	61.8 Å²	61.8	66%	0.662	36%	0.362	S	S	*	.	H	α-helix	trans	-69.8	-27.6	173.5	-68.8	0	0	0	0	113.4	G2 C8	G2-C4 PolarHBondContact O-N 3.49Å; C4-C8 PolarHBondContact O-SG 3.19Å; C4-C8 VanDerWaalsContact O-SG 3.32Å
5	S	75.1	Confident	76.5	Confident	75 Å²	75	61.6 Å²	61.6	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-74.1	-43.4	179.3	-167.6	0	0	0	0	111.4	G2 C3 R7 C8 T9	G2-S5 WeakPolarHBondContact O-CB 3.4Å; G2-S5 PolarHBondContact O-N 3.39Å; C3-S5 VanDerWaalsContact C-N 3.34Å; C3-S5 PolarHBondContact O-N 3.5Å; S5-R7 PolarHBondContact O-N 3.19Å; S5-C8 PolarHBondContact O-N 3.38Å; S5-T9 PolarHBondContact O-N 3.12Å; S5-T9 PolarHBondContact O-OG1 3.13Å
6	G	77.8	Confident	77.3	Confident	6 Å²	6	61.9 Å²	61.9	6%	0.062	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-40.5	-176.3	0	0	0	0	0	113.3	G2 T9 L10	G2-G6 PolarHBondContact O-N 3.37Å; G6-T9 PolarHBondContact O-N 3.48Å; G6-L10 WeakPolarHBondContact O-CB 3.37Å; G6-L10 PolarHBondContact O-N 3.43Å
7	R	80.6	Confident	78.1	Confident	32 Å²	32	58.8 Å²	58.8	12%	0.121	34%	0.342	C	S	.	.	H	α-helix	trans	-67.5	-44.2	177.6	-65.3	-179.9	-178	143.2	4.5	112.2	S5 T9 L10 I11 Y57 V168 E175	S5-R7 PolarHBondContact O-N 3.19Å; R7-T9 VanDerWaalsContact C-N 3.32Å; R7-T9 PolarHBondContact O-N 2.93Å; R7-L10 PolarHBondContact O-N 3.34Å; R7-I11 WeakPolarHBondContact O-CG1 3.02Å; R7-I11 PolarHBondContact O-N 2.93Å; R7-Y57 PolarHBondContact NH1-OH 3.42Å; R7-V168 HydrophobicContact CG-CG1 4.41Å; R7-V168 HydrophobicContact CG-CG2 4.31Å; R7-E175 IonicContact NH2-OE1 3.87Å; R7-E175 IonicContact NH2-OE2 3.47Å; R7-E175 PolarHBondContact NH2-OE2 3.05Å
8	C	85.1	Confident	78.7	Confident	85 Å²	85	57.1 Å²	57.1	57%	0.574	33%	0.331	S	S	*	.	H	α-helix	trans	-61.7	-40.8	174.9	-69.6	0	0	0	0	111.8	C4 S5 I11 F12	C4-C8 PolarHBondContact O-SG 3.19Å; C4-C8 VanDerWaalsContact O-SG 3.32Å; S5-C8 PolarHBondContact O-N 3.38Å; C8-I11 PolarHBondContact O-N 3.17Å; C8-F12 WeakPolarHBondContact O-CB 3.48Å; C8-F12 PolarHBondContact O-N 3.33Å
9	T	87.3	Confident	79.3	Confident	42 Å²	42	58.8 Å²	58.8	26%	0.258	34%	0.342	S	S	.	.	H	α-helix	trans	-64.5	-42.2	175.5	-56	0	0	0	0	111.7	S5 G6 R7 F12 I13 Y164	S5-T9 PolarHBondContact O-N 3.12Å; S5-T9 PolarHBondContact O-OG1 3.13Å; G6-T9 PolarHBondContact O-N 3.48Å; R7-T9 VanDerWaalsContact C-N 3.32Å; R7-T9 PolarHBondContact O-N 2.93Å; T9-F12 WeakPolarHBondContact O-CB 3.43Å; T9-F12 PolarHBondContact O-N 3.14Å; T9-I13 HydrophobicContact CG2-CD1 3.87Å; T9-I13 HydrophobicContact CG2-CG1 4.45Å; T9-I13 VanDerWaalsContact O-CG1 3.27Å; T9-I13 WeakPolarHBondContact O-CG1 3.37Å; T9-I13 PolarHBondContact O-N 3.14Å; T9-Y164 HydrophobicContact CG2-CD1 4.17Å; T9-Y164 HydrophobicContact CG2-CD2 4.33Å; T9-Y164 HydrophobicContact CG2-CE1 3.75Å; T9-Y164 HydrophobicContact CG2-CE2 3.94Å; T9-Y164 HydrophobicContact CG2-CG 4.44Å
10	L	86.9	Confident	79.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-42	177.1	-177	60.1	0	0	0	112	G6 R7 F12 I13 C14 T54 A165 V168	G6-L10 WeakPolarHBondContact O-CB 3.37Å; G6-L10 PolarHBondContact O-N 3.43Å; R7-L10 PolarHBondContact O-N 3.34Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.29Å; L10-I13 PolarHBondContact O-N 3.17Å; L10-C14 WeakPolarHBondContact O-CB 3.5Å; L10-C14 PolarHBondContact O-N 3.48Å; L10-C14 PolarHBondContact O-SG 3.33Å; L10-C14 VanDerWaalsContact O-SG 3.34Å; L10-T54 HydrophobicContact CD2-CG2 3.43Å; L10-T54 VanDerWaalsContact CD2-CG2 3.43Å; L10-T54 HydrophobicContact CG-CG2 4.06Å; L10-A165 HydrophobicContact CD1-CB 4.02Å; L10-A165 HydrophobicContact CD2-CB 4.22Å; L10-V168 HydrophobicContact CB-CG2 4.48Å; L10-V168 HydrophobicContact CD2-CB 4Å; L10-V168 HydrophobicContact CD2-CG1 4.27Å; L10-V168 HydrophobicContact CD2-CG2 3.82Å
11	I	88.9	Confident	80	Confident	56 Å²	56	54.6 Å²	54.6	29%	0.287	32%	0.317	S	S	.	.	H	α-helix	trans	-58.6	-47.8	173.7	-71.4	166.1	0	0	0	110.2	R7 C8 I13 C14 T15 L51 I55	R7-I11 WeakPolarHBondContact O-CG1 3.02Å; R7-I11 PolarHBondContact O-N 2.93Å; C8-I11 PolarHBondContact O-N 3.17Å; I11-I13 PolarHBondContact O-N 2.99Å; I11-C14 PolarHBondContact O-N 2.94Å; I11-T15 WeakPolarHBondContact O-CG2 3.35Å; I11-T15 PolarHBondContact O-N 3.3Å; I11-T15 PolarHBondContact O-OG1 3.44Å; I11-L51 HydrophobicContact CB-CD1 4.28Å; I11-L51 HydrophobicContact CG1-CD1 4.13Å; I11-L51 HydrophobicContact CG2-CD1 3.96Å; I11-I55 HydrophobicContact CD1-CG1 4.32Å
12	F	89.5	Confident	81.9	Confident	134 Å²	134	47.9 Å²	47.9	59%	0.588	29%	0.286	S	S	*	.	H	α-helix	trans	-59	-46.1	177.4	179.4	-99.6	0	0	0	111.8	C8 T9 L10 C14 T15 L16	C8-F12 WeakPolarHBondContact O-CB 3.48Å; C8-F12 PolarHBondContact O-N 3.33Å; T9-F12 WeakPolarHBondContact O-CB 3.43Å; T9-F12 PolarHBondContact O-N 3.14Å; L10-F12 VanDerWaalsContact C-N 3.34Å; L10-F12 PolarHBondContact O-N 3.29Å; F12-C14 PolarHBondContact O-N 3.41Å; F12-T15 WeakPolarHBondContact CA-OG1 3.47Å; F12-T15 PolarHBondContact O-N 3.45Å; F12-T15 PolarHBondContact O-OG1 3.11Å; F12-L16 WeakPolarHBondContact O-CB 3.47Å; F12-L16 PolarHBondContact O-N 3.27Å
13	I	89.6	Confident	83.6	Confident	12 Å²	12	49.5 Å²	49.5	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-44.8	177.5	-67.8	165	0	0	0	111	T9 L10 I11 T15 L16 Q17 V157 L160 Y164	T9-I13 HydrophobicContact CG2-CD1 3.87Å; T9-I13 HydrophobicContact CG2-CG1 4.45Å; T9-I13 VanDerWaalsContact O-CG1 3.27Å; T9-I13 WeakPolarHBondContact O-CG1 3.37Å; T9-I13 PolarHBondContact O-N 3.14Å; L10-I13 PolarHBondContact O-N 3.17Å; I11-I13 PolarHBondContact O-N 2.99Å; I13-T15 VanDerWaalsContact C-N 3.33Å; I13-T15 PolarHBondContact O-N 2.92Å; I13-L16 WeakPolarHBondContact O-CB 3.24Å; I13-L16 PolarHBondContact O-N 3.34Å; I13-Q17 HydrophobicContact CG2-CG 4.47Å; I13-Q17 WeakPolarHBondContact O-CG 3.45Å; I13-Q17 PolarHBondContact O-N 3.42Å; I13-V157 HydrophobicContact CG2-CG1 4.14Å; I13-L160 HydrophobicContact CD1-CB 4.29Å; I13-Y164 HydrophobicContact CD1-CD2 3.35Å; I13-Y164 HydrophobicContact CD1-CE2 3.84Å; I13-Y164 HydrophobicContact CD1-CG 3.99Å
14	C	88.9	Confident	84.9	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.007	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-40.5	176.7	-72.4	0	0	0	0	111.9	L10 I11 F12 L16 Q17 L18 V47 L51	L10-C14 WeakPolarHBondContact O-CB 3.5Å; L10-C14 PolarHBondContact O-N 3.48Å; L10-C14 PolarHBondContact O-SG 3.33Å; L10-C14 VanDerWaalsContact O-SG 3.34Å; I11-C14 PolarHBondContact O-N 2.94Å; F12-C14 PolarHBondContact O-N 3.41Å; C14-L16 VanDerWaalsContact C-N 3.35Å; C14-Q17 PolarHBondContact O-N 2.88Å; C14-L18 WeakPolarHBondContact O-CG 3.23Å; C14-L18 PolarHBondContact O-N 2.9Å; C14-V47 HydrophobicContact CB-CG1 4.15Å; C14-L51 HydrophobicContact CB-CD1 4.16Å
15	T	90.1	Very high	86	Confident	59 Å²	59	45 Å²	45	36%	0.362	25%	0.245	S	C	.	.	H	α-helix	trans	-64.6	-39.9	174.9	57.4	0	0	0	0	112.1	I11 F12 I13 L18 V19	I11-T15 WeakPolarHBondContact O-CG2 3.35Å; I11-T15 PolarHBondContact O-N 3.3Å; I11-T15 PolarHBondContact O-OG1 3.44Å; F12-T15 WeakPolarHBondContact CA-OG1 3.47Å; F12-T15 PolarHBondContact O-N 3.45Å; F12-T15 PolarHBondContact O-OG1 3.11Å; I13-T15 VanDerWaalsContact C-N 3.33Å; I13-T15 PolarHBondContact O-N 2.92Å; T15-L18 PolarHBondContact O-N 2.9Å; T15-V19 WeakPolarHBondContact O-CG2 3.48Å; T15-V19 PolarHBondContact O-N 3.16Å; T15-V19 VanDerWaalsContact O-N 3.1Å
16	L	89.7	Confident	86.2	Confident	66 Å²	66	45.5 Å²	45.5	35%	0.346	24%	0.244	S	C	.	.	H	α-helix	trans	-64.3	-41.3	175.3	-174.8	67.1	0	0	0	111.2	F12 I13 C14 L18 V19 L20 V157	F12-L16 WeakPolarHBondContact O-CB 3.47Å; F12-L16 PolarHBondContact O-N 3.27Å; I13-L16 WeakPolarHBondContact O-CB 3.24Å; I13-L16 PolarHBondContact O-N 3.34Å; C14-L16 VanDerWaalsContact C-N 3.35Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 PolarHBondContact O-N 3.47Å; L16-V19 PolarHBondContact O-N 2.92Å; L16-L20 HydrophobicContact CG-CD1 4.12Å; L16-L20 WeakPolarHBondContact O-CG 3.4Å; L16-L20 PolarHBondContact O-N 3.38Å; L16-V157 HydrophobicContact CD2-CG1 4.15Å; L16-V157 HydrophobicContact CD2-CG2 4.14Å; L16-V157 HydrophobicContact CG-CG1 4.43Å
17	Q	89.6	Confident	85.8	Confident	9 Å²	9	48.1 Å²	48.1	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-59.9	-42.7	174.7	-74.5	179.2	1.3	0	0	111.9	I13 C14 L20 A21 V47 Y65 V157	I13-Q17 HydrophobicContact CG2-CG 4.47Å; I13-Q17 WeakPolarHBondContact O-CG 3.45Å; I13-Q17 PolarHBondContact O-N 3.42Å; C14-Q17 PolarHBondContact O-N 2.88Å; Q17-L20 PolarHBondContact O-N 3.47Å; Q17-A21 WeakPolarHBondContact O-CB 3.4Å; Q17-A21 PolarHBondContact O-N 2.87Å; Q17-V47 HydrophobicContact CB-CG1 4.26Å; Q17-V47 HydrophobicContact CB-CG2 4.48Å; Q17-Y65 VanDerWaalsContact CD-OH 3.25Å; Q17-Y65 PolarHBondContact NE2-OH 3.02Å; Q17-Y65 PolarHBondContact OE1-OH 3.37Å; Q17-V157 HydrophobicContact CG-CB 4.49Å; Q17-V157 HydrophobicContact CG-CG1 3.46Å; Q17-V157 VanDerWaalsContact CG-CG1 3.46Å; Q17-V157 PolarHBondContact NE2-O 3.13Å
18	L	89.5	Confident	85.2	Confident	29 Å²	29	47.6 Å²	47.6	15%	0.152	25%	0.254	C	S	.	.	H	α-helix	trans	-61.6	-44.8	176.5	-71.5	172	0	0	0	111.9	C14 T15 L16 A21 L22 I44 V47 I48	C14-L18 WeakPolarHBondContact O-CG 3.23Å; C14-L18 PolarHBondContact O-N 2.9Å; T15-L18 PolarHBondContact O-N 2.9Å; L16-L18 VanDerWaalsContact C-N 3.34Å; L16-L18 PolarHBondContact O-N 3.47Å; L18-A21 PolarHBondContact O-N 3.1Å; L18-L22 WeakPolarHBondContact O-CB 3.4Å; L18-L22 VanDerWaalsContact O-CG 3.23Å; L18-L22 WeakPolarHBondContact O-CG 3.26Å; L18-L22 PolarHBondContact O-N 3.33Å; L18-I44 HydrophobicContact CD2-CG2 4.05Å; L18-V47 HydrophobicContact CD1-CG1 4.31Å; L18-V47 HydrophobicContact CD2-CB 3.87Å; L18-V47 HydrophobicContact CD2-CG1 3.72Å; L18-V47 HydrophobicContact CG-CB 4.35Å; L18-V47 HydrophobicContact CG-CG1 3.63Å; L18-I48 HydrophobicContact CD1-CG1 4.23Å; L18-I48 HydrophobicContact CD2-CD1 4.49Å; L18-I48 HydrophobicContact CD2-CG1 3.86Å
19	V	89.6	Confident	84.4	Confident	89 Å²	89	49.2 Å²	49.2	54%	0.539	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-48	178.2	173.9	0	0	0	0	110.7	T15 L16 A21 L22 E23	T15-V19 WeakPolarHBondContact O-CG2 3.48Å; T15-V19 PolarHBondContact O-N 3.16Å; T15-V19 VanDerWaalsContact O-N 3.1Å; L16-V19 PolarHBondContact O-N 2.92Å; V19-A21 VanDerWaalsContact C-N 3.32Å; V19-A21 PolarHBondContact O-N 3.06Å; V19-L22 PolarHBondContact O-N 2.92Å; V19-E23 WeakPolarHBondContact O-CB 3.15Å; V19-E23 PolarHBondContact O-N 3.3Å
20	L	87.7	Confident	83	Confident	30 Å²	30	50.8 Å²	50.8	16%	0.157	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-33.6	179	-68.4	173	0	0	0	112.9	L16 Q17 R24 V153 V157	L16-L20 HydrophobicContact CG-CD1 4.12Å; L16-L20 WeakPolarHBondContact O-CG 3.4Å; L16-L20 PolarHBondContact O-N 3.38Å; Q17-L20 PolarHBondContact O-N 3.47Å; L20-R24 WeakPolarHBondContact O-CB 3.48Å; L20-R24 PolarHBondContact O-N 2.89Å; L20-V153 HydrophobicContact CD1-CG1 4.08Å; L20-V153 HydrophobicContact CD2-CG1 4.44Å; L20-V157 HydrophobicContact CD1-CB 4.32Å; L20-V157 HydrophobicContact CD1-CG1 4.43Å; L20-V157 HydrophobicContact CD1-CG2 3.83Å
21	A	86.4	Confident	81.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-72.5	-38.8	175.6	0	0	0	0	0	111.7	Q17 L18 V19 R24 Q25 I44	Q17-A21 WeakPolarHBondContact O-CB 3.4Å; Q17-A21 PolarHBondContact O-N 2.87Å; L18-A21 PolarHBondContact O-N 3.1Å; V19-A21 VanDerWaalsContact C-N 3.32Å; V19-A21 PolarHBondContact O-N 3.06Å; A21-R24 PolarHBondContact O-N 3.36Å; A21-Q25 WeakPolarHBondContact O-CB 3.27Å; A21-Q25 PolarHBondContact O-N 3.27Å; A21-I44 HydrophobicContact CB-CD1 4.33Å; A21-I44 HydrophobicContact CB-CG1 3.78Å
22	L	87.2	Confident	79.9	Confident	95 Å²	95	55.6 Å²	55.6	50%	0.497	27%	0.274	S	S	.	.	H	α-helix	trans	-66.1	-43.7	174.9	-74.1	171.7	0	0	0	111.8	L18 V19 R24 Q25 V26 I44	L18-L22 WeakPolarHBondContact O-CB 3.4Å; L18-L22 VanDerWaalsContact O-CG 3.23Å; L18-L22 WeakPolarHBondContact O-CG 3.26Å; L18-L22 PolarHBondContact O-N 3.33Å; V19-L22 PolarHBondContact O-N 2.92Å; L22-R24 VanDerWaalsContact C-N 3.3Å; L22-R24 PolarHBondContact O-N 3.02Å; L22-Q25 PolarHBondContact O-N 2.83Å; L22-V26 WeakPolarHBondContact O-CG2 3.48Å; L22-V26 PolarHBondContact O-N 2.88Å; L22-I44 HydrophobicContact CD2-CD1 3.95Å; L22-I44 HydrophobicContact CG-CD1 4.46Å
23	E	84.9	Confident	78.7	Confident	79 Å²	79	51.2 Å²	51.2	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-55.7	-48	174.6	178.8	178.9	-175.7	0	0	110.8	V19 V26 F27 H150	V19-E23 WeakPolarHBondContact O-CB 3.15Å; V19-E23 PolarHBondContact O-N 3.3Å; E23-V26 PolarHBondContact O-N 3.48Å; E23-F27 HydrophobicContact CG-CD2 3.95Å; E23-F27 HydrophobicContact CG-CE2 3.47Å; E23-F27 VanDerWaalsContact CG-CE2 3.47Å; E23-F27 WeakPolarHBondContact O-CD2 3.31Å; E23-F27 PolarHBondContact O-N 3.06Å; E23-H150 IonicContact OE1-CE1 3.46Å; E23-H150 PolarHBondContact OE1-CE1 3.3Å
24	R	78.7	Confident	77.6	Confident	28 Å²	28	59.4 Å²	59.4	11%	0.106	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-44.7	174.8	-86.5	-102	-159.5	94.1	33.8	113.8	L20 A21 L22 V26 F27 D28 H150	L20-R24 WeakPolarHBondContact O-CB 3.48Å; L20-R24 PolarHBondContact O-N 2.89Å; A21-R24 PolarHBondContact O-N 3.36Å; L22-R24 VanDerWaalsContact C-N 3.3Å; L22-R24 PolarHBondContact O-N 3.02Å; R24-V26 VanDerWaalsContact C-N 3.25Å; R24-V26 PolarHBondContact O-N 3.28Å; R24-F27 PolarHBondContact O-N 3.32Å; R24-F27 VanDerWaalsContact O-N 3.1Å; R24-D28 PolarHBondContact O-N 2.85Å; R24-H150 VanDerWaalsContact NE-CB 3.26Å; R24-H150 PolarHBondContact NH2-O 3.31Å
25	Q	83.3	Confident	76.8	Confident	17 Å²	17	60.5 Å²	60.5	8%	0.079	30%	0.295	C	S	.	.	H	α-helix	trans	-57.3	-40.8	178.1	-175.3	67.2	47.1	0	0	111.6	A21 L22 D28 F29 I37	A21-Q25 WeakPolarHBondContact O-CB 3.27Å; A21-Q25 PolarHBondContact O-N 3.27Å; L22-Q25 PolarHBondContact O-N 2.83Å; Q25-D28 PolarHBondContact O-N 3.45Å; Q25-F29 HydrophobicContact CG-CD2 3.95Å; Q25-F29 HydrophobicContact CG-CE2 3.62Å; Q25-F29 WeakPolarHBondContact O-CD2 3.35Å; Q25-F29 PolarHBondContact O-N 3.37Å; Q25-I37 PolarHBondContact OE1-O 3.43Å
26	V	79.1	Confident	75.9	Confident	86 Å²	86	58.4 Å²	58.4	52%	0.521	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-44	176.3	172.4	0	0	0	0	110.9	L22 E23 R24 F29 L30	L22-V26 WeakPolarHBondContact O-CG2 3.48Å; L22-V26 PolarHBondContact O-N 2.88Å; E23-V26 PolarHBondContact O-N 3.48Å; R24-V26 VanDerWaalsContact C-N 3.25Å; R24-V26 PolarHBondContact O-N 3.28Å; V26-F29 PolarHBondContact O-N 3.44Å; V26-L30 WeakPolarHBondContact O-CG 3.37Å; V26-L30 PolarHBondContact O-N 3.04Å
27	F	68.6	Low	75.3	Confident	61 Å²	61	56.2 Å²	56.2	27%	0.268	27%	0.271	S	S	.	.	H	α-helix	trans	-67.6	-35.4	177.1	-68.6	-56.7	0	0	0	113.1	E23 R24 L30 G31 W107	E23-F27 HydrophobicContact CG-CD2 3.95Å; E23-F27 HydrophobicContact CG-CE2 3.47Å; E23-F27 VanDerWaalsContact CG-CE2 3.47Å; E23-F27 WeakPolarHBondContact O-CD2 3.31Å; E23-F27 PolarHBondContact O-N 3.06Å; R24-F27 PolarHBondContact O-N 3.32Å; R24-F27 VanDerWaalsContact O-N 3.1Å; F27-L30 HydrophobicContact CD1-CD1 4.26Å; F27-L30 WeakPolarHBondContact O-CB 3.4Å; F27-L30 PolarHBondContact O-N 3.34Å; F27-G31 PolarHBondContact O-N 3.34Å; F27-W107 HydrophobicContact CD1-CZ2 4.21Å; F27-W107 AromaticContact CD1-NE1 3.63Å; F27-W107 AromaticContact CE1-CZ2 3.61Å; F27-W107 HydrophobicContact CE1-CZ2 3.61Å; F27-W107 AromaticContact CE1-NE1 3.96Å; F27-W107 HydrophobicContact CZ-CZ2 4.04Å
28	D	69.2	Low	75	Confident	20 Å²	20	60.4 Å²	60.4	11%	0.107	29%	0.293	C	S	.	.	H	α-helix	trans	-69.6	-36.1	176.9	-63.4	-20.2	0	0	0	111.9	R24 Q25 L30 G31 Y32 I37 N40	R24-D28 PolarHBondContact O-N 2.85Å; Q25-D28 PolarHBondContact O-N 3.45Å; D28-L30 PolarHBondContact O-N 3.02Å; D28-G31 CarbonylContact O-C 3.53Å; D28-G31 PolarHBondContact O-N 3.15Å; D28-G31 VanDerWaalsContact O-N 3.15Å; D28-Y32 PolarHBondContact O-N 3.28Å; D28-I37 HydrophobicContact CB-CG1 3.66Å; D28-N40 PolarHBondContact OD2-ND2 3.14Å
29	F	68.4	Low	74.8	Confident	119 Å²	119	59.8 Å²	59.8	52%	0.522	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-34.2	171	-84.7	-58.5	0	0	0	112.2	Q25 V26 I37	Q25-F29 HydrophobicContact CG-CD2 3.95Å; Q25-F29 HydrophobicContact CG-CE2 3.62Å; Q25-F29 WeakPolarHBondContact O-CD2 3.35Å; Q25-F29 PolarHBondContact O-N 3.37Å; V26-F29 PolarHBondContact O-N 3.44Å; F29-I37 HydrophobicContact CD1-CD1 4.13Å; F29-I37 HydrophobicContact CE1-CD1 4.44Å; F29-I37 HydrophobicContact CE1-CG2 4.26Å; F29-I37 HydrophobicContact CZ-CG2 4.38Å
30	L	56.5	Low	74.7	Confident	75 Å²	75	55.8 Å²	55.8	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-74.5	-26.3	175.7	-66.8	169.4	0	0	0	112.5	V26 F27 D28 W106	V26-L30 WeakPolarHBondContact O-CG 3.37Å; V26-L30 PolarHBondContact O-N 3.04Å; F27-L30 HydrophobicContact CD1-CD1 4.26Å; F27-L30 WeakPolarHBondContact O-CB 3.4Å; F27-L30 PolarHBondContact O-N 3.34Å; D28-L30 PolarHBondContact O-N 3.02Å; L30-W106 HydrophobicContact CB-CB 3.67Å; L30-W106 HydrophobicContact CB-CG 4.01Å; L30-W106 HydrophobicContact CD1-CG 4.45Å
31	G	53.9	Low	74.8	Confident	3 Å²	3	59.7 Å²	59.7	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-93.9	-3.6	176.5	0	0	0	0	0	115.5	F27 D28 Q33 H103	F27-G31 PolarHBondContact O-N 3.34Å; D28-G31 CarbonylContact O-C 3.53Å; D28-G31 PolarHBondContact O-N 3.15Å; D28-G31 VanDerWaalsContact O-N 3.15Å; G31-Q33 PolarHBondContact O-N 3.29Å; G31-H103 PolarHBondContact O-ND1 3.35Å
32	Y	57.1	Low	74.9	Confident	156 Å²	156	64.3 Å²	64.3	61%	0.612	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	21.9	-178.4	-64	-84.9	0	0	0	115.8	D28 W34 H103	D28-Y32 PolarHBondContact O-N 3.28Å; Y32-W34 PolarHBondContact O-N 2.81Å; Y32-W34 VanDerWaalsContact O-N 3.17Å; Y32-H103 VanDerWaalsContact CB-CE1 3.44Å; Y32-H103 WeakPolarHBondContact CB-CE1 3.35Å; Y32-H103 WeakPolarHBondContact CB-ND1 3.46Å; Y32-H103 PolarHBondContact O-CE1 3.28Å; Y32-H103 PolarHBondContact O-ND1 3.49Å
33	Q	63.9	Low	75.1	Confident	42 Å²	42	60 Å²	60	20%	0.196	28%	0.281	C	S	.	.			trans	-81.3	99	-177.2	-63.3	-178.9	-20	0	0	111.4	G31 A35 P36 I37	G31-Q33 PolarHBondContact O-N 3.29Å; Q33-A35 PolarHBondContact O-N 2.94Å; Q33-P36 HydrophobicContact CB-CB 4.33Å; Q33-P36 HydrophobicContact CB-CG 3.79Å; Q33-P36 WeakPolarHBondContact O-CD 3.42Å; Q33-I37 WeakPolarHBondContact O-CB 3.41Å; Q33-I37 WeakPolarHBondContact O-CD1 3.27Å; Q33-I37 WeakPolarHBondContact O-CG1 3.29Å; Q33-I37 PolarHBondContact O-N 3.08Å; Q33-I37 VanDerWaalsContact O-N 3.09Å
34	W	68.1	Low	75.4	Confident	183 Å²	183	57.5 Å²	57.5	69%	0.693	27%	0.27	S	S	*	.	H	α-helix	trans	-60.5	-38.2	-173.8	-66	100.6	0	0	0	114.9	Y32 L38	Y32-W34 PolarHBondContact O-N 2.81Å; Y32-W34 VanDerWaalsContact O-N 3.17Å; W34-L38 WeakPolarHBondContact O-CB 3.43Å; W34-L38 PolarHBondContact O-N 3.34Å
35	A	70.4	Confident	76.1	Confident	25 Å²	25	59.3 Å²	59.3	21%	0.207	28%	0.281	C	S	.	.	H	α-helix	trans	-69.3	-49	-178.4	0	0	0	0	0	112.9	Q33 L38 A39	Q33-A35 PolarHBondContact O-N 2.94Å; A35-L38 PolarHBondContact O-N 3.26Å; A35-A39 WeakPolarHBondContact O-CB 3.5Å; A35-A39 PolarHBondContact O-N 3.4Å
36	P	72.7	Confident	76.5	Confident	15 Å²	15	59.8 Å²	59.8	10%	0.097	28%	0.284	C	S	.	.	H	α-helix	trans	-57.7	-42.3	169.1	-28.7	36.4	0	0	0	114.1	Q33 L38 A39 N40	Q33-P36 HydrophobicContact CB-CB 4.33Å; Q33-P36 HydrophobicContact CB-CG 3.79Å; Q33-P36 WeakPolarHBondContact O-CD 3.42Å; P36-L38 VanDerWaalsContact C-N 3.32Å; P36-L38 PolarHBondContact O-N 3.37Å; P36-A39 PolarHBondContact O-N 3.02Å; P36-N40 WeakPolarHBondContact O-CB 3.46Å; P36-N40 PolarHBondContact O-N 3.04Å; P36-N40 PolarHBondContact O-ND2 3.08Å
37	I	77.6	Confident	77.1	Confident	20 Å²	20	55.7 Å²	55.7	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-56.2	-47.9	175.5	-72.1	165.1	0	0	0	110.6	Q25 D28 F29 Q33 F41	Q25-I37 PolarHBondContact OE1-O 3.43Å; D28-I37 HydrophobicContact CB-CG1 3.66Å; F29-I37 HydrophobicContact CD1-CD1 4.13Å; F29-I37 HydrophobicContact CE1-CD1 4.44Å; F29-I37 HydrophobicContact CE1-CG2 4.26Å; F29-I37 HydrophobicContact CZ-CG2 4.38Å; Q33-I37 WeakPolarHBondContact O-CB 3.41Å; Q33-I37 WeakPolarHBondContact O-CD1 3.27Å; Q33-I37 WeakPolarHBondContact O-CG1 3.29Å; Q33-I37 PolarHBondContact O-N 3.08Å; Q33-I37 VanDerWaalsContact O-N 3.09Å; I37-F41 WeakPolarHBondContact O-CB 3.38Å; I37-F41 PolarHBondContact O-N 3.44Å
38	L	82.9	Confident	78.3	Confident	97 Å²	97	55.9 Å²	55.9	51%	0.508	26%	0.262	S	S	.	.	H	α-helix	trans	-66.8	-42.8	-179.3	-174.7	65.7	0	0	0	111.7	W34 A35 P36 F41 F42	W34-L38 WeakPolarHBondContact O-CB 3.43Å; W34-L38 PolarHBondContact O-N 3.34Å; A35-L38 PolarHBondContact O-N 3.26Å; P36-L38 VanDerWaalsContact C-N 3.32Å; P36-L38 PolarHBondContact O-N 3.37Å; L38-F41 PolarHBondContact O-N 3.42Å; L38-F42 HydrophobicContact CD1-CD2 4.14Å; L38-F42 HydrophobicContact CD1-CE2 3.52Å; L38-F42 HydrophobicContact CD1-CZ 4.16Å; L38-F42 HydrophobicContact CD2-CE2 4.11Å; L38-F42 HydrophobicContact CG-CD2 3.97Å; L38-F42 HydrophobicContact CG-CE2 3.57Å; L38-F42 WeakPolarHBondContact O-CD2 3.29Å; L38-F42 PolarHBondContact O-N 3.02Å; L38-F42 VanDerWaalsContact O-N 3.12Å
39	A	84.9	Confident	79.3	Confident	16 Å²	16	58 Å²	58	13%	0.132	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-45.1	179	0	0	0	0	0	112	A35 P36 F42 H43 W72 W75	A35-A39 WeakPolarHBondContact O-CB 3.5Å; A35-A39 PolarHBondContact O-N 3.4Å; P36-A39 PolarHBondContact O-N 3.02Å; A39-F42 PolarHBondContact O-N 3.19Å; A39-H43 PolarHBondContact O-N 3.14Å; A39-W72 HydrophobicContact CB-CZ3 4.11Å; A39-W72 WeakPolarHBondContact O-CZ3 3.43Å; A39-W75 HydrophobicContact CB-CZ2 4.1Å
40	N	87	Confident	80.3	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-38.5	176.6	-81.8	-46.4	0	0	0	112.1	D28 P36 F42 H43 I44 W72	D28-N40 PolarHBondContact OD2-ND2 3.14Å; P36-N40 WeakPolarHBondContact O-CB 3.46Å; P36-N40 PolarHBondContact O-N 3.04Å; P36-N40 PolarHBondContact O-ND2 3.08Å; N40-F42 PolarHBondContact O-N 3.27Å; N40-H43 WeakPolarHBondContact O-CB 3.36Å; N40-H43 PolarHBondContact O-N 2.96Å; N40-I44 WeakPolarHBondContact O-CG1 3.14Å; N40-I44 PolarHBondContact O-N 2.95Å; N40-W72 WeakPolarHBondContact OD1-CH2 3.49Å; N40-W72 WeakPolarHBondContact OD1-CZ2 3.49Å
41	F	89.1	Confident	81.9	Confident	112 Å²	112	50.2 Å²	50.2	49%	0.491	24%	0.237	S	C	.	.	H	α-helix	trans	-59.2	-47.6	174.6	-178	-104.4	0	0	0	112.4	I37 L38 H43 I44 I45	I37-F41 WeakPolarHBondContact O-CB 3.38Å; I37-F41 PolarHBondContact O-N 3.44Å; L38-F41 PolarHBondContact O-N 3.42Å; F41-H43 VanDerWaalsContact C-N 3.32Å; F41-H43 PolarHBondContact O-N 2.89Å; F41-I44 PolarHBondContact O-N 2.92Å; F41-I45 HydrophobicContact CD1-CD1 3.79Å; F41-I45 HydrophobicContact CE1-CD1 3.36Å; F41-I45 HydrophobicContact CE2-CD1 4.41Å; F41-I45 HydrophobicContact CG-CD1 4.49Å; F41-I45 HydrophobicContact CZ-CD1 3.72Å; F41-I45 WeakPolarHBondContact O-CG1 3.31Å; F41-I45 PolarHBondContact O-N 3.01Å
42	F	90.1	Very high	83.7	Confident	97 Å²	97	55 Å²	55	43%	0.425	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-39.7	174.8	-74.6	-61.4	0	0	0	112.1	L38 A39 N40 I44 I45 I46 W68	L38-F42 HydrophobicContact CD1-CD2 4.14Å; L38-F42 HydrophobicContact CD1-CE2 3.52Å; L38-F42 HydrophobicContact CD1-CZ 4.16Å; L38-F42 HydrophobicContact CD2-CE2 4.11Å; L38-F42 HydrophobicContact CG-CD2 3.97Å; L38-F42 HydrophobicContact CG-CE2 3.57Å; L38-F42 WeakPolarHBondContact O-CD2 3.29Å; L38-F42 PolarHBondContact O-N 3.02Å; L38-F42 VanDerWaalsContact O-N 3.12Å; A39-F42 PolarHBondContact O-N 3.19Å; N40-F42 PolarHBondContact O-N 3.27Å; F42-I44 PolarHBondContact O-N 3.32Å; F42-I45 PolarHBondContact O-N 3.32Å; F42-I46 WeakPolarHBondContact O-CG1 3.47Å; F42-I46 PolarHBondContact O-N 3.39Å; F42-W68 HydrophobicContact CB-CH2 3.88Å; F42-W68 HydrophobicContact CB-CZ2 3.74Å
43	H	91.3	Very high	85.1	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.028	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-46.3	177	-174.9	73.6	0	0	0	112.5	A39 N40 F41 I45 I46 V47 W68 W72	A39-H43 PolarHBondContact O-N 3.14Å; N40-H43 WeakPolarHBondContact O-CB 3.36Å; N40-H43 PolarHBondContact O-N 2.96Å; F41-H43 VanDerWaalsContact C-N 3.32Å; F41-H43 PolarHBondContact O-N 2.89Å; H43-I45 VanDerWaalsContact C-N 3.34Å; H43-I45 PolarHBondContact O-N 3.28Å; H43-I46 PolarHBondContact O-N 3.42Å; H43-V47 WeakPolarHBondContact O-CG2 3.34Å; H43-V47 PolarHBondContact O-N 3.46Å; H43-W68 AromaticContact ND1-CD1 3.9Å; H43-W68 AromaticContact ND1-NE1 3.42Å; H43-W68 PolarHBondContact ND1-NE1 3.29Å; H43-W72 HydrophobicContact CB-CD2 4.09Å; H43-W72 HydrophobicContact CB-CE3 3.79Å; H43-W72 HydrophobicContact CB-CH2 3.72Å; H43-W72 HydrophobicContact CB-CZ2 4.01Å; H43-W72 HydrophobicContact CB-CZ3 3.61Å; H43-W72 AromaticContact CD2-CE2 3.83Å; H43-W72 AromaticContact CD2-CZ2 3.95Å; H43-W72 AromaticContact CE1-CD1 3.32Å; H43-W72 AromaticContact CE1-CD2 3.72Å; H43-W72 AromaticContact CE1-CE2 3.68Å; H43-W72 AromaticContact CE1-CG 3.5Å; H43-W72 VanDerWaalsContact CE1-CG 3.5Å; H43-W72 AromaticContact CE1-NE1 3.4Å; H43-W72 PolarHBondContact CE1-NE1 3.07Å; H43-W72 AromaticContact CG-CD2 3.64Å; H43-W72 AromaticContact CG-CE2 3.56Å; H43-W72 AromaticContact CG-CE3 3.87Å; H43-W72 AromaticContact CG-CZ2 3.78Å; H43-W72 AromaticContact ND1-CD1 3.63Å; H43-W72 AromaticContact ND1-CD2 3.19Å; H43-W72 AromaticContact ND1-CE2 3.46Å; H43-W72 AromaticContact ND1-CE3 3.68Å; H43-W72 AromaticContact ND1-CG 3.32Å; H43-W72 VanDerWaalsContact ND1-CG 3.32Å; H43-W72 AromaticContact ND1-NE1 3.67Å; H43-W72 AromaticContact NE2-CD1 3.99Å; H43-W72 AromaticContact NE2-CE2 3.9Å; H43-W72 AromaticContact NE2-NE1 3.62Å
44	I	90.9	Very high	86.2	Confident	26 Å²	26	46 Å²	46	13%	0.133	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-46.4	177	-69.3	165.8	0	0	0	111.1	L18 A21 L22 N40 F41 F42 I46 V47 I48	L18-I44 HydrophobicContact CD2-CG2 4.05Å; A21-I44 HydrophobicContact CB-CD1 4.33Å; A21-I44 HydrophobicContact CB-CG1 3.78Å; L22-I44 HydrophobicContact CD2-CD1 3.95Å; L22-I44 HydrophobicContact CG-CD1 4.46Å; N40-I44 WeakPolarHBondContact O-CG1 3.14Å; N40-I44 PolarHBondContact O-N 2.95Å; F41-I44 PolarHBondContact O-N 2.92Å; F42-I44 PolarHBondContact O-N 3.32Å; I44-I46 PolarHBondContact O-N 3.34Å; I44-V47 PolarHBondContact O-N 3.24Å; I44-I48 HydrophobicContact CG2-CD1 3.79Å; I44-I48 HydrophobicContact CG2-CG1 4.5Å; I44-I48 VanDerWaalsContact O-CG1 3.27Å; I44-I48 WeakPolarHBondContact O-CG1 3.44Å; I44-I48 PolarHBondContact O-N 3.31Å
45	I	92.6	Very high	87.1	Confident	65 Å²	65	41.8 Å²	41.8	33%	0.333	21%	0.212	S	C	.	.	H	α-helix	trans	-59.2	-48.8	179.4	-67.6	166.5	0	0	0	110.9	F41 F42 H43 I48 L49	F41-I45 HydrophobicContact CD1-CD1 3.79Å; F41-I45 HydrophobicContact CE1-CD1 3.36Å; F41-I45 HydrophobicContact CE2-CD1 4.41Å; F41-I45 HydrophobicContact CG-CD1 4.49Å; F41-I45 HydrophobicContact CZ-CD1 3.72Å; F41-I45 WeakPolarHBondContact O-CG1 3.31Å; F41-I45 PolarHBondContact O-N 3.01Å; F42-I45 PolarHBondContact O-N 3.32Å; H43-I45 VanDerWaalsContact C-N 3.34Å; H43-I45 PolarHBondContact O-N 3.28Å; I45-I48 PolarHBondContact O-N 2.94Å; I45-L49 HydrophobicContact CG2-CD1 4.2Å; I45-L49 WeakPolarHBondContact O-CG 3.38Å; I45-L49 PolarHBondContact O-N 2.84Å
46	I	92.7	Very high	87.8	Confident	28 Å²	28	46 Å²	46	14%	0.144	23%	0.227	C	C	.	.	H	α-helix	trans	-68	-37.3	-177.5	-59.2	-62.8	0	0	0	111.7	F42 H43 I44 I48 L49 G50 V64 W68	F42-I46 WeakPolarHBondContact O-CG1 3.47Å; F42-I46 PolarHBondContact O-N 3.39Å; H43-I46 PolarHBondContact O-N 3.42Å; I44-I46 PolarHBondContact O-N 3.34Å; I46-I48 VanDerWaalsContact C-N 3.34Å; I46-I48 PolarHBondContact O-N 3.39Å; I46-L49 HydrophobicContact CD1-CD1 4.28Å; I46-L49 PolarHBondContact O-N 3.36Å; I46-G50 PolarHBondContact O-N 2.84Å; I46-V64 HydrophobicContact CD1-CG1 4.3Å; I46-V64 HydrophobicContact CG2-CG1 4.46Å; I46-W68 HydrophobicContact CB-CB 4.38Å; I46-W68 HydrophobicContact CB-CD2 4.32Å; I46-W68 HydrophobicContact CB-CG 3.85Å; I46-W68 HydrophobicContact CG1-CD2 3.87Å; I46-W68 HydrophobicContact CG1-CE3 4.42Å; I46-W68 HydrophobicContact CG1-CG 3.89Å; I46-W68 HydrophobicContact CG2-CB 3.53Å; I46-W68 HydrophobicContact CG2-CD2 4.39Å; I46-W68 HydrophobicContact CG2-CG 3.52Å
47	V	92.4	Very high	88.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-40.6	175.3	177.2	0	0	0	0	110.9	C14 Q17 L18 H43 I44 G50 L51 Y65	C14-V47 HydrophobicContact CB-CG1 4.15Å; Q17-V47 HydrophobicContact CB-CG1 4.26Å; Q17-V47 HydrophobicContact CB-CG2 4.48Å; L18-V47 HydrophobicContact CD1-CG1 4.31Å; L18-V47 HydrophobicContact CD2-CB 3.87Å; L18-V47 HydrophobicContact CD2-CG1 3.72Å; L18-V47 HydrophobicContact CG-CB 4.35Å; L18-V47 HydrophobicContact CG-CG1 3.63Å; H43-V47 WeakPolarHBondContact O-CG2 3.34Å; H43-V47 PolarHBondContact O-N 3.46Å; I44-V47 PolarHBondContact O-N 3.24Å; V47-G50 PolarHBondContact O-N 3.04Å; V47-L51 WeakPolarHBondContact O-CB 3.41Å; V47-L51 PolarHBondContact O-N 3.44Å; V47-Y65 HydrophobicContact CG2-CE2 4.11Å
48	I	92.3	Very high	88.4	Confident	64 Å²	64	57.8 Å²	57.8	33%	0.328	27%	0.269	S	S	.	.	H	α-helix	trans	-62.1	-45.2	174.5	-69.5	168.4	0	0	0	110.8	L18 I44 I45 I46 G50 L51 F52	L18-I48 HydrophobicContact CD1-CG1 4.23Å; L18-I48 HydrophobicContact CD2-CD1 4.49Å; L18-I48 HydrophobicContact CD2-CG1 3.86Å; I44-I48 HydrophobicContact CG2-CD1 3.79Å; I44-I48 HydrophobicContact CG2-CG1 4.5Å; I44-I48 VanDerWaalsContact O-CG1 3.27Å; I44-I48 WeakPolarHBondContact O-CG1 3.44Å; I44-I48 PolarHBondContact O-N 3.31Å; I45-I48 PolarHBondContact O-N 2.94Å; I46-I48 VanDerWaalsContact C-N 3.34Å; I46-I48 PolarHBondContact O-N 3.39Å; I48-G50 VanDerWaalsContact C-N 3.31Å; I48-G50 PolarHBondContact O-N 3.02Å; I48-L51 WeakPolarHBondContact O-CB 3.46Å; I48-L51 PolarHBondContact O-N 2.94Å; I48-F52 HydrophobicContact CG2-CD2 3.59Å; I48-F52 HydrophobicContact CG2-CE2 3.36Å; I48-F52 WeakPolarHBondContact O-CD2 3.42Å; I48-F52 PolarHBondContact O-N 3.48Å
49	L	91.4	Very high	88.4	Confident	65 Å²	65	54.7 Å²	54.7	34%	0.34	26%	0.255	S	S	.	.	H	α-helix	trans	-61.4	-40.6	175.6	-69.7	175.7	0	0	0	111.7	I45 I46 F52 G53	I45-L49 HydrophobicContact CG2-CD1 4.2Å; I45-L49 WeakPolarHBondContact O-CG 3.38Å; I45-L49 PolarHBondContact O-N 2.84Å; I46-L49 HydrophobicContact CD1-CD1 4.28Å; I46-L49 PolarHBondContact O-N 3.36Å; L49-F52 PolarHBondContact O-N 2.87Å; L49-G53 PolarHBondContact O-N 3.34Å
50	G	89.7	Confident	88.5	Confident	0 Å²	0	64 Å²	64	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-46.2	173.3	0	0	0	0	0	112.1	I46 V47 I48 G53 T54	I46-G50 PolarHBondContact O-N 2.84Å; V47-G50 PolarHBondContact O-N 3.04Å; I48-G50 VanDerWaalsContact C-N 3.31Å; I48-G50 PolarHBondContact O-N 3.02Å; G50-G53 WeakPolarHBondContact O-CA 3.41Å; G50-G53 PolarHBondContact O-N 3.27Å; G50-G53 VanDerWaalsContact O-N 3.12Å; G50-T54 WeakPolarHBondContact O-CG2 3.38Å; G50-T54 PolarHBondContact O-N 3.16Å
51	L	90.2	Very high	88.7	Confident	30 Å²	30	69.2 Å²	69.2	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-49.5	176.7	-175.3	68.4	0	0	0	111.4	I11 C14 V47 I48 G53 T54 I55	I11-L51 HydrophobicContact CB-CD1 4.28Å; I11-L51 HydrophobicContact CG1-CD1 4.13Å; I11-L51 HydrophobicContact CG2-CD1 3.96Å; C14-L51 HydrophobicContact CB-CD1 4.16Å; V47-L51 WeakPolarHBondContact O-CB 3.41Å; V47-L51 PolarHBondContact O-N 3.44Å; I48-L51 WeakPolarHBondContact O-CB 3.46Å; I48-L51 PolarHBondContact O-N 2.94Å; L51-G53 VanDerWaalsContact C-N 3.27Å; L51-G53 PolarHBondContact O-N 3.29Å; L51-T54 PolarHBondContact O-N 3.3Å; L51-T54 VanDerWaalsContact O-N 3.17Å; L51-T54 PolarHBondContact O-OG1 2.9Å; L51-I55 HydrophobicContact CD1-CD1 4.38Å; L51-I55 HydrophobicContact CG-CD1 4.12Å; L51-I55 WeakPolarHBondContact O-CG1 3.3Å; L51-I55 PolarHBondContact O-N 3.2Å
52	F	90	Very high	88.6	Confident	103 Å²	103	63.9 Å²	63.9	45%	0.452	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-38.5	174.1	-76.8	-59.7	0	0	0	112.3	I48 L49 T54 I55 Q56	I48-F52 HydrophobicContact CG2-CD2 3.59Å; I48-F52 HydrophobicContact CG2-CE2 3.36Å; I48-F52 WeakPolarHBondContact O-CD2 3.42Å; I48-F52 PolarHBondContact O-N 3.48Å; L49-F52 PolarHBondContact O-N 2.87Å; F52-T54 VanDerWaalsContact C-N 3.34Å; F52-T54 PolarHBondContact O-N 3.21Å; F52-I55 PolarHBondContact O-N 3.43Å; F52-Q56 VanDerWaalsContact O-CB 3.3Å; F52-Q56 WeakPolarHBondContact O-CB 3.39Å; F52-Q56 WeakPolarHBondContact O-CG 3.39Å; F52-Q56 PolarHBondContact O-N 3.38Å
53	G	87.6	Confident	88.6	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-57.3	-44.1	173.8	0	0	0	0	0	113.2	L49 G50 L51 Y57 R58	L49-G53 PolarHBondContact O-N 3.34Å; G50-G53 WeakPolarHBondContact O-CA 3.41Å; G50-G53 PolarHBondContact O-N 3.27Å; G50-G53 VanDerWaalsContact O-N 3.12Å; L51-G53 VanDerWaalsContact C-N 3.27Å; L51-G53 PolarHBondContact O-N 3.29Å; G53-Y57 PolarHBondContact O-N 2.89Å; G53-Y57 VanDerWaalsContact O-N 3.14Å; G53-R58 PolarHBondContact O-N 3.22Å
54	T	86.4	Confident	88.7	Confident	9 Å²	9	65.7 Å²	65.7	6%	0.055	30%	0.303	C	S	.	.	H	α-helix	trans	-70.2	-36.8	178.7	61.2	0	0	0	0	113.3	L10 G50 L51 F52 I62	L10-T54 HydrophobicContact CD2-CG2 3.43Å; L10-T54 VanDerWaalsContact CD2-CG2 3.43Å; L10-T54 HydrophobicContact CG-CG2 4.06Å; G50-T54 WeakPolarHBondContact O-CG2 3.38Å; G50-T54 PolarHBondContact O-N 3.16Å; L51-T54 PolarHBondContact O-N 3.3Å; L51-T54 VanDerWaalsContact O-N 3.17Å; L51-T54 PolarHBondContact O-OG1 2.9Å; F52-T54 VanDerWaalsContact C-N 3.34Å; F52-T54 PolarHBondContact O-N 3.21Å; T54-I62 HydrophobicContact CG2-CD1 4.04Å; T54-I62 HydrophobicContact CG2-CG1 4.14Å
55	I	86.7	Confident	88.7	Confident	96 Å²	96	64.7 Å²	64.7	49%	0.492	30%	0.297	S	S	.	.	H	α-helix	trans	-74.9	-40.4	179.3	-65.5	169.6	0	0	0	111.1	I11 L51 F52 Y57	I11-I55 HydrophobicContact CD1-CG1 4.32Å; L51-I55 HydrophobicContact CD1-CD1 4.38Å; L51-I55 HydrophobicContact CG-CD1 4.12Å; L51-I55 WeakPolarHBondContact O-CG1 3.3Å; L51-I55 PolarHBondContact O-N 3.2Å; F52-I55 PolarHBondContact O-N 3.43Å; I55-Y57 WeakPolarHBondContact O-CD2 3.42Å
56	Q	86.2	Confident	88.6	Confident	114 Å²	114	62.3 Å²	62.3	53%	0.533	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	4.3	-176.2	-62	-177.3	37.9	0	0	113.9	F52 R58	F52-Q56 VanDerWaalsContact O-CB 3.3Å; F52-Q56 WeakPolarHBondContact O-CB 3.39Å; F52-Q56 WeakPolarHBondContact O-CG 3.39Å; F52-Q56 PolarHBondContact O-N 3.38Å; Q56-R58 HydrophobicContact CB-CG 4.15Å; Q56-R58 PolarHBondContact O-N 2.95Å
57	Y	79.5	Confident	88.6	Confident	133 Å²	133	65.2 Å²	65.2	52%	0.522	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	38.7	-179.6	-69.3	-103.3	0	0	0	113.3	R7 G53 I55 P59	R7-Y57 PolarHBondContact NH1-OH 3.42Å; G53-Y57 PolarHBondContact O-N 2.89Å; G53-Y57 VanDerWaalsContact O-N 3.14Å; I55-Y57 WeakPolarHBondContact O-CD2 3.42Å; Y57-P59 VanDerWaalsContact O-CD 3.26Å; Y57-P59 WeakPolarHBondContact O-CD 3.35Å
58	R	83.7	Confident	88.7	Confident	148 Å²	148	68.3 Å²	68.3	56%	0.558	32%	0.316	S	S	*	.			trans	-105.6	94.6	-179.7	-71.9	-64.1	-167.1	165	2.1	109	G53 Q56 R60 Y61	G53-R58 PolarHBondContact O-N 3.22Å; Q56-R58 HydrophobicContact CB-CG 4.15Å; Q56-R58 PolarHBondContact O-N 2.95Å; R58-R60 PolarHBondContact O-N 3.34Å; R58-R60 VanDerWaalsContact O-N 3.1Å; R58-Y61 HydrophobicContact CB-CD2 3.57Å; R58-Y61 HydrophobicContact CB-CE2 4.01Å; R58-Y61 HydrophobicContact CG-CD2 4.38Å; R58-Y61 HydrophobicContact CG-CE2 4.36Å; R58-Y61 PolarHBondContact O-N 2.96Å; R58-Y61 VanDerWaalsContact O-N 3.14Å
59	P	82	Confident	88.6	Confident	32 Å²	32	65.3 Å²	65.3	21%	0.208	30%	0.302	C	S	.	.	H	α-helix	trans	-60	-29.5	-171.2	22.2	-33.4	0	0	0	112.9	Y57 Y61 I62 V63 I172	Y57-P59 VanDerWaalsContact O-CD 3.26Å; Y57-P59 WeakPolarHBondContact O-CD 3.35Å; P59-Y61 VanDerWaalsContact C-N 3.3Å; P59-Y61 PolarHBondContact O-N 3.38Å; P59-I62 PolarHBondContact O-N 2.86Å; P59-V63 WeakPolarHBondContact O-CG2 3.49Å; P59-V63 PolarHBondContact O-N 3.4Å; P59-I172 HydrophobicContact CB-CG2 4.26Å; P59-I172 HydrophobicContact CG-CG2 4.39Å
60	R	87.9	Confident	88.5	Confident	212 Å²	212	64.6 Å²	64.6	80%	0.8	31%	0.305	S	S	*	.	H	α-helix	trans	-54.9	-41	177.5	-61.5	-177.6	-174.4	163.3	1.7	113.3	R58 V64	R58-R60 PolarHBondContact O-N 3.34Å; R58-R60 VanDerWaalsContact O-N 3.1Å; R60-V64 WeakPolarHBondContact O-CG2 3.35Å; R60-V64 PolarHBondContact O-N 3.34Å
61	Y	90	Very high	88.5	Confident	113 Å²	113	69.4 Å²	69.4	44%	0.443	33%	0.33	S	S	.	.	H	α-helix	trans	-73.7	-32	178.4	-64.8	-65.4	0	0	0	112.3	R58 P59 V64 Y65	R58-Y61 HydrophobicContact CB-CD2 3.57Å; R58-Y61 HydrophobicContact CB-CE2 4.01Å; R58-Y61 HydrophobicContact CG-CD2 4.38Å; R58-Y61 HydrophobicContact CG-CE2 4.36Å; R58-Y61 PolarHBondContact O-N 2.96Å; R58-Y61 VanDerWaalsContact O-N 3.14Å; P59-Y61 VanDerWaalsContact C-N 3.3Å; P59-Y61 PolarHBondContact O-N 3.38Å; Y61-V64 PolarHBondContact O-N 2.79Å; Y61-Y65 PolarHBondContact O-N 2.71Å
62	I	88.3	Confident	88.5	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-70.4	-35.2	176.7	-48.6	176.7	0	0	0	110.5	T54 P59 Y65 T66 A165 V168 V169 I172	T54-I62 HydrophobicContact CG2-CD1 4.04Å; T54-I62 HydrophobicContact CG2-CG1 4.14Å; P59-I62 PolarHBondContact O-N 2.86Å; I62-Y65 PolarHBondContact O-N 2.85Å; I62-T66 PolarHBondContact O-N 3.17Å; I62-T66 PolarHBondContact O-OG1 3.37Å; I62-A165 HydrophobicContact CG2-CB 4.24Å; I62-V168 HydrophobicContact CD1-CG1 4.17Å; I62-V169 HydrophobicContact CB-CG2 3.91Å; I62-V169 HydrophobicContact CG2-CG2 3.46Å; I62-V169 VanDerWaalsContact CG2-CG2 3.46Å; I62-I172 HydrophobicContact CD1-CD1 3.88Å
63	V	89	Confident	88.5	Confident	68 Å²	68	64.6 Å²	64.6	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-64.7	-43.9	172.6	174.7	0	0	0	0	111.3	P59 Y65 T66 V67 V169	P59-V63 WeakPolarHBondContact O-CG2 3.49Å; P59-V63 PolarHBondContact O-N 3.4Å; V63-Y65 VanDerWaalsContact C-N 3.3Å; V63-Y65 PolarHBondContact O-N 2.71Å; V63-T66 VanDerWaalsContact CA-OG1 3.23Å; V63-T66 WeakPolarHBondContact CA-OG1 3.34Å; V63-T66 PolarHBondContact O-N 3.45Å; V63-T66 PolarHBondContact O-OG1 3.42Å; V63-V67 WeakPolarHBondContact O-CG2 3.31Å; V63-V67 PolarHBondContact O-N 3.5Å; V63-V67 VanDerWaalsContact O-N 3.08Å; V63-V169 HydrophobicContact CG2-CG1 4.31Å; V63-V169 HydrophobicContact CG2-CG2 4.4Å
64	V	92.5	Very high	88.4	Confident	73 Å²	73	67.5 Å²	67.5	44%	0.442	33%	0.333	S	S	.	.	H	α-helix	trans	-60.2	-43.5	174.9	172.7	0	0	0	0	110.8	I46 R60 Y61 W68	I46-V64 HydrophobicContact CD1-CG1 4.3Å; I46-V64 HydrophobicContact CG2-CG1 4.46Å; R60-V64 WeakPolarHBondContact O-CG2 3.35Å; R60-V64 PolarHBondContact O-N 3.34Å; Y61-V64 PolarHBondContact O-N 2.79Å; V64-W68 WeakPolarHBondContact O-CB 3.36Å; V64-W68 PolarHBondContact O-N 2.85Å
65	Y	92.4	Very high	88.3	Confident	4 Å²	4	71.1 Å²	71.1	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-60.6	-43.6	175.8	170.5	-97.3	0	0	0	112.9	Q17 V47 Y61 I62 V63 W68 A69 A165	Q17-Y65 VanDerWaalsContact CD-OH 3.25Å; Q17-Y65 PolarHBondContact NE2-OH 3.02Å; Q17-Y65 PolarHBondContact OE1-OH 3.37Å; V47-Y65 HydrophobicContact CG2-CE2 4.11Å; Y61-Y65 PolarHBondContact O-N 2.71Å; I62-Y65 PolarHBondContact O-N 2.85Å; V63-Y65 VanDerWaalsContact C-N 3.3Å; V63-Y65 PolarHBondContact O-N 2.71Å; Y65-W68 PolarHBondContact O-N 3.06Å; Y65-A69 WeakPolarHBondContact O-CB 3.37Å; Y65-A69 PolarHBondContact O-N 3.12Å; Y65-A165 HydrophobicContact CD1-CB 3.72Å; Y65-A165 HydrophobicContact CE1-CB 3.67Å
66	T	90.3	Very high	88.2	Confident	15 Å²	15	66.6 Å²	66.6	9%	0.092	32%	0.323	C	S	.	.	H	α-helix	trans	-65.2	-43.5	179.7	29.2	0	0	0	0	112.6	I62 V63 W68 A69 A70 F162 A165	I62-T66 PolarHBondContact O-N 3.17Å; I62-T66 PolarHBondContact O-OG1 3.37Å; V63-T66 VanDerWaalsContact CA-OG1 3.23Å; V63-T66 WeakPolarHBondContact CA-OG1 3.34Å; V63-T66 PolarHBondContact O-N 3.45Å; V63-T66 PolarHBondContact O-OG1 3.42Å; T66-W68 VanDerWaalsContact C-N 3.33Å; T66-W68 PolarHBondContact O-N 2.93Å; T66-A69 PolarHBondContact O-N 2.86Å; T66-A70 PolarHBondContact O-N 3.45Å; T66-F162 HydrophobicContact CG2-CD2 4.43Å; T66-A165 HydrophobicContact CG2-CB 3.38Å
67	V	92.6	Very high	88.1	Confident	90 Å²	90	64.4 Å²	64.4	55%	0.545	32%	0.317	S	S	.	.	H	α-helix	trans	-61.9	-44.2	175.1	174.7	0	0	0	0	110.7	V63 A70 L71	V63-V67 WeakPolarHBondContact O-CG2 3.31Å; V63-V67 PolarHBondContact O-N 3.5Å; V63-V67 VanDerWaalsContact O-N 3.08Å; V67-A70 PolarHBondContact O-N 2.94Å; V67-L71 PolarHBondContact O-N 2.99Å
68	W	93.6	Very high	88.1	Confident	64 Å²	64	62.1 Å²	62.1	24%	0.242	31%	0.31	C	S	.	.	H	α-helix	trans	-66	-37.9	177.8	-176.2	-102.9	0	0	0	113	F42 H43 I46 V64 Y65 T66 A70 L71 W72	F42-W68 HydrophobicContact CB-CH2 3.88Å; F42-W68 HydrophobicContact CB-CZ2 3.74Å; H43-W68 AromaticContact ND1-CD1 3.9Å; H43-W68 AromaticContact ND1-NE1 3.42Å; H43-W68 PolarHBondContact ND1-NE1 3.29Å; I46-W68 HydrophobicContact CB-CB 4.38Å; I46-W68 HydrophobicContact CB-CD2 4.32Å; I46-W68 HydrophobicContact CB-CG 3.85Å; I46-W68 HydrophobicContact CG1-CD2 3.87Å; I46-W68 HydrophobicContact CG1-CE3 4.42Å; I46-W68 HydrophobicContact CG1-CG 3.89Å; I46-W68 HydrophobicContact CG2-CB 3.53Å; I46-W68 HydrophobicContact CG2-CD2 4.39Å; I46-W68 HydrophobicContact CG2-CG 3.52Å; V64-W68 WeakPolarHBondContact O-CB 3.36Å; V64-W68 PolarHBondContact O-N 2.85Å; Y65-W68 PolarHBondContact O-N 3.06Å; T66-W68 VanDerWaalsContact C-N 3.33Å; T66-W68 PolarHBondContact O-N 2.93Å; W68-A70 VanDerWaalsContact C-N 3.26Å; W68-A70 PolarHBondContact O-N 3.24Å; W68-L71 HydrophobicContact CE3-CD1 4.13Å; W68-L71 HydrophobicContact CZ3-CD1 4.49Å; W68-L71 PolarHBondContact O-N 2.9Å; W68-L71 VanDerWaalsContact O-N 3.15Å; W68-W72 WeakPolarHBondContact O-CB 3.4Å; W68-W72 PolarHBondContact O-N 2.94Å
69	A	90	Very high	87.7	Confident	2 Å²	2	55.8 Å²	55.8	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-59.3	-38.4	176.9	0	0	0	0	0	111.6	Y65 T66 W72 V73 F162	Y65-A69 WeakPolarHBondContact O-CB 3.37Å; Y65-A69 PolarHBondContact O-N 3.12Å; T66-A69 PolarHBondContact O-N 2.86Å; A69-W72 PolarHBondContact O-N 3.3Å; A69-V73 WeakPolarHBondContact O-CG2 3.38Å; A69-V73 PolarHBondContact O-N 3.24Å; A69-F162 HydrophobicContact CB-CB 4.29Å; A69-F162 HydrophobicContact CB-CD2 4.27Å
70	A	90	Very high	87.3	Confident	50 Å²	50	55.8 Å²	55.8	41%	0.413	29%	0.285	S	S	.	.	H	α-helix	trans	-64.9	-44.5	174.3	0	0	0	0	0	112.3	T66 V67 W68 W72 V73 A74 F162	T66-A70 PolarHBondContact O-N 3.45Å; V67-A70 PolarHBondContact O-N 2.94Å; W68-A70 VanDerWaalsContact C-N 3.26Å; W68-A70 PolarHBondContact O-N 3.24Å; A70-W72 VanDerWaalsContact C-N 3.29Å; A70-W72 PolarHBondContact O-N 2.87Å; A70-V73 PolarHBondContact O-N 3.45Å; A70-A74 PolarHBondContact O-N 3.27Å; A70-F162 HydrophobicContact CB-CE2 4.43Å
71	L	90.2	Very high	86.7	Confident	101 Å²	101	48.2 Å²	48.2	53%	0.529	26%	0.264	S	S	.	.	H	α-helix	trans	-62.1	-38.4	174.3	-67.6	173.6	0	0	0	111.7	V67 W68 A74 W75	V67-L71 PolarHBondContact O-N 2.99Å; W68-L71 HydrophobicContact CE3-CD1 4.13Å; W68-L71 HydrophobicContact CZ3-CD1 4.49Å; W68-L71 PolarHBondContact O-N 2.9Å; W68-L71 VanDerWaalsContact O-N 3.15Å; L71-A74 PolarHBondContact O-N 3.46Å; L71-W75 WeakPolarHBondContact O-CB 3.39Å; L71-W75 PolarHBondContact O-N 3.47Å
72	W	90.6	Very high	85.6	Confident	7 Å²	7	44 Å²	44	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-66.4	-40.8	178.3	-171.6	-110.4	0	0	0	112.5	A39 N40 H43 W68 A69 A70 W75 N76	A39-W72 HydrophobicContact CB-CZ3 4.11Å; A39-W72 WeakPolarHBondContact O-CZ3 3.43Å; N40-W72 WeakPolarHBondContact OD1-CH2 3.49Å; N40-W72 WeakPolarHBondContact OD1-CZ2 3.49Å; H43-W72 HydrophobicContact CB-CD2 4.09Å; H43-W72 HydrophobicContact CB-CE3 3.79Å; H43-W72 HydrophobicContact CB-CH2 3.72Å; H43-W72 HydrophobicContact CB-CZ2 4.01Å; H43-W72 HydrophobicContact CB-CZ3 3.61Å; H43-W72 AromaticContact CD2-CE2 3.83Å; H43-W72 AromaticContact CD2-CZ2 3.95Å; H43-W72 AromaticContact CE1-CD1 3.32Å; H43-W72 AromaticContact CE1-CD2 3.72Å; H43-W72 AromaticContact CE1-CE2 3.68Å; H43-W72 AromaticContact CE1-CG 3.5Å; H43-W72 VanDerWaalsContact CE1-CG 3.5Å; H43-W72 AromaticContact CE1-NE1 3.4Å; H43-W72 PolarHBondContact CE1-NE1 3.07Å; H43-W72 AromaticContact CG-CD2 3.64Å; H43-W72 AromaticContact CG-CE2 3.56Å; H43-W72 AromaticContact CG-CE3 3.87Å; H43-W72 AromaticContact CG-CZ2 3.78Å; H43-W72 AromaticContact ND1-CD1 3.63Å; H43-W72 AromaticContact ND1-CD2 3.19Å; H43-W72 AromaticContact ND1-CE2 3.46Å; H43-W72 AromaticContact ND1-CE3 3.68Å; H43-W72 AromaticContact ND1-CG 3.32Å; H43-W72 VanDerWaalsContact ND1-CG 3.32Å; H43-W72 AromaticContact ND1-NE1 3.67Å; H43-W72 AromaticContact NE2-CD1 3.99Å; H43-W72 AromaticContact NE2-CE2 3.9Å; H43-W72 AromaticContact NE2-NE1 3.62Å; W68-W72 WeakPolarHBondContact O-CB 3.4Å; W68-W72 PolarHBondContact O-N 2.94Å; A69-W72 PolarHBondContact O-N 3.3Å; A70-W72 VanDerWaalsContact C-N 3.29Å; A70-W72 PolarHBondContact O-N 2.87Å; W72-W75 AromaticContact CZ3-CD1 3.95Å; W72-W75 PolarHBondContact O-N 3.02Å; W72-N76 PolarHBondContact NE1-ND2 3.44Å; W72-N76 PolarHBondContact O-N 3.1Å; W72-N76 PolarHBondContact O-ND2 3.25Å
73	V	88.6	Confident	84.5	Confident	25 Å²	25	45.2 Å²	45.2	15%	0.152	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-47.8	172.8	170.4	0	0	0	0	110	A69 A70 W75 N76 V77 I155 A158 L159	A69-V73 WeakPolarHBondContact O-CG2 3.38Å; A69-V73 PolarHBondContact O-N 3.24Å; A70-V73 PolarHBondContact O-N 3.45Å; V73-W75 VanDerWaalsContact C-N 3.3Å; V73-W75 PolarHBondContact O-N 3.43Å; V73-N76 PolarHBondContact O-N 3.17Å; V73-V77 HydrophobicContact CG1-CG2 4.34Å; V73-V77 VanDerWaalsContact O-CG2 3.31Å; V73-V77 WeakPolarHBondContact O-CG2 3.33Å; V73-V77 PolarHBondContact O-N 2.89Å; V73-I155 HydrophobicContact CG1-CG2 4.41Å; V73-A158 HydrophobicContact CG2-CB 3.75Å; V73-L159 HydrophobicContact CG1-CD2 4.38Å; V73-L159 HydrophobicContact CG2-CD2 4.19Å; V73-L159 HydrophobicContact CG2-CG 4.3Å
74	A	86.8	Confident	83.3	Confident	60 Å²	60	46.7 Å²	46.7	50%	0.496	26%	0.258	S	S	.	.	H	α-helix	trans	-59.3	-41.8	177.8	0	0	0	0	0	112	A70 L71 V77 F78	A70-A74 PolarHBondContact O-N 3.27Å; L71-A74 PolarHBondContact O-N 3.46Å; A74-V77 PolarHBondContact O-N 3.26Å; A74-F78 WeakPolarHBondContact O-CB 3.21Å; A74-F78 PolarHBondContact O-N 2.83Å
75	W	83.7	Confident	81.9	Confident	86 Å²	86	46.8 Å²	46.8	33%	0.326	26%	0.256	S	S	.	.	H	α-helix	trans	-60.7	-48.7	174.7	-179.2	-102.8	0	0	0	112.1	A39 L71 W72 V73 V77 F78 I79 L96	A39-W75 HydrophobicContact CB-CZ2 4.1Å; L71-W75 WeakPolarHBondContact O-CB 3.39Å; L71-W75 PolarHBondContact O-N 3.47Å; W72-W75 AromaticContact CZ3-CD1 3.95Å; W72-W75 PolarHBondContact O-N 3.02Å; V73-W75 VanDerWaalsContact C-N 3.3Å; V73-W75 PolarHBondContact O-N 3.43Å; W75-V77 VanDerWaalsContact C-N 3.33Å; W75-V77 PolarHBondContact O-N 3.43Å; W75-F78 HydrophobicContact CZ3-CD1 4.47Å; W75-F78 WeakPolarHBondContact O-CB 3.4Å; W75-F78 PolarHBondContact O-N 3.48Å; W75-I79 HydrophobicContact CZ2-CD1 4.22Å; W75-I79 WeakPolarHBondContact O-CG1 3.44Å; W75-I79 PolarHBondContact O-N 2.94Å; W75-L96 HydrophobicContact CH2-CD2 4.43Å
76	N	83.9	Confident	80.3	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-34.4	178.5	-79.2	-90.3	0	0	0	112.4	W72 V73 I79 I80 Q154 I155	W72-N76 PolarHBondContact NE1-ND2 3.44Å; W72-N76 PolarHBondContact O-N 3.1Å; W72-N76 PolarHBondContact O-ND2 3.25Å; V73-N76 PolarHBondContact O-N 3.17Å; N76-I79 PolarHBondContact O-N 3.34Å; N76-I80 WeakPolarHBondContact O-CG1 3.48Å; N76-I80 PolarHBondContact O-N 3.47Å; N76-Q154 PolarHBondContact OD1-OE1 3.32Å; N76-Q154 VanDerWaalsContact OD1-OE1 3.07Å; N76-I155 HydrophobicContact CB-CD1 3.76Å; N76-I155 HydrophobicContact CB-CG1 3.43Å; N76-I155 VanDerWaalsContact CB-CG1 3.43Å
77	V	83.7	Confident	78.2	Confident	68 Å²	68	53.8 Å²	53.8	41%	0.412	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-43.6	173	171.4	0	0	0	0	110.7	V73 A74 W75 I79 I80 C81 I155	V73-V77 HydrophobicContact CG1-CG2 4.34Å; V73-V77 VanDerWaalsContact O-CG2 3.31Å; V73-V77 WeakPolarHBondContact O-CG2 3.33Å; V73-V77 PolarHBondContact O-N 2.89Å; A74-V77 PolarHBondContact O-N 3.26Å; W75-V77 VanDerWaalsContact C-N 3.33Å; W75-V77 PolarHBondContact O-N 3.43Å; V77-I79 VanDerWaalsContact C-N 3.32Å; V77-I79 PolarHBondContact O-N 3.3Å; V77-I80 PolarHBondContact O-N 2.91Å; V77-C81 PolarHBondContact O-N 3.48Å; V77-C81 PolarHBondContact O-SG 3.2Å; V77-C81 VanDerWaalsContact O-SG 3.36Å; V77-I155 HydrophobicContact CG2-CD1 3.91Å
78	F	80.5	Confident	76.1	Confident	85 Å²	85	53.1 Å²	53.1	37%	0.373	32%	0.324	S	S	.	.	H	α-helix	trans	-58.3	-44.5	174.8	174.1	-101.9	0	0	0	111.7	A74 W75 I80 C81 F82 L96	A74-F78 WeakPolarHBondContact O-CB 3.21Å; A74-F78 PolarHBondContact O-N 2.83Å; W75-F78 HydrophobicContact CZ3-CD1 4.47Å; W75-F78 WeakPolarHBondContact O-CB 3.4Å; W75-F78 PolarHBondContact O-N 3.48Å; F78-I80 PolarHBondContact O-N 2.95Å; F78-C81 PolarHBondContact O-N 3.28Å; F78-F82 WeakPolarHBondContact O-CB 3.5Å; F78-F82 PolarHBondContact O-N 3.44Å; F78-L96 HydrophobicContact CE1-CD2 4.45Å
79	I	75.3	Confident	73.9	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.077	33%	0.33	C	S	.	.	H	α-helix	trans	-60.2	-44.4	175.2	-68	-66.3	0	0	0	111.3	W75 N76 V77 F82 Y83 L96	W75-I79 HydrophobicContact CZ2-CD1 4.22Å; W75-I79 WeakPolarHBondContact O-CG1 3.44Å; W75-I79 PolarHBondContact O-N 2.94Å; N76-I79 PolarHBondContact O-N 3.34Å; V77-I79 VanDerWaalsContact C-N 3.32Å; V77-I79 PolarHBondContact O-N 3.3Å; I79-F82 PolarHBondContact O-N 3.26Å; I79-Y83 HydrophobicContact CG2-CD2 3.54Å; I79-Y83 HydrophobicContact CG2-CE2 3.58Å; I79-Y83 WeakPolarHBondContact O-CD2 3.2Å; I79-Y83 PolarHBondContact O-N 2.91Å; I79-L96 HydrophobicContact CD1-CD1 4.45Å; I79-L96 HydrophobicContact CD1-CD2 4.23Å
80	I	74.2	Confident	71.6	Confident	31 Å²	31	56.3 Å²	56.3	16%	0.159	35%	0.35	C	S	.	.	H	α-helix	trans	-62.4	-45.7	176.2	-69.3	171	0	0	0	111.4	N76 V77 F78 F82 Y83 L84 I155	N76-I80 WeakPolarHBondContact O-CG1 3.48Å; N76-I80 PolarHBondContact O-N 3.47Å; V77-I80 PolarHBondContact O-N 2.91Å; F78-I80 PolarHBondContact O-N 2.95Å; I80-F82 VanDerWaalsContact C-N 3.3Å; I80-F82 PolarHBondContact O-N 2.86Å; I80-Y83 PolarHBondContact O-N 3.32Å; I80-L84 HydrophobicContact CG2-CD1 3.58Å; I80-L84 HydrophobicContact CG2-CG 4.17Å; I80-L84 WeakPolarHBondContact O-CB 3.18Å; I80-L84 WeakPolarHBondContact O-CG 3.5Å; I80-L84 PolarHBondContact O-N 2.92Å; I80-I155 HydrophobicContact CD1-CD1 3.39Å
81	C	74.4	Confident	69.7	Low	53 Å²	53	58.7 Å²	58.7	36%	0.358	35%	0.351	S	S	.	.	H	α-helix	trans	-61.7	-39.9	178	-68.7	0	0	0	0	112	V77 F78 D85 V86	V77-C81 PolarHBondContact O-N 3.48Å; V77-C81 PolarHBondContact O-SG 3.2Å; V77-C81 VanDerWaalsContact O-SG 3.36Å; F78-C81 PolarHBondContact O-N 3.28Å; C81-D85 PolarHBondContact O-N 2.98Å; C81-V86 PolarHBondContact O-N 2.91Å; C81-V86 VanDerWaalsContact O-N 3.17Å
82	F	67.5	Low	67.6	Low	25 Å²	25	62 Å²	62	11%	0.11	36%	0.363	C	S	.	.	H	α-helix	trans	-62.7	-46.1	174.2	-178	-90.4	0	0	0	111.7	F78 I79 I80 D85 L89 L96	F78-F82 WeakPolarHBondContact O-CB 3.5Å; F78-F82 PolarHBondContact O-N 3.44Å; I79-F82 PolarHBondContact O-N 3.26Å; I80-F82 VanDerWaalsContact C-N 3.3Å; I80-F82 PolarHBondContact O-N 2.86Å; F82-D85 PolarHBondContact O-N 3.33Å; F82-L89 HydrophobicContact CD2-CD2 4.38Å; F82-L96 HydrophobicContact CD1-CD1 3.46Å; F82-L96 VanDerWaalsContact CD1-CD1 3.46Å; F82-L96 HydrophobicContact CD2-CD1 3.97Å; F82-L96 HydrophobicContact CE1-CD1 3.4Å; F82-L96 VanDerWaalsContact CE1-CD1 3.4Å; F82-L96 HydrophobicContact CE2-CD1 3.9Å; F82-L96 HydrophobicContact CG-CD1 3.76Å; F82-L96 HydrophobicContact CZ-CD1 3.63Å; F82-L96 HydrophobicContact CZ-CG 4.5Å
83	Y	64.7	Low	65.4	Low	27 Å²	27	63.3 Å²	63.3	11%	0.106	37%	0.374	C	S	.	.	H	α-helix	trans	-72.6	-26.6	-180	-83.4	-65.3	0	0	0	114.3	I79 I80 Q144 E147	I79-Y83 HydrophobicContact CG2-CD2 3.54Å; I79-Y83 HydrophobicContact CG2-CE2 3.58Å; I79-Y83 WeakPolarHBondContact O-CD2 3.2Å; I79-Y83 PolarHBondContact O-N 2.91Å; I80-Y83 PolarHBondContact O-N 3.32Å; Y83-Q144 HydrophobicContact CD1-CG 4.13Å; Y83-Q144 PolarHBondContact O-NE2 3.46Å; Y83-E147 WeakPolarHBondContact CD1-OE2 3.47Å; Y83-E147 WeakPolarHBondContact CE1-OE2 3.43Å; Y83-E147 HydrophobicContact CE2-CB 4.33Å; Y83-E147 PolarHBondContact OH-OE1 3.45Å; Y83-E147 PolarHBondContact OH-OE2 2.69Å
84	L	64.9	Low	63.5	Low	98 Å²	98	66.7 Å²	66.7	51%	0.513	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	4.6	177.7	-66.7	178.5	0	0	0	113.5	I80 V86 V148	I80-L84 HydrophobicContact CG2-CD1 3.58Å; I80-L84 HydrophobicContact CG2-CG 4.17Å; I80-L84 WeakPolarHBondContact O-CB 3.18Å; I80-L84 WeakPolarHBondContact O-CG 3.5Å; I80-L84 PolarHBondContact O-N 2.92Å; L84-V86 HydrophobicContact CB-CG2 3.82Å; L84-V86 PolarHBondContact O-N 3.35Å; L84-V86 VanDerWaalsContact O-N 3.1Å; L84-V148 HydrophobicContact CD2-CG2 4.2Å; L84-V148 HydrophobicContact CG-CG2 4.4Å
85	D	62.7	Low	61.7	Low	75 Å²	75	70.2 Å²	70.2	40%	0.401	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	30.2	-175.6	-74.3	-53.3	0	0	0	112.9	C81 F82 K91	C81-D85 PolarHBondContact O-N 2.98Å; F82-D85 PolarHBondContact O-N 3.33Å; D85-K91 PolarHBondContact OD1-N 2.95Å
86	V	58.1	Low	60.1	Low	98 Å²	98	67.5 Å²	67.5	59%	0.594	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	116.4	-179.6	179	0	0	0	0	109	C81 L84	C81-V86 PolarHBondContact O-N 2.91Å; C81-V86 VanDerWaalsContact O-N 3.17Å; L84-V86 HydrophobicContact CB-CG2 3.82Å; L84-V86 PolarHBondContact O-N 3.35Å; L84-V86 VanDerWaalsContact O-N 3.1Å
87	G	46.7	Very low	58.6	Low	69 Å²	69	69.7 Å²	69.7	71%	0.711	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.4	12.1	175.3	0	0	0	0	0	115.6	L89	G87-L89 PolarHBondContact O-N 3.48Å
88	G	47.8	Very low	56.9	Low	76 Å²	76	74.8 Å²	74.8	78%	0.784	42%	0.423	S	S	*	.	S	Bend	trans	75	8.2	174.4	0	0	0	0	0	114.8	S90	G88-S90 PolarHBondContact O-N 2.9Å; G88-S90 VanDerWaalsContact O-N 3.16Å
89	L	47.1	Very low	54.9	Low	70 Å²	70	77.1 Å²	77.1	37%	0.366	44%	0.439	S	S	.	.			trans	-75.1	94.6	161.1	-94	82.2	0	0	0	107.3	F82 G87	F82-L89 HydrophobicContact CD2-CD2 4.38Å; G87-L89 PolarHBondContact O-N 3.48Å
90	S	43.2	Very low	53.5	Low	62 Å²	62	82.6 Å²	82.6	43%	0.434	47%	0.467	S	S	.	.			trans	-64.2	140	172.1	57.2	0	0	0	0	110.3	G88 E92 S93	G88-S90 PolarHBondContact O-N 2.9Å; G88-S90 VanDerWaalsContact O-N 3.16Å; S90-E92 PolarHBondContact O-N 2.99Å; S90-S93 PolarHBondContact O-N 3.41Å; S90-S93 PolarHBondContact O-OG 3.1Å
91	K	48.8	Very low	51.8	Low	100 Å²	100	85 Å²	85	44%	0.435	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41	-9.9	167.7	-145.1	172.9	-175.3	170.5	0	117.3	D85 Y143	D85-K91 PolarHBondContact OD1-N 2.95Å; K91-Y143 WeakPolarHBondContact CE-OH 3.27Å; K91-Y143 PolarHBondContact NZ-OH 3.07Å
92	E	46.9	Very low	50.3	Low	170 Å²	170	86.7 Å²	86.7	79%	0.794	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-2.2	175.5	-67	-173.5	163.1	0	0	114.6	S90 D94	S90-E92 PolarHBondContact O-N 2.99Å; E92-D94 PolarHBondContact O-N 3.4Å
93	S	44.8	Very low	49.4	Very low	35 Å²	35	87.9 Å²	87.9	25%	0.245	51%	0.511	C	S	.	.			trans	-81.6	102.8	-178.4	-45.2	0	0	0	0	110	S90 L95	S90-S93 PolarHBondContact O-N 3.41Å; S90-S93 PolarHBondContact O-OG 3.1Å; S93-L95 PolarHBondContact O-N 2.87Å
94	D	48.7	Very low	48.6	Very low	97 Å²	97	90.2 Å²	90.2	52%	0.519	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-56.2	16.7	175.1	-76.3	-40.1	0	0	0	116.2	E92 L96 T97 F98	E92-D94 PolarHBondContact O-N 3.4Å; D94-L96 VanDerWaalsContact C-N 3.32Å; D94-L96 PolarHBondContact O-N 3.01Å; D94-T97 PolarHBondContact O-N 2.78Å; D94-T97 VanDerWaalsContact O-N 3.14Å; D94-F98 PolarHBondContact O-N 3.01Å
95	L	47.4	Very low	47.7	Very low	134 Å²	134	86.1 Å²	86.1	70%	0.702	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-67.6	-27.1	-176.6	-83.2	166.4	0	0	0	113.7	S93	S93-L95 PolarHBondContact O-N 2.87Å
96	L	50.4	Low	46.8	Very low	28 Å²	28	86.9 Å²	86.9	15%	0.147	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-91.8	-4.5	174.7	-71.5	168.5	0	0	0	113	W75 F78 I79 F82 D94	W75-L96 HydrophobicContact CH2-CD2 4.43Å; F78-L96 HydrophobicContact CE1-CD2 4.45Å; I79-L96 HydrophobicContact CD1-CD1 4.45Å; I79-L96 HydrophobicContact CD1-CD2 4.23Å; F82-L96 HydrophobicContact CD1-CD1 3.46Å; F82-L96 VanDerWaalsContact CD1-CD1 3.46Å; F82-L96 HydrophobicContact CD2-CD1 3.97Å; F82-L96 HydrophobicContact CE1-CD1 3.4Å; F82-L96 VanDerWaalsContact CE1-CD1 3.4Å; F82-L96 HydrophobicContact CE2-CD1 3.9Å; F82-L96 HydrophobicContact CG-CD1 3.76Å; F82-L96 HydrophobicContact CZ-CD1 3.63Å; F82-L96 HydrophobicContact CZ-CG 4.5Å; D94-L96 VanDerWaalsContact C-N 3.32Å; D94-L96 PolarHBondContact O-N 3.01Å
97	T	53.5	Low	46.1	Very low	47 Å²	47	85.7 Å²	85.7	29%	0.288	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.8	0.9	-159.7	-26.1	0	0	0	0	114.5	D94 N99 I100 H103	D94-T97 PolarHBondContact O-N 2.78Å; D94-T97 VanDerWaalsContact O-N 3.14Å; T97-N99 PolarHBondContact O-N 2.95Å; T97-I100 PolarHBondContact O-N 3.39Å; T97-H103 VanDerWaalsContact CG2-CD2 3.43Å; T97-H103 WeakPolarHBondContact CG2-CD2 3.2Å
98	F	46.5	Very low	46.2	Very low	176 Å²	176	83.5 Å²	83.5	77%	0.772	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.7	33.1	172.2	-91.2	-72.6	0	0	0	114.9	D94 I100	D94-F98 PolarHBondContact O-N 3.01Å; F98-I100 WeakPolarHBondContact O-CG1 3.15Å; F98-I100 PolarHBondContact O-N 2.98Å
99	N	39	Very low	46.3	Very low	133 Å²	133	84.6 Å²	84.6	71%	0.711	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	36.1	175.1	-163.7	5.6	0	0	0	115.1	T97	T97-N99 PolarHBondContact O-N 2.95Å
100	I	46.3	Very low	46.4	Very low	130 Å²	130	85.9 Å²	85.9	67%	0.667	45%	0.447	S	S	*	.	S	Bend	trans	-137.3	103.5	176.1	-63.2	167.8	0	0	0	107.7	T97 F98	T97-I100 PolarHBondContact O-N 3.39Å; F98-I100 WeakPolarHBondContact O-CG1 3.15Å; F98-I100 PolarHBondContact O-N 2.98Å
101	S	38.3	Very low	46.7	Very low	81 Å²	81	83.2 Å²	83.2	57%	0.566	43%	0.429	S	S	*	.	S	Bend	trans	80.8	134.3	169.1	79.9	0	0	0	0	117.6	H103	S101-H103 PolarHBondContact O-CD2 3.4Å; S101-H103 PolarHBondContact O-N 3.46Å; S101-H103 PolarHBondContact OG-NE2 3.4Å
102	A	42.4	Very low	46.5	Very low	90 Å²	90	82.6 Å²	82.6	74%	0.744	44%	0.436	S	S	*	.			trans	-67.8	118.4	176.1	0	0	0	0	0	110
103	H	48	Very low	46.4	Very low	50 Å²	50	77.5 Å²	77.5	23%	0.231	43%	0.429	C	S	.	.			trans	-103.5	107	-178.1	-74.7	-81.8	0	0	0	111.1	G31 Y32 T97 S101	G31-H103 PolarHBondContact O-ND1 3.35Å; Y32-H103 VanDerWaalsContact CB-CE1 3.44Å; Y32-H103 WeakPolarHBondContact CB-CE1 3.35Å; Y32-H103 WeakPolarHBondContact CB-ND1 3.46Å; Y32-H103 PolarHBondContact O-CE1 3.28Å; Y32-H103 PolarHBondContact O-ND1 3.49Å; T97-H103 VanDerWaalsContact CG2-CD2 3.43Å; T97-H103 WeakPolarHBondContact CG2-CD2 3.2Å; S101-H103 PolarHBondContact O-CD2 3.4Å; S101-H103 PolarHBondContact O-N 3.46Å; S101-H103 PolarHBondContact OG-NE2 3.4Å
104	H	48.4	Very low	46.6	Very low	75 Å²	75	77.5 Å²	77.5	35%	0.347	43%	0.428	S	S	.	.			trans	-89.5	127.7	158.4	-73.1	-86.4	0	0	0	107.8	S108 E109	H104-S108 PolarHBondContact ND1-OG 3.38Å; H104-E109 HydrophobicContact CB-CG 4.26Å
105	S	45.7	Very low	46.6	Very low	13 Å²	13	78 Å²	78	9%	0.091	43%	0.434	C	S	.	.			trans	-62.4	150	171.6	60.9	0	0	0	0	109.5	W107 S108 E109	S105-W107 PolarHBondContact O-N 3.2Å; S105-W107 VanDerWaalsContact O-N 3.07Å; S105-S108 VanDerWaalsContact O-CA 3.31Å; S105-S108 WeakPolarHBondContact O-CA 3.15Å; S105-S108 WeakPolarHBondContact O-CB 3.15Å; S105-S108 PolarHBondContact O-N 3.47Å; S105-S108 PolarHBondContact OG-N 3Å; S105-E109 PolarHBondContact O-N 2.95Å
106	W	44.3	Very low	46.6	Very low	90 Å²	90	80.6 Å²	80.6	34%	0.341	44%	0.435	S	S	.	.	H	α-helix	trans	-54.9	-32.8	179.2	-178.9	90.6	0	0	0	112.8	L30 S108 E109 H110	L30-W106 HydrophobicContact CB-CB 3.67Å; L30-W106 HydrophobicContact CB-CG 4.01Å; L30-W106 HydrophobicContact CD1-CG 4.45Å; W106-S108 VanDerWaalsContact C-N 3.32Å; W106-S108 PolarHBondContact O-N 3.31Å; W106-E109 PolarHBondContact O-N 3.46Å; W106-E109 VanDerWaalsContact O-N 3.09Å; W106-H110 AromaticContact CD1-ND1 3.88Å; W106-H110 HydrophobicContact CD2-CB 3.97Å; W106-H110 AromaticContact CE2-CG 3.79Å; W106-H110 AromaticContact CE2-ND1 3.89Å; W106-H110 HydrophobicContact CE3-CB 4.11Å; W106-H110 HydrophobicContact CH2-CB 3.72Å; W106-H110 HydrophobicContact CZ2-CB 3.55Å; W106-H110 AromaticContact CZ2-CG 3.87Å; W106-H110 HydrophobicContact CZ3-CB 3.99Å; W106-H110 AromaticContact NE1-CG 3.9Å; W106-H110 AromaticContact NE1-ND1 3.57Å; W106-H110 PolarHBondContact O-N 3Å
107	W	44	Very low	46.2	Very low	73 Å²	73	89.8 Å²	89.8	28%	0.277	47%	0.468	S	S	.	.	H	α-helix	trans	-68.4	-26.1	172.6	-63.2	102.4	0	0	0	113.8	F27 S105 E109 G111 P112 I146	F27-W107 HydrophobicContact CD1-CZ2 4.21Å; F27-W107 AromaticContact CD1-NE1 3.63Å; F27-W107 AromaticContact CE1-CZ2 3.61Å; F27-W107 HydrophobicContact CE1-CZ2 3.61Å; F27-W107 AromaticContact CE1-NE1 3.96Å; F27-W107 HydrophobicContact CZ-CZ2 4.04Å; S105-W107 PolarHBondContact O-N 3.2Å; S105-W107 VanDerWaalsContact O-N 3.07Å; W107-E109 PolarHBondContact O-N 2.71Å; W107-G111 WeakPolarHBondContact O-CA 3.33Å; W107-G111 PolarHBondContact O-N 3.35Å; W107-G111 VanDerWaalsContact O-N 3.11Å; W107-P112 HydrophobicContact CZ3-CG 4.37Å; W107-I146 HydrophobicContact CD2-CD1 4.34Å; W107-I146 HydrophobicContact CE3-CD1 4.23Å
108	S	49.1	Very low	45.7	Very low	24 Å²	24	95.5 Å²	95.5	17%	0.168	49%	0.491	C	S	.	.	H	α-helix	trans	-64.1	-27.6	168.2	-177.3	0	0	0	0	111.8	H104 S105 W106 V136	H104-S108 PolarHBondContact ND1-OG 3.38Å; S105-S108 VanDerWaalsContact O-CA 3.31Å; S105-S108 WeakPolarHBondContact O-CA 3.15Å; S105-S108 WeakPolarHBondContact O-CB 3.15Å; S105-S108 PolarHBondContact O-N 3.47Å; S105-S108 PolarHBondContact OG-N 3Å; W106-S108 VanDerWaalsContact C-N 3.32Å; W106-S108 PolarHBondContact O-N 3.31Å; S108-V136 WeakPolarHBondContact O-CB 3.48Å; S108-V136 WeakPolarHBondContact O-CG2 3.45Å
109	E	49.2	Very low	45.3	Very low	99 Å²	99	93.6 Å²	93.6	46%	0.463	49%	0.486	S	S	.	.	H	α-helix	trans	-103.9	-28.7	-178.5	-65.1	-168.3	167.3	0	0	114	H104 S105 W106 W107	H104-E109 HydrophobicContact CB-CG 4.26Å; S105-E109 PolarHBondContact O-N 2.95Å; W106-E109 PolarHBondContact O-N 3.46Å; W106-E109 VanDerWaalsContact O-N 3.09Å; W107-E109 PolarHBondContact O-N 2.71Å
110	H	49.3	Very low	45.2	Very low	97 Å²	97	93.1 Å²	93.1	45%	0.449	49%	0.49	S	S	.	.	H	α-helix	trans	-125.2	21.7	-172.6	-66.2	86.1	0	0	0	114	W106	W106-H110 AromaticContact CD1-ND1 3.88Å; W106-H110 HydrophobicContact CD2-CB 3.97Å; W106-H110 AromaticContact CE2-CG 3.79Å; W106-H110 AromaticContact CE2-ND1 3.89Å; W106-H110 HydrophobicContact CE3-CB 4.11Å; W106-H110 HydrophobicContact CH2-CB 3.72Å; W106-H110 HydrophobicContact CZ2-CB 3.55Å; W106-H110 AromaticContact CZ2-CG 3.87Å; W106-H110 HydrophobicContact CZ3-CB 3.99Å; W106-H110 AromaticContact NE1-CG 3.9Å; W106-H110 AromaticContact NE1-ND1 3.57Å; W106-H110 PolarHBondContact O-N 3Å
111	G	50.5	Low	44.9	Very low	6 Å²	6	95.3 Å²	95.3	6%	0.062	50%	0.498	C	S	.	.			trans	-52.5	133.6	177.6	0	0	0	0	0	113.1	W107 G113 C114	W107-G111 WeakPolarHBondContact O-CA 3.33Å; W107-G111 PolarHBondContact O-N 3.35Å; W107-G111 VanDerWaalsContact O-N 3.11Å; G111-G113 PolarHBondContact O-N 3.06Å; G111-G113 VanDerWaalsContact O-N 3.14Å; G111-C114 WeakPolarHBondContact O-CB 3.23Å; G111-C114 PolarHBondContact O-N 3.12Å
112	P	43.3	Very low	44.9	Very low	87 Å²	87	95.5 Å²	95.5	57%	0.565	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	117.4	178.8	22.7	-31.2	0	0	0	110.5	W107	W107-P112 HydrophobicContact CZ3-CG 4.37Å
113	G	44.8	Very low	44.7	Very low	63 Å²	63	97.7 Å²	97.7	65%	0.649	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-3.6	-177.8	0	0	0	0	0	115.3	G111	G111-G113 PolarHBondContact O-N 3.06Å; G111-G113 VanDerWaalsContact O-N 3.14Å
114	C	50.2	Low	44.4	Very low	35 Å²	35	98.7 Å²	98.7	24%	0.236	54%	0.535	C	S	.	.			trans	-76.3	126.2	178	-79.8	0	0	0	0	112.8	G111 V136 C139	G111-C114 WeakPolarHBondContact O-CB 3.23Å; G111-C114 PolarHBondContact O-N 3.12Å; C114-V136 HydrophobicContact CB-CG1 3.51Å; C114-V136 WeakPolarHBondContact SG-CG1 3.34Å; C114-C139 VanDerWaalsContact SG-CA 3.56Å; C114-C139 WeakPolarHBondContact SG-CB 2.84Å
115	V	47	Very low	43.9	Very low	106 Å²	106	101 Å²	101	64%	0.642	55%	0.554	S	S	*	*			trans	-95.2	117.2	167.6	178.3	0	0	0	0	108.4	R117	V115-R117 HydrophobicContact CG1-CG 4.41Å; V115-R117 PolarHBondContact O-N 3.29Å
116	R	47.4	Very low	43.8	Very low	190 Å²	190	112.4 Å²	112.4	72%	0.717	60%	0.595	S	S	*	*			trans	-58.7	106.1	170.2	-175.9	-171	-80.2	146.8	-5.5	108.7
117	R	42.7	Very low	43.3	Very low	221 Å²	221	112.7 Å²	112.7	83%	0.834	61%	0.607	S	S	*	*			trans	-111.3	106.7	165.8	-83	-161.2	174.4	-178.4	0.7	109.5	V115 M119	V115-R117 HydrophobicContact CG1-CG 4.41Å; V115-R117 PolarHBondContact O-N 3.29Å; R117-M119 PolarHBondContact O-N 3.22Å
118	E	43.8	Very low	43.2	Very low	167 Å²	167	115.8 Å²	115.8	78%	0.78	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-63.5	122.9	162.2	-61	-178.9	-174.5	0	0	107.4
119	M	37.8	Very low	42.7	Very low	135 Å²	135	123 Å²	123	67%	0.665	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-61.3	128.9	171.3	-97.8	174.8	179.5	0	0	108.1	R117 Q121 Y133	R117-M119 PolarHBondContact O-N 3.22Å; M119-Q121 PolarHBondContact O-N 2.75Å; M119-Q121 VanDerWaalsContact O-N 3.12Å; M119-Y133 HydrophobicContact SD-CE2 4.11Å
120	P	37	Very low	41.8	Very low	124 Å²	124	122.8 Å²	122.8	81%	0.805	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-61.1	122	173.7	-13.6	26.3	0	0	0	108	A122	P120-A122 PolarHBondContact O-N 3.31Å; P120-A122 VanDerWaalsContact O-N 3.15Å
121	Q	39.2	Very low	41.3	Very low	175 Å²	175	125.7 Å²	125.7	82%	0.818	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-52.5	122.2	169.3	-78.7	-177	-41.4	0	0	108.7	M119	M119-Q121 PolarHBondContact O-N 2.75Å; M119-Q121 VanDerWaalsContact O-N 3.12Å
122	A	38.8	Very low	40.4	Very low	85 Å²	85	129.8 Å²	129.8	70%	0.702	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-59.9	128.5	167.3	0	0	0	0	0	108.3	P120 G124	P120-A122 PolarHBondContact O-N 3.31Å; P120-A122 VanDerWaalsContact O-N 3.15Å; A122-G124 PolarHBondContact O-N 3.4Å
123	P	37.5	Very low	40	Very low	136 Å²	136	133.6 Å²	133.6	88%	0.883	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	108.3	-175.3	27.7	-30.4	0	0	0	108.9
124	G	41.8	Very low	39.7	Very low	72 Å²	72	134.5 Å²	134.5	74%	0.742	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	154.6	-13.5	165.1	0	0	0	0	0	118.9	A122	A122-G124 PolarHBondContact O-N 3.4Å
125	V	38.2	Very low	38.8	Very low	124 Å²	124	136 Å²	136	75%	0.752	72%	0.72	S	S	*	*			trans	-106.2	93.4	-175.7	-173.7	0	0	0	0	110.5	T127	V125-T127 HydrophobicContact CG1-CG2 4.41Å; V125-T127 PolarHBondContact O-N 3.43Å
126	R	44.4	Very low	38.5	Very low	252 Å²	252	132.7 Å²	132.7	95%	0.951	70%	0.7	S	S	*	*			trans	-82.3	90	164.9	-76.7	-179.7	169.3	159.7	-2.9	108.6
127	T	33.9	Very low	38.1	Very low	95 Å²	95	131.6 Å²	131.6	58%	0.583	71%	0.705	S	S	*	*			trans	-134.8	128.5	161.4	48.9	0	0	0	0	109.4	V125	V125-T127 HydrophobicContact CG1-CG2 4.41Å; V125-T127 PolarHBondContact O-N 3.43Å
128	T	42.2	Very low	38	Very low	138 Å²	138	123.7 Å²	123.7	85%	0.847	69%	0.692	S	S	*	*	S	Bend	trans	-40.5	146.1	172.6	38.5	0	0	0	0	114.3
129	E	37.1	Very low	38.1	Very low	176 Å²	176	117.4 Å²	117.4	82%	0.822	67%	0.666	S	S	*	*			trans	66.8	62.2	175.1	-60.8	-168.7	149.1	0	0	116	H131	E129-H131 PolarHBondContact O-N 3.44Å
130	S	31.3	Very low	38.1	Very low	94 Å²	94	120.5 Å²	120.5	66%	0.657	68%	0.676	S	S	*	*			trans	-84.8	86	165.8	-52	0	0	0	0	109.5	S132	S130-S132 VanDerWaalsContact C-N 3.28Å; S130-S132 PolarHBondContact O-N 2.84Å
131	H	37.5	Very low	38.3	Very low	159 Å²	159	119.5 Å²	119.5	74%	0.736	66%	0.662	S	S	*	*			trans	-52.1	99.8	155.9	-76.9	-86	0	0	0	107.4	E129 Y133	E129-H131 PolarHBondContact O-N 3.44Å; H131-Y133 VanDerWaalsContact C-N 3.31Å; H131-Y133 PolarHBondContact O-N 2.77Å
132	S	31.5	Very low	38.7	Very low	92 Å²	92	115.3 Å²	115.3	64%	0.643	65%	0.645	S	S	*	*			trans	-65.4	95.2	175.4	51.1	0	0	0	0	107.4	S130 I134	S130-S132 VanDerWaalsContact C-N 3.28Å; S130-S132 PolarHBondContact O-N 2.84Å; S132-I134 VanDerWaalsContact C-N 3.34Å; S132-I134 PolarHBondContact O-N 2.99Å
133	Y	36	Very low	39.3	Very low	166 Å²	166	114.6 Å²	114.6	65%	0.651	63%	0.625	S	S	*	*			trans	-63.2	99.4	166.5	51.6	-85.6	0	0	0	106.7	M119 H131 S135	M119-Y133 HydrophobicContact SD-CE2 4.11Å; H131-Y133 VanDerWaalsContact C-N 3.31Å; H131-Y133 PolarHBondContact O-N 2.77Å; Y133-S135 PolarHBondContact O-N 2.69Å
134	I	37.9	Very low	40.1	Very low	82 Å²	82	110.5 Å²	110.5	42%	0.421	59%	0.594	S	S	.	*			trans	-78.4	78.7	172.2	-60.3	170.4	0	0	0	105.4	S132 V136	S132-I134 VanDerWaalsContact C-N 3.34Å; S132-I134 PolarHBondContact O-N 2.99Å; I134-V136 HydrophobicContact CG2-CG2 3.83Å; I134-V136 PolarHBondContact O-N 3.21Å
135	S	32.5	Very low	41.1	Very low	66 Å²	66	114 Å²	114	46%	0.462	59%	0.586	S	S	.	*			trans	-81.1	97.5	172.9	65.1	0	0	0	0	108.5	Y133 M137	Y133-S135 PolarHBondContact O-N 2.69Å; S135-M137 PolarHBondContact O-N 2.89Å
136	V	39.9	Very low	42.3	Very low	38 Å²	38	109.9 Å²	109.9	23%	0.23	56%	0.559	C	S	.	*			trans	-77.5	99.6	176.3	-172.7	0	0	0	0	108.7	S108 C114 I134	S108-V136 WeakPolarHBondContact O-CB 3.48Å; S108-V136 WeakPolarHBondContact O-CG2 3.45Å; C114-V136 HydrophobicContact CB-CG1 3.51Å; C114-V136 WeakPolarHBondContact SG-CG1 3.34Å; I134-V136 HydrophobicContact CG2-CG2 3.83Å; I134-V136 PolarHBondContact O-N 3.21Å
137	M	39.8	Very low	43.4	Very low	167 Å²	167	99.5 Å²	99.5	82%	0.823	52%	0.521	S	S	*	.			trans	-97.1	128.5	172.1	-78.6	-70.1	-144.2	0	0	110	S135	S135-M137 PolarHBondContact O-N 2.89Å
138	G	40.7	Very low	45.1	Very low	54 Å²	54	96.4 Å²	96.4	56%	0.557	50%	0.502	S	S	*	.			trans	119.3	34	173.2	0	0	0	0	0	116.3
139	C	44.5	Very low	46.6	Very low	35 Å²	35	95.4 Å²	95.4	24%	0.236	49%	0.489	C	S	.	.			trans	-82.4	148	168	-153.7	0	0	0	0	110.2	C114 M141	C114-C139 VanDerWaalsContact SG-CA 3.56Å; C114-C139 WeakPolarHBondContact SG-CB 2.84Å; C139-M141 PolarHBondContact O-N 2.88Å; C139-M141 PolarHBondContact SG-O 2.7Å
140	F	39.1	Very low	48.5	Very low	200 Å²	200	89.3 Å²	89.3	88%	0.877	46%	0.461	S	S	*	.	S	Bend	trans	-64.7	-16.9	173	-170.6	-100.4	0	0	0	112.3
141	M	39.4	Very low	50.7	Low	103 Å²	103	85 Å²	85	51%	0.507	43%	0.431	S	S	.	.	S	Bend	trans	-153.2	122.1	-179.3	-172.1	143.1	43.2	0	0	109.5	C139 I146	C139-M141 PolarHBondContact O-N 2.88Å; C139-M141 PolarHBondContact SG-O 2.7Å; M141-I146 HydrophobicContact CG-CG1 4.43Å
142	D	48.5	Very low	52.8	Low	87 Å²	87	79.3 Å²	79.3	47%	0.465	41%	0.409	S	S	.	.			trans	-66.2	145.8	179.7	-67.8	-54.3	0	0	0	111.4	Q144 Y145	D142-Q144 PolarHBondContact O-N 3.29Å; D142-Q144 VanDerWaalsContact O-N 3.13Å; D142-Y145 HydrophobicContact CB-CD2 3.97Å; D142-Y145 HydrophobicContact CB-CE2 4.42Å; D142-Y145 PolarHBondContact O-N 2.99Å
143	Y	51.4	Low	55.4	Low	70 Å²	70	77.7 Å²	77.7	28%	0.275	40%	0.395	S	S	.	.	H	α-helix	trans	-54.6	-32.6	179.4	71.1	-85	0	0	0	112.9	K91 Y145 I146 E147	K91-Y143 WeakPolarHBondContact CE-OH 3.27Å; K91-Y143 PolarHBondContact NZ-OH 3.07Å; Y143-Y145 VanDerWaalsContact C-N 3.29Å; Y143-Y145 PolarHBondContact O-N 3.36Å; Y143-I146 PolarHBondContact O-N 3.36Å; Y143-E147 WeakPolarHBondContact CD2-OE2 3.49Å; Y143-E147 PolarHBondContact O-N 2.85Å
144	Q	54.2	Low	57.7	Low	50 Å²	50	70.4 Å²	70.4	23%	0.234	37%	0.367	C	S	.	.	H	α-helix	trans	-56.6	-38.4	173.2	-98.9	168.5	-51.2	0	0	112.6	Y83 D142 V148	Y83-Q144 HydrophobicContact CD1-CG 4.13Å; Y83-Q144 PolarHBondContact O-NE2 3.46Å; D142-Q144 PolarHBondContact O-N 3.29Å; D142-Q144 VanDerWaalsContact O-N 3.13Å; Q144-V148 WeakPolarHBondContact O-CB 3.23Å; Q144-V148 WeakPolarHBondContact O-CG2 3.38Å; Q144-V148 PolarHBondContact O-N 3.42Å
145	Y	62	Low	60.1	Low	147 Å²	147	67.5 Å²	67.5	58%	0.576	35%	0.352	S	S	*	.	H	α-helix	trans	-71.6	-34.6	179.1	-74.8	-80.3	0	0	0	112	D142 Y143 M149	D142-Y145 HydrophobicContact CB-CD2 3.97Å; D142-Y145 HydrophobicContact CB-CE2 4.42Å; D142-Y145 PolarHBondContact O-N 2.99Å; Y143-Y145 VanDerWaalsContact C-N 3.29Å; Y143-Y145 PolarHBondContact O-N 3.36Å; Y145-M149 WeakPolarHBondContact O-CB 3.4Å; Y145-M149 WeakPolarHBondContact O-CG 3.21Å; Y145-M149 PolarHBondContact O-N 3.35Å
146	I	64.8	Low	62.8	Low	37 Å²	37	69.5 Å²	69.5	19%	0.19	36%	0.357	C	S	.	.	H	α-helix	trans	-68.9	-43.7	178.2	-61	173.3	0	0	0	110	W107 M141 Y143 M149 H150	W107-I146 HydrophobicContact CD2-CD1 4.34Å; W107-I146 HydrophobicContact CE3-CD1 4.23Å; M141-I146 HydrophobicContact CG-CG1 4.43Å; Y143-I146 PolarHBondContact O-N 3.36Å; I146-M149 PolarHBondContact O-N 3.2Å; I146-H150 WeakPolarHBondContact O-CB 3.38Å; I146-H150 PolarHBondContact O-CD2 3.48Å; I146-H150 PolarHBondContact O-N 2.88Å
147	E	67.1	Low	65.1	Low	34 Å²	34	68.5 Å²	68.5	16%	0.159	35%	0.351	C	S	.	.	H	α-helix	trans	-66	-41.9	178.1	-72.2	168.2	166.1	0	0	111.7	Y83 Y143 S151	Y83-E147 WeakPolarHBondContact CD1-OE2 3.47Å; Y83-E147 WeakPolarHBondContact CE1-OE2 3.43Å; Y83-E147 HydrophobicContact CE2-CB 4.33Å; Y83-E147 PolarHBondContact OH-OE1 3.45Å; Y83-E147 PolarHBondContact OH-OE2 2.69Å; Y143-E147 WeakPolarHBondContact CD2-OE2 3.49Å; Y143-E147 PolarHBondContact O-N 2.85Å; E147-S151 VanDerWaalsContact O-CB 3.23Å; E147-S151 WeakPolarHBondContact O-CB 3.33Å; E147-S151 PolarHBondContact O-N 2.63Å; E147-S151 PolarHBondContact O-OG 3.26Å
148	V	70	Confident	67.4	Low	30 Å²	30	60.7 Å²	60.7	18%	0.182	31%	0.313	C	S	.	.	H	α-helix	trans	-67.4	-43.5	175.4	171.5	0	0	0	0	111.3	L84 Q144 S151 S152	L84-V148 HydrophobicContact CD2-CG2 4.2Å; L84-V148 HydrophobicContact CG-CG2 4.4Å; Q144-V148 WeakPolarHBondContact O-CB 3.23Å; Q144-V148 WeakPolarHBondContact O-CG2 3.38Å; Q144-V148 PolarHBondContact O-N 3.42Å; V148-S151 PolarHBondContact O-N 2.9Å; V148-S152 WeakPolarHBondContact O-CB 3.42Å; V148-S152 PolarHBondContact O-N 3.49Å; V148-S152 PolarHBondContact O-OG 3.39Å
149	M	72.2	Confident	69.7	Low	116 Å²	116	61.9 Å²	61.9	57%	0.571	31%	0.306	S	S	*	.	H	α-helix	trans	-60.9	-48.5	176.7	-79.4	-65.3	-65.4	0	0	110.9	Y145 I146 S151 S152 V153	Y145-M149 WeakPolarHBondContact O-CB 3.4Å; Y145-M149 WeakPolarHBondContact O-CG 3.21Å; Y145-M149 PolarHBondContact O-N 3.35Å; I146-M149 PolarHBondContact O-N 3.2Å; M149-S151 VanDerWaalsContact C-N 3.32Å; M149-S151 PolarHBondContact O-N 3.41Å; M149-S152 PolarHBondContact O-N 3.1Å; M149-S152 PolarHBondContact O-OG 3.25Å; M149-V153 WeakPolarHBondContact O-CG2 3.42Å; M149-V153 PolarHBondContact O-N 3.09Å
150	H	77.4	Confident	71.9	Confident	49 Å²	49	64.7 Å²	64.7	23%	0.227	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-44.1	175.2	-85.9	-119	0	0	0	111	E23 R24 I146 S152 V153 Q154	E23-H150 IonicContact OE1-CE1 3.46Å; E23-H150 PolarHBondContact OE1-CE1 3.3Å; R24-H150 VanDerWaalsContact NE-CB 3.26Å; R24-H150 PolarHBondContact NH2-O 3.31Å; I146-H150 WeakPolarHBondContact O-CB 3.38Å; I146-H150 PolarHBondContact O-CD2 3.48Å; I146-H150 PolarHBondContact O-N 2.88Å; H150-S152 VanDerWaalsContact C-N 3.34Å; H150-S152 PolarHBondContact O-N 2.85Å; H150-V153 PolarHBondContact O-N 3.32Å; H150-Q154 PolarHBondContact O-N 3.34Å
151	S	78.4	Confident	74.2	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-42.2	-177.3	-61.2	0	0	0	0	111.5	E147 V148 M149 Q154 I155	E147-S151 VanDerWaalsContact O-CB 3.23Å; E147-S151 WeakPolarHBondContact O-CB 3.33Å; E147-S151 PolarHBondContact O-N 2.63Å; E147-S151 PolarHBondContact O-OG 3.26Å; V148-S151 PolarHBondContact O-N 2.9Å; M149-S151 VanDerWaalsContact C-N 3.32Å; M149-S151 PolarHBondContact O-N 3.41Å; S151-Q154 PolarHBondContact O-N 3.39Å; S151-I155 VanDerWaalsContact O-CG1 3.31Å; S151-I155 WeakPolarHBondContact O-CG1 3.42Å; S151-I155 PolarHBondContact O-N 3.27Å
152	S	82.3	Confident	76.6	Confident	39 Å²	39	54 Å²	54	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-62.4	-43.7	174.1	70.4	0	0	0	0	112.6	V148 M149 H150 Q154 I155 L156	V148-S152 WeakPolarHBondContact O-CB 3.42Å; V148-S152 PolarHBondContact O-N 3.49Å; V148-S152 PolarHBondContact O-OG 3.39Å; M149-S152 PolarHBondContact O-N 3.1Å; M149-S152 PolarHBondContact O-OG 3.25Å; H150-S152 VanDerWaalsContact C-N 3.34Å; H150-S152 PolarHBondContact O-N 2.85Å; S152-Q154 PolarHBondContact O-N 3.21Å; S152-I155 PolarHBondContact O-N 3.14Å; S152-L156 WeakPolarHBondContact O-CG 3.48Å; S152-L156 PolarHBondContact O-N 3Å
153	V	84.8	Confident	78.7	Confident	59 Å²	59	54 Å²	54	36%	0.358	27%	0.272	S	S	.	.	H	α-helix	trans	-62	-43.9	176.5	172.9	0	0	0	0	110.8	L20 M149 H150 I155 L156 V157	L20-V153 HydrophobicContact CD1-CG1 4.08Å; L20-V153 HydrophobicContact CD2-CG1 4.44Å; M149-V153 WeakPolarHBondContact O-CG2 3.42Å; M149-V153 PolarHBondContact O-N 3.09Å; H150-V153 PolarHBondContact O-N 3.32Å; V153-I155 PolarHBondContact O-N 3.01Å; V153-L156 PolarHBondContact O-N 3.42Å; V153-V157 HydrophobicContact CG1-CG2 4.47Å; V153-V157 WeakPolarHBondContact O-CG2 3.1Å; V153-V157 PolarHBondContact O-N 3.17Å
154	Q	85.8	Confident	80.4	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.056	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-39.9	176.1	-83.5	-167.8	-8.7	0	0	112.6	N76 H150 S151 S152 V157 A158	N76-Q154 PolarHBondContact OD1-OE1 3.32Å; N76-Q154 VanDerWaalsContact OD1-OE1 3.07Å; H150-Q154 PolarHBondContact O-N 3.34Å; S151-Q154 PolarHBondContact O-N 3.39Å; S152-Q154 PolarHBondContact O-N 3.21Å; Q154-V157 PolarHBondContact O-N 3.34Å; Q154-A158 WeakPolarHBondContact O-CB 3.44Å; Q154-A158 PolarHBondContact O-N 3.34Å
155	I	87.4	Confident	82	Confident	22 Å²	22	52.4 Å²	52.4	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-47.2	174.7	-71.1	167.4	0	0	0	110.6	V73 N76 V77 I80 S151 S152 V153 V157 A158 L159	V73-I155 HydrophobicContact CG1-CG2 4.41Å; N76-I155 HydrophobicContact CB-CD1 3.76Å; N76-I155 HydrophobicContact CB-CG1 3.43Å; N76-I155 VanDerWaalsContact CB-CG1 3.43Å; V77-I155 HydrophobicContact CG2-CD1 3.91Å; I80-I155 HydrophobicContact CD1-CD1 3.39Å; S151-I155 VanDerWaalsContact O-CG1 3.31Å; S151-I155 WeakPolarHBondContact O-CG1 3.42Å; S151-I155 PolarHBondContact O-N 3.27Å; S152-I155 PolarHBondContact O-N 3.14Å; V153-I155 PolarHBondContact O-N 3.01Å; I155-V157 VanDerWaalsContact C-N 3.35Å; I155-V157 PolarHBondContact O-N 2.91Å; I155-A158 PolarHBondContact O-N 3.04Å; I155-L159 HydrophobicContact CG2-CD1 3.77Å; I155-L159 HydrophobicContact CG2-CG 4.2Å; I155-L159 WeakPolarHBondContact O-CB 3.11Å; I155-L159 VanDerWaalsContact O-CG 3.29Å; I155-L159 WeakPolarHBondContact O-CG 3.43Å; I155-L159 PolarHBondContact O-N 2.85Å
156	L	88.1	Confident	83.3	Confident	108 Å²	108	47.6 Å²	47.6	57%	0.565	25%	0.251	S	S	*	.	H	α-helix	trans	-59.2	-47	-179.9	-71.8	171.9	0	0	0	111.4	S152 V153 L159 L160	S152-L156 WeakPolarHBondContact O-CG 3.48Å; S152-L156 PolarHBondContact O-N 3Å; V153-L156 PolarHBondContact O-N 3.42Å; L156-L159 PolarHBondContact O-N 3.06Å; L156-L160 WeakPolarHBondContact O-CG 3.03Å; L156-L160 PolarHBondContact O-N 3.46Å; L156-L160 VanDerWaalsContact O-N 3.08Å
157	V	88.6	Confident	84.4	Confident	16 Å²	16	51.3 Å²	51.3	10%	0.097	26%	0.263	C	S	.	.	H	α-helix	trans	-69.5	-35.3	179.1	-178	0	0	0	0	111.4	I13 L16 Q17 L20 V153 Q154 I155 G161	I13-V157 HydrophobicContact CG2-CG1 4.14Å; L16-V157 HydrophobicContact CD2-CG1 4.15Å; L16-V157 HydrophobicContact CD2-CG2 4.14Å; L16-V157 HydrophobicContact CG-CG1 4.43Å; Q17-V157 HydrophobicContact CG-CB 4.49Å; Q17-V157 HydrophobicContact CG-CG1 3.46Å; Q17-V157 VanDerWaalsContact CG-CG1 3.46Å; Q17-V157 PolarHBondContact NE2-O 3.13Å; L20-V157 HydrophobicContact CD1-CB 4.32Å; L20-V157 HydrophobicContact CD1-CG1 4.43Å; L20-V157 HydrophobicContact CD1-CG2 3.83Å; V153-V157 HydrophobicContact CG1-CG2 4.47Å; V153-V157 WeakPolarHBondContact O-CG2 3.1Å; V153-V157 PolarHBondContact O-N 3.17Å; Q154-V157 PolarHBondContact O-N 3.34Å; I155-V157 VanDerWaalsContact C-N 3.35Å; I155-V157 PolarHBondContact O-N 2.91Å; V157-G161 PolarHBondContact O-N 3.21Å
158	A	88.3	Confident	85.3	Confident	3 Å²	3	49.9 Å²	49.9	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-41.2	175.2	0	0	0	0	0	112.3	V73 Q154 I155 G161 F162	V73-A158 HydrophobicContact CG2-CB 3.75Å; Q154-A158 WeakPolarHBondContact O-CB 3.44Å; Q154-A158 PolarHBondContact O-N 3.34Å; I155-A158 PolarHBondContact O-N 3.04Å; A158-G161 PolarHBondContact O-N 3.37Å; A158-F162 WeakPolarHBondContact O-CB 3.09Å; A158-F162 PolarHBondContact O-N 2.93Å
159	L	89.8	Confident	86.1	Confident	80 Å²	80	49.7 Å²	49.7	42%	0.419	26%	0.256	S	S	.	.	H	α-helix	trans	-64.2	-44.3	175.9	-74.8	172.4	0	0	0	111.7	V73 I155 L156 G161 F162 V163	V73-L159 HydrophobicContact CG1-CD2 4.38Å; V73-L159 HydrophobicContact CG2-CD2 4.19Å; V73-L159 HydrophobicContact CG2-CG 4.3Å; I155-L159 HydrophobicContact CG2-CD1 3.77Å; I155-L159 HydrophobicContact CG2-CG 4.2Å; I155-L159 WeakPolarHBondContact O-CB 3.11Å; I155-L159 VanDerWaalsContact O-CG 3.29Å; I155-L159 WeakPolarHBondContact O-CG 3.43Å; I155-L159 PolarHBondContact O-N 2.85Å; L156-L159 PolarHBondContact O-N 3.06Å; L159-G161 VanDerWaalsContact C-N 3.34Å; L159-F162 PolarHBondContact O-N 3.28Å; L159-V163 WeakPolarHBondContact O-CG2 3.39Å; L159-V163 PolarHBondContact O-N 3.15Å
160	L	89.7	Confident	86.8	Confident	94 Å²	94	47.8 Å²	47.8	49%	0.492	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-47.1	173.6	-70.5	172.9	0	0	0	110.6	I13 L156 F162 V163 Y164	I13-L160 HydrophobicContact CD1-CB 4.29Å; L156-L160 WeakPolarHBondContact O-CG 3.03Å; L156-L160 PolarHBondContact O-N 3.46Å; L156-L160 VanDerWaalsContact O-N 3.08Å; L160-F162 VanDerWaalsContact C-N 3.32Å; L160-F162 PolarHBondContact O-N 2.82Å; L160-V163 PolarHBondContact O-N 3.43Å; L160-Y164 VanDerWaalsContact O-CD2 3.29Å; L160-Y164 WeakPolarHBondContact O-CD2 3.43Å; L160-Y164 PolarHBondContact O-N 3.43Å
161	G	88.3	Confident	87.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.5	-42	176.5	0	0	0	0	0	112.9	V157 A158 L159 A165	V157-G161 PolarHBondContact O-N 3.21Å; A158-G161 PolarHBondContact O-N 3.37Å; L159-G161 VanDerWaalsContact C-N 3.34Å; G161-A165 WeakPolarHBondContact O-CB 3.46Å; G161-A165 PolarHBondContact O-N 2.93Å
162	F	90.4	Very high	87.2	Confident	77 Å²	77	46.7 Å²	46.7	34%	0.338	25%	0.252	S	S	.	.	H	α-helix	trans	-61.1	-50.7	176.3	177.8	-97.2	0	0	0	111.8	T66 A69 A70 A158 L159 L160 Y164 A165 C166	T66-F162 HydrophobicContact CG2-CD2 4.43Å; A69-F162 HydrophobicContact CB-CB 4.29Å; A69-F162 HydrophobicContact CB-CD2 4.27Å; A70-F162 HydrophobicContact CB-CE2 4.43Å; A158-F162 WeakPolarHBondContact O-CB 3.09Å; A158-F162 PolarHBondContact O-N 2.93Å; L159-F162 PolarHBondContact O-N 3.28Å; L160-F162 VanDerWaalsContact C-N 3.32Å; L160-F162 PolarHBondContact O-N 2.82Å; F162-Y164 PolarHBondContact O-N 3.39Å; F162-A165 PolarHBondContact O-N 3.01Å; F162-C166 WeakPolarHBondContact O-CB 3.15Å; F162-C166 PolarHBondContact O-N 3.43Å; F162-C166 PolarHBondContact O-SG 3.25Å; F162-C166 VanDerWaalsContact O-SG 3.34Å
163	V	91.2	Very high	87.2	Confident	89 Å²	89	47.9 Å²	47.9	54%	0.539	26%	0.257	S	S	.	.	H	α-helix	trans	-60.4	-46.8	179.7	173	0	0	0	0	111.2	L159 L160 C166 Y167	L159-V163 WeakPolarHBondContact O-CG2 3.39Å; L159-V163 PolarHBondContact O-N 3.15Å; L160-V163 PolarHBondContact O-N 3.43Å; V163-C166 PolarHBondContact O-N 3.43Å; V163-Y167 WeakPolarHBondContact O-CB 3.45Å; V163-Y167 PolarHBondContact O-N 3.1Å
164	Y	88.4	Confident	87	Confident	86 Å²	86	52.1 Å²	52.1	34%	0.337	27%	0.273	S	S	.	.	H	α-helix	trans	-68.2	-35.4	179.1	-84.2	-76.8	0	0	0	112.6	T9 I13 L160 F162 Y167 V168	T9-Y164 HydrophobicContact CG2-CD1 4.17Å; T9-Y164 HydrophobicContact CG2-CD2 4.33Å; T9-Y164 HydrophobicContact CG2-CE1 3.75Å; T9-Y164 HydrophobicContact CG2-CE2 3.94Å; T9-Y164 HydrophobicContact CG2-CG 4.44Å; I13-Y164 HydrophobicContact CD1-CD2 3.35Å; I13-Y164 HydrophobicContact CD1-CE2 3.84Å; I13-Y164 HydrophobicContact CD1-CG 3.99Å; L160-Y164 VanDerWaalsContact O-CD2 3.29Å; L160-Y164 WeakPolarHBondContact O-CD2 3.43Å; L160-Y164 PolarHBondContact O-N 3.43Å; F162-Y164 PolarHBondContact O-N 3.39Å; Y164-Y167 PolarHBondContact O-N 3.38Å; Y164-V168 WeakPolarHBondContact O-CB 3.31Å; Y164-V168 VanDerWaalsContact O-CG2 3.31Å; Y164-V168 WeakPolarHBondContact O-CG2 3.45Å; Y164-V168 PolarHBondContact O-N 2.98Å
165	A	87.6	Confident	86.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-69.8	-40.3	176.2	0	0	0	0	0	111.7	L10 I62 Y65 T66 G161 F162 V168 V169	L10-A165 HydrophobicContact CD1-CB 4.02Å; L10-A165 HydrophobicContact CD2-CB 4.22Å; I62-A165 HydrophobicContact CG2-CB 4.24Å; Y65-A165 HydrophobicContact CD1-CB 3.72Å; Y65-A165 HydrophobicContact CE1-CB 3.67Å; T66-A165 HydrophobicContact CG2-CB 3.38Å; G161-A165 WeakPolarHBondContact O-CB 3.46Å; G161-A165 PolarHBondContact O-N 2.93Å; F162-A165 PolarHBondContact O-N 3.01Å; A165-V168 PolarHBondContact O-N 3.22Å; A165-V169 WeakPolarHBondContact O-CB 3.44Å; A165-V169 VanDerWaalsContact O-CG2 3.27Å; A165-V169 WeakPolarHBondContact O-CG2 3.32Å; A165-V169 PolarHBondContact O-N 3.31Å
166	C	88.6	Confident	85.7	Confident	45 Å²	45	60 Å²	60	30%	0.304	31%	0.309	S	S	.	.	H	α-helix	trans	-59.2	-46.2	170.3	-71.1	0	0	0	0	111.4	F162 V163 V168 V169 S170	F162-C166 WeakPolarHBondContact O-CB 3.15Å; F162-C166 PolarHBondContact O-N 3.43Å; F162-C166 PolarHBondContact O-SG 3.25Å; F162-C166 VanDerWaalsContact O-SG 3.34Å; V163-C166 PolarHBondContact O-N 3.43Å; C166-V168 PolarHBondContact O-N 2.83Å; C166-V169 PolarHBondContact O-N 3.3Å; C166-S170 WeakPolarHBondContact O-CB 3.36Å; C166-S170 PolarHBondContact O-N 3.03Å; C166-S170 PolarHBondContact O-OG 3.37Å
167	Y	88.8	Confident	84.8	Confident	115 Å²	115	59.9 Å²	59.9	45%	0.451	31%	0.309	S	S	.	.	H	α-helix	trans	-57.4	-47.1	175.6	172.2	-101.2	0	0	0	112.3	V163 Y164 S170 A171	V163-Y167 WeakPolarHBondContact O-CB 3.45Å; V163-Y167 PolarHBondContact O-N 3.1Å; Y164-Y167 PolarHBondContact O-N 3.38Å; Y167-S170 PolarHBondContact O-N 3.17Å; Y167-A171 WeakPolarHBondContact O-CB 3.06Å; Y167-A171 PolarHBondContact O-N 2.76Å
168	V	86.4	Confident	83.7	Confident	4 Å²	4	62.2 Å²	62.2	2%	0.024	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-39.1	179.2	169.6	0	0	0	0	111.6	R7 L10 I62 Y164 A165 C166 A171 I172	R7-V168 HydrophobicContact CG-CG1 4.41Å; R7-V168 HydrophobicContact CG-CG2 4.31Å; L10-V168 HydrophobicContact CB-CG2 4.48Å; L10-V168 HydrophobicContact CD2-CB 4Å; L10-V168 HydrophobicContact CD2-CG1 4.27Å; L10-V168 HydrophobicContact CD2-CG2 3.82Å; I62-V168 HydrophobicContact CD1-CG1 4.17Å; Y164-V168 WeakPolarHBondContact O-CB 3.31Å; Y164-V168 VanDerWaalsContact O-CG2 3.31Å; Y164-V168 WeakPolarHBondContact O-CG2 3.45Å; Y164-V168 PolarHBondContact O-N 2.98Å; A165-V168 PolarHBondContact O-N 3.22Å; C166-V168 PolarHBondContact O-N 2.83Å; V168-A171 PolarHBondContact O-N 3.5Å; V168-I172 HydrophobicContact CG1-CD1 3.81Å; V168-I172 HydrophobicContact CG1-CG1 4.5Å; V168-I172 WeakPolarHBondContact O-CD1 3.38Å; V168-I172 VanDerWaalsContact O-CG1 3.24Å; V168-I172 WeakPolarHBondContact O-CG1 3.44Å; V168-I172 PolarHBondContact O-N 2.86Å
169	V	86.3	Confident	82.3	Confident	26 Å²	26	69.1 Å²	69.1	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-62.9	-49.6	174.8	170.6	0	0	0	0	110.4	I62 V63 A165 C166 A171 I172 T173	I62-V169 HydrophobicContact CB-CG2 3.91Å; I62-V169 HydrophobicContact CG2-CG2 3.46Å; I62-V169 VanDerWaalsContact CG2-CG2 3.46Å; V63-V169 HydrophobicContact CG2-CG1 4.31Å; V63-V169 HydrophobicContact CG2-CG2 4.4Å; A165-V169 WeakPolarHBondContact O-CB 3.44Å; A165-V169 VanDerWaalsContact O-CG2 3.27Å; A165-V169 WeakPolarHBondContact O-CG2 3.32Å; A165-V169 PolarHBondContact O-N 3.31Å; C166-V169 PolarHBondContact O-N 3.3Å; V169-A171 VanDerWaalsContact C-N 3.31Å; V169-A171 PolarHBondContact O-N 3.07Å; V169-I172 PolarHBondContact O-N 3.46Å; V169-I172 VanDerWaalsContact O-N 3.16Å; V169-T173 PolarHBondContact O-N 3.25Å; V169-T173 PolarHBondContact O-OG1 3.17Å; V169-T173 VanDerWaalsContact O-OG1 3.11Å
170	S	85.8	Confident	80.9	Confident	76 Å²	76	71.5 Å²	71.5	53%	0.531	37%	0.37	S	S	.	.	H	α-helix	trans	-58.9	-42.1	177.6	-65.1	0	0	0	0	112.2	C166 Y167 I172 T173 E174	C166-S170 WeakPolarHBondContact O-CB 3.36Å; C166-S170 PolarHBondContact O-N 3.03Å; C166-S170 PolarHBondContact O-OG 3.37Å; Y167-S170 PolarHBondContact O-N 3.17Å; S170-I172 PolarHBondContact O-N 3.32Å; S170-T173 PolarHBondContact O-N 3.19Å; S170-E174 WeakPolarHBondContact O-CB 3.41Å; S170-E174 PolarHBondContact O-N 3.2Å
171	A	84.4	Confident	79.4	Confident	17 Å²	17	74.5 Å²	74.5	14%	0.14	38%	0.379	C	S	.	.	H	α-helix	trans	-64	-38.3	176.9	0	0	0	0	0	112.7	Y167 V168 V169 E175	Y167-A171 WeakPolarHBondContact O-CB 3.06Å; Y167-A171 PolarHBondContact O-N 2.76Å; V168-A171 PolarHBondContact O-N 3.5Å; V169-A171 VanDerWaalsContact C-N 3.31Å; V169-A171 PolarHBondContact O-N 3.07Å; A171-E175 WeakPolarHBondContact O-CG 3.39Å; A171-E175 PolarHBondContact O-N 3.18Å
172	I	81.2	Confident	78.1	Confident	12 Å²	12	80 Å²	80	6%	0.062	41%	0.407	C	S	.	.	H	α-helix	trans	-69	-41.6	176	-67.5	164.6	0	0	0	110.7	P59 I62 V168 V169 S170 E175 E176	P59-I172 HydrophobicContact CB-CG2 4.26Å; P59-I172 HydrophobicContact CG-CG2 4.39Å; I62-I172 HydrophobicContact CD1-CD1 3.88Å; V168-I172 HydrophobicContact CG1-CD1 3.81Å; V168-I172 HydrophobicContact CG1-CG1 4.5Å; V168-I172 WeakPolarHBondContact O-CD1 3.38Å; V168-I172 VanDerWaalsContact O-CG1 3.24Å; V168-I172 WeakPolarHBondContact O-CG1 3.44Å; V168-I172 PolarHBondContact O-N 2.86Å; V169-I172 PolarHBondContact O-N 3.46Å; V169-I172 VanDerWaalsContact O-N 3.16Å; S170-I172 PolarHBondContact O-N 3.32Å; I172-E175 PolarHBondContact O-N 3.24Å; I172-E176 PolarHBondContact O-N 3.06Å
173	T	80.9	Confident	76.4	Confident	64 Å²	64	79.3 Å²	79.3	39%	0.393	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-41.9	178.1	-58.2	0	0	0	0	111.9	V169 S170 E175 E176 D177	V169-T173 PolarHBondContact O-N 3.25Å; V169-T173 PolarHBondContact O-OG1 3.17Å; V169-T173 VanDerWaalsContact O-OG1 3.11Å; S170-T173 PolarHBondContact O-N 3.19Å; T173-E175 VanDerWaalsContact C-N 3.31Å; T173-E175 PolarHBondContact O-N 3.18Å; T173-E176 PolarHBondContact O-N 3.11Å; T173-D177 PolarHBondContact O-N 3.23Å
174	E	80.7	Confident	74.5	Confident	148 Å²	148	78 Å²	78	69%	0.692	43%	0.427	S	S	*	.	H	α-helix	trans	-63.6	-37	176	-170.7	177.9	174.6	0	0	112	S170 S178	S170-E174 WeakPolarHBondContact O-CB 3.41Å; S170-E174 PolarHBondContact O-N 3.2Å; E174-S178 WeakPolarHBondContact O-CB 3.41Å; E174-S178 PolarHBondContact O-N 3.06Å; E174-S178 VanDerWaalsContact O-N 3.12Å
175	E	76.1	Confident	72.6	Confident	83 Å²	83	81.6 Å²	81.6	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-64	-48.4	172.7	-74.4	174.9	-172.6	0	0	111	R7 A171 I172 T173 S178 F179	R7-E175 IonicContact NH2-OE1 3.87Å; R7-E175 IonicContact NH2-OE2 3.47Å; R7-E175 PolarHBondContact NH2-OE2 3.05Å; A171-E175 WeakPolarHBondContact O-CG 3.39Å; A171-E175 PolarHBondContact O-N 3.18Å; I172-E175 PolarHBondContact O-N 3.24Å; T173-E175 VanDerWaalsContact C-N 3.31Å; T173-E175 PolarHBondContact O-N 3.18Å; E175-S178 PolarHBondContact O-N 2.94Å; E175-F179 WeakPolarHBondContact O-CD2 3.08Å; E175-F179 PolarHBondContact O-N 3.09Å; E175-F179 VanDerWaalsContact O-N 3.13Å
176	E	70.9	Confident	70.6	Confident	116 Å²	116	88.9 Å²	88.9	54%	0.542	48%	0.483	S	S	.	.	H	α-helix	trans	-62.7	-44.7	179	-70.3	-162.1	164.2	0	0	112.8	I172 T173 S178 F179 D180	I172-E176 PolarHBondContact O-N 3.06Å; T173-E176 PolarHBondContact O-N 3.11Å; E176-S178 VanDerWaalsContact C-N 3.27Å; E176-S178 PolarHBondContact O-N 2.81Å; E176-F179 PolarHBondContact O-N 2.96Å; E176-F179 VanDerWaalsContact O-N 3.14Å; E176-D180 PolarHBondContact O-N 2.87Å; E176-D180 VanDerWaalsContact O-N 3.14Å
177	D	68.4	Low	69.1	Low	106 Å²	106	91.1 Å²	91.1	57%	0.567	50%	0.497	S	S	*	.	H	α-helix	trans	-63.1	-33.8	177.1	-74.5	-23.4	0	0	0	112	T173 F181	T173-D177 PolarHBondContact O-N 3.23Å; D177-F181 PolarHBondContact O-N 2.87Å
178	S	64.8	Low	66.9	Low	66 Å²	66	94.9 Å²	94.9	46%	0.462	52%	0.516	S	S	.	.	H	α-helix	trans	-70.2	-33.1	175.2	-178.4	0	0	0	0	112.9	E174 E175 E176 I182	E174-S178 WeakPolarHBondContact O-CB 3.41Å; E174-S178 PolarHBondContact O-N 3.06Å; E174-S178 VanDerWaalsContact O-N 3.12Å; E175-S178 PolarHBondContact O-N 2.94Å; E176-S178 VanDerWaalsContact C-N 3.27Å; E176-S178 PolarHBondContact O-N 2.81Å; S178-I182 PolarHBondContact O-N 3.44Å
179	F	58.9	Low	65.7	Low	148 Å²	148	100.3 Å²	100.3	65%	0.649	55%	0.551	S	S	*	*	H	α-helix	trans	-73.2	-36.8	177.4	-78.9	-69.7	0	0	0	111.8	E175 E176 F181 I182 G183	E175-F179 WeakPolarHBondContact O-CD2 3.08Å; E175-F179 PolarHBondContact O-N 3.09Å; E175-F179 VanDerWaalsContact O-N 3.13Å; E176-F179 PolarHBondContact O-N 2.96Å; E176-F179 VanDerWaalsContact O-N 3.14Å; F179-F181 VanDerWaalsContact C-N 3.27Å; F179-F181 PolarHBondContact O-N 3.21Å; F179-I182 PolarHBondContact O-N 3.14Å; F179-G183 PolarHBondContact O-N 3Å
180	D	60.8	Low	63.7	Low	130 Å²	130	106.1 Å²	106.1	70%	0.695	58%	0.581	S	S	*	*	H	α-helix	trans	-62.4	-33.6	175	-85.7	-4.2	0	0	0	112.2	E176	E176-D180 PolarHBondContact O-N 2.87Å; E176-D180 VanDerWaalsContact O-N 3.14Å
181	F	58.3	Low	61.3	Low	156 Å²	156	112 Å²	112	68%	0.684	59%	0.593	S	S	*	*	H	α-helix	trans	-70.2	-32.9	175.4	-172.7	-99.5	0	0	0	113.6	D177 F179	D177-F181 PolarHBondContact O-N 2.87Å; F179-F181 VanDerWaalsContact C-N 3.27Å; F179-F181 PolarHBondContact O-N 3.21Å
182	I	62	Low	59.5	Low	115 Å²	115	120 Å²	120	59%	0.59	63%	0.627	S	S	*	*	H	α-helix	trans	-82.8	-28.4	-178.9	-65.7	173.7	0	0	0	111.6	S178 F179 G184	S178-I182 PolarHBondContact O-N 3.44Å; F179-I182 PolarHBondContact O-N 3.14Å; I182-G184 VanDerWaalsContact C-N 3.28Å; I182-G184 PolarHBondContact O-N 3.39Å
183	G	54.8	Low	57.3	Low	64 Å²	64	125.2 Å²	125.2	66%	0.66	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-11.1	174.9	0	0	0	0	0	115.1	F179	F179-G183 PolarHBondContact O-N 3Å
184	G	50.1	Low	54.9	Low	61 Å²	61	129 Å²	129	63%	0.629	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	2.5	-177.8	0	0	0	0	0	116.2	I182 D186	I182-G184 VanDerWaalsContact C-N 3.28Å; I182-G184 PolarHBondContact O-N 3.39Å; G184-D186 VanDerWaalsContact C-N 3.31Å; G184-D186 PolarHBondContact O-N 3.33Å
185	F	49.2	Very low	53.3	Low	161 Å²	161	130.4 Å²	130.4	71%	0.706	68%	0.684	S	S	*	*			trans	-88.5	60.7	177.4	-89.6	-85.8	0	0	0	112.4	P187	F185-P187 WeakPolarHBondContact O-CD 3.35Å
186	D	46.1	Very low	51.2	Low	154 Å²	154	136.1 Å²	136.1	82%	0.824	71%	0.707	S	S	*	*			trans	-99.3	99.3	151.9	-85.2	-32.2	0	0	0	107.8	G184 F188	G184-D186 VanDerWaalsContact C-N 3.31Å; G184-D186 PolarHBondContact O-N 3.33Å; D186-F188 PolarHBondContact O-N 3.15Å
187	P	56	Low	49.8	Very low	91 Å²	91	135.3 Å²	135.3	59%	0.591	71%	0.714	S	S	*	*			trans	-82.5	117.3	170.4	30.4	-25.4	0	0	0	108.1	F185	F185-P187 WeakPolarHBondContact O-CD 3.35Å
188	F	42.1	Very low	48.3	Very low	195 Å²	195	135 Å²	135	86%	0.855	72%	0.72	S	S	*	*				-178.3	116.7	127.3	-83.5	-57.8	0	0	0	111.1	D186	D186-F188 PolarHBondContact O-N 3.15Å
189	P	62.6	Low	47.1	Very low	117 Å²	117	139.4 Å²	139.4	76%	0.76	73%	0.733	S	S	*	*			trans	-96.6	123.2	167.2	33.5	-23.9	0	0	0	109.7
190	L	43.3	Very low	46.3	Very low	149 Å²	149	139.4 Å²	139.4	78%	0.78	74%	0.739	S	S	*	*			trans	-153	110.6	164	-119.2	121.9	0	0	0	113.3
191	Y	35.5	Very low	45.3	Very low	200 Å²	200	140.5 Å²	140.5	78%	0.784	74%	0.744	S	S	*	*			trans	79.6	100.3	151	-81.6	-109.7	0	0	0	119.5	V193	Y191-V193 PolarHBondContact O-N 3.12Å
192	H	47.3	Very low	44.8	Very low	184 Å²	184	141 Å²	141	85%	0.852	75%	0.753	S	S	*	*				-32.7	129	124.3	-102	-84.3	0	0	0	111.1
193	V	34.8	Very low	43.7	Very low	122 Å²	122	145 Å²	145	74%	0.739	77%	0.767	S	S	*	*			trans	-176.7	128.2	134.8	148.5	0	0	0	0	110.6	Y191	Y191-V193 PolarHBondContact O-N 3.12Å
194	N	31.2	Very low	43.4	Very low	144 Å²	144	147 Å²	147	77%	0.77	77%	0.768	S	S	*	*			trans	69.8	98.1	155.9	-96.7	-9.9	0	0	0	122	K196	N194-K196 PolarHBondContact O-N 3.07Å
195	E	46.3	Very low	42.8	Very low	177 Å²	177	153.4 Å²	153.4	83%	0.827	78%	0.784	S	S	*	*				-8.3	107.9	115.1	-164.4	178.1	-174.4	0	0	116.1
196	K	31.5	Very low	42.4	Very low	202 Å²	202	153.9 Å²	153.9	88%	0.878	79%	0.788	S	S	*	*			trans	-174.3	131.5	130.2	-114.2	175	-179.3	174.6	0	113.8	N194	N194-K196 PolarHBondContact O-N 3.07Å
197	S	41.3	Very low	42.1	Very low	99 Å²	99	154.6 Å²	154.6	69%	0.692	79%	0.791	S	S	*	*			trans	-48.1	141.6	157.5	173.3	0	0	0	0	112.3
198	S	38	Very low	41.5	Very low	100 Å²	100	155.6 Å²	155.6	70%	0.699	80%	0.8	S	S	*	*			trans	170.9	115.2	134.1	-73.2	0	0	0	0	112.6
199	H	38.5	Very low	41.6	Very low	158 Å²	158	156.3 Å²	156.3	73%	0.731	82%	0.82	S	S	*	*				47	132.4	125.6	-73.6	-90.1	0	0	0	122.6
200	L	41.8	Very low	40.5	Very low	148 Å²	148	158.3 Å²	158.3	78%	0.775	82%	0.823	S	S	*	*			trans	72.1	139.1	143	-66.7	158.3	0	0	0	115
201	L	41.4	Very low	40.4	Very low	154 Å²	154	158.7 Å²	158.7	81%	0.806	83%	0.826	S	S	*	*			cis	-172.6	142.6	38.2	-134.3	171.2	0	0	0	108.1
202	L	47.3	Very low	40.6	Very low	166 Å²	166	156.4 Å²	156.4	87%	0.869	83%	0.828	S	S	*	*			trans	-55.3	149.3	165.9	-90.3	83.6	0	0	0	112.1
203	K	38.7	Very low	40.2	Very low	200 Å²	200	154.8 Å²	154.8	87%	0.87	83%	0.826	S	S	*	*			trans	-142.6	134.9	151.4	-159.2	169	-176.6	176.6	0	111
204	P	47.9	Very low	40.6	Very low	106 Å²	106	156.9 Å²	156.9	69%	0.688	83%	0.832	S	S	*	*			trans	-83.2	152.5	-170.6	33.1	-34	0	0	0	112.8
205	M	38.1	Very low	41.2	Very low	195 Å²	195	157.7 Å²	157.7	96%	0.961	84%	0.836	S	S	*	*			trans	-88	111.8	172.2	-164.2	-179.8	-78.3	0	0	108.7
206	H	40.8	Very low	40.8	Very low	170 Å²	170	156.4 Å²	156.4	79%	0.787	84%	0.837	S	S	*	*			trans	-102.3	128.5	168.7	-99.3	-77.1	0	0	0	110.3
207	L	39.2	Very low	41.6	Very low	169 Å²	169	152.8 Å²	152.8	89%	0.885	83%	0.833	S	S	*	*			trans	25.5	126.5	149.3	-140.3	81.8	0	0	0	120.3
208	S	43.3	Very low	41.6	Very low	112 Å²	112	157.3 Å²	157.3	78%	0.783	85%	0.845	S	S	*	*			trans	-130.3	115.8	151.5	63.1	0	0	0	0	110.2
209	T	44.2	Very low	41.9	Very low	210 Å²	210	162.5 Å²	162.5	100%	1.288	86%	0.859	S	S	*	*			trans	31.4	0	151	-41.4	0	0	0	0	120.2

Retrieved 209 of 209 residues in 364.2 ms (Link to these results)

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