A0A5K4F310_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A5K4F310, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 279 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	53.5	Low	81	Confident	183 Å²	183	84.6 Å²	84.6	90%	0.901	42%	0.416	S	S	*	.				0	98.2	0	-170.5	164.6	107.2	0	0	108.1	V3 Q100	M1-V3 HydrophobicContact CE-CG2 3.69Å; M1-V3 HydrophobicContact CG-CG2 4.19Å; M1-V3 PolarHBondContact O-N 3.07Å; M1-Q100 PolarHBondContact SD-NE2 3.38Å; M1-Q100 VanDerWaalsContact SD-NE2 3.38Å
2	F	58.8	Low	82.1	Confident	207 Å²	207	82.9 Å²	82.9	91%	0.908	41%	0.414	S	S	*	.			trans	-75.4	94.7	175.7	-119	-93	0	0	0	107.5	A4	F2-A4 PolarHBondContact O-N 3.38Å
3	V	68.5	Low	83.1	Confident	62 Å²	62	78.9 Å²	78.9	38%	0.376	40%	0.396	S	S	.	.			trans	-74.5	116.7	173.3	-178.7	0	0	0	0	106.9	M1 K5 H7	M1-V3 HydrophobicContact CE-CG2 3.69Å; M1-V3 HydrophobicContact CG-CG2 4.19Å; M1-V3 PolarHBondContact O-N 3.07Å; V3-K5 PolarHBondContact O-N 3.33Å; V3-H7 HydrophobicContact CG1-CB 3.88Å
4	A	78.8	Confident	83.9	Confident	16 Å²	16	73.3 Å²	73.3	13%	0.132	37%	0.368	C	S	.	.			trans	-58.4	136.9	176	0	0	0	0	0	109.2	F2 S6 H7 T8 D273	F2-A4 PolarHBondContact O-N 3.38Å; A4-S6 PolarHBondContact O-N 3.34Å; A4-H7 WeakPolarHBondContact O-CB 2.93Å; A4-H7 PolarHBondContact O-N 3.5Å; A4-T8 PolarHBondContact O-N 3.14Å; A4-D273 HydrophobicContact CB-CB 4Å
5	K	87.7	Confident	84.7	Confident	193 Å²	193	76.7 Å²	76.7	84%	0.839	38%	0.38	S	S	*	.	H	α-helix	trans	-52	-29.8	178.4	-68.3	-176.1	178.1	-178.3	0	112.6	V3 L9	V3-K5 PolarHBondContact O-N 3.33Å; K5-L9 WeakPolarHBondContact O-CB 3.39Å; K5-L9 PolarHBondContact O-N 3.34Å; K5-L9 VanDerWaalsContact O-N 3.08Å
6	S	88.2	Confident	85.3	Confident	7 Å²	7	77.4 Å²	77.4	5%	0.049	39%	0.385	C	S	.	.	H	α-helix	trans	-65	-35.7	175.6	52.8	0	0	0	0	113.4	A4 L10 I266 D273	A4-S6 PolarHBondContact O-N 3.34Å; S6-L10 WeakPolarHBondContact O-CB 3.4Å; S6-L10 PolarHBondContact O-N 3.3Å; S6-I266 WeakPolarHBondContact O-CG2 3.42Å; S6-D273 VanDerWaalsContact CB-OD2 3.32Å; S6-D273 WeakPolarHBondContact CB-OD2 3.35Å; S6-D273 PolarHBondContact OG-OD2 2.75Å
7	H	87.4	Confident	85.9	Confident	11 Å²	11	73.5 Å²	73.5	5%	0.051	37%	0.366	C	S	.	.	H	α-helix	trans	-70.2	-44.8	177.5	-67.8	-179.6	0	0	0	111.2	V3 A4 L9 L10 F11 I97 A270	V3-H7 HydrophobicContact CG1-CB 3.88Å; A4-H7 WeakPolarHBondContact O-CB 2.93Å; A4-H7 PolarHBondContact O-N 3.5Å; H7-L9 VanDerWaalsContact C-N 3.34Å; H7-L9 PolarHBondContact O-N 3.43Å; H7-L10 PolarHBondContact O-N 3.43Å; H7-F11 WeakPolarHBondContact O-CB 3.44Å; H7-F11 PolarHBondContact O-N 3.48Å; H7-I97 HydrophobicContact CB-CG2 4.31Å; H7-A270 VanDerWaalsContact CD2-CB 3.47Å; H7-A270 WeakPolarHBondContact CD2-CB 3Å; H7-A270 PolarHBondContact NE2-O 3.42Å; H7-A270 VanDerWaalsContact NE2-O 3.16Å
8	T	89.7	Confident	86.5	Confident	77 Å²	77	70.1 Å²	70.1	47%	0.472	35%	0.351	S	S	.	.	H	α-helix	trans	-59.9	-45.8	175.3	-50.2	0	0	0	0	111	A4 F11 T12	A4-T8 PolarHBondContact O-N 3.14Å; T8-F11 PolarHBondContact O-N 3.41Å; T8-T12 PolarHBondContact O-N 3.03Å; T8-T12 PolarHBondContact O-OG1 3.47Å; T8-T12 VanDerWaalsContact O-OG1 3.05Å
9	L	92.8	Very high	87	Confident	90 Å²	90	73.1 Å²	73.1	47%	0.471	36%	0.362	S	S	.	.	H	α-helix	trans	-63.1	-45.5	178.2	-175.9	65.9	0	0	0	111.9	K5 H7 F11 T12 V13 I266	K5-L9 WeakPolarHBondContact O-CB 3.39Å; K5-L9 PolarHBondContact O-N 3.34Å; K5-L9 VanDerWaalsContact O-N 3.08Å; H7-L9 VanDerWaalsContact C-N 3.34Å; H7-L9 PolarHBondContact O-N 3.43Å; L9-F11 VanDerWaalsContact C-N 3.29Å; L9-F11 PolarHBondContact O-N 3.17Å; L9-T12 PolarHBondContact O-N 3.05Å; L9-V13 HydrophobicContact CD1-CG2 4.43Å; L9-V13 WeakPolarHBondContact O-CG2 3.38Å; L9-V13 PolarHBondContact O-N 3.21Å; L9-I266 HydrophobicContact CD2-CD1 3.69Å; L9-I266 HydrophobicContact CD2-CG1 4.02Å; L9-I266 HydrophobicContact CD2-CG2 4.33Å; L9-I266 HydrophobicContact CG-CD1 3.94Å; L9-I266 HydrophobicContact CG-CG2 4.49Å
10	L	92.8	Very high	87.4	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-61.6	-39.7	178.4	-169.7	63	0	0	0	111.5	S6 H7 N14 I97 Y108 M263 I266 A270	S6-L10 WeakPolarHBondContact O-CB 3.4Å; S6-L10 PolarHBondContact O-N 3.3Å; H7-L10 PolarHBondContact O-N 3.43Å; L10-N14 WeakPolarHBondContact O-CB 3.47Å; L10-N14 PolarHBondContact O-N 2.96Å; L10-N14 PolarHBondContact O-ND2 3.05Å; L10-I97 HydrophobicContact CB-CD1 3.9Å; L10-I97 HydrophobicContact CD2-CD1 3.84Å; L10-I97 HydrophobicContact CD2-CG1 3.97Å; L10-I97 HydrophobicContact CG-CD1 3.71Å; L10-I97 HydrophobicContact CG-CG1 4.4Å; L10-Y108 HydrophobicContact CD1-CE1 4.44Å; L10-Y108 HydrophobicContact CD2-CE1 4.42Å; L10-M263 HydrophobicContact CD1-CB 4.49Å; L10-I266 HydrophobicContact CB-CG2 3.78Å; L10-I266 HydrophobicContact CD1-CB 4.15Å; L10-I266 HydrophobicContact CD1-CG2 4.03Å; L10-I266 HydrophobicContact CG-CG2 4.42Å; L10-A270 HydrophobicContact CD2-CB 4.38Å
11	F	93.3	Very high	87.8	Confident	84 Å²	84	70.1 Å²	70.1	37%	0.368	35%	0.349	S	S	.	.	H	α-helix	trans	-61.9	-50	176.7	-178.3	-87.3	0	0	0	110.8	H7 T8 L9 V13 N14 F15 L94 I97	H7-F11 WeakPolarHBondContact O-CB 3.44Å; H7-F11 PolarHBondContact O-N 3.48Å; T8-F11 PolarHBondContact O-N 3.41Å; L9-F11 VanDerWaalsContact C-N 3.29Å; L9-F11 PolarHBondContact O-N 3.17Å; F11-V13 PolarHBondContact O-N 3.35Å; F11-N14 PolarHBondContact O-N 3.16Å; F11-F15 WeakPolarHBondContact O-CB 3.42Å; F11-F15 PolarHBondContact O-N 3Å; F11-L94 HydrophobicContact CD2-CD2 3.56Å; F11-L94 HydrophobicContact CE2-CD2 3.63Å; F11-L94 HydrophobicContact CG-CD2 4.16Å; F11-L94 HydrophobicContact CZ-CD2 4.26Å; F11-I97 HydrophobicContact CB-CD1 4.05Å; F11-I97 HydrophobicContact CB-CG2 4.42Å; F11-I97 HydrophobicContact CD2-CG2 4.48Å
12	T	93.9	Very high	89.9	Confident	64 Å²	64	65.8 Å²	65.8	39%	0.393	33%	0.328	S	S	.	.	H	α-helix	trans	-59	-46.8	179.6	-58.8	0	0	0	0	111.9	T8 L9 F15 I16	T8-T12 PolarHBondContact O-N 3.03Å; T8-T12 PolarHBondContact O-OG1 3.47Å; T8-T12 VanDerWaalsContact O-OG1 3.05Å; L9-T12 PolarHBondContact O-N 3.05Å; T12-F15 PolarHBondContact O-N 3.34Å; T12-I16 HydrophobicContact CG2-CD1 3.86Å; T12-I16 WeakPolarHBondContact O-CG1 3.33Å; T12-I16 PolarHBondContact O-N 3.3Å
13	V	94.5	Very high	91.7	Very high	31 Å²	31	60.5 Å²	60.5	19%	0.188	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-46.4	-179.7	179.9	0	0	0	0	110.8	L9 F11 F15 I16 T17 I259 M263 I266	L9-V13 HydrophobicContact CD1-CG2 4.43Å; L9-V13 WeakPolarHBondContact O-CG2 3.38Å; L9-V13 PolarHBondContact O-N 3.21Å; F11-V13 PolarHBondContact O-N 3.35Å; V13-F15 VanDerWaalsContact C-N 3.31Å; V13-F15 PolarHBondContact O-N 3.44Å; V13-I16 PolarHBondContact O-N 3.35Å; V13-T17 WeakPolarHBondContact O-CB 3.46Å; V13-T17 PolarHBondContact O-N 2.85Å; V13-T17 PolarHBondContact O-OG1 2.98Å; V13-I259 HydrophobicContact CG1-CG2 4.26Å; V13-M263 HydrophobicContact CB-CG 4.34Å; V13-M263 HydrophobicContact CG1-CG 3.47Å; V13-M263 VanDerWaalsContact CG1-CG 3.47Å; V13-M263 HydrophobicContact CG1-SD 3.84Å; V13-I266 HydrophobicContact CG2-CD1 4.44Å
14	N	95.1	Very high	93	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.6	-39.7	177.2	-84.7	-86	0	0	0	112.5	L10 F11 A18 C90 L94 Y108	L10-N14 WeakPolarHBondContact O-CB 3.47Å; L10-N14 PolarHBondContact O-N 2.96Å; L10-N14 PolarHBondContact O-ND2 3.05Å; F11-N14 PolarHBondContact O-N 3.16Å; N14-A18 VanDerWaalsContact O-CB 3.24Å; N14-A18 WeakPolarHBondContact O-CB 3.32Å; N14-A18 PolarHBondContact O-N 2.6Å; N14-C90 WeakPolarHBondContact OD1-CA 3.44Å; N14-L94 HydrophobicContact CB-CD2 3.93Å; N14-L94 HydrophobicContact CB-CG 4.15Å; N14-Y108 PolarHBondContact ND2-OH 3.48Å; N14-Y108 PolarHBondContact OD1-OH 3.08Å
15	F	95.5	Very high	93.8	Very high	124 Å²	124	61 Å²	61	54%	0.544	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-46.3	178.8	-175.9	-95.7	0	0	0	111.9	F11 T12 V13 A18 F19	F11-F15 WeakPolarHBondContact O-CB 3.42Å; F11-F15 PolarHBondContact O-N 3Å; T12-F15 PolarHBondContact O-N 3.34Å; V13-F15 VanDerWaalsContact C-N 3.31Å; V13-F15 PolarHBondContact O-N 3.44Å; F15-A18 PolarHBondContact O-N 3.11Å; F15-F19 PolarHBondContact O-N 3.34Å; F15-F19 VanDerWaalsContact O-N 3.11Å
16	I	95.3	Very high	94.2	Very high	89 Å²	89	55.2 Å²	55.2	46%	0.456	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-46.8	177.2	-66.7	168.3	0	0	0	110.4	T12 V13 A18 F19 I20	T12-I16 HydrophobicContact CG2-CD1 3.86Å; T12-I16 WeakPolarHBondContact O-CG1 3.33Å; T12-I16 PolarHBondContact O-N 3.3Å; V13-I16 PolarHBondContact O-N 3.35Å; I16-A18 VanDerWaalsContact C-N 3.34Å; I16-A18 PolarHBondContact O-N 3.44Å; I16-F19 PolarHBondContact O-N 2.88Å; I16-I20 HydrophobicContact CG2-CD1 3.88Å; I16-I20 WeakPolarHBondContact O-CG1 3.49Å; I16-I20 PolarHBondContact O-N 2.92Å
17	T	94.8	Very high	94.5	Very high	11 Å²	11	56.2 Å²	56.2	7%	0.067	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-41.8	178.7	-60.5	0	0	0	0	111.6	V13 F19 I20 C21 M263	V13-T17 WeakPolarHBondContact O-CB 3.46Å; V13-T17 PolarHBondContact O-N 2.85Å; V13-T17 PolarHBondContact O-OG1 2.98Å; T17-F19 VanDerWaalsContact C-N 3.34Å; T17-F19 PolarHBondContact O-N 3.11Å; T17-I20 PolarHBondContact O-N 2.97Å; T17-C21 WeakPolarHBondContact O-CB 3.43Å; T17-C21 PolarHBondContact O-N 3.23Å; T17-C21 PolarHBondContact O-SG 3.39Å; T17-M263 HydrophobicContact CG2-CE 4.39Å
18	A	96.1	Very high	94.8	Very high	11 Å²	11	56.2 Å²	56.2	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-44.4	175.7	0	0	0	0	0	112	N14 F15 I16 C21 I22 L87 C90	N14-A18 VanDerWaalsContact O-CB 3.24Å; N14-A18 WeakPolarHBondContact O-CB 3.32Å; N14-A18 PolarHBondContact O-N 2.6Å; F15-A18 PolarHBondContact O-N 3.11Å; I16-A18 VanDerWaalsContact C-N 3.34Å; I16-A18 PolarHBondContact O-N 3.44Å; A18-C21 PolarHBondContact O-N 3.01Å; A18-I22 WeakPolarHBondContact O-CG1 3.17Å; A18-I22 PolarHBondContact O-N 3.47Å; A18-L87 HydrophobicContact CB-CD1 3.89Å; A18-C90 HydrophobicContact CB-CB 3.91Å
19	F	96.1	Very high	95	Very high	127 Å²	127	53.1 Å²	53.1	56%	0.557	29%	0.286	S	S	*	.	H	α-helix	trans	-61.5	-45.2	176.9	-176.5	-100.4	0	0	0	111.9	F15 I16 T17 C21 I22 L23	F15-F19 PolarHBondContact O-N 3.34Å; F15-F19 VanDerWaalsContact O-N 3.11Å; I16-F19 PolarHBondContact O-N 2.88Å; T17-F19 VanDerWaalsContact C-N 3.34Å; T17-F19 PolarHBondContact O-N 3.11Å; F19-C21 VanDerWaalsContact C-N 3.35Å; F19-C21 PolarHBondContact O-N 3.39Å; F19-I22 PolarHBondContact O-N 3.02Å; F19-L23 HydrophobicContact CD1-CD1 4.16Å; F19-L23 HydrophobicContact CE1-CD1 3.69Å; F19-L23 HydrophobicContact CE1-CG 4.29Å; F19-L23 HydrophobicContact CZ-CD1 4.28Å; F19-L23 PolarHBondContact O-N 3.2Å
20	I	95.4	Very high	95.1	Very high	77 Å²	77	53.4 Å²	53.4	40%	0.395	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-43.9	176.1	-66.2	168	0	0	0	110.8	I16 T17 I22 L23 I24	I16-I20 HydrophobicContact CG2-CD1 3.88Å; I16-I20 WeakPolarHBondContact O-CG1 3.49Å; I16-I20 PolarHBondContact O-N 2.92Å; T17-I20 PolarHBondContact O-N 2.97Å; I20-I22 VanDerWaalsContact C-N 3.32Å; I20-I22 PolarHBondContact O-N 3.25Å; I20-L23 PolarHBondContact O-N 3.35Å; I20-I24 HydrophobicContact CG2-CD1 3.77Å; I20-I24 HydrophobicContact CG2-CG1 4.38Å; I20-I24 WeakPolarHBondContact O-CG1 3.38Å; I20-I24 PolarHBondContact O-N 2.94Å
21	C	96.3	Very high	95	Very high	8 Å²	8	57 Å²	57	5%	0.054	30%	0.304	C	S	.	.	H	α-helix	trans	-59.5	-41.1	176.9	-71.8	0	0	0	0	111.9	T17 A18 F19 L23 I24 I25 L87	T17-C21 WeakPolarHBondContact O-CB 3.43Å; T17-C21 PolarHBondContact O-N 3.23Å; T17-C21 PolarHBondContact O-SG 3.39Å; A18-C21 PolarHBondContact O-N 3.01Å; F19-C21 VanDerWaalsContact C-N 3.35Å; F19-C21 PolarHBondContact O-N 3.39Å; C21-L23 VanDerWaalsContact C-N 3.33Å; C21-L23 PolarHBondContact O-N 3.39Å; C21-I24 PolarHBondContact O-N 3.37Å; C21-I25 HydrophobicContact CB-CD1 4.49Å; C21-I25 VanDerWaalsContact O-CB 3.31Å; C21-I25 WeakPolarHBondContact O-CB 3.27Å; C21-I25 WeakPolarHBondContact O-CD1 3.36Å; C21-I25 WeakPolarHBondContact O-CG1 3.25Å; C21-I25 PolarHBondContact O-N 2.92Å; C21-L87 HydrophobicContact CB-CB 3.99Å; C21-L87 HydrophobicContact CB-CD1 4.4Å
22	I	96.9	Very high	95	Very high	92 Å²	92	55 Å²	55	47%	0.472	30%	0.296	S	S	.	.	H	α-helix	trans	-60.1	-44.4	176.6	-69.1	164.6	0	0	0	110.9	A18 F19 I20 I25 S26 L87	A18-I22 WeakPolarHBondContact O-CG1 3.17Å; A18-I22 PolarHBondContact O-N 3.47Å; F19-I22 PolarHBondContact O-N 3.02Å; I20-I22 VanDerWaalsContact C-N 3.32Å; I20-I22 PolarHBondContact O-N 3.25Å; I22-I25 PolarHBondContact O-N 2.83Å; I22-S26 WeakPolarHBondContact O-CB 3.35Å; I22-S26 PolarHBondContact O-N 3.13Å; I22-S26 PolarHBondContact O-OG 3Å; I22-L87 HydrophobicContact CD1-CD1 4.41Å; I22-L87 HydrophobicContact CG1-CD1 4.06Å; I22-L87 HydrophobicContact CG1-CD2 4.09Å
23	L	96.2	Very high	94.9	Very high	95 Å²	95	58.7 Å²	58.7	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-46.9	176.9	-65.2	177.9	0	0	0	111.5	F19 I20 C21 S26 G27	F19-L23 HydrophobicContact CD1-CD1 4.16Å; F19-L23 HydrophobicContact CE1-CD1 3.69Å; F19-L23 HydrophobicContact CE1-CG 4.29Å; F19-L23 HydrophobicContact CZ-CD1 4.28Å; F19-L23 PolarHBondContact O-N 3.2Å; I20-L23 PolarHBondContact O-N 3.35Å; C21-L23 VanDerWaalsContact C-N 3.33Å; C21-L23 PolarHBondContact O-N 3.39Å; L23-S26 PolarHBondContact O-N 3.44Å; L23-S26 PolarHBondContact O-OG 3.24Å; L23-G27 PolarHBondContact O-N 3.05Å
24	I	95.7	Very high	94.8	Very high	64 Å²	64	58.8 Å²	58.8	33%	0.328	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-43.7	179.3	-63.4	170.1	0	0	0	111.2	I20 C21 S26 G27 A28 V79 S83	I20-I24 HydrophobicContact CG2-CD1 3.77Å; I20-I24 HydrophobicContact CG2-CG1 4.38Å; I20-I24 WeakPolarHBondContact O-CG1 3.38Å; I20-I24 PolarHBondContact O-N 2.94Å; C21-I24 PolarHBondContact O-N 3.37Å; I24-S26 VanDerWaalsContact C-N 3.3Å; I24-S26 PolarHBondContact O-N 3.4Å; I24-G27 PolarHBondContact O-N 3.01Å; I24-A28 VanDerWaalsContact O-CB 3.31Å; I24-A28 WeakPolarHBondContact O-CB 3.41Å; I24-A28 PolarHBondContact O-N 3.38Å; I24-V79 HydrophobicContact CG2-CG1 3.61Å; I24-S83 VanDerWaalsContact CG2-OG 3.22Å; I24-S83 WeakPolarHBondContact CG2-OG 3.48Å
25	I	96.9	Very high	94.6	Very high	25 Å²	25	61.7 Å²	61.7	13%	0.128	33%	0.328	C	S	.	.	H	α-helix	trans	-58.9	-43.8	176.2	-71.8	164.8	0	0	0	110.3	C21 I22 G29 F80 L84 L87	C21-I25 HydrophobicContact CB-CD1 4.49Å; C21-I25 VanDerWaalsContact O-CB 3.31Å; C21-I25 WeakPolarHBondContact O-CB 3.27Å; C21-I25 WeakPolarHBondContact O-CD1 3.36Å; C21-I25 WeakPolarHBondContact O-CG1 3.25Å; C21-I25 PolarHBondContact O-N 2.92Å; I22-I25 PolarHBondContact O-N 2.83Å; I25-G29 WeakPolarHBondContact O-CA 3.42Å; I25-G29 PolarHBondContact O-N 3.37Å; I25-F80 HydrophobicContact CG2-CD2 3.96Å; I25-F80 HydrophobicContact CG2-CE2 3.49Å; I25-F80 VanDerWaalsContact CG2-CE2 3.49Å; I25-F80 HydrophobicContact CG2-CZ 4.15Å; I25-L84 HydrophobicContact CD1-CB 4.33Å; I25-L84 HydrophobicContact CD1-CD1 4.39Å; I25-L87 HydrophobicContact CD1-CB 4.08Å; I25-L87 HydrophobicContact CD1-CD2 3.65Å
26	S	95.5	Very high	94.4	Very high	72 Å²	72	62.2 Å²	62.2	50%	0.503	33%	0.332	S	S	.	.	H	α-helix	trans	-63.5	-43.6	178.6	74	0	0	0	0	112.1	I22 L23 I24 L30	I22-S26 WeakPolarHBondContact O-CB 3.35Å; I22-S26 PolarHBondContact O-N 3.13Å; I22-S26 PolarHBondContact O-OG 3Å; L23-S26 PolarHBondContact O-N 3.44Å; L23-S26 PolarHBondContact O-OG 3.24Å; I24-S26 VanDerWaalsContact C-N 3.3Å; I24-S26 PolarHBondContact O-N 3.4Å; S26-L30 WeakPolarHBondContact O-CB 3.35Å; S26-L30 PolarHBondContact O-N 3Å
27	G	93.7	Very high	94.2	Very high	28 Å²	28	58.5 Å²	58.5	29%	0.289	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-50.5	176.9	0	0	0	0	0	112.4	L23 I24 G29 L30 F31	L23-G27 PolarHBondContact O-N 3.05Å; I24-G27 PolarHBondContact O-N 3.01Å; G27-G29 VanDerWaalsContact C-N 3.33Å; G27-G29 PolarHBondContact O-N 3.41Å; G27-L30 WeakPolarHBondContact O-CB 3.32Å; G27-L30 PolarHBondContact O-N 3.47Å; G27-F31 VanDerWaalsContact O-CD2 3.3Å; G27-F31 WeakPolarHBondContact O-CD2 3.39Å; G27-F31 PolarHBondContact O-N 3.45Å
28	A	94.2	Very high	94	Very high	10 Å²	10	58 Å²	58	8%	0.083	31%	0.312	C	S	.	.	H	α-helix	trans	-62.5	-39.7	178.6	0	0	0	0	0	112	I24 F31 M32 V79 F80	I24-A28 VanDerWaalsContact O-CB 3.31Å; I24-A28 WeakPolarHBondContact O-CB 3.41Å; I24-A28 PolarHBondContact O-N 3.38Å; A28-F31 PolarHBondContact O-N 3.19Å; A28-M32 VanDerWaalsContact O-CB 3.26Å; A28-M32 WeakPolarHBondContact O-CB 3.45Å; A28-M32 PolarHBondContact O-N 3.31Å; A28-V79 HydrophobicContact CB-CB 4.39Å; A28-V79 HydrophobicContact CB-CG1 4.05Å; A28-F80 HydrophobicContact CB-CB 4.05Å; A28-F80 HydrophobicContact CB-CD2 4.5Å
29	G	94.5	Very high	93.8	Very high	12 Å²	12	59 Å²	59	12%	0.124	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-39.4	174.5	0	0	0	0	0	112.5	I25 G27 M32 L33	I25-G29 WeakPolarHBondContact O-CA 3.42Å; I25-G29 PolarHBondContact O-N 3.37Å; G27-G29 VanDerWaalsContact C-N 3.33Å; G27-G29 PolarHBondContact O-N 3.41Å; G29-M32 PolarHBondContact O-N 3.03Å; G29-L33 WeakPolarHBondContact O-CB 3.5Å; G29-L33 WeakPolarHBondContact O-CG 3.43Å; G29-L33 PolarHBondContact O-N 3.38Å
30	L	93.9	Very high	93.6	Very high	96 Å²	96	59.1 Å²	59.1	50%	0.503	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-48.7	174.5	-175.5	68.3	0	0	0	111.3	S26 G27 M32 L33 S34 A37	S26-L30 WeakPolarHBondContact O-CB 3.35Å; S26-L30 PolarHBondContact O-N 3Å; G27-L30 WeakPolarHBondContact O-CB 3.32Å; G27-L30 PolarHBondContact O-N 3.47Å; L30-M32 VanDerWaalsContact C-N 3.3Å; L30-M32 PolarHBondContact O-N 3.24Å; L30-L33 PolarHBondContact O-N 2.82Å; L30-S34 WeakPolarHBondContact O-CA 3.37Å; L30-S34 WeakPolarHBondContact O-CB 3.45Å; L30-S34 PolarHBondContact O-N 3.15Å; L30-A37 HydrophobicContact CD1-CB 4.32Å; L30-A37 HydrophobicContact CD2-CB 4.12Å; L30-A37 HydrophobicContact CG-CB 3.76Å
31	F	91.8	Very high	93.4	Very high	78 Å²	78	60 Å²	60	34%	0.342	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-29	176.5	-79.8	-75.8	0	0	0	113.3	G27 A28 N38 I41	G27-F31 VanDerWaalsContact O-CD2 3.3Å; G27-F31 WeakPolarHBondContact O-CD2 3.39Å; G27-F31 PolarHBondContact O-N 3.45Å; A28-F31 PolarHBondContact O-N 3.19Å; F31-N38 PolarHBondContact O-ND2 3.46Å; F31-I41 HydrophobicContact CE1-CD1 4.09Å; F31-I41 HydrophobicContact CE1-CG1 4.43Å
32	M	92.5	Very high	93.2	Very high	42 Å²	42	60.1 Å²	60.1	21%	0.207	32%	0.323	C	S	.	.	H	α-helix	trans	-72.6	-33.5	177.2	-175	-179	71.3	0	0	112.9	A28 G29 L30 I77	A28-M32 VanDerWaalsContact O-CB 3.26Å; A28-M32 WeakPolarHBondContact O-CB 3.45Å; A28-M32 PolarHBondContact O-N 3.31Å; G29-M32 PolarHBondContact O-N 3.03Å; L30-M32 VanDerWaalsContact C-N 3.3Å; L30-M32 PolarHBondContact O-N 3.24Å; M32-I77 HydrophobicContact CG-CG1 4.12Å; M32-I77 HydrophobicContact SD-CG1 3.63Å
33	L	91.3	Very high	93	Very high	140 Å²	140	61.3 Å²	61.3	73%	0.733	32%	0.321	S	S	*	.	H	α-helix	trans	-111.8	-19.4	-169.4	-63	175	0	0	0	114.5	G29 L30	G29-L33 WeakPolarHBondContact O-CB 3.5Å; G29-L33 WeakPolarHBondContact O-CG 3.43Å; G29-L33 PolarHBondContact O-N 3.38Å; L30-L33 PolarHBondContact O-N 2.82Å
34	S	92.3	Very high	92.8	Very high	33 Å²	33	64.1 Å²	64.1	23%	0.231	33%	0.329	C	S	.	.			trans	-107.8	110	-173.9	-176.6	0	0	0	0	112	L30 E36 A37 N38	L30-S34 WeakPolarHBondContact O-CA 3.37Å; L30-S34 WeakPolarHBondContact O-CB 3.45Å; L30-S34 PolarHBondContact O-N 3.15Å; S34-E36 VanDerWaalsContact C-N 3.25Å; S34-E36 PolarHBondContact O-N 3.28Å; S34-A37 PolarHBondContact O-N 3.14Å; S34-A37 PolarHBondContact OG-N 3.11Å; S34-A37 VanDerWaalsContact OG-N 3.12Å; S34-N38 PolarHBondContact O-N 3.33Å; S34-N38 PolarHBondContact O-ND2 3.41Å
35	E	91	Very high	92.7	Very high	62 Å²	62	61.8 Å²	61.8	29%	0.29	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-40.6	168.4	169.2	158.6	-160.1	0	0	111.2	A37 N38 F39 G63 G65 K66	E35-A37 PolarHBondContact O-N 3.32Å; E35-N38 PolarHBondContact O-N 3.27Å; E35-F39 WeakPolarHBondContact O-CB 3.27Å; E35-F39 PolarHBondContact O-N 2.85Å; E35-G63 WeakPolarHBondContact OE1-CA 3.38Å; E35-G63 PolarHBondContact OE1-N 2.89Å; E35-G63 VanDerWaalsContact OE1-N 3.15Å; E35-G65 WeakPolarHBondContact O-CA 3.29Å; E35-K66 WeakPolarHBondContact OE1-CB 3.38Å; E35-K66 PolarHBondContact OE1-N 2.99Å
36	E	91.1	Very high	92.5	Very high	135 Å²	135	60.7 Å²	60.7	63%	0.631	31%	0.313	S	S	*	.	H	α-helix	trans	-62.8	-39.7	179	-71.7	-65.4	165.9	0	0	112.6	S34 N38 F39 M40	S34-E36 VanDerWaalsContact C-N 3.25Å; S34-E36 PolarHBondContact O-N 3.28Å; E36-N38 VanDerWaalsContact C-N 3.34Å; E36-F39 PolarHBondContact O-N 3.01Å; E36-M40 PolarHBondContact O-N 3.39Å
37	A	91.7	Very high	92.4	Very high	11 Å²	11	62.2 Å²	62.2	9%	0.091	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-40.7	176.3	0	0	0	0	0	111.5	L30 S34 E35 M40	L30-A37 HydrophobicContact CD1-CB 4.32Å; L30-A37 HydrophobicContact CD2-CB 4.12Å; L30-A37 HydrophobicContact CG-CB 3.76Å; S34-A37 PolarHBondContact O-N 3.14Å; S34-A37 PolarHBondContact OG-N 3.11Å; S34-A37 VanDerWaalsContact OG-N 3.12Å; E35-A37 PolarHBondContact O-N 3.32Å; A37-M40 VanDerWaalsContact O-CB 3.25Å; A37-M40 WeakPolarHBondContact O-CB 3.24Å; A37-M40 PolarHBondContact O-N 2.96Å
38	N	91.3	Very high	92.4	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.7	-41.6	174.8	-76.3	-78	0	0	0	111.7	F31 S34 E35 E36 M40 I41 G65 I68 M69 T72	F31-N38 PolarHBondContact O-ND2 3.46Å; S34-N38 PolarHBondContact O-N 3.33Å; S34-N38 PolarHBondContact O-ND2 3.41Å; E35-N38 PolarHBondContact O-N 3.27Å; E36-N38 VanDerWaalsContact C-N 3.34Å; N38-M40 PolarHBondContact O-N 3.48Å; N38-I41 WeakPolarHBondContact O-CB 3.41Å; N38-I41 WeakPolarHBondContact O-CG1 3.39Å; N38-I41 PolarHBondContact O-N 3.24Å; N38-I41 VanDerWaalsContact O-N 3.16Å; N38-G65 WeakPolarHBondContact CB-O 3.48Å; N38-I68 HydrophobicContact CB-CB 3.99Å; N38-I68 HydrophobicContact CB-CG2 3.77Å; N38-I68 WeakPolarHBondContact O-CD1 3.42Å; N38-M69 HydrophobicContact CB-CB 4.33Å; N38-T72 PolarHBondContact OD1-OG1 3.18Å
39	F	92.2	Very high	92.3	Very high	31 Å²	31	62 Å²	62	14%	0.136	30%	0.301	C	S	.	.	H	α-helix	trans	-59.5	-31.8	176.4	-178.3	-116.8	0	0	0	112.1	E35 E36 I41 L42 R43 V46 V64	E35-F39 WeakPolarHBondContact O-CB 3.27Å; E35-F39 PolarHBondContact O-N 2.85Å; E36-F39 PolarHBondContact O-N 3.01Å; F39-I41 PolarHBondContact O-N 3.43Å; F39-L42 CarbonylContact O-C 3.58Å; F39-L42 PolarHBondContact O-N 3.32Å; F39-R43 HydrophobicContact CD1-CB 4.29Å; F39-R43 HydrophobicContact CD1-CG 4.31Å; F39-R43 HydrophobicContact CE1-CB 4.14Å; F39-R43 HydrophobicContact CE1-CG 3.89Å; F39-R43 WeakPolarHBondContact O-CB 3.45Å; F39-R43 PolarHBondContact O-N 3.37Å; F39-V46 HydrophobicContact CE2-CB 3.97Å; F39-V46 HydrophobicContact CE2-CG1 3.89Å; F39-V46 HydrophobicContact CE2-CG2 4.01Å; F39-V46 HydrophobicContact CZ-CB 4.05Å; F39-V46 HydrophobicContact CZ-CG1 3.89Å; F39-V64 HydrophobicContact CD2-CB 3.93Å; F39-V64 HydrophobicContact CD2-CG1 4.13Å; F39-V64 HydrophobicContact CE2-CB 4.07Å; F39-V64 HydrophobicContact CE2-CG1 4.34Å
40	M	91.8	Very high	92.2	Very high	130 Å²	130	65.5 Å²	65.5	64%	0.64	31%	0.314	S	S	*	.	H	α-helix	trans	-52.6	-30.6	177.2	-161.7	179	-65.8	0	0	113.3	E36 A37 N38 L42 R43	E36-M40 PolarHBondContact O-N 3.39Å; A37-M40 VanDerWaalsContact O-CB 3.25Å; A37-M40 WeakPolarHBondContact O-CB 3.24Å; A37-M40 PolarHBondContact O-N 2.96Å; N38-M40 PolarHBondContact O-N 3.48Å; M40-L42 PolarHBondContact O-N 3.01Å; M40-R43 PolarHBondContact O-N 3.34Å
41	I	89.8	Confident	92.1	Very high	97 Å²	97	67.4 Å²	67.4	50%	0.497	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-44.5	177.8	-61.4	177.2	0	0	0	111.4	F31 N38 F39 I68	F31-I41 HydrophobicContact CE1-CD1 4.09Å; F31-I41 HydrophobicContact CE1-CG1 4.43Å; N38-I41 WeakPolarHBondContact O-CB 3.41Å; N38-I41 WeakPolarHBondContact O-CG1 3.39Å; N38-I41 PolarHBondContact O-N 3.24Å; N38-I41 VanDerWaalsContact O-N 3.16Å; F39-I41 PolarHBondContact O-N 3.43Å; I41-I68 HydrophobicContact CD1-CG2 3.97Å
42	L	92.2	Very high	92.2	Very high	10 Å²	10	63.8 Å²	63.8	5%	0.052	30%	0.303	C	S	.	.	H	α-helix	trans	-103.8	1.2	-178.6	-63.3	-173.7	0	0	0	113.4	F39 M40 K44 T45 V46 V64 I68 F160 M167	F39-L42 CarbonylContact O-C 3.58Å; F39-L42 PolarHBondContact O-N 3.32Å; M40-L42 PolarHBondContact O-N 3.01Å; L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 3.43Å; L42-K44 VanDerWaalsContact O-N 3.15Å; L42-T45 PolarHBondContact O-N 3.11Å; L42-V46 HydrophobicContact CB-CG2 4.11Å; L42-V46 WeakPolarHBondContact O-CG2 3.28Å; L42-V46 PolarHBondContact O-N 3.44Å; L42-V64 HydrophobicContact CD1-CG1 4.11Å; L42-I68 HydrophobicContact CB-CD1 4.14Å; L42-I68 HydrophobicContact CD1-CD1 3.78Å; L42-I68 HydrophobicContact CD1-CG1 4.21Å; L42-I68 HydrophobicContact CG-CD1 3.74Å; L42-F160 HydrophobicContact CD1-CD2 3.48Å; L42-F160 VanDerWaalsContact CD1-CD2 3.48Å; L42-F160 HydrophobicContact CD1-CE2 3.9Å; L42-F160 HydrophobicContact CD1-CG 4.37Å; L42-M167 HydrophobicContact CD2-CE 3.29Å; L42-M167 HydrophobicContact CD2-SD 3.61Å
43	R	92.6	Very high	92.1	Very high	116 Å²	116	61.8 Å²	61.8	44%	0.438	29%	0.293	S	S	.	.	H	α-helix	trans	-53.4	-41.8	-172.7	-176.3	-179.9	-167.4	-156.7	3.8	112.7	F39 M40 K47	F39-R43 HydrophobicContact CD1-CB 4.29Å; F39-R43 HydrophobicContact CD1-CG 4.31Å; F39-R43 HydrophobicContact CE1-CB 4.14Å; F39-R43 HydrophobicContact CE1-CG 3.89Å; F39-R43 WeakPolarHBondContact O-CB 3.45Å; F39-R43 PolarHBondContact O-N 3.37Å; M40-R43 PolarHBondContact O-N 3.34Å; R43-K47 HydrophobicContact CG-CD 4.18Å; R43-K47 VanDerWaalsContact O-CB 3.27Å; R43-K47 WeakPolarHBondContact O-CB 3.39Å; R43-K47 VanDerWaalsContact O-CG 3.22Å; R43-K47 WeakPolarHBondContact O-CG 3.44Å; R43-K47 PolarHBondContact O-N 3.33Å
44	K	93.5	Very high	91.7	Very high	154 Å²	154	57.9 Å²	57.9	67%	0.67	28%	0.275	S	S	*	.	H	α-helix	trans	-61.6	-51.9	178.6	-175.9	-176.2	174.1	-169.5	0	110.7	L42 K47 L48	L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 3.43Å; L42-K44 VanDerWaalsContact O-N 3.15Å; K44-K47 PolarHBondContact O-N 3Å; K44-L48 HydrophobicContact CG-CD1 4.33Å; K44-L48 WeakPolarHBondContact O-CG 3.36Å; K44-L48 PolarHBondContact O-N 3.33Å
45	T	93.4	Very high	91.2	Very high	16 Å²	16	61 Å²	61	10%	0.098	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-44	-177.1	-58	0	0	0	0	112.1	L42 K47 L48 F49 M167 L212	L42-T45 PolarHBondContact O-N 3.11Å; T45-K47 PolarHBondContact O-N 3.03Å; T45-L48 PolarHBondContact O-N 2.93Å; T45-F49 HydrophobicContact CG2-CD2 4.05Å; T45-F49 HydrophobicContact CG2-CE2 3.6Å; T45-F49 HydrophobicContact CG2-CZ 4.27Å; T45-F49 WeakPolarHBondContact O-CD2 3.4Å; T45-F49 PolarHBondContact O-N 2.87Å; T45-M167 HydrophobicContact CG2-CE 4.18Å; T45-M167 WeakPolarHBondContact OG1-CE 3.41Å; T45-L212 HydrophobicContact CG2-CD1 4.05Å
46	V	92.4	Very high	90.5	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-63.2	-41.3	177.4	175.3	0	0	0	0	111.5	F39 L42 L48 F49 E50 Y60 V64 L159	F39-V46 HydrophobicContact CE2-CB 3.97Å; F39-V46 HydrophobicContact CE2-CG1 3.89Å; F39-V46 HydrophobicContact CE2-CG2 4.01Å; F39-V46 HydrophobicContact CZ-CB 4.05Å; F39-V46 HydrophobicContact CZ-CG1 3.89Å; L42-V46 HydrophobicContact CB-CG2 4.11Å; L42-V46 WeakPolarHBondContact O-CG2 3.28Å; L42-V46 PolarHBondContact O-N 3.44Å; V46-L48 VanDerWaalsContact C-N 3.31Å; V46-L48 PolarHBondContact O-N 3.28Å; V46-F49 PolarHBondContact O-N 2.84Å; V46-E50 PolarHBondContact O-N 3.49Å; V46-Y60 HydrophobicContact CG1-CD1 4.09Å; V46-Y60 HydrophobicContact CG1-CE1 4.11Å; V46-V64 HydrophobicContact CG2-CG1 4.36Å; V46-L159 HydrophobicContact CG1-CD1 4.3Å
47	K	92.2	Very high	89.9	Confident	103 Å²	103	56.1 Å²	56.1	45%	0.448	28%	0.28	S	S	.	.	H	α-helix	trans	-64.7	-34.5	175	-78.9	-175.8	172.6	-164.1	0	113.2	R43 K44 T45 E50 K51	R43-K47 HydrophobicContact CG-CD 4.18Å; R43-K47 VanDerWaalsContact O-CB 3.27Å; R43-K47 WeakPolarHBondContact O-CB 3.39Å; R43-K47 VanDerWaalsContact O-CG 3.22Å; R43-K47 WeakPolarHBondContact O-CG 3.44Å; R43-K47 PolarHBondContact O-N 3.33Å; K44-K47 PolarHBondContact O-N 3Å; T45-K47 PolarHBondContact O-N 3.03Å; K47-E50 PolarHBondContact O-N 3.03Å; K47-K51 PolarHBondContact O-N 2.91Å
48	L	93.7	Very high	89.2	Confident	35 Å²	35	67.6 Å²	67.6	18%	0.183	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-46.7	173.7	-73	169.9	0	0	0	109.9	K44 T45 V46 E50 K51 H52 L212	K44-L48 HydrophobicContact CG-CD1 4.33Å; K44-L48 WeakPolarHBondContact O-CG 3.36Å; K44-L48 PolarHBondContact O-N 3.33Å; T45-L48 PolarHBondContact O-N 2.93Å; V46-L48 VanDerWaalsContact C-N 3.31Å; V46-L48 PolarHBondContact O-N 3.28Å; L48-E50 VanDerWaalsContact C-N 3.3Å; L48-E50 PolarHBondContact O-N 2.86Å; L48-K51 VanDerWaalsContact O-CB 3.31Å; L48-K51 WeakPolarHBondContact O-CB 3.32Å; L48-K51 PolarHBondContact O-N 2.96Å; L48-H52 PolarHBondContact O-CD2 3.49Å; L48-H52 PolarHBondContact O-N 3.22Å; L48-L212 HydrophobicContact CB-CB 4.35Å; L48-L212 HydrophobicContact CB-CD1 3.37Å; L48-L212 HydrophobicContact CB-CG 3.75Å; L48-L212 HydrophobicContact CD1-CD1 4.3Å; L48-L212 HydrophobicContact CD1-CG 4.01Å; L48-L212 HydrophobicContact CG-CD1 4.47Å; L48-L212 HydrophobicContact CG-CG 4.5Å
49	F	93.5	Very high	88.6	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-59.3	-39.8	174.4	-69.4	-53.8	0	0	0	113	T45 V46 K51 H52 V53 Y60 L151 A162 V166 Y191 M208 L212	T45-F49 HydrophobicContact CG2-CD2 4.05Å; T45-F49 HydrophobicContact CG2-CE2 3.6Å; T45-F49 HydrophobicContact CG2-CZ 4.27Å; T45-F49 WeakPolarHBondContact O-CD2 3.4Å; T45-F49 PolarHBondContact O-N 2.87Å; V46-F49 PolarHBondContact O-N 2.84Å; F49-K51 PolarHBondContact O-N 3.25Å; F49-H52 PolarHBondContact O-N 3.22Å; F49-V53 WeakPolarHBondContact O-CB 3.5Å; F49-V53 VanDerWaalsContact O-CG2 3.31Å; F49-V53 WeakPolarHBondContact O-CG2 3.49Å; F49-V53 PolarHBondContact O-N 3.4Å; F49-Y60 HydrophobicContact CB-CE1 4.04Å; F49-Y60 WeakPolarHBondContact CB-OH 3.44Å; F49-L151 HydrophobicContact CD1-CD1 4.16Å; F49-L151 HydrophobicContact CD1-CD2 3.97Å; F49-L151 HydrophobicContact CD2-CD2 4.38Å; F49-L151 HydrophobicContact CE1-CD1 4.25Å; F49-L151 HydrophobicContact CE1-CD2 4.15Å; F49-L151 HydrophobicContact CG-CD2 4.09Å; F49-L151 HydrophobicContact CZ-CD2 4.43Å; F49-A162 HydrophobicContact CE2-CB 3.85Å; F49-A162 HydrophobicContact CZ-CB 3.85Å; F49-V166 HydrophobicContact CE1-CG2 4.22Å; F49-V166 HydrophobicContact CZ-CG2 3.78Å; F49-Y191 HydrophobicContact CD1-CE2 4.11Å; F49-M208 HydrophobicContact CE1-SD 4.5Å; F49-L212 HydrophobicContact CD1-CD1 3.6Å; F49-L212 HydrophobicContact CD2-CD1 4.15Å; F49-L212 HydrophobicContact CE1-CD1 3.68Å; F49-L212 HydrophobicContact CE2-CD1 4.2Å; F49-L212 HydrophobicContact CG-CD1 3.85Å; F49-L212 HydrophobicContact CZ-CD1 3.98Å
50	E	92.1	Very high	88.1	Confident	84 Å²	84	72.2 Å²	72.2	39%	0.393	35%	0.346	S	S	.	.	H	α-helix	trans	-57.1	-37.1	175.4	-170.9	-175.8	-178.8	0	0	112.3	V46 K47 L48 P56 Y60	V46-E50 PolarHBondContact O-N 3.49Å; K47-E50 PolarHBondContact O-N 3.03Å; L48-E50 VanDerWaalsContact C-N 3.3Å; L48-E50 PolarHBondContact O-N 2.86Å; E50-P56 HydrophobicContact CG-CB 4.01Å; E50-Y60 HydrophobicContact CB-CD1 3.64Å; E50-Y60 HydrophobicContact CB-CE1 3.82Å; E50-Y60 HydrophobicContact CB-CG 4.41Å; E50-Y60 HydrophobicContact CG-CD1 3.97Å; E50-Y60 HydrophobicContact CG-CG 4.3Å
51	K	92.4	Very high	87.5	Confident	136 Å²	136	66.4 Å²	66.4	59%	0.591	32%	0.319	S	S	*	.	H	α-helix	trans	-65.9	-37.9	176.1	-176.4	-166.5	169.7	-157	0	112.1	K47 L48 F49	K47-K51 PolarHBondContact O-N 2.91Å; L48-K51 VanDerWaalsContact O-CB 3.31Å; L48-K51 WeakPolarHBondContact O-CB 3.32Å; L48-K51 PolarHBondContact O-N 2.96Å; F49-K51 PolarHBondContact O-N 3.25Å
52	H	92.6	Very high	87.3	Confident	3 Å²	3	66.6 Å²	66.6	1%	0.014	32%	0.321	C	S	.	.	H	α-helix	trans	-86.1	-26.8	-176	-68.6	-73.9	0	0	0	112.9	L48 F49 V54 Y191 D192 Q211	L48-H52 PolarHBondContact O-CD2 3.49Å; L48-H52 PolarHBondContact O-N 3.22Å; F49-H52 PolarHBondContact O-N 3.22Å; H52-V54 PolarHBondContact O-N 2.87Å; H52-Y191 HydrophobicContact CB-CD1 4.14Å; H52-Y191 HydrophobicContact CB-CD2 3.94Å; H52-Y191 HydrophobicContact CB-CE1 3.7Å; H52-Y191 HydrophobicContact CB-CE2 3.48Å; H52-Y191 VanDerWaalsContact CB-CE2 3.48Å; H52-Y191 HydrophobicContact CB-CG 4.24Å; H52-Y191 AromaticContact CG-CE1 3.87Å; H52-Y191 AromaticContact CG-CZ 3.69Å; H52-Y191 CarbonylContact O-C 3.54Å; H52-Y191 WeakPolarHBondContact O-CA 3.5Å; H52-D192 IonicContact CE1-OD1 3.37Å; H52-D192 IonicContact CG-OD1 2.96Å; H52-D192 VanDerWaalsContact ND1-CG 3.33Å; H52-D192 IonicContact ND1-OD1 3.83Å; H52-D192 PolarHBondContact ND1-OD1 3.49Å; H52-D192 IonicContact ND1-OD2 3.51Å; H52-D192 PolarHBondContact ND1-OD2 3.48Å; H52-D192 PolarHBondContact O-N 3.46Å; H52-Q211 PolarHBondContact NE2-O 2.94Å
53	V	90.1	Very high	87.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	33%	0.326	C	S	.	.	S	Bend	trans	-92.4	103.1	-178.9	179.1	0	0	0	0	110.3	F49 P55 P56 Y60 L151 Y191	F49-V53 WeakPolarHBondContact O-CB 3.5Å; F49-V53 VanDerWaalsContact O-CG2 3.31Å; F49-V53 WeakPolarHBondContact O-CG2 3.49Å; F49-V53 PolarHBondContact O-N 3.4Å; V53-P55 CarbonylContact O-C 3.52Å; V53-P56 WeakPolarHBondContact O-CA 3.35Å; V53-P56 VanDerWaalsContact O-N 3.13Å; V53-Y60 HydrophobicContact CB-CE2 4.25Å; V53-Y60 HydrophobicContact CG1-CE2 4.18Å; V53-L151 HydrophobicContact CG2-CB 3.84Å; V53-L151 HydrophobicContact CG2-CD1 4.43Å; V53-Y191 HydrophobicContact CG2-CD2 4.1Å; V53-Y191 HydrophobicContact CG2-CE2 4.42Å
54	V	84.3	Confident	87	Confident	58 Å²	58	61.3 Å²	61.3	35%	0.352	31%	0.305	S	S	.	.	S	Bend	trans	-120.9	128.5	-175.9	-176.2	0	0	0	0	111.7	H52 V190 N193	H52-V54 PolarHBondContact O-N 2.87Å; V54-V190 WeakPolarHBondContact O-CG1 3.47Å; V54-N193 WeakPolarHBondContact CB-OD1 3.5Å; V54-N193 VanDerWaalsContact CG1-OD1 3.25Å; V54-N193 WeakPolarHBondContact CG1-OD1 3.35Å; V54-N193 WeakPolarHBondContact CG2-OD1 2.98Å
55	P	81.9	Confident	86.9	Confident	97 Å²	97	54 Å²	54	63%	0.63	27%	0.273	S	S	*	.	S	Bend	cis	-72.7	141.9	-6.4	30.7	-33.7	0	0	0	110.8	V53	V53-P55 CarbonylContact O-C 3.52Å
56	P	76.5	Confident	86.8	Confident	59 Å²	59	59.6 Å²	59.6	38%	0.383	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-65.6	147	173.8	27.6	-33.6	0	0	0	109.5	E50 V53	E50-P56 HydrophobicContact CG-CB 4.01Å; V53-P56 WeakPolarHBondContact O-CA 3.35Å; V53-P56 VanDerWaalsContact O-N 3.13Å
57	S	77.9	Confident	86.6	Confident	36 Å²	36	60.7 Å²	60.7	25%	0.252	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-64.3	148.4	172.5	80.4	0	0	0	0	109.8	N59 Y60	S57-N59 PolarHBondContact O-N 2.92Å; S57-Y60 PolarHBondContact O-N 2.98Å; S57-Y60 VanDerWaalsContact O-N 3.11Å; S57-Y60 PolarHBondContact OG-N 3.41Å
58	R	77.3	Confident	86.6	Confident	253 Å²	253	56.1 Å²	56.1	96%	0.955	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-17.6	-177.1	-70.1	-175.5	-179.1	177.2	0.5	114.6
59	N	78.6	Confident	86.4	Confident	105 Å²	105	56.2 Å²	56.2	56%	0.561	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	27.3	-175.5	-66.8	-43	0	0	0	111.4	S57 G61 N62	S57-N59 PolarHBondContact O-N 2.92Å; N59-G61 PolarHBondContact O-N 3.25Å; N59-N62 HydrophobicContact CB-CB 4.04Å; N59-N62 WeakPolarHBondContact O-CB 3.43Å; N59-N62 PolarHBondContact O-N 3.39Å
60	Y	82.4	Confident	86.1	Confident	23 Å²	23	62.9 Å²	62.9	9%	0.09	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	124.7	-177.2	-152.2	-89.5	0	0	0	111	V46 F49 E50 V53 S57 N62 L159	V46-Y60 HydrophobicContact CG1-CD1 4.09Å; V46-Y60 HydrophobicContact CG1-CE1 4.11Å; F49-Y60 HydrophobicContact CB-CE1 4.04Å; F49-Y60 WeakPolarHBondContact CB-OH 3.44Å; E50-Y60 HydrophobicContact CB-CD1 3.64Å; E50-Y60 HydrophobicContact CB-CE1 3.82Å; E50-Y60 HydrophobicContact CB-CG 4.41Å; E50-Y60 HydrophobicContact CG-CD1 3.97Å; E50-Y60 HydrophobicContact CG-CG 4.3Å; V53-Y60 HydrophobicContact CB-CE2 4.25Å; V53-Y60 HydrophobicContact CG1-CE2 4.18Å; S57-Y60 PolarHBondContact O-N 2.98Å; S57-Y60 VanDerWaalsContact O-N 3.11Å; S57-Y60 PolarHBondContact OG-N 3.41Å; Y60-N62 VanDerWaalsContact C-N 3.26Å; Y60-N62 PolarHBondContact O-N 3.1Å; Y60-L159 HydrophobicContact CD1-CD1 3.89Å; Y60-L159 HydrophobicContact CD1-CD2 4.44Å; Y60-L159 HydrophobicContact CD2-CD1 4.36Å; Y60-L159 HydrophobicContact CD2-CD2 4.48Å; Y60-L159 HydrophobicContact CE1-CD1 3.85Å; Y60-L159 HydrophobicContact CE1-CD2 3.61Å; Y60-L159 HydrophobicContact CE1-CG 4.39Å; Y60-L159 HydrophobicContact CE2-CD1 4.34Å; Y60-L159 HydrophobicContact CE2-CD2 3.69Å; Y60-L159 HydrophobicContact CG-CD1 4.16Å; Y60-L159 WeakPolarHBondContact OH-CD2 3.5Å
61	G	78.9	Confident	85.8	Confident	7 Å²	7	61 Å²	61	7%	0.072	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	-17.2	-175.8	0	0	0	0	0	115.7	N59 G63 V64	N59-G61 PolarHBondContact O-N 3.25Å; G61-G63 PolarHBondContact O-N 3.43Å; G61-V64 WeakPolarHBondContact O-CB 3.34Å; G61-V64 WeakPolarHBondContact O-CG2 3.39Å; G61-V64 PolarHBondContact O-N 3.3Å; G61-V64 VanDerWaalsContact O-N 3.17Å
62	N	84.9	Confident	85.6	Confident	101 Å²	101	55.7 Å²	55.7	54%	0.54	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	130	177.5	-162.1	3.5	0	0	0	109.7	N59 Y60 V64 P156	N59-N62 HydrophobicContact CB-CB 4.04Å; N59-N62 WeakPolarHBondContact O-CB 3.43Å; N59-N62 PolarHBondContact O-N 3.39Å; Y60-N62 VanDerWaalsContact C-N 3.26Å; Y60-N62 PolarHBondContact O-N 3.1Å; N62-V64 VanDerWaalsContact C-N 3.33Å; N62-P156 WeakPolarHBondContact O-CG 3.33Å
63	G	88.4	Confident	85.4	Confident	15 Å²	15	59.2 Å²	59.2	16%	0.155	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-13.3	-176	0	0	0	0	0	115.3	E35 G61 G65 K66 L67	E35-G63 WeakPolarHBondContact OE1-CA 3.38Å; E35-G63 PolarHBondContact OE1-N 2.89Å; E35-G63 VanDerWaalsContact OE1-N 3.15Å; G61-G63 PolarHBondContact O-N 3.43Å; G63-G65 VanDerWaalsContact C-N 3.31Å; G63-K66 WeakPolarHBondContact O-CB 3.5Å; G63-K66 PolarHBondContact O-N 3.47Å; G63-L67 PolarHBondContact O-N 2.97Å; G63-L67 VanDerWaalsContact O-N 3.15Å
64	V	90.5	Very high	85.3	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-64.2	-41.8	176.4	175.1	0	0	0	0	109.9	F39 L42 V46 G61 N62 K66 L67 I68 P156 L159 F160	F39-V64 HydrophobicContact CD2-CB 3.93Å; F39-V64 HydrophobicContact CD2-CG1 4.13Å; F39-V64 HydrophobicContact CE2-CB 4.07Å; F39-V64 HydrophobicContact CE2-CG1 4.34Å; L42-V64 HydrophobicContact CD1-CG1 4.11Å; V46-V64 HydrophobicContact CG2-CG1 4.36Å; G61-V64 WeakPolarHBondContact O-CB 3.34Å; G61-V64 WeakPolarHBondContact O-CG2 3.39Å; G61-V64 PolarHBondContact O-N 3.3Å; G61-V64 VanDerWaalsContact O-N 3.17Å; N62-V64 VanDerWaalsContact C-N 3.33Å; V64-K66 VanDerWaalsContact C-N 3.28Å; V64-K66 PolarHBondContact O-N 2.93Å; V64-L67 WeakPolarHBondContact O-CB 3.41Å; V64-L67 PolarHBondContact O-N 3.16Å; V64-L67 VanDerWaalsContact O-N 3.11Å; V64-I68 HydrophobicContact CG1-CD1 4.09Å; V64-I68 WeakPolarHBondContact O-CG1 2.9Å; V64-I68 PolarHBondContact O-N 3.08Å; V64-P156 HydrophobicContact CG2-CB 4.47Å; V64-L159 HydrophobicContact CG2-CB 3.78Å; V64-L159 HydrophobicContact CG2-CD1 4.04Å; V64-F160 HydrophobicContact CG1-CB 4.5Å
65	G	90.2	Very high	85.5	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.7	-36.5	175.5	0	0	0	0	0	112.1	E35 N38 G63 L67 I68 M69	E35-G65 WeakPolarHBondContact O-CA 3.29Å; N38-G65 WeakPolarHBondContact CB-O 3.48Å; G63-G65 VanDerWaalsContact C-N 3.31Å; G65-L67 VanDerWaalsContact C-N 3.32Å; G65-L67 PolarHBondContact O-N 3.24Å; G65-I68 PolarHBondContact O-N 3.37Å; G65-M69 VanDerWaalsContact O-CB 3.23Å; G65-M69 WeakPolarHBondContact O-CB 3.49Å; G65-M69 PolarHBondContact O-N 3.47Å
66	K	91.3	Very high	85.9	Confident	134 Å²	134	61 Å²	61	58%	0.583	30%	0.301	S	S	*	.	H	α-helix	trans	-63.2	-36.2	173.3	-172.6	176.2	-176.5	175.7	0	112.8	E35 G63 V64 M69 K70	E35-K66 WeakPolarHBondContact OE1-CB 3.38Å; E35-K66 PolarHBondContact OE1-N 2.99Å; G63-K66 WeakPolarHBondContact O-CB 3.5Å; G63-K66 PolarHBondContact O-N 3.47Å; V64-K66 VanDerWaalsContact C-N 3.28Å; V64-K66 PolarHBondContact O-N 2.93Å; K66-M69 HydrophobicContact CG-CE 4.39Å; K66-K70 PolarHBondContact O-N 3.44Å
67	L	89.9	Confident	86.7	Confident	25 Å²	25	61.2 Å²	61.2	13%	0.131	30%	0.299	C	S	.	.	H	α-helix	trans	-69.7	-44.9	176.6	-170.2	68.4	0	0	0	111.4	G63 V64 G65 M69 K70 I71 L144 F160	G63-L67 PolarHBondContact O-N 2.97Å; G63-L67 VanDerWaalsContact O-N 3.15Å; V64-L67 WeakPolarHBondContact O-CB 3.41Å; V64-L67 PolarHBondContact O-N 3.16Å; V64-L67 VanDerWaalsContact O-N 3.11Å; G65-L67 VanDerWaalsContact C-N 3.32Å; G65-L67 PolarHBondContact O-N 3.24Å; L67-M69 VanDerWaalsContact C-N 3.3Å; L67-M69 PolarHBondContact O-N 3.3Å; L67-K70 WeakPolarHBondContact O-CB 3.44Å; L67-K70 PolarHBondContact O-N 3.2Å; L67-K70 VanDerWaalsContact O-N 3.15Å; L67-I71 PolarHBondContact O-N 3.45Å; L67-L144 HydrophobicContact CD1-CD2 4.05Å; L67-L144 HydrophobicContact CD2-CD2 3.96Å; L67-L144 HydrophobicContact CG-CD2 4.47Å; L67-F160 HydrophobicContact CD2-CB 3.45Å; L67-F160 VanDerWaalsContact CD2-CB 3.45Å; L67-F160 HydrophobicContact CD2-CD1 3.78Å; L67-F160 HydrophobicContact CD2-CD2 4.15Å; L67-F160 HydrophobicContact CD2-CG 3.51Å; L67-F160 HydrophobicContact CG-CG 4.39Å
68	I	90.6	Very high	87.3	Confident	7 Å²	7	62.2 Å²	62.2	4%	0.036	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-46.3	172.8	-63.6	166.9	0	0	0	109.9	N38 I41 L42 V64 G65 K70 I71 T72 F160	N38-I68 HydrophobicContact CB-CB 3.99Å; N38-I68 HydrophobicContact CB-CG2 3.77Å; N38-I68 WeakPolarHBondContact O-CD1 3.42Å; I41-I68 HydrophobicContact CD1-CG2 3.97Å; L42-I68 HydrophobicContact CB-CD1 4.14Å; L42-I68 HydrophobicContact CD1-CD1 3.78Å; L42-I68 HydrophobicContact CD1-CG1 4.21Å; L42-I68 HydrophobicContact CG-CD1 3.74Å; V64-I68 HydrophobicContact CG1-CD1 4.09Å; V64-I68 WeakPolarHBondContact O-CG1 2.9Å; V64-I68 PolarHBondContact O-N 3.08Å; G65-I68 PolarHBondContact O-N 3.37Å; I68-K70 VanDerWaalsContact C-N 3.25Å; I68-K70 PolarHBondContact O-N 3.2Å; I68-I71 WeakPolarHBondContact O-CA 3.34Å; I68-I71 WeakPolarHBondContact O-CB 3.3Å; I68-I71 PolarHBondContact O-N 3.25Å; I68-T72 HydrophobicContact CG2-CG2 4.01Å; I68-T72 PolarHBondContact O-N 3.01Å; I68-T72 PolarHBondContact O-OG1 3.39Å; I68-F160 HydrophobicContact CG1-CD2 3.85Å; I68-F160 HydrophobicContact CG1-CE2 3.77Å
69	M	90.3	Very high	88.1	Confident	37 Å²	37	52.4 Å²	52.4	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-56.2	-39.8	177	-170.2	177.4	70.4	0	0	111.1	N38 G65 K66 L67 I71 T72 Q73	N38-M69 HydrophobicContact CB-CB 4.33Å; G65-M69 VanDerWaalsContact O-CB 3.23Å; G65-M69 WeakPolarHBondContact O-CB 3.49Å; G65-M69 PolarHBondContact O-N 3.47Å; K66-M69 HydrophobicContact CG-CE 4.39Å; L67-M69 VanDerWaalsContact C-N 3.3Å; L67-M69 PolarHBondContact O-N 3.3Å; M69-I71 PolarHBondContact O-N 2.86Å; M69-T72 WeakPolarHBondContact CA-OG1 3.38Å; M69-T72 PolarHBondContact O-N 2.91Å; M69-T72 PolarHBondContact O-OG1 3.27Å; M69-Q73 WeakPolarHBondContact O-CA 3.31Å; M69-Q73 WeakPolarHBondContact O-CB 3.37Å; M69-Q73 PolarHBondContact O-N 3.18Å
70	K	87.9	Confident	88.9	Confident	141 Å²	141	49.9 Å²	49.9	61%	0.613	26%	0.262	S	S	*	.	H	α-helix	trans	-60.4	-32.3	175.7	-170.9	177.7	178.8	-177.9	0	113.1	K66 L67 I68	K66-K70 PolarHBondContact O-N 3.44Å; L67-K70 WeakPolarHBondContact O-CB 3.44Å; L67-K70 PolarHBondContact O-N 3.2Å; L67-K70 VanDerWaalsContact O-N 3.15Å; I68-K70 VanDerWaalsContact C-N 3.25Å; I68-K70 PolarHBondContact O-N 3.2Å
71	I	84.7	Confident	89.4	Confident	43 Å²	43	52.3 Å²	52.3	22%	0.221	28%	0.279	C	S	.	.	H	α-helix	trans	-77.5	-46.7	176.3	-56.1	168.6	0	0	0	110.1	L67 I68 M69 Y140 F160	L67-I71 PolarHBondContact O-N 3.45Å; I68-I71 WeakPolarHBondContact O-CA 3.34Å; I68-I71 WeakPolarHBondContact O-CB 3.3Å; I68-I71 PolarHBondContact O-N 3.25Å; M69-I71 PolarHBondContact O-N 2.86Å; I71-Y140 HydrophobicContact CD1-CE1 3.53Å; I71-Y140 HydrophobicContact CG1-CE1 3.53Å; I71-Y140 VanDerWaalsContact CG1-OH 3.26Å; I71-Y140 WeakPolarHBondContact CG1-OH 3.37Å; I71-F160 HydrophobicContact CD1-CE1 4.11Å; I71-F160 HydrophobicContact CD1-CE2 3.93Å; I71-F160 HydrophobicContact CD1-CZ 3.4Å
72	T	88.2	Confident	90.1	Very high	26 Å²	26	54 Å²	54	16%	0.16	28%	0.284	C	S	.	.	H	α-helix	trans	-83.6	-16.6	-172.8	60.8	0	0	0	0	113.6	N38 I68 M69 L75 S76	N38-T72 PolarHBondContact OD1-OG1 3.18Å; I68-T72 HydrophobicContact CG2-CG2 4.01Å; I68-T72 PolarHBondContact O-N 3.01Å; I68-T72 PolarHBondContact O-OG1 3.39Å; M69-T72 WeakPolarHBondContact CA-OG1 3.38Å; M69-T72 PolarHBondContact O-N 2.91Å; M69-T72 PolarHBondContact O-OG1 3.27Å; T72-L75 WeakPolarHBondContact O-CB 3.36Å; T72-L75 PolarHBondContact O-N 3.29Å; T72-S76 WeakPolarHBondContact O-CB 3.11Å; T72-S76 PolarHBondContact O-N 3.49Å; T72-S76 PolarHBondContact O-OG 3.26Å
73	Q	88.7	Confident	90.6	Very high	77 Å²	77	49.6 Å²	49.6	36%	0.36	26%	0.261	S	S	.	.	H	α-helix	trans	-63	-50	-171.8	173.2	174.9	18.8	0	0	112	M69 L75 S76 I77	M69-Q73 WeakPolarHBondContact O-CA 3.31Å; M69-Q73 WeakPolarHBondContact O-CB 3.37Å; M69-Q73 PolarHBondContact O-N 3.18Å; Q73-L75 VanDerWaalsContact C-N 3.25Å; Q73-L75 PolarHBondContact O-N 2.9Å; Q73-S76 PolarHBondContact O-N 3.04Å; Q73-I77 HydrophobicContact CG-CD1 3.65Å; Q73-I77 HydrophobicContact CG-CG1 4.33Å; Q73-I77 WeakPolarHBondContact O-CB 3.31Å; Q73-I77 VanDerWaalsContact O-CG1 3.24Å; Q73-I77 WeakPolarHBondContact O-CG1 3.22Å; Q73-I77 PolarHBondContact O-N 3.44Å
74	N	87.7	Confident	90.9	Very high	123 Å²	123	52 Å²	52	66%	0.658	27%	0.27	S	S	*	.	H	α-helix	trans	-60	-41.2	-179.2	-71.8	-13.4	0	0	0	111.5	A78	N74-A78 PolarHBondContact O-N 3.47Å; N74-A78 VanDerWaalsContact O-N 3.09Å
75	L	88.3	Confident	91.2	Very high	57 Å²	57	54.2 Å²	54.2	30%	0.298	29%	0.286	S	S	.	.	H	α-helix	trans	-65.5	-46.6	176.1	176.9	67.7	0	0	0	111.7	T72 Q73 I77 A78 V79 L246 M249	T72-L75 WeakPolarHBondContact O-CB 3.36Å; T72-L75 PolarHBondContact O-N 3.29Å; Q73-L75 VanDerWaalsContact C-N 3.25Å; Q73-L75 PolarHBondContact O-N 2.9Å; L75-I77 VanDerWaalsContact C-N 3.34Å; L75-I77 PolarHBondContact O-N 3.38Å; L75-A78 WeakPolarHBondContact O-CB 3.27Å; L75-A78 PolarHBondContact O-N 2.91Å; L75-V79 WeakPolarHBondContact O-CG2 3.39Å; L75-V79 PolarHBondContact O-N 3.39Å; L75-L246 HydrophobicContact CD1-CD2 3.78Å; L75-L246 HydrophobicContact CD2-CD2 4.37Å; L75-M249 HydrophobicContact CD1-CE 3.82Å; L75-M249 HydrophobicContact CD1-SD 3.69Å; L75-M249 HydrophobicContact CD2-CE 3.29Å; L75-M249 HydrophobicContact CD2-SD 3.61Å; L75-M249 HydrophobicContact CG-CE 4.05Å; L75-M249 HydrophobicContact CG-SD 3.88Å
76	S	91.5	Very high	91.4	Very high	11 Å²	11	54.3 Å²	54.3	8%	0.077	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-39.7	179.4	-58.3	0	0	0	0	111.4	T72 Q73 V79 F80	T72-S76 WeakPolarHBondContact O-CB 3.11Å; T72-S76 PolarHBondContact O-N 3.49Å; T72-S76 PolarHBondContact O-OG 3.26Å; Q73-S76 PolarHBondContact O-N 3.04Å; S76-V79 PolarHBondContact O-N 2.85Å; S76-F80 WeakPolarHBondContact O-CB 3.24Å; S76-F80 PolarHBondContact O-N 2.91Å
77	I	92.6	Very high	91.6	Very high	65 Å²	65	49.1 Å²	49.1	33%	0.333	27%	0.265	S	S	.	.	H	α-helix	trans	-61.5	-44.6	173.8	-70.2	166.3	0	0	0	110.7	M32 Q73 L75 F80 T81	M32-I77 HydrophobicContact CG-CG1 4.12Å; M32-I77 HydrophobicContact SD-CG1 3.63Å; Q73-I77 HydrophobicContact CG-CD1 3.65Å; Q73-I77 HydrophobicContact CG-CG1 4.33Å; Q73-I77 WeakPolarHBondContact O-CB 3.31Å; Q73-I77 VanDerWaalsContact O-CG1 3.24Å; Q73-I77 WeakPolarHBondContact O-CG1 3.22Å; Q73-I77 PolarHBondContact O-N 3.44Å; L75-I77 VanDerWaalsContact C-N 3.34Å; L75-I77 PolarHBondContact O-N 3.38Å; I77-F80 PolarHBondContact O-N 3.22Å; I77-T81 VanDerWaalsContact O-CB 3.28Å; I77-T81 WeakPolarHBondContact O-CB 3.48Å; I77-T81 PolarHBondContact O-N 3.45Å; I77-T81 PolarHBondContact O-OG1 3.09Å
78	A	91.2	Very high	91.9	Very high	57 Å²	57	52.5 Å²	52.5	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-62.3	-48.7	178.5	0	0	0	0	0	111.4	N74 L75 F80 T81 F82	N74-A78 PolarHBondContact O-N 3.47Å; N74-A78 VanDerWaalsContact O-N 3.09Å; L75-A78 WeakPolarHBondContact O-CB 3.27Å; L75-A78 PolarHBondContact O-N 2.91Å; A78-F80 PolarHBondContact O-N 3.22Å; A78-T81 PolarHBondContact O-N 3.23Å; A78-F82 VanDerWaalsContact O-CB 3.28Å; A78-F82 WeakPolarHBondContact O-CB 3.27Å; A78-F82 PolarHBondContact O-N 3.47Å
79	V	93.1	Very high	92.2	Very high	47 Å²	47	52.8 Å²	52.8	29%	0.285	28%	0.284	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.5	174.2	0	0	0	0	111.2	I24 A28 L75 S76 S83	I24-V79 HydrophobicContact CG2-CG1 3.61Å; A28-V79 HydrophobicContact CB-CB 4.39Å; A28-V79 HydrophobicContact CB-CG1 4.05Å; L75-V79 WeakPolarHBondContact O-CG2 3.39Å; L75-V79 PolarHBondContact O-N 3.39Å; S76-V79 PolarHBondContact O-N 2.85Å; V79-S83 VanDerWaalsContact O-CB 3.24Å; V79-S83 WeakPolarHBondContact O-CB 3.48Å; V79-S83 PolarHBondContact O-N 3.37Å; V79-S83 PolarHBondContact O-OG 3.24Å
80	F	95.3	Very high	92.4	Very high	52 Å²	52	51 Å²	51	23%	0.228	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-50.6	178.2	-178.5	-86.9	0	0	0	111.4	I25 A28 S76 I77 A78 F82 S83 L84	I25-F80 HydrophobicContact CG2-CD2 3.96Å; I25-F80 HydrophobicContact CG2-CE2 3.49Å; I25-F80 VanDerWaalsContact CG2-CE2 3.49Å; I25-F80 HydrophobicContact CG2-CZ 4.15Å; A28-F80 HydrophobicContact CB-CB 4.05Å; A28-F80 HydrophobicContact CB-CD2 4.5Å; S76-F80 WeakPolarHBondContact O-CB 3.24Å; S76-F80 PolarHBondContact O-N 2.91Å; I77-F80 PolarHBondContact O-N 3.22Å; A78-F80 PolarHBondContact O-N 3.22Å; F80-F82 PolarHBondContact O-N 2.92Å; F80-S83 PolarHBondContact O-N 2.94Å; F80-L84 HydrophobicContact CE1-CD2 4.09Å; F80-L84 VanDerWaalsContact O-CB 3.27Å; F80-L84 WeakPolarHBondContact O-CB 3.18Å; F80-L84 PolarHBondContact O-N 3.47Å
81	T	93.6	Very high	92.8	Very high	74 Å²	74	47.9 Å²	47.9	45%	0.454	26%	0.264	S	S	.	.	H	α-helix	trans	-64.4	-43.1	-177.5	-55.8	0	0	0	0	111.4	I77 A78 S85	I77-T81 VanDerWaalsContact O-CB 3.28Å; I77-T81 WeakPolarHBondContact O-CB 3.48Å; I77-T81 PolarHBondContact O-N 3.45Å; I77-T81 PolarHBondContact O-OG1 3.09Å; A78-T81 PolarHBondContact O-N 3.23Å; T81-S85 WeakPolarHBondContact O-CB 3.38Å; T81-S85 PolarHBondContact O-N 3.29Å; T81-S85 PolarHBondContact O-OG 3.27Å
82	F	93.1	Very high	93.2	Very high	42 Å²	42	48.7 Å²	48.7	18%	0.184	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-46.7	176.2	-179.1	-102.2	0	0	0	111.5	A78 F80 L84 S85 N86 L115 H119 V256	A78-F82 VanDerWaalsContact O-CB 3.28Å; A78-F82 WeakPolarHBondContact O-CB 3.27Å; A78-F82 PolarHBondContact O-N 3.47Å; F80-F82 PolarHBondContact O-N 2.92Å; F82-L84 PolarHBondContact O-N 3.01Å; F82-S85 WeakPolarHBondContact O-CB 3.16Å; F82-S85 PolarHBondContact O-N 2.69Å; F82-N86 WeakPolarHBondContact CE1-ND2 3.38Å; F82-N86 WeakPolarHBondContact CZ-ND2 3.36Å; F82-N86 PolarHBondContact O-N 3.27Å; F82-N86 PolarHBondContact O-ND2 3.45Å; F82-L115 HydrophobicContact CE2-CD1 4.13Å; F82-H119 AromaticContact CE1-CE1 3.88Å; F82-H119 HydrophobicContact CE2-CB 3.97Å; F82-H119 AromaticContact CE2-CG 3.75Å; F82-H119 AromaticContact CE2-ND1 3.67Å; F82-H119 HydrophobicContact CZ-CB 4.34Å; F82-H119 AromaticContact CZ-CE1 3.38Å; F82-H119 WeakPolarHBondContact CZ-CE1 3.5Å; F82-H119 AromaticContact CZ-CG 3.73Å; F82-H119 AromaticContact CZ-ND1 3.15Å; F82-H119 WeakPolarHBondContact CZ-ND1 3.19Å; F82-V256 HydrophobicContact CE1-CG1 3.96Å; F82-V256 HydrophobicContact CZ-CG1 4.29Å
83	S	94.9	Very high	93.5	Very high	8 Å²	8	47.4 Å²	47.4	6%	0.056	26%	0.261	C	S	.	.	H	α-helix	trans	-66	-37.8	179.9	-56.7	0	0	0	0	112.2	I24 V79 F80 N86 L87	I24-S83 VanDerWaalsContact CG2-OG 3.22Å; I24-S83 WeakPolarHBondContact CG2-OG 3.48Å; V79-S83 VanDerWaalsContact O-CB 3.24Å; V79-S83 WeakPolarHBondContact O-CB 3.48Å; V79-S83 PolarHBondContact O-N 3.37Å; V79-S83 PolarHBondContact O-OG 3.24Å; F80-S83 PolarHBondContact O-N 2.94Å; S83-N86 PolarHBondContact O-N 2.82Å; S83-L87 WeakPolarHBondContact O-CB 3.37Å; S83-L87 PolarHBondContact O-N 3.43Å
84	L	96.3	Very high	93.8	Very high	66 Å²	66	45.5 Å²	45.5	35%	0.346	25%	0.253	S	S	.	.	H	α-helix	trans	-63.2	-42.6	174.4	-179.2	61.3	0	0	0	111.4	I25 F80 F82 N86 L87 L88	I25-L84 HydrophobicContact CD1-CB 4.33Å; I25-L84 HydrophobicContact CD1-CD1 4.39Å; F80-L84 HydrophobicContact CE1-CD2 4.09Å; F80-L84 VanDerWaalsContact O-CB 3.27Å; F80-L84 WeakPolarHBondContact O-CB 3.18Å; F80-L84 PolarHBondContact O-N 3.47Å; F82-L84 PolarHBondContact O-N 3.01Å; L84-N86 VanDerWaalsContact C-N 3.35Å; L84-N86 PolarHBondContact O-N 3.26Å; L84-L87 WeakPolarHBondContact O-CB 3.46Å; L84-L87 PolarHBondContact O-N 3.02Å; L84-L88 WeakPolarHBondContact O-CG 3.15Å; L84-L88 PolarHBondContact O-N 2.83Å
85	S	95.2	Very high	94.1	Very high	46 Å²	46	43.6 Å²	43.6	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-61.3	-43.7	176.1	-58	0	0	0	0	111.6	T81 F82 L88 I89	T81-S85 WeakPolarHBondContact O-CB 3.38Å; T81-S85 PolarHBondContact O-N 3.29Å; T81-S85 PolarHBondContact O-OG 3.27Å; F82-S85 WeakPolarHBondContact O-CB 3.16Å; F82-S85 PolarHBondContact O-N 2.69Å; S85-L88 PolarHBondContact O-N 3.3Å; S85-I89 WeakPolarHBondContact O-CD1 3.36Å; S85-I89 WeakPolarHBondContact O-CG1 3.49Å; S85-I89 PolarHBondContact O-N 3Å; S85-I89 VanDerWaalsContact O-N 3.1Å
86	N	94.7	Very high	94.2	Very high	2 Å²	2	41 Å²	41	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-41.6	174.8	-78.7	-92.8	0	0	0	111.9	F82 S83 L84 I89 C90 L115 N260	F82-N86 WeakPolarHBondContact CE1-ND2 3.38Å; F82-N86 WeakPolarHBondContact CZ-ND2 3.36Å; F82-N86 PolarHBondContact O-N 3.27Å; F82-N86 PolarHBondContact O-ND2 3.45Å; S83-N86 PolarHBondContact O-N 2.82Å; L84-N86 VanDerWaalsContact C-N 3.35Å; L84-N86 PolarHBondContact O-N 3.26Å; N86-I89 PolarHBondContact O-N 3.47Å; N86-C90 PolarHBondContact O-N 2.72Å; N86-C90 PolarHBondContact O-SG 3.32Å; N86-L115 VanDerWaalsContact OD1-CD2 3.27Å; N86-L115 WeakPolarHBondContact OD1-CD2 3.4Å; N86-N260 PolarHBondContact OD1-ND2 2.94Å; N86-N260 PolarHBondContact OD1-OD1 3.5Å
87	L	96.8	Very high	94.2	Very high	26 Å²	26	41.2 Å²	41.2	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-60.7	-46.9	177.1	178.7	61.7	0	0	0	111.6	A18 C21 I22 I25 S83 L84 I89 C90 I91	A18-L87 HydrophobicContact CB-CD1 3.89Å; C21-L87 HydrophobicContact CB-CB 3.99Å; C21-L87 HydrophobicContact CB-CD1 4.4Å; I22-L87 HydrophobicContact CD1-CD1 4.41Å; I22-L87 HydrophobicContact CG1-CD1 4.06Å; I22-L87 HydrophobicContact CG1-CD2 4.09Å; I25-L87 HydrophobicContact CD1-CB 4.08Å; I25-L87 HydrophobicContact CD1-CD2 3.65Å; S83-L87 WeakPolarHBondContact O-CB 3.37Å; S83-L87 PolarHBondContact O-N 3.43Å; L84-L87 WeakPolarHBondContact O-CB 3.46Å; L84-L87 PolarHBondContact O-N 3.02Å; L87-I89 VanDerWaalsContact C-N 3.3Å; L87-I89 PolarHBondContact O-N 2.84Å; L87-C90 WeakPolarHBondContact O-CB 3.41Å; L87-C90 PolarHBondContact O-N 2.83Å; L87-C90 VanDerWaalsContact O-N 3.16Å; L87-I91 HydrophobicContact CD1-CD1 4.4Å; L87-I91 HydrophobicContact CG-CD1 4.17Å; L87-I91 WeakPolarHBondContact O-CG1 3.28Å; L87-I91 PolarHBondContact O-N 2.93Å
88	L	96.2	Very high	94.1	Very high	95 Å²	95	48 Å²	48	50%	0.497	25%	0.25	S	C	.	.	H	α-helix	trans	-60	-41.6	177.5	-68.9	175	0	0	0	111.5	L84 S85 I91 I92	L84-L88 WeakPolarHBondContact O-CG 3.15Å; L84-L88 PolarHBondContact O-N 2.83Å; S85-L88 PolarHBondContact O-N 3.3Å; L88-I91 PolarHBondContact O-N 2.81Å; L88-I92 VanDerWaalsContact O-CG1 3.32Å; L88-I92 WeakPolarHBondContact O-CG1 3.14Å; L88-I92 PolarHBondContact O-N 3.25Å
89	I	95.2	Very high	93.9	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-41.3	175.8	-72.4	163.2	0	0	0	111.2	S85 N86 L87 I91 I92 G93 Y108 I111 L112 L115	S85-I89 WeakPolarHBondContact O-CD1 3.36Å; S85-I89 WeakPolarHBondContact O-CG1 3.49Å; S85-I89 PolarHBondContact O-N 3Å; S85-I89 VanDerWaalsContact O-N 3.1Å; N86-I89 PolarHBondContact O-N 3.47Å; L87-I89 VanDerWaalsContact C-N 3.3Å; L87-I89 PolarHBondContact O-N 2.84Å; I89-I91 VanDerWaalsContact C-N 3.34Å; I89-I91 PolarHBondContact O-N 3.04Å; I89-I92 PolarHBondContact O-N 3.41Å; I89-G93 PolarHBondContact O-N 3.26Å; I89-Y108 HydrophobicContact CG2-CD2 4.09Å; I89-Y108 HydrophobicContact CG2-CE2 3.66Å; I89-Y108 WeakPolarHBondContact O-CE2 3.48Å; I89-I111 HydrophobicContact CD1-CG2 3.88Å; I89-I111 HydrophobicContact CG1-CG2 3.73Å; I89-L112 HydrophobicContact CG2-CB 4.3Å; I89-L112 HydrophobicContact CG2-CD1 4.07Å; I89-L115 HydrophobicContact CD1-CB 3.85Å; I89-L115 HydrophobicContact CD1-CD1 4.23Å; I89-L115 HydrophobicContact CD1-CD2 3.62Å; I89-L115 HydrophobicContact CD1-CG 4.09Å
90	C	95.2	Very high	93.5	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-61.8	-42.3	175.8	-66.3	0	0	0	0	111.7	N14 A18 N86 L87 G93 L94	N14-C90 WeakPolarHBondContact OD1-CA 3.44Å; A18-C90 HydrophobicContact CB-CB 3.91Å; N86-C90 PolarHBondContact O-N 2.72Å; N86-C90 PolarHBondContact O-SG 3.32Å; L87-C90 WeakPolarHBondContact O-CB 3.41Å; L87-C90 PolarHBondContact O-N 2.83Å; L87-C90 VanDerWaalsContact O-N 3.16Å; C90-G93 PolarHBondContact O-N 3.34Å; C90-L94 WeakPolarHBondContact O-CG 3.13Å; C90-L94 PolarHBondContact O-N 3.04Å
91	I	95.6	Very high	93	Very high	75 Å²	75	54 Å²	54	39%	0.385	27%	0.266	S	S	.	.	H	α-helix	trans	-61	-46.9	175.9	-67.5	166.2	0	0	0	110.5	L87 L88 I89 G93 L94 I95	L87-I91 HydrophobicContact CD1-CD1 4.4Å; L87-I91 HydrophobicContact CG-CD1 4.17Å; L87-I91 WeakPolarHBondContact O-CG1 3.28Å; L87-I91 PolarHBondContact O-N 2.93Å; L88-I91 PolarHBondContact O-N 2.81Å; I89-I91 VanDerWaalsContact C-N 3.34Å; I89-I91 PolarHBondContact O-N 3.04Å; I91-G93 VanDerWaalsContact C-N 3.28Å; I91-G93 PolarHBondContact O-N 3.03Å; I91-L94 PolarHBondContact O-N 3.22Å; I91-I95 HydrophobicContact CG2-CD1 3.84Å; I91-I95 VanDerWaalsContact O-CG1 3.29Å; I91-I95 WeakPolarHBondContact O-CG1 3.28Å; I91-I95 PolarHBondContact O-N 3.38Å
92	I	94.5	Very high	92.6	Very high	59 Å²	59	51.3 Å²	51.3	30%	0.303	25%	0.25	S	S	.	.	H	α-helix	trans	-59.2	-41.9	175.4	-66.6	165.9	0	0	0	110.5	L88 I89 I95 A96 Y108 I111	L88-I92 VanDerWaalsContact O-CG1 3.32Å; L88-I92 WeakPolarHBondContact O-CG1 3.14Å; L88-I92 PolarHBondContact O-N 3.25Å; I89-I92 PolarHBondContact O-N 3.41Å; I92-I95 PolarHBondContact O-N 3.01Å; I92-A96 VanDerWaalsContact O-CB 3.27Å; I92-A96 WeakPolarHBondContact O-CB 3.34Å; I92-A96 PolarHBondContact O-N 3.46Å; I92-Y108 HydrophobicContact CG2-CD2 4.45Å; I92-I111 HydrophobicContact CD1-CD1 4.41Å
93	G	93.6	Very high	92.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.5	-46	176.5	0	0	0	0	0	113	I89 C90 I91 A96 I97	I89-G93 PolarHBondContact O-N 3.26Å; C90-G93 PolarHBondContact O-N 3.34Å; I91-G93 VanDerWaalsContact C-N 3.28Å; I91-G93 PolarHBondContact O-N 3.03Å; G93-A96 WeakPolarHBondContact O-CB 3.37Å; G93-A96 PolarHBondContact O-N 3.47Å; G93-I97 WeakPolarHBondContact O-CD1 3.42Å; G93-I97 VanDerWaalsContact O-CG1 3.25Å; G93-I97 WeakPolarHBondContact O-CG1 3.3Å; G93-I97 PolarHBondContact O-N 3.01Å
94	L	94.5	Very high	92.3	Very high	37 Å²	37	56.5 Å²	56.5	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-62.1	-44.5	176.4	-67.7	172.6	0	0	0	111.7	F11 N14 C90 I91 A96 I97 W98	F11-L94 HydrophobicContact CD2-CD2 3.56Å; F11-L94 HydrophobicContact CE2-CD2 3.63Å; F11-L94 HydrophobicContact CG-CD2 4.16Å; F11-L94 HydrophobicContact CZ-CD2 4.26Å; N14-L94 HydrophobicContact CB-CD2 3.93Å; N14-L94 HydrophobicContact CB-CG 4.15Å; C90-L94 WeakPolarHBondContact O-CG 3.13Å; C90-L94 PolarHBondContact O-N 3.04Å; I91-L94 PolarHBondContact O-N 3.22Å; L94-A96 VanDerWaalsContact C-N 3.32Å; L94-A96 PolarHBondContact O-N 2.92Å; L94-I97 PolarHBondContact O-N 2.93Å; L94-W98 WeakPolarHBondContact O-CB 3.49Å; L94-W98 PolarHBondContact O-N 3.15Å
95	I	93.9	Very high	92.1	Very high	83 Å²	83	53.6 Å²	53.6	43%	0.426	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-38.3	176.1	-63.1	167.5	0	0	0	110.9	I91 I92 W98 N99 L104	I91-I95 HydrophobicContact CG2-CD1 3.84Å; I91-I95 VanDerWaalsContact O-CG1 3.29Å; I91-I95 WeakPolarHBondContact O-CG1 3.28Å; I91-I95 PolarHBondContact O-N 3.38Å; I92-I95 PolarHBondContact O-N 3.01Å; I95-W98 PolarHBondContact O-N 2.97Å; I95-N99 WeakPolarHBondContact CG2-ND2 3.35Å; I95-N99 WeakPolarHBondContact O-CB 3.39Å; I95-N99 PolarHBondContact O-N 3.22Å; I95-N99 PolarHBondContact O-ND2 3.46Å; I95-L104 HydrophobicContact CG2-CD2 4.13Å
96	A	91.8	Very high	91.9	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-47.1	177.1	0	0	0	0	0	112	I92 G93 L94 Q100 L104 L105	I92-A96 VanDerWaalsContact O-CB 3.27Å; I92-A96 WeakPolarHBondContact O-CB 3.34Å; I92-A96 PolarHBondContact O-N 3.46Å; G93-A96 WeakPolarHBondContact O-CB 3.37Å; G93-A96 PolarHBondContact O-N 3.47Å; L94-A96 VanDerWaalsContact C-N 3.32Å; L94-A96 PolarHBondContact O-N 2.92Å; A96-Q100 PolarHBondContact O-N 2.86Å; A96-L104 HydrophobicContact CB-CB 4.3Å; A96-L104 HydrophobicContact CB-CD2 4.17Å; A96-L104 HydrophobicContact CB-CG 3.75Å; A96-L105 HydrophobicContact CB-CD1 3.93Å; A96-L105 HydrophobicContact CB-CG 4.32Å; A96-L105 WeakPolarHBondContact O-CD1 3.33Å
97	I	90.9	Very high	91.9	Very high	16 Å²	16	62 Å²	62	8%	0.082	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-45.2	178.3	-62.4	160.8	0	0	0	110.6	H7 L10 F11 G93 L94 N99 Q100	H7-I97 HydrophobicContact CB-CG2 4.31Å; L10-I97 HydrophobicContact CB-CD1 3.9Å; L10-I97 HydrophobicContact CD2-CD1 3.84Å; L10-I97 HydrophobicContact CD2-CG1 3.97Å; L10-I97 HydrophobicContact CG-CD1 3.71Å; L10-I97 HydrophobicContact CG-CG1 4.4Å; F11-I97 HydrophobicContact CB-CD1 4.05Å; F11-I97 HydrophobicContact CB-CG2 4.42Å; F11-I97 HydrophobicContact CD2-CG2 4.48Å; G93-I97 WeakPolarHBondContact O-CD1 3.42Å; G93-I97 VanDerWaalsContact O-CG1 3.25Å; G93-I97 WeakPolarHBondContact O-CG1 3.3Å; G93-I97 PolarHBondContact O-N 3.01Å; L94-I97 PolarHBondContact O-N 2.93Å; I97-N99 VanDerWaalsContact C-N 3.35Å; I97-N99 PolarHBondContact O-N 3.03Å; I97-Q100 WeakPolarHBondContact O-CG 3.43Å; I97-Q100 PolarHBondContact O-N 3.4Å; I97-Q100 VanDerWaalsContact O-N 3.17Å
98	W	89.6	Confident	91.8	Very high	207 Å²	207	60.9 Å²	60.9	78%	0.784	29%	0.292	S	S	*	.	H	α-helix	trans	-58.7	-45.4	-179.4	-174	-91	0	0	0	112.4	L94 I95 Q100	L94-W98 WeakPolarHBondContact O-CB 3.49Å; L94-W98 PolarHBondContact O-N 3.15Å; I95-W98 PolarHBondContact O-N 2.97Å; W98-Q100 VanDerWaalsContact C-N 3.25Å; W98-Q100 PolarHBondContact O-N 2.92Å
99	N	88.9	Confident	91.7	Very high	77 Å²	77	57.5 Å²	57.5	41%	0.412	27%	0.274	S	S	.	.	H	α-helix	trans	-74.5	-13.2	-178.8	-74.9	-36.8	0	0	0	113.9	I95 I97 K101 L104	I95-N99 WeakPolarHBondContact CG2-ND2 3.35Å; I95-N99 WeakPolarHBondContact O-CB 3.39Å; I95-N99 PolarHBondContact O-N 3.22Å; I95-N99 PolarHBondContact O-ND2 3.46Å; I97-N99 VanDerWaalsContact C-N 3.35Å; I97-N99 PolarHBondContact O-N 3.03Å; N99-K101 HydrophobicContact CB-CG 4.41Å; N99-K101 PolarHBondContact O-N 3.28Å; N99-K101 VanDerWaalsContact O-N 3.14Å; N99-L104 HydrophobicContact CB-CD2 4.16Å
100	Q	83.6	Confident	91.7	Very high	72 Å²	72	61.3 Å²	61.3	34%	0.336	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	40.1	-176.8	-59.1	-177.8	7.1	0	0	113.1	M1 A96 I97 W98 F274	M1-Q100 PolarHBondContact SD-NE2 3.38Å; M1-Q100 VanDerWaalsContact SD-NE2 3.38Å; A96-Q100 PolarHBondContact O-N 2.86Å; I97-Q100 WeakPolarHBondContact O-CG 3.43Å; I97-Q100 PolarHBondContact O-N 3.4Å; I97-Q100 VanDerWaalsContact O-N 3.17Å; W98-Q100 VanDerWaalsContact C-N 3.25Å; W98-Q100 PolarHBondContact O-N 2.92Å; Q100-F274 HydrophobicContact CB-CE2 4.18Å; Q100-F274 WeakPolarHBondContact O-CE2 3.48Å; Q100-F274 WeakPolarHBondContact O-CZ 3.44Å
101	K	85.3	Confident	91.7	Very high	135 Å²	135	64.3 Å²	64.3	59%	0.587	31%	0.308	S	S	*	.			trans	-107.1	118.1	178.5	-72.1	-175.5	-177.8	178.8	0	110.7	N99 T103 L104 L105	N99-K101 HydrophobicContact CB-CG 4.41Å; N99-K101 PolarHBondContact O-N 3.28Å; N99-K101 VanDerWaalsContact O-N 3.14Å; K101-T103 PolarHBondContact O-N 3.42Å; K101-L104 HydrophobicContact CB-CB 4.17Å; K101-L104 PolarHBondContact O-N 3.19Å; K101-L105 PolarHBondContact O-N 2.99Å; K101-L105 VanDerWaalsContact O-N 3.13Å
102	S	85.7	Confident	91.7	Very high	16 Å²	16	60.8 Å²	60.8	11%	0.112	29%	0.29	C	S	.	.	H	α-helix	trans	-51.2	-42.3	177.2	-166.9	0	0	0	0	112.7	L104 L105 R106 N275	S102-L104 VanDerWaalsContact C-N 3.33Å; S102-L104 PolarHBondContact O-N 3.07Å; S102-L105 PolarHBondContact O-N 3.34Å; S102-R106 WeakPolarHBondContact O-CG 3.48Å; S102-R106 PolarHBondContact O-N 2.82Å; S102-N275 PolarHBondContact OG-OD1 2.86Å
103	T	89.8	Confident	91.7	Very high	108 Å²	108	59.2 Å²	59.2	66%	0.663	29%	0.288	S	S	*	.	H	α-helix	trans	-59.9	-41.6	178.4	-45.2	0	0	0	0	112.2	K101 R106 M107	K101-T103 PolarHBondContact O-N 3.42Å; T103-R106 PolarHBondContact O-N 3.4Å; T103-M107 WeakPolarHBondContact O-CG 3.46Å; T103-M107 PolarHBondContact O-N 3.42Å
104	L	91.6	Very high	91.9	Very high	51 Å²	51	66 Å²	66	27%	0.267	32%	0.318	S	S	.	.	H	α-helix	trans	-72.3	-38.6	-178.3	-168.6	59.1	0	0	0	111.4	I95 A96 N99 K101 S102 R106 M107 Y108	I95-L104 HydrophobicContact CG2-CD2 4.13Å; A96-L104 HydrophobicContact CB-CB 4.3Å; A96-L104 HydrophobicContact CB-CD2 4.17Å; A96-L104 HydrophobicContact CB-CG 3.75Å; N99-L104 HydrophobicContact CB-CD2 4.16Å; K101-L104 HydrophobicContact CB-CB 4.17Å; K101-L104 PolarHBondContact O-N 3.19Å; S102-L104 VanDerWaalsContact C-N 3.33Å; S102-L104 PolarHBondContact O-N 3.07Å; L104-R106 VanDerWaalsContact C-N 3.35Å; L104-M107 PolarHBondContact O-N 2.88Å; L104-Y108 PolarHBondContact O-N 2.97Å
105	L	91.1	Very high	91.9	Very high	6 Å²	6	65.5 Å²	65.5	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-43.2	170.8	-91	78.1	0	0	0	111.5	A96 K101 S102 M107 Y108 Q109 A270 V271	A96-L105 HydrophobicContact CB-CD1 3.93Å; A96-L105 HydrophobicContact CB-CG 4.32Å; A96-L105 WeakPolarHBondContact O-CD1 3.33Å; K101-L105 PolarHBondContact O-N 2.99Å; K101-L105 VanDerWaalsContact O-N 3.13Å; S102-L105 PolarHBondContact O-N 3.34Å; L105-M107 PolarHBondContact O-N 2.83Å; L105-Y108 WeakPolarHBondContact O-CB 3.49Å; L105-Y108 PolarHBondContact O-N 3.45Å; L105-Q109 VanDerWaalsContact O-CG 3.28Å; L105-Q109 WeakPolarHBondContact O-CG 3.24Å; L105-Q109 PolarHBondContact O-N 3.04Å; L105-A270 HydrophobicContact CD2-CB 3.8Å; L105-V271 HydrophobicContact CB-CG2 3.6Å; L105-V271 HydrophobicContact CD2-CG2 3.93Å; L105-V271 HydrophobicContact CG-CG2 4.42Å
106	R	92.3	Very high	92	Very high	126 Å²	126	62.6 Å²	62.6	48%	0.475	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-43.1	177.2	-72.5	179.1	-171.9	-158	2.4	112	S102 T103 L104 Q109 I110 V271	S102-R106 WeakPolarHBondContact O-CG 3.48Å; S102-R106 PolarHBondContact O-N 2.82Å; T103-R106 PolarHBondContact O-N 3.4Å; L104-R106 VanDerWaalsContact C-N 3.35Å; R106-Q109 PolarHBondContact O-N 2.88Å; R106-I110 WeakPolarHBondContact O-CG1 3.46Å; R106-I110 PolarHBondContact O-N 3.45Å; R106-V271 HydrophobicContact CG-CG1 4.29Å; R106-V271 HydrophobicContact CG-CG2 4.41Å
107	M	93.4	Very high	92.2	Very high	98 Å²	98	67 Å²	67	48%	0.483	33%	0.325	S	S	.	.	H	α-helix	trans	-61.1	-46.1	175.6	-70.2	-58	-64	0	0	111.8	T103 L104 L105 Q109 I110 I111	T103-M107 WeakPolarHBondContact O-CG 3.46Å; T103-M107 PolarHBondContact O-N 3.42Å; L104-M107 PolarHBondContact O-N 2.88Å; L105-M107 PolarHBondContact O-N 2.83Å; M107-Q109 VanDerWaalsContact C-N 3.3Å; M107-Q109 PolarHBondContact O-N 3.45Å; M107-I110 PolarHBondContact O-N 3.49Å; M107-I111 WeakPolarHBondContact O-CG1 3.25Å; M107-I111 PolarHBondContact O-N 3.48Å; M107-I111 VanDerWaalsContact O-N 3.08Å
108	Y	94.6	Very high	92.4	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.008	34%	0.336	C	S	.	.	H	α-helix	trans	-54.5	-45.5	173.9	161.6	-100.2	0	0	0	112	L10 N14 I89 I92 L104 L105 I110 I111 L112	L10-Y108 HydrophobicContact CD1-CE1 4.44Å; L10-Y108 HydrophobicContact CD2-CE1 4.42Å; N14-Y108 PolarHBondContact ND2-OH 3.48Å; N14-Y108 PolarHBondContact OD1-OH 3.08Å; I89-Y108 HydrophobicContact CG2-CD2 4.09Å; I89-Y108 HydrophobicContact CG2-CE2 3.66Å; I89-Y108 WeakPolarHBondContact O-CE2 3.48Å; I92-Y108 HydrophobicContact CG2-CD2 4.45Å; L104-Y108 PolarHBondContact O-N 2.97Å; L105-Y108 WeakPolarHBondContact O-CB 3.49Å; L105-Y108 PolarHBondContact O-N 3.45Å; Y108-I110 PolarHBondContact O-N 2.87Å; Y108-I111 PolarHBondContact O-N 3.32Å; Y108-L112 HydrophobicContact CE1-CD2 4.17Å; Y108-L112 WeakPolarHBondContact O-CB 3.5Å; Y108-L112 PolarHBondContact O-N 3Å
109	Q	93.6	Very high	92.7	Very high	25 Å²	25	58.2 Å²	58.2	12%	0.117	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-39.5	179.3	-68.5	176	-66.5	0	0	113.4	L105 R106 M107 G113 L264 G267	L105-Q109 VanDerWaalsContact O-CG 3.28Å; L105-Q109 WeakPolarHBondContact O-CG 3.24Å; L105-Q109 PolarHBondContact O-N 3.04Å; R106-Q109 PolarHBondContact O-N 2.88Å; M107-Q109 VanDerWaalsContact C-N 3.3Å; M107-Q109 PolarHBondContact O-N 3.45Å; Q109-G113 PolarHBondContact O-N 3.45Å; Q109-L264 HydrophobicContact CB-CD1 4.09Å; Q109-L264 HydrophobicContact CG-CD1 4.47Å; Q109-L264 WeakPolarHBondContact O-CD1 3.26Å; Q109-G267 PolarHBondContact NE2-O 3.02Å
110	I	95.4	Very high	93	Very high	92 Å²	92	58.6 Å²	58.6	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-48.2	177.7	-69	165	0	0	0	109.5	R106 M107 Y108 G113 F114	R106-I110 WeakPolarHBondContact O-CG1 3.46Å; R106-I110 PolarHBondContact O-N 3.45Å; M107-I110 PolarHBondContact O-N 3.49Å; Y108-I110 PolarHBondContact O-N 2.87Å; I110-G113 PolarHBondContact O-N 2.95Å; I110-F114 HydrophobicContact CG2-CD2 3.87Å; I110-F114 HydrophobicContact CG2-CE2 3.53Å; I110-F114 WeakPolarHBondContact O-CD2 3.44Å; I110-F114 PolarHBondContact O-N 2.97Å
111	I	95.6	Very high	93.5	Very high	65 Å²	65	60.6 Å²	60.6	33%	0.333	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-45.9	179.4	-62.4	167.5	0	0	0	110.7	I89 I92 M107 Y108 G113 F114 L115	I89-I111 HydrophobicContact CD1-CG2 3.88Å; I89-I111 HydrophobicContact CG1-CG2 3.73Å; I92-I111 HydrophobicContact CD1-CD1 4.41Å; M107-I111 WeakPolarHBondContact O-CG1 3.25Å; M107-I111 PolarHBondContact O-N 3.48Å; M107-I111 VanDerWaalsContact O-N 3.08Å; Y108-I111 PolarHBondContact O-N 3.32Å; I111-G113 VanDerWaalsContact C-N 3.29Å; I111-G113 PolarHBondContact O-N 3.32Å; I111-F114 PolarHBondContact O-N 2.88Å; I111-L115 PolarHBondContact O-N 3.45Å
112	L	95.8	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.4	-38.3	176.2	-179.3	62.3	0	0	0	111.8	I89 Y108 L115 V116 N260 M263 L264	I89-L112 HydrophobicContact CG2-CB 4.3Å; I89-L112 HydrophobicContact CG2-CD1 4.07Å; Y108-L112 HydrophobicContact CE1-CD2 4.17Å; Y108-L112 WeakPolarHBondContact O-CB 3.5Å; Y108-L112 PolarHBondContact O-N 3Å; L112-L115 HydrophobicContact CD1-CD2 4.37Å; L112-L115 WeakPolarHBondContact O-CB 3.34Å; L112-L115 PolarHBondContact O-N 3.38Å; L112-V116 WeakPolarHBondContact O-CG2 3.47Å; L112-V116 PolarHBondContact O-N 3.01Å; L112-N260 HydrophobicContact CD1-CB 3.99Å; L112-M263 HydrophobicContact CD1-CE 4.45Å; L112-M263 HydrophobicContact CD2-CB 3.85Å; L112-L264 HydrophobicContact CD2-CB 4Å; L112-L264 HydrophobicContact CD2-CD1 4.32Å; L112-L264 HydrophobicContact CG-CD1 4.48Å
113	G	95.7	Very high	94.3	Very high	26 Å²	26	60 Å²	60	27%	0.268	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-43.6	175.3	0	0	0	0	0	112.7	Q109 I110 I111 L115 V116 L117	Q109-G113 PolarHBondContact O-N 3.45Å; I110-G113 PolarHBondContact O-N 2.95Å; I111-G113 VanDerWaalsContact C-N 3.29Å; I111-G113 PolarHBondContact O-N 3.32Å; G113-L115 VanDerWaalsContact C-N 3.35Å; G113-V116 PolarHBondContact O-N 3.39Å; G113-L117 PolarHBondContact O-N 3.3Å
114	F	95.9	Very high	94.5	Very high	143 Å²	143	57.9 Å²	57.9	63%	0.627	30%	0.303	S	S	*	.	H	α-helix	trans	-63.2	-39.8	173.4	-77	-64.9	0	0	0	112.5	I110 I111 L117 G118	I110-F114 HydrophobicContact CG2-CD2 3.87Å; I110-F114 HydrophobicContact CG2-CE2 3.53Å; I110-F114 WeakPolarHBondContact O-CD2 3.44Å; I110-F114 PolarHBondContact O-N 2.97Å; I111-F114 PolarHBondContact O-N 2.88Å; F114-L117 PolarHBondContact O-N 3.02Å; F114-G118 PolarHBondContact O-N 2.86Å
115	L	94.8	Very high	94.6	Very high	26 Å²	26	57.1 Å²	57.1	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-46.4	175.7	-176.9	77.9	0	0	0	111.4	F82 N86 I89 I111 L112 G113 L117 G118 H119	F82-L115 HydrophobicContact CE2-CD1 4.13Å; N86-L115 VanDerWaalsContact OD1-CD2 3.27Å; N86-L115 WeakPolarHBondContact OD1-CD2 3.4Å; I89-L115 HydrophobicContact CD1-CB 3.85Å; I89-L115 HydrophobicContact CD1-CD1 4.23Å; I89-L115 HydrophobicContact CD1-CD2 3.62Å; I89-L115 HydrophobicContact CD1-CG 4.09Å; I111-L115 PolarHBondContact O-N 3.45Å; L112-L115 HydrophobicContact CD1-CD2 4.37Å; L112-L115 WeakPolarHBondContact O-CB 3.34Å; L112-L115 PolarHBondContact O-N 3.38Å; G113-L115 VanDerWaalsContact C-N 3.35Å; L115-L117 VanDerWaalsContact C-N 3.33Å; L115-L117 PolarHBondContact O-N 3.23Å; L115-G118 PolarHBondContact O-N 3.42Å; L115-H119 WeakPolarHBondContact O-CB 3.47Å; L115-H119 PolarHBondContact O-N 3.46Å
116	V	96.4	Very high	94.7	Very high	23 Å²	23	58.4 Å²	58.4	14%	0.139	31%	0.312	C	S	.	.	H	α-helix	trans	-58.4	-45.9	177	167.5	0	0	0	0	110.7	L112 G113 H119 L120 L257 N260 V261	L112-V116 WeakPolarHBondContact O-CG2 3.47Å; L112-V116 PolarHBondContact O-N 3.01Å; G113-V116 PolarHBondContact O-N 3.39Å; V116-H119 PolarHBondContact O-N 2.81Å; V116-L120 WeakPolarHBondContact O-CB 3.49Å; V116-L120 PolarHBondContact O-N 3.2Å; V116-L257 HydrophobicContact CB-CD1 4.34Å; V116-L257 HydrophobicContact CG1-CD1 3.89Å; V116-L257 HydrophobicContact CG2-CD1 4.47Å; V116-N260 HydrophobicContact CG2-CB 3.69Å; V116-V261 HydrophobicContact CG1-CG2 3.96Å; V116-V261 HydrophobicContact CG2-CG2 4.44Å
117	L	96.1	Very high	94.8	Very high	92 Å²	92	57 Å²	57	48%	0.482	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-47.4	177.5	-179.2	61.9	0	0	0	111.7	G113 F114 L115 H119 L120 L121	G113-L117 PolarHBondContact O-N 3.3Å; F114-L117 PolarHBondContact O-N 3.02Å; L115-L117 VanDerWaalsContact C-N 3.33Å; L115-L117 PolarHBondContact O-N 3.23Å; L117-H119 VanDerWaalsContact C-N 3.35Å; L117-H119 PolarHBondContact O-N 3.48Å; L117-L120 PolarHBondContact O-N 2.71Å; L117-L121 HydrophobicContact CG-CD1 4.35Å; L117-L121 WeakPolarHBondContact O-CG 3.37Å; L117-L121 PolarHBondContact O-N 3.08Å
118	G	94.9	Very high	94.9	Very high	31 Å²	31	60.7 Å²	60.7	32%	0.32	32%	0.321	S	S	.	.	H	α-helix	trans	-61	-42.2	178.2	0	0	0	0	0	112.6	F114 L115 L121 L122	F114-G118 PolarHBondContact O-N 2.86Å; L115-G118 PolarHBondContact O-N 3.42Å; G118-L121 PolarHBondContact O-N 3.09Å; G118-L122 WeakPolarHBondContact O-CG 3.21Å; G118-L122 PolarHBondContact O-N 3.31Å
119	H	95.3	Very high	94.8	Very high	9 Å²	9	62.9 Å²	62.9	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-66.2	-40.5	177.3	-171.3	-179.1	0	0	0	112.1	F82 L115 V116 L117 L121 L122 T123 S253 L257	F82-H119 AromaticContact CE1-CE1 3.88Å; F82-H119 HydrophobicContact CE2-CB 3.97Å; F82-H119 AromaticContact CE2-CG 3.75Å; F82-H119 AromaticContact CE2-ND1 3.67Å; F82-H119 HydrophobicContact CZ-CB 4.34Å; F82-H119 AromaticContact CZ-CE1 3.38Å; F82-H119 WeakPolarHBondContact CZ-CE1 3.5Å; F82-H119 AromaticContact CZ-CG 3.73Å; F82-H119 AromaticContact CZ-ND1 3.15Å; F82-H119 WeakPolarHBondContact CZ-ND1 3.19Å; L115-H119 WeakPolarHBondContact O-CB 3.47Å; L115-H119 PolarHBondContact O-N 3.46Å; V116-H119 PolarHBondContact O-N 2.81Å; L117-H119 VanDerWaalsContact C-N 3.35Å; L117-H119 PolarHBondContact O-N 3.48Å; H119-L121 VanDerWaalsContact C-N 3.34Å; H119-L121 PolarHBondContact O-N 2.94Å; H119-L122 PolarHBondContact O-N 3.47Å; H119-T123 PolarHBondContact CD2-OG1 3.35Å; H119-T123 WeakPolarHBondContact O-CB 3.29Å; H119-T123 PolarHBondContact O-N 2.87Å; H119-T123 PolarHBondContact O-OG1 2.73Å; H119-S253 PolarHBondContact CE1-O 2.58Å; H119-S253 WeakPolarHBondContact NE2-CB 3.43Å; H119-S253 PolarHBondContact NE2-OG 3.41Å; H119-S253 VanDerWaalsContact NE2-OG 3.08Å; H119-L257 HydrophobicContact CB-CD1 4.08Å
120	L	95.4	Very high	94.7	Very high	84 Å²	84	64.8 Å²	64.8	44%	0.44	34%	0.344	S	S	.	.	H	α-helix	trans	-59.4	-46.9	173.5	-178	65.8	0	0	0	111.1	V116 L117 L122 T123 V124 L257	V116-L120 WeakPolarHBondContact O-CB 3.49Å; V116-L120 PolarHBondContact O-N 3.2Å; L117-L120 PolarHBondContact O-N 2.71Å; L120-L122 PolarHBondContact O-N 2.87Å; L120-T123 PolarHBondContact O-N 2.88Å; L120-V124 HydrophobicContact CD1-CG2 4.38Å; L120-V124 WeakPolarHBondContact O-CB 3.23Å; L120-V124 VanDerWaalsContact O-CG2 3.28Å; L120-V124 WeakPolarHBondContact O-CG2 3.37Å; L120-V124 PolarHBondContact O-N 2.81Å; L120-L257 HydrophobicContact CD1-CD2 4.4Å
121	L	95.4	Very high	94.6	Very high	115 Å²	115	65.5 Å²	65.5	60%	0.602	35%	0.346	S	S	*	.	H	α-helix	trans	-61.3	-42.5	177.9	-68.8	173.9	0	0	0	112.4	L117 G118 H119 G125	L117-L121 HydrophobicContact CG-CD1 4.35Å; L117-L121 WeakPolarHBondContact O-CG 3.37Å; L117-L121 PolarHBondContact O-N 3.08Å; G118-L121 PolarHBondContact O-N 3.09Å; H119-L121 VanDerWaalsContact C-N 3.34Å; H119-L121 PolarHBondContact O-N 2.94Å; L121-G125 PolarHBondContact O-N 3.37Å
122	L	93	Very high	94.5	Very high	123 Å²	123	66 Å²	66	64%	0.644	35%	0.352	S	S	*	.	H	α-helix	trans	-63.6	-43.1	176.2	-73.1	171.9	0	0	0	112.2	G118 H119 L120 G125 Y126	G118-L122 WeakPolarHBondContact O-CG 3.21Å; G118-L122 PolarHBondContact O-N 3.31Å; H119-L122 PolarHBondContact O-N 3.47Å; L120-L122 PolarHBondContact O-N 2.87Å; L122-G125 PolarHBondContact O-N 3.44Å; L122-Y126 PolarHBondContact O-N 3.12Å
123	T	93.8	Very high	94.2	Very high	16 Å²	16	68 Å²	68	10%	0.098	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-47.7	179	-56.2	0	0	0	0	110.6	H119 L120 Y126 Y127 V250 I254	H119-T123 PolarHBondContact CD2-OG1 3.35Å; H119-T123 WeakPolarHBondContact O-CB 3.29Å; H119-T123 PolarHBondContact O-N 2.87Å; H119-T123 PolarHBondContact O-OG1 2.73Å; L120-T123 PolarHBondContact O-N 2.88Å; T123-Y126 PolarHBondContact O-N 3.25Å; T123-Y127 HydrophobicContact CG2-CD2 4.42Å; T123-Y127 HydrophobicContact CG2-CE2 4.09Å; T123-Y127 VanDerWaalsContact O-CD2 3.23Å; T123-Y127 WeakPolarHBondContact O-CD2 3.49Å; T123-Y127 PolarHBondContact O-N 3.34Å; T123-V250 HydrophobicContact CG2-CG1 4.01Å; T123-I254 HydrophobicContact CG2-CD1 4.35Å; T123-I254 HydrophobicContact CG2-CG1 4.21Å
124	V	95	Very high	94	Very high	63 Å²	63	68.3 Å²	68.3	38%	0.382	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-45.2	176.9	171.5	0	0	0	0	110.6	L120 Y126 Y127 F128	L120-V124 HydrophobicContact CD1-CG2 4.38Å; L120-V124 WeakPolarHBondContact O-CB 3.23Å; L120-V124 VanDerWaalsContact O-CG2 3.28Å; L120-V124 WeakPolarHBondContact O-CG2 3.37Å; L120-V124 PolarHBondContact O-N 2.81Å; V124-Y126 VanDerWaalsContact C-N 3.32Å; V124-Y126 PolarHBondContact O-N 2.77Å; V124-Y127 PolarHBondContact O-N 2.8Å; V124-Y127 VanDerWaalsContact O-N 3.16Å; V124-F128 HydrophobicContact CG1-CD2 3.58Å; V124-F128 HydrophobicContact CG1-CE2 3.37Å; V124-F128 VanDerWaalsContact O-CD2 3.24Å; V124-F128 WeakPolarHBondContact O-CD2 3.46Å; V124-F128 PolarHBondContact O-N 3.45Å; V124-F128 VanDerWaalsContact O-N 3.1Å
125	G	94	Very high	93.9	Very high	34 Å²	34	64.7 Å²	64.7	35%	0.351	35%	0.346	S	S	.	.	H	α-helix	trans	-56.9	-42	177.2	0	0	0	0	0	113.2	L121 L122 Y127 F128 S129	L121-G125 PolarHBondContact O-N 3.37Å; L122-G125 PolarHBondContact O-N 3.44Å; G125-Y127 PolarHBondContact O-N 3.37Å; G125-F128 PolarHBondContact O-N 3.44Å; G125-S129 PolarHBondContact O-N 3.03Å; G125-S129 PolarHBondContact O-OG 3.22Å
126	Y	92.7	Very high	93.8	Very high	34 Å²	34	69.4 Å²	69.4	13%	0.133	37%	0.367	C	S	.	.	H	α-helix	trans	-57.7	-45.8	175.2	169.5	-98	0	0	0	112.4	L122 T123 V124 F128 S129 K130 L246 N247 V250	L122-Y126 PolarHBondContact O-N 3.12Å; T123-Y126 PolarHBondContact O-N 3.25Å; V124-Y126 VanDerWaalsContact C-N 3.32Å; V124-Y126 PolarHBondContact O-N 2.77Å; Y126-F128 VanDerWaalsContact C-N 3.32Å; Y126-F128 PolarHBondContact O-N 2.84Å; Y126-S129 CarbonylContact O-C 3.54Å; Y126-S129 PolarHBondContact O-N 3.45Å; Y126-S129 PolarHBondContact O-OG 2.96Å; Y126-K130 PolarHBondContact O-N 2.75Å; Y126-L246 HydrophobicContact CE2-CB 4.13Å; Y126-L246 WeakPolarHBondContact OH-CB 3.16Å; Y126-N247 PolarHBondContact OH-OD1 3.32Å; Y126-V250 HydrophobicContact CD1-CB 4.32Å; Y126-V250 HydrophobicContact CD1-CG1 4.12Å; Y126-V250 HydrophobicContact CD1-CG2 3.67Å; Y126-V250 HydrophobicContact CD2-CG2 4.26Å; Y126-V250 HydrophobicContact CE1-CB 4.31Å; Y126-V250 HydrophobicContact CE1-CG1 4.47Å; Y126-V250 HydrophobicContact CE1-CG2 3.78Å; Y126-V250 HydrophobicContact CE2-CG2 4.36Å; Y126-V250 HydrophobicContact CG-CG2 3.91Å
127	Y	93.8	Very high	93.6	Very high	96 Å²	96	69.3 Å²	69.3	38%	0.376	37%	0.365	S	S	.	.	H	α-helix	trans	-67.3	-34.1	179.2	-75.6	-69.5	0	0	0	112.3	T123 V124 G125 V250	T123-Y127 HydrophobicContact CG2-CD2 4.42Å; T123-Y127 HydrophobicContact CG2-CE2 4.09Å; T123-Y127 VanDerWaalsContact O-CD2 3.23Å; T123-Y127 WeakPolarHBondContact O-CD2 3.49Å; T123-Y127 PolarHBondContact O-N 3.34Å; V124-Y127 PolarHBondContact O-N 2.8Å; V124-Y127 VanDerWaalsContact O-N 3.16Å; G125-Y127 PolarHBondContact O-N 3.37Å; Y127-V250 HydrophobicContact CE2-CG1 3.95Å
128	F	95	Very high	93.5	Very high	176 Å²	176	67.4 Å²	67.4	77%	0.772	35%	0.353	S	S	*	.	H	α-helix	trans	-68.6	-33.8	173.3	-81.7	-70.1	0	0	0	113.1	V124 G125 Y126	V124-F128 HydrophobicContact CG1-CD2 3.58Å; V124-F128 HydrophobicContact CG1-CE2 3.37Å; V124-F128 VanDerWaalsContact O-CD2 3.24Å; V124-F128 WeakPolarHBondContact O-CD2 3.46Å; V124-F128 PolarHBondContact O-N 3.45Å; V124-F128 VanDerWaalsContact O-N 3.1Å; G125-F128 PolarHBondContact O-N 3.44Å; Y126-F128 VanDerWaalsContact C-N 3.32Å; Y126-F128 PolarHBondContact O-N 2.84Å
129	S	92.9	Very high	93.4	Very high	47 Å²	47	71 Å²	71	33%	0.329	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	7.2	-178.8	74.6	0	0	0	0	114	G125 Y126 Q131 T132 T133	G125-S129 PolarHBondContact O-N 3.03Å; G125-S129 PolarHBondContact O-OG 3.22Å; Y126-S129 CarbonylContact O-C 3.54Å; Y126-S129 PolarHBondContact O-N 3.45Å; Y126-S129 PolarHBondContact O-OG 2.96Å; S129-Q131 VanDerWaalsContact C-N 3.32Å; S129-Q131 PolarHBondContact O-N 3.18Å; S129-T132 WeakPolarHBondContact O-CB 3.28Å; S129-T132 PolarHBondContact O-N 2.81Å; S129-T132 VanDerWaalsContact O-N 3.11Å; S129-T133 PolarHBondContact O-N 3.15Å; S129-T133 PolarHBondContact O-OG1 3.02Å
130	K	92.4	Very high	93.2	Very high	66 Å²	66	73.4 Å²	73.4	29%	0.287	37%	0.374	S	S	.	.	H	α-helix	trans	-55.8	-46.2	-173.3	-178.7	176.4	173.5	178.6	0	112.2	Y126 T132 T133 E134	Y126-K130 PolarHBondContact O-N 2.75Å; K130-T132 VanDerWaalsContact C-N 3.35Å; K130-T132 PolarHBondContact O-N 3.19Å; K130-T133 WeakPolarHBondContact O-CB 3.19Å; K130-T133 PolarHBondContact O-N 3.05Å; K130-E134 VanDerWaalsContact CE-OE1 3.25Å; K130-E134 WeakPolarHBondContact CE-OE1 3.22Å; K130-E134 PolarHBondContact O-N 2.86Å
131	Q	92.9	Very high	93.1	Very high	106 Å²	106	69.4 Å²	69.4	50%	0.495	35%	0.353	S	S	.	.	H	α-helix	trans	-60.2	-44.7	178.3	-174.8	60.5	44	0	0	111.8	S129 T133 E134 D135	S129-Q131 VanDerWaalsContact C-N 3.32Å; S129-Q131 PolarHBondContact O-N 3.18Å; Q131-T133 VanDerWaalsContact C-N 3.31Å; Q131-T133 PolarHBondContact O-N 3.16Å; Q131-E134 PolarHBondContact O-N 3.47Å; Q131-D135 PolarHBondContact NE2-OD1 2.94Å; Q131-D135 PolarHBondContact NE2-OD2 3Å; Q131-D135 PolarHBondContact O-N 3.35Å
132	T	93.1	Very high	93	Very high	77 Å²	77	68.6 Å²	68.6	47%	0.472	35%	0.345	S	S	.	.	H	α-helix	trans	-61.9	-39.9	177.8	-51.9	0	0	0	0	111.8	S129 K130 D135 H136	S129-T132 WeakPolarHBondContact O-CB 3.28Å; S129-T132 PolarHBondContact O-N 2.81Å; S129-T132 VanDerWaalsContact O-N 3.11Å; K130-T132 VanDerWaalsContact C-N 3.35Å; K130-T132 PolarHBondContact O-N 3.19Å; T132-D135 PolarHBondContact O-N 3.09Å; T132-H136 PolarHBondContact O-CD2 3.24Å; T132-H136 PolarHBondContact O-N 3.35Å
133	T	90	Very high	93	Very high	40 Å²	40	64.3 Å²	64.3	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-62.2	-45.1	174.3	-57.2	0	0	0	0	111.5	S129 K130 Q131 D135 H136 L137 L246	S129-T133 PolarHBondContact O-N 3.15Å; S129-T133 PolarHBondContact O-OG1 3.02Å; K130-T133 WeakPolarHBondContact O-CB 3.19Å; K130-T133 PolarHBondContact O-N 3.05Å; Q131-T133 VanDerWaalsContact C-N 3.31Å; Q131-T133 PolarHBondContact O-N 3.16Å; T133-D135 VanDerWaalsContact C-N 3.34Å; T133-D135 PolarHBondContact O-N 3.49Å; T133-H136 PolarHBondContact O-N 3.49Å; T133-L137 HydrophobicContact CG2-CD1 4.23Å; T133-L137 VanDerWaalsContact O-CG 3.31Å; T133-L137 WeakPolarHBondContact O-CG 3.02Å; T133-L137 PolarHBondContact O-N 3.23Å; T133-L246 HydrophobicContact CG2-CD1 3.94Å
134	E	92.1	Very high	92.9	Very high	34 Å²	34	64.2 Å²	64.2	16%	0.159	33%	0.329	C	S	.	.	H	α-helix	trans	-60.6	-43.4	176.5	-75.6	179	-162.9	0	0	111.8	K130 Q131 L137 K138 S243	K130-E134 VanDerWaalsContact CE-OE1 3.25Å; K130-E134 WeakPolarHBondContact CE-OE1 3.22Å; K130-E134 PolarHBondContact O-N 2.86Å; Q131-E134 PolarHBondContact O-N 3.47Å; E134-L137 WeakPolarHBondContact O-CB 3.06Å; E134-L137 PolarHBondContact O-N 3.47Å; E134-K138 WeakPolarHBondContact O-CG 3.43Å; E134-K138 PolarHBondContact O-N 3.4Å; E134-S243 WeakPolarHBondContact CG-OG 3.43Å
135	D	93.5	Very high	92.9	Very high	67 Å²	67	61.2 Å²	61.2	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-67	-38.7	179.3	-64.8	-26.9	0	0	0	111.8	Q131 T132 T133 L137 K138 D139	Q131-D135 PolarHBondContact NE2-OD1 2.94Å; Q131-D135 PolarHBondContact NE2-OD2 3Å; Q131-D135 PolarHBondContact O-N 3.35Å; T132-D135 PolarHBondContact O-N 3.09Å; T133-D135 VanDerWaalsContact C-N 3.34Å; T133-D135 PolarHBondContact O-N 3.49Å; D135-L137 VanDerWaalsContact C-N 3.32Å; D135-L137 PolarHBondContact O-N 3.23Å; D135-K138 WeakPolarHBondContact O-CB 3.49Å; D135-K138 PolarHBondContact O-N 3.4Å; D135-K138 IonicContact OD1-NZ 2.64Å; D135-K138 PolarHBondContact OD1-NZ 3.3Å; D135-D139 PolarHBondContact O-N 3.48Å
136	H	92	Very high	92.8	Very high	125 Å²	125	61.7 Å²	61.7	58%	0.579	31%	0.307	S	S	*	.	H	α-helix	trans	-61	-37.8	170.5	-77.8	-47.4	0	0	0	113.1	T132 T133 D139 Y140	T132-H136 PolarHBondContact O-CD2 3.24Å; T132-H136 PolarHBondContact O-N 3.35Å; T133-H136 PolarHBondContact O-N 3.49Å; H136-D139 PolarHBondContact O-N 3.46Å; H136-Y140 VanDerWaalsContact O-CB 3.28Å; H136-Y140 WeakPolarHBondContact O-CB 3.36Å; H136-Y140 PolarHBondContact O-N 3.37Å
137	L	92.3	Very high	92.8	Very high	20 Å²	20	64 Å²	64	11%	0.105	32%	0.319	C	S	.	.	H	α-helix	trans	-67.4	-38.7	176.7	-71	166.4	0	0	0	111.6	T133 E134 D135 Y140 I141 F238 A239 I242	T133-L137 HydrophobicContact CG2-CD1 4.23Å; T133-L137 VanDerWaalsContact O-CG 3.31Å; T133-L137 WeakPolarHBondContact O-CG 3.02Å; T133-L137 PolarHBondContact O-N 3.23Å; E134-L137 WeakPolarHBondContact O-CB 3.06Å; E134-L137 PolarHBondContact O-N 3.47Å; D135-L137 VanDerWaalsContact C-N 3.32Å; D135-L137 PolarHBondContact O-N 3.23Å; L137-Y140 PolarHBondContact O-N 2.95Å; L137-I141 WeakPolarHBondContact O-CG2 3.45Å; L137-I141 PolarHBondContact O-N 3.24Å; L137-F238 HydrophobicContact CB-CD1 4.46Å; L137-F238 HydrophobicContact CB-CE1 4.43Å; L137-F238 HydrophobicContact CD2-CE1 4.18Å; L137-A239 HydrophobicContact CB-CB 4.07Å; L137-I242 HydrophobicContact CD1-CB 3.91Å; L137-I242 HydrophobicContact CD1-CG2 3.73Å; L137-I242 HydrophobicContact CD2-CB 4.24Å; L137-I242 HydrophobicContact CD2-CG2 3.77Å; L137-I242 HydrophobicContact CG-CG2 4.42Å
138	K	93.9	Very high	92.9	Very high	53 Å²	53	59.4 Å²	59.4	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-45.9	173.9	-67.2	172.4	-166.7	154.6	0	111.7	E134 D135 Y140 I141 K142 D235 A239	E134-K138 WeakPolarHBondContact O-CG 3.43Å; E134-K138 PolarHBondContact O-N 3.4Å; D135-K138 WeakPolarHBondContact O-CB 3.49Å; D135-K138 PolarHBondContact O-N 3.4Å; D135-K138 IonicContact OD1-NZ 2.64Å; D135-K138 PolarHBondContact OD1-NZ 3.3Å; K138-Y140 VanDerWaalsContact C-N 3.31Å; K138-Y140 PolarHBondContact O-N 2.83Å; K138-I141 VanDerWaalsContact O-CG2 3.28Å; K138-I141 WeakPolarHBondContact O-CG2 3.4Å; K138-K142 WeakPolarHBondContact O-CB 2.96Å; K138-K142 PolarHBondContact O-N 2.87Å; K138-D235 HydrophobicContact CB-CB 4.19Å; K138-D235 HydrophobicContact CG-CB 4.08Å; K138-A239 HydrophobicContact CG-CB 3.98Å
139	D	92.7	Very high	92.9	Very high	105 Å²	105	52.9 Å²	52.9	56%	0.561	28%	0.275	S	S	*	.	H	α-helix	trans	-63.6	-39.9	176.4	-76.8	-22.6	0	0	0	111.8	D135 H136 K142 G143	D135-D139 PolarHBondContact O-N 3.48Å; H136-D139 PolarHBondContact O-N 3.46Å; D139-K142 WeakPolarHBondContact O-CB 3.23Å; D139-K142 PolarHBondContact O-N 2.94Å; D139-G143 PolarHBondContact O-N 3.19Å
140	Y	92.2	Very high	92.9	Very high	61 Å²	61	50.7 Å²	50.7	24%	0.239	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-51	178	-178.7	-100.1	0	0	0	112	I71 H136 L137 K138 K142 G143 L144 F238	I71-Y140 HydrophobicContact CD1-CE1 3.53Å; I71-Y140 HydrophobicContact CG1-CE1 3.53Å; I71-Y140 VanDerWaalsContact CG1-OH 3.26Å; I71-Y140 WeakPolarHBondContact CG1-OH 3.37Å; H136-Y140 VanDerWaalsContact O-CB 3.28Å; H136-Y140 WeakPolarHBondContact O-CB 3.36Å; H136-Y140 PolarHBondContact O-N 3.37Å; L137-Y140 PolarHBondContact O-N 2.95Å; K138-Y140 VanDerWaalsContact C-N 3.31Å; K138-Y140 PolarHBondContact O-N 2.83Å; Y140-K142 VanDerWaalsContact C-N 3.29Å; Y140-K142 PolarHBondContact O-N 3.44Å; Y140-G143 PolarHBondContact O-N 3.28Å; Y140-G143 VanDerWaalsContact O-N 3.15Å; Y140-L144 HydrophobicContact CD1-CD1 3.94Å; Y140-L144 HydrophobicContact CD1-CG 4.5Å; Y140-L144 HydrophobicContact CE1-CD1 3.38Å; Y140-L144 HydrophobicContact CE1-CG 4.09Å; Y140-L144 PolarHBondContact O-N 3Å; Y140-L144 VanDerWaalsContact O-N 3.09Å; Y140-F238 HydrophobicContact CD1-CE1 4.23Å; Y140-F238 HydrophobicContact CD1-CZ 4.31Å
141	I	92.6	Very high	93	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66.2	-34.1	178.7	-168.1	62.7	0	0	0	111.4	L137 K138 G143 L144 M145 V164 C234 D235 F238	L137-I141 WeakPolarHBondContact O-CG2 3.45Å; L137-I141 PolarHBondContact O-N 3.24Å; K138-I141 VanDerWaalsContact O-CG2 3.28Å; K138-I141 WeakPolarHBondContact O-CG2 3.4Å; I141-G143 VanDerWaalsContact C-N 3.31Å; I141-G143 PolarHBondContact O-N 3.15Å; I141-L144 HydrophobicContact CD1-CB 4.28Å; I141-L144 HydrophobicContact CD1-CD1 3.97Å; I141-L144 WeakPolarHBondContact O-CB 3.35Å; I141-L144 PolarHBondContact O-N 3.24Å; I141-L144 VanDerWaalsContact O-N 3.12Å; I141-M145 HydrophobicContact CD1-CE 3.85Å; I141-M145 HydrophobicContact CG1-CE 3.81Å; I141-M145 HydrophobicContact CG1-CG 4.41Å; I141-M145 WeakPolarHBondContact O-CG 3.48Å; I141-M145 PolarHBondContact O-N 3.46Å; I141-V164 HydrophobicContact CD1-CB 4.46Å; I141-V164 HydrophobicContact CD1-CG1 4Å; I141-V164 HydrophobicContact CD1-CG2 4.38Å; I141-C234 HydrophobicContact CG1-CB 4.47Å; I141-D235 HydrophobicContact CG2-CB 4.36Å; I141-F238 HydrophobicContact CB-CB 4.45Å; I141-F238 HydrophobicContact CB-CD1 3.65Å; I141-F238 HydrophobicContact CB-CE1 4Å; I141-F238 HydrophobicContact CB-CG 4.01Å; I141-F238 HydrophobicContact CD1-CD2 4.05Å; I141-F238 HydrophobicContact CD1-CE2 4.17Å; I141-F238 HydrophobicContact CD1-CG 4.22Å; I141-F238 HydrophobicContact CD1-CZ 4.45Å; I141-F238 HydrophobicContact CG1-CB 4.26Å; I141-F238 HydrophobicContact CG1-CD1 4.17Å; I141-F238 HydrophobicContact CG1-CD2 4.33Å; I141-F238 HydrophobicContact CG1-CG 4Å; I141-F238 HydrophobicContact CG2-CB 4.34Å; I141-F238 HydrophobicContact CG2-CD1 3.94Å; I141-F238 HydrophobicContact CG2-CG 4.33Å
142	K	93.1	Very high	92.9	Very high	98 Å²	98	48.3 Å²	48.3	43%	0.426	25%	0.245	S	C	.	.	H	α-helix	trans	-58.8	-43	172	-175.9	176.7	-179.9	-178.3	0	112.2	K138 D139 Y140 L144 M145 T146 A173	K138-K142 WeakPolarHBondContact O-CB 2.96Å; K138-K142 PolarHBondContact O-N 2.87Å; D139-K142 WeakPolarHBondContact O-CB 3.23Å; D139-K142 PolarHBondContact O-N 2.94Å; Y140-K142 VanDerWaalsContact C-N 3.29Å; Y140-K142 PolarHBondContact O-N 3.44Å; K142-L144 VanDerWaalsContact C-N 3.35Å; K142-L144 PolarHBondContact O-N 2.79Å; K142-M145 PolarHBondContact O-N 2.94Å; K142-T146 WeakPolarHBondContact O-CG2 3.22Å; K142-T146 PolarHBondContact O-N 3.27Å; K142-A173 HydrophobicContact CB-CB 3.81Å; K142-A173 HydrophobicContact CG-CB 3.75Å
143	G	92.6	Very high	92.8	Very high	33 Å²	33	46.4 Å²	46.4	34%	0.34	24%	0.235	S	C	.	.	H	α-helix	trans	-59.2	-43.7	172.6	0	0	0	0	0	112.6	D139 Y140 I141 M145 T146 E147	D139-G143 PolarHBondContact O-N 3.19Å; Y140-G143 PolarHBondContact O-N 3.28Å; Y140-G143 VanDerWaalsContact O-N 3.15Å; I141-G143 VanDerWaalsContact C-N 3.31Å; I141-G143 PolarHBondContact O-N 3.15Å; G143-M145 VanDerWaalsContact C-N 3.35Å; G143-M145 PolarHBondContact O-N 2.96Å; G143-T146 PolarHBondContact O-N 2.91Å; G143-T146 PolarHBondContact O-OG1 3.39Å; G143-E147 WeakPolarHBondContact O-CG 3.27Å; G143-E147 PolarHBondContact O-N 3.16Å
144	L	92.9	Very high	92.8	Very high	13 Å²	13	44.7 Å²	44.7	7%	0.068	23%	0.225	C	C	.	.	H	α-helix	trans	-65.4	-36.2	177.4	-66.1	176.9	0	0	0	113.3	L67 Y140 I141 K142 E147 Y148 T157 F160 T161	L67-L144 HydrophobicContact CD1-CD2 4.05Å; L67-L144 HydrophobicContact CD2-CD2 3.96Å; L67-L144 HydrophobicContact CG-CD2 4.47Å; Y140-L144 HydrophobicContact CD1-CD1 3.94Å; Y140-L144 HydrophobicContact CD1-CG 4.5Å; Y140-L144 HydrophobicContact CE1-CD1 3.38Å; Y140-L144 HydrophobicContact CE1-CG 4.09Å; Y140-L144 PolarHBondContact O-N 3Å; Y140-L144 VanDerWaalsContact O-N 3.09Å; I141-L144 HydrophobicContact CD1-CB 4.28Å; I141-L144 HydrophobicContact CD1-CD1 3.97Å; I141-L144 WeakPolarHBondContact O-CB 3.35Å; I141-L144 PolarHBondContact O-N 3.24Å; I141-L144 VanDerWaalsContact O-N 3.12Å; K142-L144 VanDerWaalsContact C-N 3.35Å; K142-L144 PolarHBondContact O-N 2.79Å; L144-E147 PolarHBondContact O-N 3.38Å; L144-Y148 PolarHBondContact O-N 3.41Å; L144-T157 HydrophobicContact CB-CG2 4.48Å; L144-T157 HydrophobicContact CD2-CG2 3.94Å; L144-F160 HydrophobicContact CD1-CD1 3.64Å; L144-F160 HydrophobicContact CD1-CE1 3.39Å; L144-T161 PolarHBondContact O-OG1 3.33Å
145	M	93.2	Very high	92.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.8	-37.5	176.5	-63.7	-76.8	166.1	0	0	111.5	I141 K142 G143 E147 Y148 T161 M165 A173 W180 Y182 C234	I141-M145 HydrophobicContact CD1-CE 3.85Å; I141-M145 HydrophobicContact CG1-CE 3.81Å; I141-M145 HydrophobicContact CG1-CG 4.41Å; I141-M145 WeakPolarHBondContact O-CG 3.48Å; I141-M145 PolarHBondContact O-N 3.46Å; K142-M145 PolarHBondContact O-N 2.94Å; G143-M145 VanDerWaalsContact C-N 3.35Å; G143-M145 PolarHBondContact O-N 2.96Å; M145-E147 PolarHBondContact O-N 3.44Å; M145-Y148 WeakPolarHBondContact O-CB 3.47Å; M145-Y148 PolarHBondContact O-N 3.36Å; M145-T161 HydrophobicContact CE-CG2 3.52Å; M145-T161 HydrophobicContact CG-CG2 4.17Å; M145-T161 HydrophobicContact SD-CG2 3.29Å; M145-T161 WeakPolarHBondContact SD-CG2 3.19Å; M145-M165 HydrophobicContact CE-CE 4.34Å; M145-M165 HydrophobicContact CE-CG 4.11Å; M145-M165 HydrophobicContact SD-CE 3.74Å; M145-A173 HydrophobicContact CB-CB 3.99Å; M145-A173 HydrophobicContact CG-CB 3.95Å; M145-W180 HydrophobicContact CB-CZ2 4.38Å; M145-W180 HydrophobicContact SD-CH2 3.63Å; M145-W180 HydrophobicContact SD-CZ2 4.17Å; M145-Y182 HydrophobicContact CB-CE2 4.15Å; M145-C234 HydrophobicContact CE-CB 3.62Å
146	T	92.6	Very high	92.7	Very high	45 Å²	45	44.4 Å²	44.4	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-65.8	-24.7	175.5	60.5	0	0	0	0	113.5	K142 G143 Y182	K142-T146 WeakPolarHBondContact O-CG2 3.22Å; K142-T146 PolarHBondContact O-N 3.27Å; G143-T146 PolarHBondContact O-N 2.91Å; G143-T146 PolarHBondContact O-OG1 3.39Å; T146-Y182 HydrophobicContact CG2-CD1 3.42Å; T146-Y182 VanDerWaalsContact CG2-CD1 3.42Å; T146-Y182 HydrophobicContact CG2-CE1 3.41Å; T146-Y182 VanDerWaalsContact CG2-CE1 3.41Å; T146-Y182 HydrophobicContact CG2-CG 4.41Å
147	E	94	Very high	92.8	Very high	82 Å²	82	40 Å²	40	38%	0.383	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-1.2	-177.4	-70.5	-68.3	130.5	0	0	113.2	G143 L144 M145 T157 K184	G143-E147 WeakPolarHBondContact O-CG 3.27Å; G143-E147 PolarHBondContact O-N 3.16Å; L144-E147 PolarHBondContact O-N 3.38Å; M145-E147 PolarHBondContact O-N 3.44Å; E147-T157 HydrophobicContact CB-CG2 3.63Å; E147-K184 IonicContact OE1-NZ 3.66Å; E147-K184 PolarHBondContact OE1-NZ 2.87Å; E147-K184 IonicContact OE2-NZ 2.74Å; E147-K184 PolarHBondContact OE2-NZ 2.73Å
148	Y	94.5	Very high	92.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.			trans	-67.4	132.1	175.1	-178.7	-87.4	0	0	0	110.9	L144 M145 L151 S158 T161 A162 M165 W180 K184 F185 P202	L144-Y148 PolarHBondContact O-N 3.41Å; M145-Y148 WeakPolarHBondContact O-CB 3.47Å; M145-Y148 PolarHBondContact O-N 3.36Å; Y148-L151 PolarHBondContact OH-N 3.25Å; Y148-S158 WeakPolarHBondContact CE2-O 3.39Å; Y148-T161 HydrophobicContact CD2-CG2 4.13Å; Y148-A162 HydrophobicContact CE2-CB 4.31Å; Y148-M165 HydrophobicContact CD2-CE 4.16Å; Y148-M165 HydrophobicContact CE2-CE 4.36Å; Y148-W180 HydrophobicContact CD1-CZ2 4.31Å; Y148-W180 HydrophobicContact CG-CZ2 4.31Å; Y148-K184 CarbonylContact O-C 3.59Å; Y148-F185 AromaticContact CD1-CD2 3.97Å; Y148-F185 HydrophobicContact CD1-CD2 3.97Å; Y148-F185 AromaticContact CE1-CD2 3.95Å; Y148-F185 HydrophobicContact CE1-CD2 3.95Å; Y148-F185 HydrophobicContact CE1-CE2 4.13Å; Y148-F185 PolarHBondContact O-N 3.06Å; Y148-P202 HydrophobicContact CD1-CB 4.36Å; Y148-P202 HydrophobicContact CD1-CG 3.87Å; Y148-P202 HydrophobicContact CE1-CB 3.61Å; Y148-P202 HydrophobicContact CE1-CG 3.57Å
149	V	94.8	Very high	92.9	Very high	38 Å²	38	36.5 Å²	36.5	23%	0.23	20%	0.195	C	C	.	.			trans	-106.2	-70.8	177.3	-179.3	0	0	0	0	110.1	S158 K184 F185 D186	V149-S158 PolarHBondContact N-OG 3.43Å; V149-K184 WeakPolarHBondContact CA-O 3.31Å; V149-K184 HydrophobicContact CG2-CB 4.23Å; V149-F185 WeakPolarHBondContact O-CD2 3.39Å; V149-D186 HydrophobicContact CG1-CB 4.07Å; V149-D186 PolarHBondContact O-N 3.45Å
150	S	93.6	Very high	93	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.014	17%	0.171	C	C	.	.			trans	-170.5	163.1	180	60.1	0	0	0	0	109.4	R152 S153 S158	S150-R152 VanDerWaalsContact C-N 3.34Å; S150-S153 WeakPolarHBondContact O-CB 2.95Å; S150-S153 PolarHBondContact O-N 3.32Å; S150-S153 PolarHBondContact O-OG 3.43Å; S150-S153 PolarHBondContact OG-N 3.49Å; S150-S158 WeakPolarHBondContact O-CB 3.38Å
151	L	93.5	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-64.6	-41.4	172.6	-79.8	175.3	0	0	0	111.1	F49 V53 Y148 S153 G154 L159 A162 D189 Y191 I203 P204	F49-L151 HydrophobicContact CD1-CD1 4.16Å; F49-L151 HydrophobicContact CD1-CD2 3.97Å; F49-L151 HydrophobicContact CD2-CD2 4.38Å; F49-L151 HydrophobicContact CE1-CD1 4.25Å; F49-L151 HydrophobicContact CE1-CD2 4.15Å; F49-L151 HydrophobicContact CG-CD2 4.09Å; F49-L151 HydrophobicContact CZ-CD2 4.43Å; V53-L151 HydrophobicContact CG2-CB 3.84Å; V53-L151 HydrophobicContact CG2-CD1 4.43Å; Y148-L151 PolarHBondContact OH-N 3.25Å; L151-S153 PolarHBondContact O-N 3.22Å; L151-G154 PolarHBondContact O-N 2.88Å; L151-L159 HydrophobicContact CD2-CD2 4.3Å; L151-A162 HydrophobicContact CD2-CB 3.51Å; L151-A162 HydrophobicContact CG-CB 4.48Å; L151-D189 WeakPolarHBondContact CB-OD2 3.38Å; L151-D189 PolarHBondContact N-OD1 3.28Å; L151-D189 PolarHBondContact N-OD2 3.26Å; L151-Y191 HydrophobicContact CD1-CD2 3.65Å; L151-Y191 HydrophobicContact CD1-CE2 3.62Å; L151-I203 HydrophobicContact CD1-CB 4.19Å; L151-I203 HydrophobicContact CD1-CG2 4.36Å; L151-P204 HydrophobicContact CD1-CG 3.85Å; L151-P204 HydrophobicContact CD2-CG 4.09Å; L151-P204 HydrophobicContact CG-CG 3.93Å
152	R	92	Very high	93.2	Very high	122 Å²	122	29.2 Å²	29.2	46%	0.46	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-35.6	175.2	-179.5	-173.8	177.9	173.5	-2.1	113.2	S150 G154 D189 V190	S150-R152 VanDerWaalsContact C-N 3.34Å; R152-G154 PolarHBondContact O-N 3.06Å; R152-G154 VanDerWaalsContact O-N 3.14Å; R152-D189 VanDerWaalsContact CB-OD1 3.23Å; R152-D189 WeakPolarHBondContact CB-OD1 3.44Å; R152-D189 PolarHBondContact N-OD1 2.91Å; R152-V190 HydrophobicContact CG-CG2 4.49Å
153	S	90.8	Very high	93.3	Very high	36 Å²	36	24.6 Å²	24.6	25%	0.252	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.1	177.9	78.4	0	0	0	0	112.2	S150 L151 T155 S158	S150-S153 WeakPolarHBondContact O-CB 2.95Å; S150-S153 PolarHBondContact O-N 3.32Å; S150-S153 PolarHBondContact O-OG 3.43Å; S150-S153 PolarHBondContact OG-N 3.49Å; L151-S153 PolarHBondContact O-N 3.22Å; S153-T155 PolarHBondContact O-N 3.45Å; S153-T155 VanDerWaalsContact O-N 3.07Å; S153-T155 PolarHBondContact OG-N 3.18Å; S153-T155 PolarHBondContact OG-OG1 3.31Å; S153-S158 PolarHBondContact OG-OG 3.05Å
154	G	89.5	Confident	93.5	Very high	5 Å²	5	23.5 Å²	23.5	5%	0.052	13%	0.126	C	C	.	.			trans	57.9	18.9	-176.6	0	0	0	0	0	113.7	L151 R152	L151-G154 PolarHBondContact O-N 2.88Å; R152-G154 PolarHBondContact O-N 3.06Å; R152-G154 VanDerWaalsContact O-N 3.14Å
155	T	92.1	Very high	93.6	Very high	48 Å²	48	22.9 Å²	22.9	29%	0.294	12%	0.123	S	C	.	.			trans	-70.9	146.6	179.9	53.8	0	0	0	0	110.5	S153 T157 S158 L159	S153-T155 PolarHBondContact O-N 3.45Å; S153-T155 VanDerWaalsContact O-N 3.07Å; S153-T155 PolarHBondContact OG-N 3.18Å; S153-T155 PolarHBondContact OG-OG1 3.31Å; T155-T157 PolarHBondContact O-N 3.05Å; T155-T157 VanDerWaalsContact O-N 3.17Å; T155-S158 PolarHBondContact O-N 2.96Å; T155-S158 VanDerWaalsContact OG1-CB 3.23Å; T155-S158 WeakPolarHBondContact OG1-CB 3.35Å; T155-S158 PolarHBondContact OG1-N 3.37Å; T155-S158 PolarHBondContact OG1-OG 3.27Å; T155-L159 WeakPolarHBondContact O-CG 3.42Å; T155-L159 PolarHBondContact O-N 3.44Å
156	P	92	Very high	93.7	Very high	47 Å²	47	23.8 Å²	23.8	31%	0.305	13%	0.128	S	C	.	.	H	α-helix	trans	-50.5	-44.8	-179.5	-26.4	29.7	0	0	0	113.6	N62 V64 F160	N62-P156 WeakPolarHBondContact O-CG 3.33Å; V64-P156 HydrophobicContact CG2-CB 4.47Å; P156-F160 VanDerWaalsContact O-CB 3.31Å; P156-F160 WeakPolarHBondContact O-CB 3.42Å; P156-F160 PolarHBondContact O-N 2.95Å
157	T	93.4	Very high	93.8	Very high	32 Å²	32	26 Å²	26	20%	0.196	14%	0.137	C	C	.	.	H	α-helix	trans	-66.4	-45.1	179.3	-51.8	0	0	0	0	111.4	L144 E147 T155 L159 F160 T161	L144-T157 HydrophobicContact CB-CG2 4.48Å; L144-T157 HydrophobicContact CD2-CG2 3.94Å; E147-T157 HydrophobicContact CB-CG2 3.63Å; T155-T157 PolarHBondContact O-N 3.05Å; T155-T157 VanDerWaalsContact O-N 3.17Å; T157-L159 VanDerWaalsContact C-N 3.34Å; T157-L159 PolarHBondContact O-N 2.96Å; T157-F160 PolarHBondContact O-N 3.07Å; T157-T161 VanDerWaalsContact O-CB 3.23Å; T157-T161 WeakPolarHBondContact O-CB 3.39Å; T157-T161 PolarHBondContact O-N 3.44Å; T157-T161 PolarHBondContact O-OG1 2.84Å
158	S	94.6	Very high	93.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.8	-40.9	179.7	-59	0	0	0	0	111.8	Y148 V149 S150 S153 T155 A162	Y148-S158 WeakPolarHBondContact CE2-O 3.39Å; V149-S158 PolarHBondContact N-OG 3.43Å; S150-S158 WeakPolarHBondContact O-CB 3.38Å; S153-S158 PolarHBondContact OG-OG 3.05Å; T155-S158 PolarHBondContact O-N 2.96Å; T155-S158 VanDerWaalsContact OG1-CB 3.23Å; T155-S158 WeakPolarHBondContact OG1-CB 3.35Å; T155-S158 PolarHBondContact OG1-N 3.37Å; T155-S158 PolarHBondContact OG1-OG 3.27Å; S158-A162 WeakPolarHBondContact O-CB 3.3Å; S158-A162 PolarHBondContact O-N 3.22Å
159	L	94.4	Very high	93.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.1	-41.8	178.8	-62.3	-177.7	0	0	0	113	V46 Y60 V64 L151 T155 T157 S163	V46-L159 HydrophobicContact CG1-CD1 4.3Å; Y60-L159 HydrophobicContact CD1-CD1 3.89Å; Y60-L159 HydrophobicContact CD1-CD2 4.44Å; Y60-L159 HydrophobicContact CD2-CD1 4.36Å; Y60-L159 HydrophobicContact CD2-CD2 4.48Å; Y60-L159 HydrophobicContact CE1-CD1 3.85Å; Y60-L159 HydrophobicContact CE1-CD2 3.61Å; Y60-L159 HydrophobicContact CE1-CG 4.39Å; Y60-L159 HydrophobicContact CE2-CD1 4.34Å; Y60-L159 HydrophobicContact CE2-CD2 3.69Å; Y60-L159 HydrophobicContact CG-CD1 4.16Å; Y60-L159 WeakPolarHBondContact OH-CD2 3.5Å; V64-L159 HydrophobicContact CG2-CB 3.78Å; V64-L159 HydrophobicContact CG2-CD1 4.04Å; L151-L159 HydrophobicContact CD2-CD2 4.3Å; T155-L159 WeakPolarHBondContact O-CG 3.42Å; T155-L159 PolarHBondContact O-N 3.44Å; T157-L159 VanDerWaalsContact C-N 3.34Å; T157-L159 PolarHBondContact O-N 2.96Å; L159-S163 WeakPolarHBondContact O-CB 3.09Å; L159-S163 PolarHBondContact O-N 2.97Å; L159-S163 PolarHBondContact O-OG 3.13Å
160	F	94.5	Very high	93.9	Very high	13 Å²	13	26 Å²	26	6%	0.057	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-50.1	175.3	179.3	-88.3	0	0	0	111	L42 V64 L67 I68 I71 L144 P156 T157 A162 S163 V164 F238	L42-F160 HydrophobicContact CD1-CD2 3.48Å; L42-F160 VanDerWaalsContact CD1-CD2 3.48Å; L42-F160 HydrophobicContact CD1-CE2 3.9Å; L42-F160 HydrophobicContact CD1-CG 4.37Å; V64-F160 HydrophobicContact CG1-CB 4.5Å; L67-F160 HydrophobicContact CD2-CB 3.45Å; L67-F160 VanDerWaalsContact CD2-CB 3.45Å; L67-F160 HydrophobicContact CD2-CD1 3.78Å; L67-F160 HydrophobicContact CD2-CD2 4.15Å; L67-F160 HydrophobicContact CD2-CG 3.51Å; L67-F160 HydrophobicContact CG-CG 4.39Å; I68-F160 HydrophobicContact CG1-CD2 3.85Å; I68-F160 HydrophobicContact CG1-CE2 3.77Å; I71-F160 HydrophobicContact CD1-CE1 4.11Å; I71-F160 HydrophobicContact CD1-CE2 3.93Å; I71-F160 HydrophobicContact CD1-CZ 3.4Å; L144-F160 HydrophobicContact CD1-CD1 3.64Å; L144-F160 HydrophobicContact CD1-CE1 3.39Å; P156-F160 VanDerWaalsContact O-CB 3.31Å; P156-F160 WeakPolarHBondContact O-CB 3.42Å; P156-F160 PolarHBondContact O-N 2.95Å; T157-F160 PolarHBondContact O-N 3.07Å; F160-A162 VanDerWaalsContact C-N 3.33Å; F160-A162 PolarHBondContact O-N 3.25Å; F160-S163 WeakPolarHBondContact O-CB 3.41Å; F160-S163 PolarHBondContact O-N 3.1Å; F160-S163 VanDerWaalsContact O-N 3.08Å; F160-V164 HydrophobicContact CD1-CG2 4.06Å; F160-V164 HydrophobicContact CE1-CG2 3.61Å; F160-V164 HydrophobicContact CZ-CG2 3.93Å; F160-V164 WeakPolarHBondContact O-CG2 3.24Å; F160-V164 PolarHBondContact O-N 2.93Å; F160-F238 HydrophobicContact CE1-CE2 4.46Å; F160-F238 HydrophobicContact CZ-CE2 4.34Å
161	T	94.3	Very high	93.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.7	-41.6	179.7	-56.5	0	0	0	0	111	L144 M145 Y148 T157 S163 V164 M165	L144-T161 PolarHBondContact O-OG1 3.33Å; M145-T161 HydrophobicContact CE-CG2 3.52Å; M145-T161 HydrophobicContact CG-CG2 4.17Å; M145-T161 HydrophobicContact SD-CG2 3.29Å; M145-T161 WeakPolarHBondContact SD-CG2 3.19Å; Y148-T161 HydrophobicContact CD2-CG2 4.13Å; T157-T161 VanDerWaalsContact O-CB 3.23Å; T157-T161 WeakPolarHBondContact O-CB 3.39Å; T157-T161 PolarHBondContact O-N 3.44Å; T157-T161 PolarHBondContact O-OG1 2.84Å; T161-S163 VanDerWaalsContact C-N 3.34Å; T161-S163 PolarHBondContact O-N 3.16Å; T161-V164 PolarHBondContact O-N 2.95Å; T161-M165 HydrophobicContact CG2-CE 3.45Å; T161-M165 VanDerWaalsContact CG2-CE 3.45Å; T161-M165 WeakPolarHBondContact O-CG 3.4Å; T161-M165 PolarHBondContact O-N 2.81Å
162	A	95.7	Very high	93.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.3	-43.6	172.1	0	0	0	0	0	112.4	F49 Y148 L151 S158 F160 V164 M165 V166 P204	F49-A162 HydrophobicContact CE2-CB 3.85Å; F49-A162 HydrophobicContact CZ-CB 3.85Å; Y148-A162 HydrophobicContact CE2-CB 4.31Å; L151-A162 HydrophobicContact CD2-CB 3.51Å; L151-A162 HydrophobicContact CG-CB 4.48Å; S158-A162 WeakPolarHBondContact O-CB 3.3Å; S158-A162 PolarHBondContact O-N 3.22Å; F160-A162 VanDerWaalsContact C-N 3.33Å; F160-A162 PolarHBondContact O-N 3.25Å; A162-V164 VanDerWaalsContact C-N 3.32Å; A162-V164 PolarHBondContact O-N 3.21Å; A162-M165 PolarHBondContact O-N 2.92Å; A162-V166 PolarHBondContact O-N 3.46Å; A162-V166 VanDerWaalsContact O-N 3.1Å; A162-P204 HydrophobicContact CB-CB 4.04Å; A162-P204 HydrophobicContact CB-CG 3.41Å; A162-P204 VanDerWaalsContact CB-CG 3.41Å
163	S	95.2	Very high	93.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-42.3	177.4	-58.5	0	0	0	0	111.1	L159 F160 T161 V166 M167	L159-S163 WeakPolarHBondContact O-CB 3.09Å; L159-S163 PolarHBondContact O-N 2.97Å; L159-S163 PolarHBondContact O-OG 3.13Å; F160-S163 WeakPolarHBondContact O-CB 3.41Å; F160-S163 PolarHBondContact O-N 3.1Å; F160-S163 VanDerWaalsContact O-N 3.08Å; T161-S163 VanDerWaalsContact C-N 3.34Å; T161-S163 PolarHBondContact O-N 3.16Å; S163-V166 PolarHBondContact O-N 2.97Å; S163-M167 VanDerWaalsContact O-CB 3.25Å; S163-M167 WeakPolarHBondContact O-CB 3.43Å; S163-M167 WeakPolarHBondContact O-CG 3.4Å; S163-M167 PolarHBondContact O-N 2.87Å
164	V	94.9	Very high	92.8	Very high	11 Å²	11	21.8 Å²	21.8	7%	0.067	13%	0.125	C	C	.	.	H	α-helix	trans	-61.2	-47.1	175.4	173.4	0	0	0	0	111.2	I141 F160 T161 A162 V166 M167 L168 F238	I141-V164 HydrophobicContact CD1-CB 4.46Å; I141-V164 HydrophobicContact CD1-CG1 4Å; I141-V164 HydrophobicContact CD1-CG2 4.38Å; F160-V164 HydrophobicContact CD1-CG2 4.06Å; F160-V164 HydrophobicContact CE1-CG2 3.61Å; F160-V164 HydrophobicContact CZ-CG2 3.93Å; F160-V164 WeakPolarHBondContact O-CG2 3.24Å; F160-V164 PolarHBondContact O-N 2.93Å; T161-V164 PolarHBondContact O-N 2.95Å; A162-V164 VanDerWaalsContact C-N 3.32Å; A162-V164 PolarHBondContact O-N 3.21Å; V164-V166 VanDerWaalsContact C-N 3.35Å; V164-V166 PolarHBondContact O-N 3.11Å; V164-M167 PolarHBondContact O-N 3.17Å; V164-L168 HydrophobicContact CG1-CD1 3.77Å; V164-L168 HydrophobicContact CG1-CG 4.35Å; V164-L168 WeakPolarHBondContact O-CB 3.41Å; V164-L168 WeakPolarHBondContact O-CG 3.47Å; V164-L168 PolarHBondContact O-N 3.02Å; V164-F238 HydrophobicContact CG1-CD2 3.78Å; V164-F238 HydrophobicContact CG1-CE2 4.48Å; V164-F238 HydrophobicContact CG2-CD2 4.2Å; V164-F238 HydrophobicContact CG2-CE2 4.11Å
165	M	95.7	Very high	91.8	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.3	-46.1	179.7	-72.5	-174.1	-132.1	0	0	112.3	M145 Y148 T161 A162 N169 C170 W180 P202 P204	M145-M165 HydrophobicContact CE-CE 4.34Å; M145-M165 HydrophobicContact CE-CG 4.11Å; M145-M165 HydrophobicContact SD-CE 3.74Å; Y148-M165 HydrophobicContact CD2-CE 4.16Å; Y148-M165 HydrophobicContact CE2-CE 4.36Å; T161-M165 HydrophobicContact CG2-CE 3.45Å; T161-M165 VanDerWaalsContact CG2-CE 3.45Å; T161-M165 WeakPolarHBondContact O-CG 3.4Å; T161-M165 PolarHBondContact O-N 2.81Å; A162-M165 PolarHBondContact O-N 2.92Å; M165-N169 WeakPolarHBondContact O-CA 3.37Å; M165-N169 PolarHBondContact O-N 3.4Å; M165-C170 WeakPolarHBondContact CA-O 3.37Å; M165-C170 VanDerWaalsContact CB-O 3.3Å; M165-C170 WeakPolarHBondContact CB-O 3.26Å; M165-C170 PolarHBondContact O-N 3.32Å; M165-W180 HydrophobicContact CE-CH2 3.39Å; M165-W180 HydrophobicContact CE-CZ2 3.95Å; M165-W180 HydrophobicContact CE-CZ3 4.22Å; M165-W180 HydrophobicContact SD-CH2 4.05Å; M165-W180 HydrophobicContact SD-CZ3 4.34Å; M165-P202 HydrophobicContact CE-CB 4.29Å; M165-P202 HydrophobicContact CE-CG 4.17Å; M165-P202 HydrophobicContact SD-CB 4.26Å; M165-P202 HydrophobicContact SD-CG 4.45Å; M165-P204 HydrophobicContact CB-CB 3.95Å; M165-P204 HydrophobicContact SD-CB 4.12Å
166	V	96	Very high	90.2	Very high	18 Å²	18	26.1 Å²	26.1	11%	0.109	14%	0.144	C	C	.	.	H	α-helix	trans	-73.9	-45.4	-179.5	-177.5	0	0	0	0	111.8	F49 A162 S163 V164 L168 N169 P204 M208 L212	F49-V166 HydrophobicContact CE1-CG2 4.22Å; F49-V166 HydrophobicContact CZ-CG2 3.78Å; A162-V166 PolarHBondContact O-N 3.46Å; A162-V166 VanDerWaalsContact O-N 3.1Å; S163-V166 PolarHBondContact O-N 2.97Å; V164-V166 VanDerWaalsContact C-N 3.35Å; V164-V166 PolarHBondContact O-N 3.11Å; V166-L168 VanDerWaalsContact C-N 3.29Å; V166-L168 PolarHBondContact O-N 3.11Å; V166-N169 PolarHBondContact O-N 3.39Å; V166-P204 HydrophobicContact CG2-CB 3.96Å; V166-M208 HydrophobicContact CG1-CB 4.43Å; V166-M208 HydrophobicContact CG1-SD 4.41Å; V166-M208 HydrophobicContact CG2-SD 3.71Å; V166-L212 HydrophobicContact CB-CD2 4.35Å; V166-L212 HydrophobicContact CG1-CD2 3.52Å
167	M	94.7	Very high	88.7	Confident	91 Å²	91	30 Å²	30	45%	0.448	16%	0.158	S	C	.	.	H	α-helix	trans	-62.3	-37.1	-178.7	-74.3	-175.8	177	0	0	112.6	L42 T45 S163 V164	L42-M167 HydrophobicContact CD2-CE 3.29Å; L42-M167 HydrophobicContact CD2-SD 3.61Å; T45-M167 HydrophobicContact CG2-CE 4.18Å; T45-M167 WeakPolarHBondContact OG1-CE 3.41Å; S163-M167 VanDerWaalsContact O-CB 3.25Å; S163-M167 WeakPolarHBondContact O-CB 3.43Å; S163-M167 WeakPolarHBondContact O-CG 3.4Å; S163-M167 PolarHBondContact O-N 2.87Å; V164-M167 PolarHBondContact O-N 3.17Å
168	L	95.2	Very high	87.5	Confident	38 Å²	38	31.1 Å²	31.1	20%	0.199	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	5.3	-177.4	-55.7	-175.7	0	0	0	113.3	V164 V166 C170 P237 F238 E241	V164-L168 HydrophobicContact CG1-CD1 3.77Å; V164-L168 HydrophobicContact CG1-CG 4.35Å; V164-L168 WeakPolarHBondContact O-CB 3.41Å; V164-L168 WeakPolarHBondContact O-CG 3.47Å; V164-L168 PolarHBondContact O-N 3.02Å; V166-L168 VanDerWaalsContact C-N 3.29Å; V166-L168 PolarHBondContact O-N 3.11Å; L168-C170 VanDerWaalsContact C-N 3.26Å; L168-C170 PolarHBondContact O-N 3.15Å; L168-P237 HydrophobicContact CB-CB 4.18Å; L168-P237 HydrophobicContact CD1-CB 4.26Å; L168-F238 VanDerWaalsContact CD1-CA 3.49Å; L168-F238 HydrophobicContact CD1-CB 3.9Å; L168-F238 HydrophobicContact CD1-CD2 4.2Å; L168-E241 HydrophobicContact CD2-CB 4.11Å; L168-E241 HydrophobicContact CD2-CG 4.04Å
169	N	95.1	Very high	86.7	Confident	82 Å²	82	33 Å²	33	44%	0.439	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	48.8	-176.9	-68.3	-63.9	0	0	0	113.2	M165 V166 N229	M165-N169 WeakPolarHBondContact O-CA 3.37Å; M165-N169 PolarHBondContact O-N 3.4Å; V166-N169 PolarHBondContact O-N 3.39Å; N169-N229 WeakPolarHBondContact CA-ND2 3.31Å; N169-N229 WeakPolarHBondContact O-CB 3.38Å
170	C	94.8	Very high	86.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.186	C	C	.	.			trans	-130.6	165.4	-176	67.3	0	0	0	0	110.5	M165 L168 I232 C234 P237	M165-C170 WeakPolarHBondContact CA-O 3.37Å; M165-C170 VanDerWaalsContact CB-O 3.3Å; M165-C170 WeakPolarHBondContact CB-O 3.26Å; M165-C170 PolarHBondContact O-N 3.32Å; L168-C170 VanDerWaalsContact C-N 3.26Å; L168-C170 PolarHBondContact O-N 3.15Å; C170-I232 CarbonylContact C-O 3.58Å; C170-I232 WeakPolarHBondContact CA-O 3.46Å; C170-I232 HydrophobicContact CB-CG2 4.1Å; C170-C234 HydrophobicContact CB-CB 3.9Å; C170-C234 WeakPolarHBondContact CB-SG 3.32Å; C170-C234 WeakPolarHBondContact SG-CA 3.28Å; C170-C234 WeakPolarHBondContact SG-CB 3.35Å; C170-C234 CovalentContact SG-SG 2.03Å; C170-C234 PolarHBondContact SG-SG 3.15Å; C170-P237 HydrophobicContact CB-CG 4.49Å
171	C	93.8	Very high	85.5	Confident	6 Å²	6	41.2 Å²	41.2	4%	0.041	22%	0.218	C	C	.	.			trans	-143.5	127	178	-178.7	0	0	0	0	110.5	C205 N229 I232 C234	C171-C205 HydrophobicContact CB-CB 3.67Å; C171-C205 WeakPolarHBondContact CB-SG 3.4Å; C171-C205 WeakPolarHBondContact SG-CB 2.79Å; C171-C205 CovalentContact SG-SG 2.03Å; C171-C205 PolarHBondContact SG-SG 3.45Å; C171-N229 HydrophobicContact CB-CB 4.41Å; C171-N229 WeakPolarHBondContact CB-O 3.34Å; C171-I232 PolarHBondContact N-O 3.4Å; C171-C234 PolarHBondContact N-SG 3.41Å
172	G	90.3	Very high	85.1	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.01	23%	0.226	C	C	.	.	S	Bend	trans	74.7	167.6	175.7	0	0	0	0	0	113.8	W180 C234	G172-W180 VanDerWaalsContact N-CZ3 3.31Å; G172-C234 VanDerWaalsContact O-CB 3.28Å; G172-C234 WeakPolarHBondContact O-CB 3.38Å; G172-C234 PolarHBondContact O-N 3.3Å
173	A	84.1	Confident	84.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-76.2	-43.8	-179.5	0	0	0	0	0	112.3	K142 M145 Y182 S233 D235	K142-A173 HydrophobicContact CB-CB 3.81Å; K142-A173 HydrophobicContact CG-CB 3.75Å; M145-A173 HydrophobicContact CB-CB 3.99Å; M145-A173 HydrophobicContact CG-CB 3.95Å; A173-Y182 VanDerWaalsContact CB-OH 3.26Å; A173-Y182 WeakPolarHBondContact CB-OH 3.25Å; A173-S233 WeakPolarHBondContact O-CB 3.2Å; A173-D235 WeakPolarHBondContact O-CB 3.02Å; A173-D235 PolarHBondContact O-N 3.09Å
174	T	79.5	Confident	84.7	Confident	66 Å²	66	54.1 Å²	54.1	41%	0.405	29%	0.286	S	S	.	.	S	Bend	trans	-119.9	152.9	-177.5	52.1	0	0	0	0	109.2	S176 S233	T174-S176 PolarHBondContact O-N 3.15Å; T174-S233 VanDerWaalsContact C-CB 3.5Å
175	H	67.7	Low	84.7	Confident	110 Å²	110	54.9 Å²	54.9	51%	0.509	29%	0.289	S	S	.	.			trans	-58.4	108.2	179.2	-175.6	42.3	0	0	0	109.7	G231	H175-G231 PolarHBondContact CE1-O 2.83Å; H175-G231 PolarHBondContact ND1-O 2.86Å
176	S	59.3	Low	84.6	Confident	33 Å²	33	57.9 Å²	57.9	23%	0.231	31%	0.305	C	S	.	.			trans	-139.8	104.3	173.2	71.7	0	0	0	0	108.5	T174 S178	T174-S176 PolarHBondContact O-N 3.15Å; S176-S178 PolarHBondContact O-N 3.02Å; S176-S178 PolarHBondContact OG-O 3.07Å
177	Q	59.8	Low	84.5	Confident	129 Å²	129	59.8 Å²	59.8	60%	0.603	32%	0.317	S	S	*	.	S	Bend	trans	-64	-14.7	164.7	-61.2	-177.2	7.6	0	0	111.3
178	S	68	Low	84.5	Confident	56 Å²	56	57.1 Å²	57.1	39%	0.392	31%	0.306	S	S	.	.	S	Bend	trans	-80.2	157.9	176	65.6	0	0	0	0	112.8	S176 Q201	S176-S178 PolarHBondContact O-N 3.02Å; S176-S178 PolarHBondContact OG-O 3.07Å; S178-Q201 VanDerWaalsContact C-NE2 3.3Å; S178-Q201 PolarHBondContact O-NE2 3.36Å
179	A	77.9	Confident	84.4	Confident	40 Å²	40	55.3 Å²	55.3	33%	0.331	30%	0.297	S	S	.	.			trans	-40.3	147.9	175.1	0	0	0	0	0	114.6	K181 N200	A179-K181 WeakPolarHBondContact O-CG 3.44Å; A179-K181 PolarHBondContact O-N 3.28Å; A179-N200 CarbonylContact C-O 3.44Å; A179-N200 WeakPolarHBondContact CA-O 3.42Å; A179-N200 HydrophobicContact CB-CB 3.92Å
180	W	83.8	Confident	84.3	Confident	15 Å²	15	51.7 Å²	51.7	6%	0.057	28%	0.278	C	S	.	.			trans	-64.2	99.1	174.3	-161	-90.4	0	0	0	110.4	M145 Y148 M165 G172 Y182 F185 N200 Q201 P202	M145-W180 HydrophobicContact CB-CZ2 4.38Å; M145-W180 HydrophobicContact SD-CH2 3.63Å; M145-W180 HydrophobicContact SD-CZ2 4.17Å; Y148-W180 HydrophobicContact CD1-CZ2 4.31Å; Y148-W180 HydrophobicContact CG-CZ2 4.31Å; M165-W180 HydrophobicContact CE-CH2 3.39Å; M165-W180 HydrophobicContact CE-CZ2 3.95Å; M165-W180 HydrophobicContact CE-CZ3 4.22Å; M165-W180 HydrophobicContact SD-CH2 4.05Å; M165-W180 HydrophobicContact SD-CZ3 4.34Å; G172-W180 VanDerWaalsContact N-CZ3 3.31Å; W180-Y182 VanDerWaalsContact C-N 3.29Å; W180-Y182 AromaticContact CD1-CD2 3.68Å; W180-Y182 AromaticContact CD2-CD2 3.87Å; W180-Y182 HydrophobicContact CD2-CD2 3.87Å; W180-Y182 HydrophobicContact CD2-CE2 4.3Å; W180-Y182 AromaticContact CE2-CD2 3.45Å; W180-Y182 VanDerWaalsContact CE2-CD2 3.45Å; W180-Y182 HydrophobicContact CG-CD2 4.05Å; W180-Y182 AromaticContact CZ2-CD2 3.88Å; W180-Y182 HydrophobicContact CZ2-CD2 3.88Å; W180-Y182 HydrophobicContact CZ2-CE2 4.11Å; W180-Y182 AromaticContact NE1-CD2 3.37Å; W180-Y182 PolarHBondContact O-N 2.91Å; W180-F185 HydrophobicContact CB-CD1 3.93Å; W180-F185 HydrophobicContact CB-CE1 4.04Å; W180-F185 HydrophobicContact CB-CG 4.34Å; W180-F185 AromaticContact CD1-CD1 3.73Å; W180-F185 AromaticContact CD1-CD2 3.74Å; W180-F185 AromaticContact CD1-CG 3.3Å; W180-F185 HydrophobicContact CG-CB 4.42Å; W180-F185 HydrophobicContact CG-CD1 4.14Å; W180-F185 HydrophobicContact CG-CD2 4.34Å; W180-F185 HydrophobicContact CG-CG 4.04Å; W180-F185 AromaticContact NE1-CG 3.92Å; W180-N200 VanDerWaalsContact CB-O 3.31Å; W180-N200 WeakPolarHBondContact CB-O 3.36Å; W180-N200 PolarHBondContact N-O 3Å; W180-Q201 VanDerWaalsContact CE3-OE1 3.31Å; W180-P202 HydrophobicContact CD2-CG 3.55Å; W180-P202 HydrophobicContact CE3-CG 3.59Å; W180-P202 HydrophobicContact CG-CG 4.23Å; W180-P202 HydrophobicContact CH2-CG 3.75Å; W180-P202 HydrophobicContact CZ2-CG 3.73Å; W180-P202 HydrophobicContact CZ3-CG 3.65Å
181	K	80.6	Confident	84.2	Confident	170 Å²	170	51.7 Å²	51.7	74%	0.739	28%	0.278	S	S	*	.			trans	-88.7	13.3	-174.6	-73.1	172.2	-173.8	-179.2	0	113.9	A179	A179-K181 WeakPolarHBondContact O-CG 3.44Å; A179-K181 PolarHBondContact O-N 3.28Å
182	Y	85.8	Confident	84.2	Confident	42 Å²	42	54.7 Å²	54.7	17%	0.165	29%	0.293	C	S	.	.			trans	-78.5	131.5	-176.8	-63.6	-63.9	0	0	0	111.1	M145 T146 A173 W180 K184 F185	M145-Y182 HydrophobicContact CB-CE2 4.15Å; T146-Y182 HydrophobicContact CG2-CD1 3.42Å; T146-Y182 VanDerWaalsContact CG2-CD1 3.42Å; T146-Y182 HydrophobicContact CG2-CE1 3.41Å; T146-Y182 VanDerWaalsContact CG2-CE1 3.41Å; T146-Y182 HydrophobicContact CG2-CG 4.41Å; A173-Y182 VanDerWaalsContact CB-OH 3.26Å; A173-Y182 WeakPolarHBondContact CB-OH 3.25Å; W180-Y182 VanDerWaalsContact C-N 3.29Å; W180-Y182 AromaticContact CD1-CD2 3.68Å; W180-Y182 AromaticContact CD2-CD2 3.87Å; W180-Y182 HydrophobicContact CD2-CD2 3.87Å; W180-Y182 HydrophobicContact CD2-CE2 4.3Å; W180-Y182 AromaticContact CE2-CD2 3.45Å; W180-Y182 VanDerWaalsContact CE2-CD2 3.45Å; W180-Y182 HydrophobicContact CG-CD2 4.05Å; W180-Y182 AromaticContact CZ2-CD2 3.88Å; W180-Y182 HydrophobicContact CZ2-CD2 3.88Å; W180-Y182 HydrophobicContact CZ2-CE2 4.11Å; W180-Y182 AromaticContact NE1-CD2 3.37Å; W180-Y182 PolarHBondContact O-N 2.91Å; Y182-K184 PolarHBondContact O-N 3.32Å; Y182-K184 VanDerWaalsContact O-N 3.08Å; Y182-F185 WeakPolarHBondContact O-CB 3.37Å; Y182-F185 PolarHBondContact O-N 3.27Å; Y182-F185 VanDerWaalsContact O-N 3.13Å
183	P	87.7	Confident	84.1	Confident	129 Å²	129	60.3 Å²	60.3	84%	0.838	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.9	-167.3	-27.1	34.5	0	0	0	116.3
184	K	94.2	Very high	84.5	Confident	100 Å²	100	63.8 Å²	63.8	44%	0.435	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-9.9	-176.4	-72.2	-175	170.3	168.2	0	113.8	E147 Y148 V149 Y182 D186	E147-K184 IonicContact OE1-NZ 3.66Å; E147-K184 PolarHBondContact OE1-NZ 2.87Å; E147-K184 IonicContact OE2-NZ 2.74Å; E147-K184 PolarHBondContact OE2-NZ 2.73Å; Y148-K184 CarbonylContact O-C 3.59Å; V149-K184 WeakPolarHBondContact CA-O 3.31Å; V149-K184 HydrophobicContact CG2-CB 4.23Å; Y182-K184 PolarHBondContact O-N 3.32Å; Y182-K184 VanDerWaalsContact O-N 3.08Å; K184-D186 PolarHBondContact O-N 2.71Å
185	F	94.7	Very high	85.2	Confident	27 Å²	27	65.6 Å²	65.6	12%	0.118	35%	0.347	C	S	.	.			trans	-65.2	126	-177.4	174.6	-119.5	0	0	0	111	Y148 V149 W180 Y182 P187 I199 P202	Y148-F185 AromaticContact CD1-CD2 3.97Å; Y148-F185 HydrophobicContact CD1-CD2 3.97Å; Y148-F185 AromaticContact CE1-CD2 3.95Å; Y148-F185 HydrophobicContact CE1-CD2 3.95Å; Y148-F185 HydrophobicContact CE1-CE2 4.13Å; Y148-F185 PolarHBondContact O-N 3.06Å; V149-F185 WeakPolarHBondContact O-CD2 3.39Å; W180-F185 HydrophobicContact CB-CD1 3.93Å; W180-F185 HydrophobicContact CB-CE1 4.04Å; W180-F185 HydrophobicContact CB-CG 4.34Å; W180-F185 AromaticContact CD1-CD1 3.73Å; W180-F185 AromaticContact CD1-CD2 3.74Å; W180-F185 AromaticContact CD1-CG 3.3Å; W180-F185 HydrophobicContact CG-CB 4.42Å; W180-F185 HydrophobicContact CG-CD1 4.14Å; W180-F185 HydrophobicContact CG-CD2 4.34Å; W180-F185 HydrophobicContact CG-CG 4.04Å; W180-F185 AromaticContact NE1-CG 3.92Å; Y182-F185 WeakPolarHBondContact O-CB 3.37Å; Y182-F185 PolarHBondContact O-N 3.27Å; Y182-F185 VanDerWaalsContact O-N 3.13Å; F185-P187 HydrophobicContact CE1-CB 4.34Å; F185-I199 WeakPolarHBondContact CE1-O 3.31Å; F185-I199 HydrophobicContact CZ-CD1 4.45Å; F185-I199 HydrophobicContact CZ-CG1 4.15Å; F185-P202 HydrophobicContact CD2-CG 4.44Å; F185-P202 HydrophobicContact CE2-CG 4.08Å
186	D	94.4	Very high	86.5	Confident	63 Å²	63	61.2 Å²	61.2	34%	0.337	33%	0.326	S	S	.	.			trans	-92.9	115.7	172.6	-172.8	-11.1	0	0	0	108.2	V149 K184 T188	V149-D186 HydrophobicContact CG1-CB 4.07Å; V149-D186 PolarHBondContact O-N 3.45Å; K184-D186 PolarHBondContact O-N 2.71Å; D186-T188 PolarHBondContact O-N 2.64Å; D186-T188 WeakPolarHBondContact OD1-CB 3.44Å; D186-T188 PolarHBondContact OD1-N 3.37Å
187	P	93.2	Very high	88.1	Confident	57 Å²	57	66 Å²	66	37%	0.37	35%	0.348	S	S	.	.	S	Bend	trans	-72.3	7.9	177.1	34	-37.7	0	0	0	112.6	F185 I197 G198 I199	F185-P187 HydrophobicContact CE1-CB 4.34Å; P187-I197 CarbonylContact O-C 3.56Å; P187-G198 PolarHBondContact O-N 2.94Å; P187-I199 VanDerWaalsContact CB-O 3.31Å; P187-I199 WeakPolarHBondContact CB-O 3.25Å; P187-I199 WeakPolarHBondContact O-CG1 3.47Å; P187-I199 PolarHBondContact O-N 3.43Å
188	T	94.2	Very high	89.6	Confident	35 Å²	35	62.6 Å²	62.6	22%	0.215	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.8	170.7	-50.3	0	0	0	0	110.4	D186 I195 Y196 I197	D186-T188 PolarHBondContact O-N 2.64Å; D186-T188 WeakPolarHBondContact OD1-CB 3.44Å; D186-T188 PolarHBondContact OD1-N 3.37Å; T188-I195 HydrophobicContact CG2-CG2 4.15Å; T188-Y196 VanDerWaalsContact CA-O 3.28Å; T188-Y196 WeakPolarHBondContact CA-O 3.47Å; T188-I197 HydrophobicContact CG2-CG1 4.27Å
189	D	93.6	Very high	90.8	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	164.1	177.8	-151	-12.6	0	0	0	110.5	L151 R152 Y196 I199 I203	L151-D189 WeakPolarHBondContact CB-OD2 3.38Å; L151-D189 PolarHBondContact N-OD1 3.28Å; L151-D189 PolarHBondContact N-OD2 3.26Å; R152-D189 VanDerWaalsContact CB-OD1 3.23Å; R152-D189 WeakPolarHBondContact CB-OD1 3.44Å; R152-D189 PolarHBondContact N-OD1 2.91Å; D189-Y196 PolarHBondContact N-O 3.41Å; D189-Y196 PolarHBondContact O-N 3.11Å; D189-I199 HydrophobicContact CB-CD1 3.89Å; D189-I203 HydrophobicContact CB-CD1 3.77Å; D189-I203 HydrophobicContact CB-CG1 4.31Å
190	V	92.7	Very high	91.5	Very high	7 Å²	7	62 Å²	62	4%	0.042	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	124.6	-179.3	-176.4	0	0	0	0	109.8	V54 R152 I194 I195	V54-V190 WeakPolarHBondContact O-CG1 3.47Å; R152-V190 HydrophobicContact CG-CG2 4.49Å; V190-I194 WeakPolarHBondContact CA-O 3.36Å; V190-I195 HydrophobicContact CG2-CB 4.35Å; V190-I195 HydrophobicContact CG2-CG1 3.99Å; V190-I195 HydrophobicContact CG2-CG2 4.22Å
191	Y	93.8	Very high	91.9	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	134.9	-178.3	-153.8	-97.4	0	0	0	109.5	F49 H52 V53 L151 N193 I194 I203 M208 L212 I214	F49-Y191 HydrophobicContact CD1-CE2 4.11Å; H52-Y191 HydrophobicContact CB-CD1 4.14Å; H52-Y191 HydrophobicContact CB-CD2 3.94Å; H52-Y191 HydrophobicContact CB-CE1 3.7Å; H52-Y191 HydrophobicContact CB-CE2 3.48Å; H52-Y191 VanDerWaalsContact CB-CE2 3.48Å; H52-Y191 HydrophobicContact CB-CG 4.24Å; H52-Y191 AromaticContact CG-CE1 3.87Å; H52-Y191 AromaticContact CG-CZ 3.69Å; H52-Y191 CarbonylContact O-C 3.54Å; H52-Y191 WeakPolarHBondContact O-CA 3.5Å; V53-Y191 HydrophobicContact CG2-CD2 4.1Å; V53-Y191 HydrophobicContact CG2-CE2 4.42Å; L151-Y191 HydrophobicContact CD1-CD2 3.65Å; L151-Y191 HydrophobicContact CD1-CE2 3.62Å; Y191-N193 VanDerWaalsContact C-N 3.29Å; Y191-N193 PolarHBondContact O-N 3.08Å; Y191-I194 PolarHBondContact N-O 3.48Å; Y191-I194 WeakPolarHBondContact O-CB 3.45Å; Y191-I194 PolarHBondContact O-N 3.28Å; Y191-I203 HydrophobicContact CD1-CG2 4.26Å; Y191-I203 HydrophobicContact CD2-CG2 4.05Å; Y191-I203 HydrophobicContact CE2-CG2 4.42Å; Y191-I203 HydrophobicContact CG-CD1 4.31Å; Y191-I203 HydrophobicContact CG-CG2 3.96Å; Y191-M208 HydrophobicContact CE1-CE 4.37Å; Y191-L212 WeakPolarHBondContact CE1-O 3.05Å; Y191-L212 WeakPolarHBondContact OH-CB 3.18Å; Y191-L212 PolarHBondContact OH-O 3.46Å; Y191-I214 HydrophobicContact CD1-CD1 4.12Å; Y191-I214 HydrophobicContact CD1-CG1 4.42Å; Y191-I214 HydrophobicContact CE1-CD1 4.42Å; Y191-I214 HydrophobicContact CE1-CG1 4.24Å
192	D	92.4	Very high	92.6	Very high	68 Å²	68	53.3 Å²	53.3	36%	0.364	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	42.2	-177.3	-75.2	-44	0	0	0	114.5	H52 I194	H52-D192 IonicContact CE1-OD1 3.37Å; H52-D192 IonicContact CG-OD1 2.96Å; H52-D192 VanDerWaalsContact ND1-CG 3.33Å; H52-D192 IonicContact ND1-OD1 3.83Å; H52-D192 PolarHBondContact ND1-OD1 3.49Å; H52-D192 IonicContact ND1-OD2 3.51Å; H52-D192 PolarHBondContact ND1-OD2 3.48Å; H52-D192 PolarHBondContact O-N 3.46Å; D192-I194 PolarHBondContact O-N 2.91Å; D192-I194 VanDerWaalsContact O-N 3.15Å
193	N	89.6	Confident	93.1	Very high	120 Å²	120	51.3 Å²	51.3	64%	0.642	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	12.5	-173.9	-61.2	-44.7	0	0	0	114.8	V54 Y191	V54-N193 WeakPolarHBondContact CB-OD1 3.5Å; V54-N193 VanDerWaalsContact CG1-OD1 3.25Å; V54-N193 WeakPolarHBondContact CG1-OD1 3.35Å; V54-N193 WeakPolarHBondContact CG2-OD1 2.98Å; Y191-N193 VanDerWaalsContact C-N 3.29Å; Y191-N193 PolarHBondContact O-N 3.08Å
194	I	92.4	Very high	93.4	Very high	73 Å²	73	45.2 Å²	45.2	37%	0.374	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128	175.8	-58.8	170	0	0	0	108.8	V190 Y191 D192 Y196	V190-I194 WeakPolarHBondContact CA-O 3.36Å; Y191-I194 PolarHBondContact N-O 3.48Å; Y191-I194 WeakPolarHBondContact O-CB 3.45Å; Y191-I194 PolarHBondContact O-N 3.28Å; D192-I194 PolarHBondContact O-N 2.91Å; D192-I194 VanDerWaalsContact O-N 3.15Å; I194-Y196 HydrophobicContact CB-CD2 4.41Å; I194-Y196 HydrophobicContact CB-CE1 4.49Å; I194-Y196 HydrophobicContact CB-CE2 3.74Å; I194-Y196 HydrophobicContact CG2-CD1 4.12Å; I194-Y196 HydrophobicContact CG2-CD2 4.16Å; I194-Y196 HydrophobicContact CG2-CE1 3.71Å; I194-Y196 HydrophobicContact CG2-CE2 3.75Å; I194-Y196 HydrophobicContact CG2-CG 4.35Å; I194-Y196 WeakPolarHBondContact O-CD2 3.3Å
195	I	93.5	Very high	93.5	Very high	104 Å²	104	40.4 Å²	40.4	53%	0.533	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	112.6	171.9	-50.7	-177.9	0	0	0	107.8	T188 V190 I197	T188-I195 HydrophobicContact CG2-CG2 4.15Å; V190-I195 HydrophobicContact CG2-CB 4.35Å; V190-I195 HydrophobicContact CG2-CG1 3.99Å; V190-I195 HydrophobicContact CG2-CG2 4.22Å; I195-I197 HydrophobicContact CG2-CD1 4.49Å; I195-I197 HydrophobicContact CG2-CG1 4.07Å
196	Y	94	Very high	93.6	Very high	17 Å²	17	39.2 Å²	39.2	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.5	174.8	-62.2	-81.3	0	0	0	109.2	T188 D189 I194 I203 P220 Y221	T188-Y196 VanDerWaalsContact CA-O 3.28Å; T188-Y196 WeakPolarHBondContact CA-O 3.47Å; D189-Y196 PolarHBondContact N-O 3.41Å; D189-Y196 PolarHBondContact O-N 3.11Å; I194-Y196 HydrophobicContact CB-CD2 4.41Å; I194-Y196 HydrophobicContact CB-CE1 4.49Å; I194-Y196 HydrophobicContact CB-CE2 3.74Å; I194-Y196 HydrophobicContact CG2-CD1 4.12Å; I194-Y196 HydrophobicContact CG2-CD2 4.16Å; I194-Y196 HydrophobicContact CG2-CE1 3.71Å; I194-Y196 HydrophobicContact CG2-CE2 3.75Å; I194-Y196 HydrophobicContact CG2-CG 4.35Å; I194-Y196 WeakPolarHBondContact O-CD2 3.3Å; Y196-I203 HydrophobicContact CD2-CD1 3.72Å; Y196-I203 HydrophobicContact CE2-CD1 4.2Å; Y196-I203 HydrophobicContact CG-CD1 4.48Å; Y196-P220 HydrophobicContact CD1-CG 3.37Å; Y196-P220 HydrophobicContact CD2-CG 4.06Å; Y196-P220 VanDerWaalsContact CE1-CD 3.43Å; Y196-P220 HydrophobicContact CE1-CG 3.5Å; Y196-P220 VanDerWaalsContact CE1-CG 3.5Å; Y196-P220 HydrophobicContact CE2-CG 4.17Å; Y196-P220 HydrophobicContact CG-CG 3.65Å; Y196-Y221 HydrophobicContact CD1-CE1 4.07Å; Y196-Y221 HydrophobicContact CD1-CE2 4.19Å; Y196-Y221 AromaticContact CD1-CZ 3.79Å; Y196-Y221 HydrophobicContact CE1-CD2 4.44Å; Y196-Y221 HydrophobicContact CE1-CE1 4.44Å; Y196-Y221 AromaticContact CE1-CE2 3.74Å; Y196-Y221 HydrophobicContact CE1-CE2 3.74Å; Y196-Y221 AromaticContact CE1-CZ 3.73Å
197	I	93.4	Very high	93.6	Very high	133 Å²	133	41.1 Å²	41.1	68%	0.682	23%	0.226	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.7	-178.1	-54.9	173.3	0	0	0	108.4	P187 T188 I195	P187-I197 CarbonylContact O-C 3.56Å; T188-I197 HydrophobicContact CG2-CG1 4.27Å; I195-I197 HydrophobicContact CG2-CD1 4.49Å; I195-I197 HydrophobicContact CG2-CG1 4.07Å
198	G	92.2	Very high	93.8	Very high	58 Å²	58	39.3 Å²	39.3	60%	0.598	21%	0.213	S	C	*	.	S	Bend	trans	76.9	21.2	177.8	0	0	0	0	0	113.7	P187	P187-G198 PolarHBondContact O-N 2.94Å
199	I	93.2	Very high	93.8	Very high	7 Å²	7	40 Å²	40	4%	0.036	22%	0.215	C	C	.	.			trans	-66.4	136.9	173.5	57.6	172.1	0	0	0	109.3	F185 P187 D189 Q201 I203 P220	F185-I199 WeakPolarHBondContact CE1-O 3.31Å; F185-I199 HydrophobicContact CZ-CD1 4.45Å; F185-I199 HydrophobicContact CZ-CG1 4.15Å; P187-I199 VanDerWaalsContact CB-O 3.31Å; P187-I199 WeakPolarHBondContact CB-O 3.25Å; P187-I199 WeakPolarHBondContact O-CG1 3.47Å; P187-I199 PolarHBondContact O-N 3.43Å; D189-I199 HydrophobicContact CB-CD1 3.89Å; I199-Q201 WeakPolarHBondContact CD1-O 3.2Å; I199-I203 HydrophobicContact CD1-CD1 4.46Å; I199-I203 HydrophobicContact CD1-CG1 3.88Å; I199-P220 HydrophobicContact CG2-CB 3.96Å; I199-P220 HydrophobicContact CG2-CG 4.09Å
200	N	91.9	Very high	93.8	Very high	77 Å²	77	46.5 Å²	46.5	41%	0.412	25%	0.25	S	S	.	.	S	Bend	trans	-97	-2.5	-177	67.2	-4.5	0	0	0	113	A179 W180 Y223	A179-N200 CarbonylContact C-O 3.44Å; A179-N200 WeakPolarHBondContact CA-O 3.42Å; A179-N200 HydrophobicContact CB-CB 3.92Å; W180-N200 VanDerWaalsContact CB-O 3.31Å; W180-N200 WeakPolarHBondContact CB-O 3.36Å; W180-N200 PolarHBondContact N-O 3Å; N200-Y223 WeakPolarHBondContact OD1-CD2 3.37Å; N200-Y223 VanDerWaalsContact OD1-CE2 3.26Å; N200-Y223 WeakPolarHBondContact OD1-CE2 3.41Å
201	Q	93	Very high	93.9	Very high	3 Å²	3	50.6 Å²	50.6	1%	0.014	27%	0.269	C	S	.	.	S	Bend	trans	-141.6	161.2	174	-53.4	-71.8	-5.6	0	0	109.6	S178 W180 I199 Y223 I230	S178-Q201 VanDerWaalsContact C-NE2 3.3Å; S178-Q201 PolarHBondContact O-NE2 3.36Å; W180-Q201 VanDerWaalsContact CE3-OE1 3.31Å; I199-Q201 WeakPolarHBondContact CD1-O 3.2Å; Q201-Y223 HydrophobicContact CB-CD1 4.01Å; Q201-Y223 HydrophobicContact CB-CD2 4.07Å; Q201-Y223 HydrophobicContact CB-CE1 3.68Å; Q201-Y223 HydrophobicContact CB-CE2 3.73Å; Q201-Y223 HydrophobicContact CB-CG 4.2Å; Q201-Y223 HydrophobicContact CG-CD1 4.14Å; Q201-Y223 HydrophobicContact CG-CD2 3.9Å; Q201-Y223 HydrophobicContact CG-CE1 4.31Å; Q201-Y223 HydrophobicContact CG-CE2 4.06Å; Q201-Y223 HydrophobicContact CG-CG 3.94Å; Q201-Y223 PolarHBondContact O-OH 3.44Å; Q201-I230 HydrophobicContact CG-CG2 4.17Å
202	P	94.8	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.			trans	-61.5	141.3	170.5	-26.4	36.7	0	0	0	112.9	Y148 M165 W180 F185 P204 C205 Y223	Y148-P202 HydrophobicContact CD1-CB 4.36Å; Y148-P202 HydrophobicContact CD1-CG 3.87Å; Y148-P202 HydrophobicContact CE1-CB 3.61Å; Y148-P202 HydrophobicContact CE1-CG 3.57Å; M165-P202 HydrophobicContact CE-CB 4.29Å; M165-P202 HydrophobicContact CE-CG 4.17Å; M165-P202 HydrophobicContact SD-CB 4.26Å; M165-P202 HydrophobicContact SD-CG 4.45Å; W180-P202 HydrophobicContact CD2-CG 3.55Å; W180-P202 HydrophobicContact CE3-CG 3.59Å; W180-P202 HydrophobicContact CG-CG 4.23Å; W180-P202 HydrophobicContact CH2-CG 3.75Å; W180-P202 HydrophobicContact CZ2-CG 3.73Å; W180-P202 HydrophobicContact CZ3-CG 3.65Å; F185-P202 HydrophobicContact CD2-CG 4.44Å; F185-P202 HydrophobicContact CE2-CG 4.08Å; P202-P204 VanDerWaalsContact C-CD 3.42Å; P202-P204 VanDerWaalsContact C-N 3.31Å; P202-C205 WeakPolarHBondContact O-CB 3.39Å; P202-C205 PolarHBondContact O-N 2.99Å; P202-Y223 PolarHBondContact O-OH 3.48Å
203	I	95.6	Very high	94.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-52.6	-40.7	173.2	-62.8	-177.2	0	0	0	113.1	L151 D189 Y191 Y196 I199 C205 C206 M208 I214 P220	L151-I203 HydrophobicContact CD1-CB 4.19Å; L151-I203 HydrophobicContact CD1-CG2 4.36Å; D189-I203 HydrophobicContact CB-CD1 3.77Å; D189-I203 HydrophobicContact CB-CG1 4.31Å; Y191-I203 HydrophobicContact CD1-CG2 4.26Å; Y191-I203 HydrophobicContact CD2-CG2 4.05Å; Y191-I203 HydrophobicContact CE2-CG2 4.42Å; Y191-I203 HydrophobicContact CG-CD1 4.31Å; Y191-I203 HydrophobicContact CG-CG2 3.96Å; Y196-I203 HydrophobicContact CD2-CD1 3.72Å; Y196-I203 HydrophobicContact CE2-CD1 4.2Å; Y196-I203 HydrophobicContact CG-CD1 4.48Å; I199-I203 HydrophobicContact CD1-CD1 4.46Å; I199-I203 HydrophobicContact CD1-CG1 3.88Å; I203-C205 PolarHBondContact O-N 3.23Å; I203-C206 VanDerWaalsContact O-CB 3.3Å; I203-C206 WeakPolarHBondContact O-CB 3.44Å; I203-C206 PolarHBondContact O-N 3.42Å; I203-C206 PolarHBondContact O-SG 3.23Å; I203-M208 HydrophobicContact CG2-CE 3.8Å; I203-M208 WeakPolarHBondContact O-CE 3.12Å; I203-I214 HydrophobicContact CG2-CD1 3.94Å; I203-P220 HydrophobicContact CG1-CB 4.27Å; I203-P220 HydrophobicContact CG1-CG 4.25Å
204	P	95.4	Very high	94.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-56.8	-13.6	173.8	-28.5	36.5	0	0	0	116.1	L151 A162 M165 V166 P202 C206	L151-P204 HydrophobicContact CD1-CG 3.85Å; L151-P204 HydrophobicContact CD2-CG 4.09Å; L151-P204 HydrophobicContact CG-CG 3.93Å; A162-P204 HydrophobicContact CB-CB 4.04Å; A162-P204 HydrophobicContact CB-CG 3.41Å; A162-P204 VanDerWaalsContact CB-CG 3.41Å; M165-P204 HydrophobicContact CB-CB 3.95Å; M165-P204 HydrophobicContact SD-CB 4.12Å; V166-P204 HydrophobicContact CG2-CB 3.96Å; P202-P204 VanDerWaalsContact C-CD 3.42Å; P202-P204 VanDerWaalsContact C-N 3.31Å; P204-C206 VanDerWaalsContact C-N 3.31Å
205	C	95.4	Very high	94.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-75.9	-18.6	172.3	-66.7	0	0	0	0	113	C171 P202 I203 Y223 S228 N229	C171-C205 HydrophobicContact CB-CB 3.67Å; C171-C205 WeakPolarHBondContact CB-SG 3.4Å; C171-C205 WeakPolarHBondContact SG-CB 2.79Å; C171-C205 CovalentContact SG-SG 2.03Å; C171-C205 PolarHBondContact SG-SG 3.45Å; P202-C205 WeakPolarHBondContact O-CB 3.39Å; P202-C205 PolarHBondContact O-N 2.99Å; I203-C205 PolarHBondContact O-N 3.23Å; C205-Y223 HydrophobicContact CB-CD1 4.44Å; C205-Y223 HydrophobicContact CB-CE1 4.15Å; C205-S228 CarbonylContact O-C 3.56Å; C205-S228 VanDerWaalsContact O-CA 3.31Å; C205-S228 WeakPolarHBondContact O-CA 3.49Å; C205-S228 VanDerWaalsContact O-CB 3.28Å; C205-S228 WeakPolarHBondContact O-CB 3.45Å; C205-N229 PolarHBondContact O-N 3.32Å
206	C	96	Very high	94.4	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.007	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-64.9	149.2	171.1	-62	0	0	0	0	110.5	I203 P204 M208 I214 C219	I203-C206 VanDerWaalsContact O-CB 3.3Å; I203-C206 WeakPolarHBondContact O-CB 3.44Å; I203-C206 PolarHBondContact O-N 3.42Å; I203-C206 PolarHBondContact O-SG 3.23Å; P204-C206 VanDerWaalsContact C-N 3.31Å; C206-M208 PolarHBondContact O-N 3.25Å; C206-I214 HydrophobicContact CB-CG1 4.34Å; C206-I214 HydrophobicContact CB-CG2 4.04Å; C206-C219 WeakPolarHBondContact CA-SG 3.31Å; C206-C219 HydrophobicContact CB-CB 3.82Å; C206-C219 WeakPolarHBondContact CB-SG 3.44Å; C206-C219 WeakPolarHBondContact SG-CB 3.49Å; C206-C219 CovalentContact SG-SG 2.03Å; C206-C219 PolarHBondContact SG-SG 2.68Å
207	R	96	Very high	94.1	Very high	104 Å²	104	52.6 Å²	52.6	39%	0.392	28%	0.283	S	S	.	.			trans	-70.5	130.1	170.5	-72	-176.7	-179.5	-177.9	0.3	109.6	I215 I225 Y226 N227	R207-I215 HydrophobicContact CB-CD1 4.34Å; R207-I215 PolarHBondContact O-N 3.47Å; R207-I225 PolarHBondContact NH2-O 3.31Å; R207-Y226 PolarHBondContact NH1-O 3.44Å; R207-Y226 VanDerWaalsContact NH1-O 3.11Å; R207-N227 WeakPolarHBondContact CB-O 3.25Å; R207-N227 PolarHBondContact N-O 3.11Å
208	M	95.7	Very high	94	Very high	18 Å²	18	49.2 Å²	49.2	9%	0.089	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-124.3	153.8	-176.9	-65	176.8	175	0	0	111.2	F49 V166 Y191 I203 C206 L212 E213 I214	F49-M208 HydrophobicContact CE1-SD 4.5Å; V166-M208 HydrophobicContact CG1-CB 4.43Å; V166-M208 HydrophobicContact CG1-SD 4.41Å; V166-M208 HydrophobicContact CG2-SD 3.71Å; Y191-M208 HydrophobicContact CE1-CE 4.37Å; I203-M208 HydrophobicContact CG2-CE 3.8Å; I203-M208 WeakPolarHBondContact O-CE 3.12Å; C206-M208 PolarHBondContact O-N 3.25Å; M208-L212 HydrophobicContact SD-CB 4.18Å; M208-L212 HydrophobicContact SD-CD2 4.41Å; M208-E213 CarbonylContact C-O 3.54Å; M208-E213 WeakPolarHBondContact CA-O 3.11Å; M208-I214 HydrophobicContact CE-CG1 4.13Å
209	N	95.2	Very high	94.1	Very high	50 Å²	50	46.4 Å²	46.4	27%	0.267	24%	0.24	S	C	.	.			trans	-81.6	-177.3	170.5	70.4	10.5	0	0	0	111.7	Q211 L212 E213 I215	N209-Q211 PolarHBondContact O-N 2.59Å; N209-Q211 VanDerWaalsContact O-N 3.13Å; N209-Q211 WeakPolarHBondContact OD1-CA 3.08Å; N209-Q211 WeakPolarHBondContact OD1-CB 3.46Å; N209-Q211 PolarHBondContact OD1-N 3.18Å; N209-L212 PolarHBondContact O-N 3.34Å; N209-L212 PolarHBondContact OD1-N 2.96Å; N209-E213 PolarHBondContact N-O 3.4Å; N209-E213 PolarHBondContact ND2-OE2 2.88Å; N209-E213 WeakPolarHBondContact OD1-CB 3.44Å; N209-E213 PolarHBondContact OD1-N 3.31Å; N209-I215 HydrophobicContact CB-CG1 4.32Å
210	D	93.3	Very high	94.1	Very high	137 Å²	137	46.1 Å²	46.1	73%	0.733	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-17.2	-180	-69.4	-21.4	0	0	0	114.1
211	Q	95.1	Very high	94.1	Very high	93 Å²	93	50 Å²	50	44%	0.435	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	0.4	175.8	-66.5	71.9	28.1	0	0	112.3	H52 N209 E213	H52-Q211 PolarHBondContact NE2-O 2.94Å; N209-Q211 PolarHBondContact O-N 2.59Å; N209-Q211 VanDerWaalsContact O-N 3.13Å; N209-Q211 WeakPolarHBondContact OD1-CA 3.08Å; N209-Q211 WeakPolarHBondContact OD1-CB 3.46Å; N209-Q211 PolarHBondContact OD1-N 3.18Å; Q211-E213 VanDerWaalsContact C-N 3.29Å; Q211-E213 HydrophobicContact CB-CG 4.19Å
212	L	95.1	Very high	94	Very high	8 Å²	8	55.6 Å²	55.6	4%	0.042	27%	0.274	C	S	.	.			trans	67.1	22.1	-172	-51.1	-174.5	0	0	0	114.4	T45 L48 F49 V166 Y191 M208 N209	T45-L212 HydrophobicContact CG2-CD1 4.05Å; L48-L212 HydrophobicContact CB-CB 4.35Å; L48-L212 HydrophobicContact CB-CD1 3.37Å; L48-L212 HydrophobicContact CB-CG 3.75Å; L48-L212 HydrophobicContact CD1-CD1 4.3Å; L48-L212 HydrophobicContact CD1-CG 4.01Å; L48-L212 HydrophobicContact CG-CD1 4.47Å; L48-L212 HydrophobicContact CG-CG 4.5Å; F49-L212 HydrophobicContact CD1-CD1 3.6Å; F49-L212 HydrophobicContact CD2-CD1 4.15Å; F49-L212 HydrophobicContact CE1-CD1 3.68Å; F49-L212 HydrophobicContact CE2-CD1 4.2Å; F49-L212 HydrophobicContact CG-CD1 3.85Å; F49-L212 HydrophobicContact CZ-CD1 3.98Å; V166-L212 HydrophobicContact CB-CD2 4.35Å; V166-L212 HydrophobicContact CG1-CD2 3.52Å; Y191-L212 WeakPolarHBondContact CE1-O 3.05Å; Y191-L212 WeakPolarHBondContact OH-CB 3.18Å; Y191-L212 PolarHBondContact OH-O 3.46Å; M208-L212 HydrophobicContact SD-CB 4.18Å; M208-L212 HydrophobicContact SD-CD2 4.41Å; N209-L212 PolarHBondContact O-N 3.34Å; N209-L212 PolarHBondContact OD1-N 2.96Å
213	E	94.4	Very high	93.9	Very high	82 Å²	82	56.8 Å²	56.8	38%	0.383	28%	0.279	S	S	.	.			trans	-81.5	137	172.3	-59.2	165.3	167.4	0	0	109.6	M208 N209 Q211 I215	M208-E213 CarbonylContact C-O 3.54Å; M208-E213 WeakPolarHBondContact CA-O 3.11Å; N209-E213 PolarHBondContact N-O 3.4Å; N209-E213 PolarHBondContact ND2-OE2 2.88Å; N209-E213 WeakPolarHBondContact OD1-CB 3.44Å; N209-E213 PolarHBondContact OD1-N 3.31Å; Q211-E213 VanDerWaalsContact C-N 3.29Å; Q211-E213 HydrophobicContact CB-CG 4.19Å; E213-I215 PolarHBondContact O-N 3.45Å
214	I	95	Very high	93.7	Very high	27 Å²	27	58.6 Å²	58.6	14%	0.138	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-67.6	120.8	178.5	-59.5	173.2	0	0	0	109.1	Y191 I203 C206 M208 N216 C219	Y191-I214 HydrophobicContact CD1-CD1 4.12Å; Y191-I214 HydrophobicContact CD1-CG1 4.42Å; Y191-I214 HydrophobicContact CE1-CD1 4.42Å; Y191-I214 HydrophobicContact CE1-CG1 4.24Å; I203-I214 HydrophobicContact CG2-CD1 3.94Å; C206-I214 HydrophobicContact CB-CG1 4.34Å; C206-I214 HydrophobicContact CB-CG2 4.04Å; M208-I214 HydrophobicContact CE-CG1 4.13Å; I214-N216 VanDerWaalsContact C-N 3.35Å; I214-N216 WeakPolarHBondContact CG2-O 3.21Å; I214-N216 PolarHBondContact O-N 2.91Å; I214-C219 HydrophobicContact CG2-CB 4.33Å
215	I	94.4	Very high	93.5	Very high	116 Å²	116	62.8 Å²	62.8	60%	0.595	31%	0.312	S	S	*	.	S	Bend	trans	-68.8	-35.7	-174	-63.3	173.7	0	0	0	111.6	R207 N209 E213	R207-I215 HydrophobicContact CB-CD1 4.34Å; R207-I215 PolarHBondContact O-N 3.47Å; N209-I215 HydrophobicContact CB-CG1 4.32Å; E213-I215 PolarHBondContact O-N 3.45Å
216	N	92.9	Very high	93.3	Very high	69 Å²	69	71.5 Å²	71.5	37%	0.369	35%	0.346	S	S	.	.	S	Bend	trans	-126	114	-177.6	-177.1	-23.9	0	0	0	110.4	I214 T218 C219 N227	I214-N216 VanDerWaalsContact C-N 3.35Å; I214-N216 WeakPolarHBondContact CG2-O 3.21Å; I214-N216 PolarHBondContact O-N 2.91Å; N216-T218 VanDerWaalsContact CG-OG1 3.22Å; N216-T218 PolarHBondContact O-N 3.49Å; N216-T218 WeakPolarHBondContact OD1-CB 3.23Å; N216-T218 PolarHBondContact OD1-N 2.89Å; N216-T218 PolarHBondContact OD1-OG1 3.21Å; N216-C219 PolarHBondContact O-N 2.95Å; N216-N227 HydrophobicContact CB-CB 3.84Å
217	T	87.8	Confident	93.3	Very high	122 Å²	122	71.6 Å²	71.6	75%	0.748	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-9.7	-174.6	56.4	0	0	0	0	114.9	C219	T217-C219 VanDerWaalsContact C-N 3.3Å
218	T	92.7	Very high	93.2	Very high	61 Å²	61	66.7 Å²	66.7	37%	0.374	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-31.4	169.6	53.8	0	0	0	0	111.9	N216 Y221 E222 N227	N216-T218 VanDerWaalsContact CG-OG1 3.22Å; N216-T218 PolarHBondContact O-N 3.49Å; N216-T218 WeakPolarHBondContact OD1-CB 3.23Å; N216-T218 PolarHBondContact OD1-N 2.89Å; N216-T218 PolarHBondContact OD1-OG1 3.21Å; T218-Y221 CarbonylContact O-C 3.48Å; T218-Y221 WeakPolarHBondContact O-CA 3.43Å; T218-Y221 WeakPolarHBondContact O-CB 3.29Å; T218-Y221 PolarHBondContact O-N 3.02Å; T218-E222 PolarHBondContact O-N 3.1Å; T218-N227 PolarHBondContact OG1-ND2 3.28Å
219	C	93.2	Very high	93.1	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	134.6	168.7	-159.3	0	0	0	0	108.4	C206 I214 N216 T217 Y223 N227	C206-C219 WeakPolarHBondContact CA-SG 3.31Å; C206-C219 HydrophobicContact CB-CB 3.82Å; C206-C219 WeakPolarHBondContact CB-SG 3.44Å; C206-C219 WeakPolarHBondContact SG-CB 3.49Å; C206-C219 CovalentContact SG-SG 2.03Å; C206-C219 PolarHBondContact SG-SG 2.68Å; I214-C219 HydrophobicContact CG2-CB 4.33Å; N216-C219 PolarHBondContact O-N 2.95Å; T217-C219 VanDerWaalsContact C-N 3.3Å; C219-Y223 VanDerWaalsContact SG-CD1 3.5Å; C219-Y223 WeakPolarHBondContact SG-CE1 3.28Å; C219-N227 HydrophobicContact CB-CB 4.47Å
220	P	94.2	Very high	93	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.006	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	cis	-95.2	11.9	13.1	38	-37.9	0	0	0	116.1	Y196 I199 I203 Y223	Y196-P220 HydrophobicContact CD1-CG 3.37Å; Y196-P220 HydrophobicContact CD2-CG 4.06Å; Y196-P220 VanDerWaalsContact CE1-CD 3.43Å; Y196-P220 HydrophobicContact CE1-CG 3.5Å; Y196-P220 VanDerWaalsContact CE1-CG 3.5Å; Y196-P220 HydrophobicContact CE2-CG 4.17Å; Y196-P220 HydrophobicContact CG-CG 3.65Å; I199-P220 HydrophobicContact CG2-CB 3.96Å; I199-P220 HydrophobicContact CG2-CG 4.09Å; I203-P220 HydrophobicContact CG1-CB 4.27Å; I203-P220 HydrophobicContact CG1-CG 4.25Å; P220-Y223 HydrophobicContact CB-CE1 4.41Å; P220-Y223 HydrophobicContact CB-CE2 4.19Å; P220-Y223 WeakPolarHBondContact CB-OH 3.42Å; P220-Y223 WeakPolarHBondContact O-CE2 3.48Å
221	Y	90.9	Very high	92.8	Very high	158 Å²	158	59.2 Å²	59.2	62%	0.62	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-38.4	177.1	-63	-72.6	0	0	0	112.2	Y196 T218	Y196-Y221 HydrophobicContact CD1-CE1 4.07Å; Y196-Y221 HydrophobicContact CD1-CE2 4.19Å; Y196-Y221 AromaticContact CD1-CZ 3.79Å; Y196-Y221 HydrophobicContact CE1-CD2 4.44Å; Y196-Y221 HydrophobicContact CE1-CE1 4.44Å; Y196-Y221 AromaticContact CE1-CE2 3.74Å; Y196-Y221 HydrophobicContact CE1-CE2 3.74Å; Y196-Y221 AromaticContact CE1-CZ 3.73Å; T218-Y221 CarbonylContact O-C 3.48Å; T218-Y221 WeakPolarHBondContact O-CA 3.43Å; T218-Y221 WeakPolarHBondContact O-CB 3.29Å; T218-Y221 PolarHBondContact O-N 3.02Å
222	E	91.6	Very high	92.6	Very high	121 Å²	121	58.6 Å²	58.6	57%	0.565	29%	0.294	S	S	*	.	S	Bend	trans	-135.2	121.6	177.2	-171.6	179.9	178.9	0	0	110.6	T218 T224 N227	T218-E222 PolarHBondContact O-N 3.1Å; E222-T224 HydrophobicContact CG-CG2 4.07Å; E222-N227 PolarHBondContact O-ND2 3.2Å
223	Y	91.7	Very high	92.5	Very high	24 Å²	24	59.3 Å²	59.3	9%	0.094	30%	0.3	C	S	.	.			trans	-97	116.3	176.8	-63.3	-95.2	0	0	0	109.8	N200 Q201 P202 C205 C219 P220 I230	N200-Y223 WeakPolarHBondContact OD1-CD2 3.37Å; N200-Y223 VanDerWaalsContact OD1-CE2 3.26Å; N200-Y223 WeakPolarHBondContact OD1-CE2 3.41Å; Q201-Y223 HydrophobicContact CB-CD1 4.01Å; Q201-Y223 HydrophobicContact CB-CD2 4.07Å; Q201-Y223 HydrophobicContact CB-CE1 3.68Å; Q201-Y223 HydrophobicContact CB-CE2 3.73Å; Q201-Y223 HydrophobicContact CB-CG 4.2Å; Q201-Y223 HydrophobicContact CG-CD1 4.14Å; Q201-Y223 HydrophobicContact CG-CD2 3.9Å; Q201-Y223 HydrophobicContact CG-CE1 4.31Å; Q201-Y223 HydrophobicContact CG-CE2 4.06Å; Q201-Y223 HydrophobicContact CG-CG 3.94Å; Q201-Y223 PolarHBondContact O-OH 3.44Å; P202-Y223 PolarHBondContact O-OH 3.48Å; C205-Y223 HydrophobicContact CB-CD1 4.44Å; C205-Y223 HydrophobicContact CB-CE1 4.15Å; C219-Y223 VanDerWaalsContact SG-CD1 3.5Å; C219-Y223 WeakPolarHBondContact SG-CE1 3.28Å; P220-Y223 HydrophobicContact CB-CE1 4.41Å; P220-Y223 HydrophobicContact CB-CE2 4.19Å; P220-Y223 WeakPolarHBondContact CB-OH 3.42Å; P220-Y223 WeakPolarHBondContact O-CE2 3.48Å; Y223-I230 HydrophobicContact CD1-CG2 4.05Å; Y223-I230 HydrophobicContact CG-CG2 4.26Å; Y223-I230 WeakPolarHBondContact O-CD1 3.03Å
224	T	91.8	Very high	92.5	Very high	39 Å²	39	55.4 Å²	55.4	24%	0.239	28%	0.281	C	S	.	.			trans	-121.2	161	175.8	72.8	0	0	0	0	109.7	E222 Y226 N227 S228	E222-T224 HydrophobicContact CG-CG2 4.07Å; T224-Y226 PolarHBondContact O-N 3.28Å; T224-Y226 PolarHBondContact OG1-N 2.98Å; T224-N227 WeakPolarHBondContact CA-OD1 3.28Å; T224-N227 PolarHBondContact N-OD1 3Å; T224-N227 PolarHBondContact O-N 3.25Å; T224-N227 PolarHBondContact O-OD1 3.07Å; T224-N227 PolarHBondContact OG1-N 3.14Å; T224-N227 PolarHBondContact OG1-OD1 2.98Å; T224-S228 WeakPolarHBondContact O-CB 3.3Å; T224-S228 PolarHBondContact O-N 3.04Å; T224-S228 PolarHBondContact O-OG 3.17Å
225	I	90.7	Very high	92.5	Very high	88 Å²	88	55.9 Å²	55.9	45%	0.451	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.2	174.7	62.4	171.8	0	0	0	113.7	R207	R207-I225 PolarHBondContact NH2-O 3.31Å
226	Y	92.2	Very high	92.4	Very high	183 Å²	183	56.2 Å²	56.2	72%	0.718	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-36.8	-178	-58.7	-70.2	0	0	0	113.2	R207 T224	R207-Y226 PolarHBondContact NH1-O 3.44Å; R207-Y226 VanDerWaalsContact NH1-O 3.11Å; T224-Y226 PolarHBondContact O-N 3.28Å; T224-Y226 PolarHBondContact OG1-N 2.98Å
227	N	94.5	Very high	92.5	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.016	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-6.5	-177.7	70.7	-3.6	0	0	0	113.7	R207 N216 T218 C219 E222 T224	R207-N227 WeakPolarHBondContact CB-O 3.25Å; R207-N227 PolarHBondContact N-O 3.11Å; N216-N227 HydrophobicContact CB-CB 3.84Å; T218-N227 PolarHBondContact OG1-ND2 3.28Å; C219-N227 HydrophobicContact CB-CB 4.47Å; E222-N227 PolarHBondContact O-ND2 3.2Å; T224-N227 WeakPolarHBondContact CA-OD1 3.28Å; T224-N227 PolarHBondContact N-OD1 3Å; T224-N227 PolarHBondContact O-N 3.25Å; T224-N227 PolarHBondContact O-OD1 3.07Å; T224-N227 PolarHBondContact OG1-N 3.14Å; T224-N227 PolarHBondContact OG1-OD1 2.98Å
228	S	94.4	Very high	92.8	Very high	1 Å²	1	49 Å²	49	1%	0.007	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-142.9	174.3	-174.7	76.6	0	0	0	0	111.9	C205 T224 I230	C205-S228 CarbonylContact O-C 3.56Å; C205-S228 VanDerWaalsContact O-CA 3.31Å; C205-S228 WeakPolarHBondContact O-CA 3.49Å; C205-S228 VanDerWaalsContact O-CB 3.28Å; C205-S228 WeakPolarHBondContact O-CB 3.45Å; T224-S228 WeakPolarHBondContact O-CB 3.3Å; T224-S228 PolarHBondContact O-N 3.04Å; T224-S228 PolarHBondContact O-OG 3.17Å; S228-I230 WeakPolarHBondContact OG-CG1 3.3Å
229	N	94.1	Very high	92.9	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	22%	0.222	C	C	.	.	S	Bend	trans	-105.5	16	-179.2	-63.3	-33.9	0	0	0	112.5	N169 C171 C205 G231 I232	N169-N229 WeakPolarHBondContact CA-ND2 3.31Å; N169-N229 WeakPolarHBondContact O-CB 3.38Å; C171-N229 HydrophobicContact CB-CB 4.41Å; C171-N229 WeakPolarHBondContact CB-O 3.34Å; C205-N229 PolarHBondContact O-N 3.32Å; N229-G231 PolarHBondContact O-N 2.96Å; N229-I232 PolarHBondContact O-N 3.47Å
230	I	92.1	Very high	92.9	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.051	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.1	179.2	65.4	172.2	0	0	0	113.8	Q201 Y223 S228 I232	Q201-I230 HydrophobicContact CG-CG2 4.17Å; Y223-I230 HydrophobicContact CD1-CG2 4.05Å; Y223-I230 HydrophobicContact CG-CG2 4.26Å; Y223-I230 WeakPolarHBondContact O-CD1 3.03Å; S228-I230 WeakPolarHBondContact OG-CG1 3.3Å; I230-I232 VanDerWaalsContact C-N 3.27Å; I230-I232 PolarHBondContact O-N 3.42Å
231	G	89.7	Confident	92.9	Very high	30 Å²	30	54.4 Å²	54.4	31%	0.309	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-13.8	177	0	0	0	0	0	114.2	H175 N229	H175-G231 PolarHBondContact CE1-O 2.83Å; H175-G231 PolarHBondContact ND1-O 2.86Å; N229-G231 PolarHBondContact O-N 2.96Å
232	I	92.3	Very high	93	Very high	81 Å²	81	49 Å²	49	42%	0.415	24%	0.242	S	C	.	.	S	Bend	trans	-126.2	114.3	-169.1	-56.2	174.1	0	0	0	108.7	C170 C171 N229 I230 P237	C170-I232 CarbonylContact C-O 3.58Å; C170-I232 WeakPolarHBondContact CA-O 3.46Å; C170-I232 HydrophobicContact CB-CG2 4.1Å; C171-I232 PolarHBondContact N-O 3.4Å; N229-I232 PolarHBondContact O-N 3.47Å; I230-I232 VanDerWaalsContact C-N 3.27Å; I230-I232 PolarHBondContact O-N 3.42Å; I232-P237 HydrophobicContact CG2-CG 4.23Å
233	S	92.6	Very high	93	Very high	22 Å²	22	43.5 Å²	43.5	15%	0.154	22%	0.217	C	C	.	.			trans	-74.8	149.9	174.6	58.4	0	0	0	0	111.9	A173 T174 D235 P237	A173-S233 WeakPolarHBondContact O-CB 3.2Å; T174-S233 VanDerWaalsContact C-CB 3.5Å; S233-D235 VanDerWaalsContact CB-OD1 3.24Å; S233-D235 WeakPolarHBondContact CB-OD1 3.41Å; S233-D235 PolarHBondContact OG-OD1 3.17Å; S233-P237 WeakPolarHBondContact O-CD 2.99Å; S233-P237 WeakPolarHBondContact O-CG 3.43Å
234	C	94.6	Very high	93.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-83.6	-17.4	-178.5	-67.9	0	0	0	0	114.2	I141 M145 C170 C171 G172 K236 F238	I141-C234 HydrophobicContact CG1-CB 4.47Å; M145-C234 HydrophobicContact CE-CB 3.62Å; C170-C234 HydrophobicContact CB-CB 3.9Å; C170-C234 WeakPolarHBondContact CB-SG 3.32Å; C170-C234 WeakPolarHBondContact SG-CA 3.28Å; C170-C234 WeakPolarHBondContact SG-CB 3.35Å; C170-C234 CovalentContact SG-SG 2.03Å; C170-C234 PolarHBondContact SG-SG 3.15Å; C171-C234 PolarHBondContact N-SG 3.41Å; G172-C234 VanDerWaalsContact O-CB 3.28Å; G172-C234 WeakPolarHBondContact O-CB 3.38Å; G172-C234 PolarHBondContact O-N 3.3Å; C234-K236 PolarHBondContact O-N 2.88Å; C234-F238 WeakPolarHBondContact O-CB 3.39Å; C234-F238 PolarHBondContact O-N 3.29Å
235	D	93.4	Very high	93.1	Very high	38 Å²	38	51.7 Å²	51.7	20%	0.203	25%	0.247	C	C	.	.	H	α-helix	trans	-54	-51.7	-178.7	60.2	-21.9	0	0	0	113.2	K138 I141 A173 S233 A239	K138-D235 HydrophobicContact CB-CB 4.19Å; K138-D235 HydrophobicContact CG-CB 4.08Å; I141-D235 HydrophobicContact CG2-CB 4.36Å; A173-D235 WeakPolarHBondContact O-CB 3.02Å; A173-D235 PolarHBondContact O-N 3.09Å; S233-D235 VanDerWaalsContact CB-OD1 3.24Å; S233-D235 WeakPolarHBondContact CB-OD1 3.41Å; S233-D235 PolarHBondContact OG-OD1 3.17Å; D235-A239 VanDerWaalsContact O-CB 3.3Å; D235-A239 WeakPolarHBondContact O-CB 3.36Å; D235-A239 PolarHBondContact O-N 2.74Å; D235-A239 VanDerWaalsContact O-N 3.1Å
236	K	93.2	Very high	93.2	Very high	123 Å²	123	49 Å²	49	54%	0.535	23%	0.233	S	C	.	.	H	α-helix	trans	-72.5	-53.3	-178.5	178.4	179.1	177.8	-177.7	0	112.8	C234 F238 A239 E240	C234-K236 PolarHBondContact O-N 2.88Å; K236-F238 VanDerWaalsContact C-N 3.27Å; K236-F238 PolarHBondContact O-N 3.15Å; K236-A239 PolarHBondContact O-N 2.91Å; K236-E240 WeakPolarHBondContact CE-OE1 3.23Å; K236-E240 HydrophobicContact CG-CG 4.31Å; K236-E240 IonicContact NZ-OE1 2.58Å; K236-E240 WeakPolarHBondContact O-CB 3.01Å; K236-E240 WeakPolarHBondContact O-CG 3.49Å; K236-E240 PolarHBondContact O-N 3.28Å
237	P	94.9	Very high	93.2	Very high	30 Å²	30	41.5 Å²	41.5	20%	0.195	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-39	177.4	-25.6	35.1	0	0	0	112.9	L168 C170 I232 S233 E240 E241	L168-P237 HydrophobicContact CB-CB 4.18Å; L168-P237 HydrophobicContact CD1-CB 4.26Å; C170-P237 HydrophobicContact CB-CG 4.49Å; I232-P237 HydrophobicContact CG2-CG 4.23Å; S233-P237 WeakPolarHBondContact O-CD 2.99Å; S233-P237 WeakPolarHBondContact O-CG 3.43Å; P237-E240 PolarHBondContact O-N 3.1Å; P237-E241 VanDerWaalsContact O-CB 3.3Å; P237-E241 WeakPolarHBondContact O-CB 3.45Å; P237-E241 PolarHBondContact O-N 3.47Å
238	F	94.7	Very high	93.1	Very high	8 Å²	8	45.4 Å²	45.4	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-46.9	177.8	-179.2	-96.8	0	0	0	111.8	L137 Y140 I141 F160 V164 L168 C234 K236 E240 E241 I242	L137-F238 HydrophobicContact CB-CD1 4.46Å; L137-F238 HydrophobicContact CB-CE1 4.43Å; L137-F238 HydrophobicContact CD2-CE1 4.18Å; Y140-F238 HydrophobicContact CD1-CE1 4.23Å; Y140-F238 HydrophobicContact CD1-CZ 4.31Å; I141-F238 HydrophobicContact CB-CB 4.45Å; I141-F238 HydrophobicContact CB-CD1 3.65Å; I141-F238 HydrophobicContact CB-CE1 4Å; I141-F238 HydrophobicContact CB-CG 4.01Å; I141-F238 HydrophobicContact CD1-CD2 4.05Å; I141-F238 HydrophobicContact CD1-CE2 4.17Å; I141-F238 HydrophobicContact CD1-CG 4.22Å; I141-F238 HydrophobicContact CD1-CZ 4.45Å; I141-F238 HydrophobicContact CG1-CB 4.26Å; I141-F238 HydrophobicContact CG1-CD1 4.17Å; I141-F238 HydrophobicContact CG1-CD2 4.33Å; I141-F238 HydrophobicContact CG1-CG 4Å; I141-F238 HydrophobicContact CG2-CB 4.34Å; I141-F238 HydrophobicContact CG2-CD1 3.94Å; I141-F238 HydrophobicContact CG2-CG 4.33Å; F160-F238 HydrophobicContact CE1-CE2 4.46Å; F160-F238 HydrophobicContact CZ-CE2 4.34Å; V164-F238 HydrophobicContact CG1-CD2 3.78Å; V164-F238 HydrophobicContact CG1-CE2 4.48Å; V164-F238 HydrophobicContact CG2-CD2 4.2Å; V164-F238 HydrophobicContact CG2-CE2 4.11Å; L168-F238 VanDerWaalsContact CD1-CA 3.49Å; L168-F238 HydrophobicContact CD1-CB 3.9Å; L168-F238 HydrophobicContact CD1-CD2 4.2Å; C234-F238 WeakPolarHBondContact O-CB 3.39Å; C234-F238 PolarHBondContact O-N 3.29Å; K236-F238 VanDerWaalsContact C-N 3.27Å; K236-F238 PolarHBondContact O-N 3.15Å; F238-E240 VanDerWaalsContact C-N 3.33Å; F238-E240 PolarHBondContact O-N 2.99Å; F238-E241 PolarHBondContact O-N 2.92Å; F238-I242 HydrophobicContact CD1-CG1 4.49Å; F238-I242 HydrophobicContact CE1-CG1 4.15Å; F238-I242 HydrophobicContact CE2-CD1 4.49Å; F238-I242 HydrophobicContact CE2-CG1 4.17Å; F238-I242 HydrophobicContact CZ-CG1 3.99Å; F238-I242 WeakPolarHBondContact O-CG1 3.37Å; F238-I242 PolarHBondContact O-N 3.41Å
239	A	93.8	Very high	93	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-62.5	-41	177.3	0	0	0	0	0	111.8	L137 K138 D235 K236 S243	L137-A239 HydrophobicContact CB-CB 4.07Å; K138-A239 HydrophobicContact CG-CB 3.98Å; D235-A239 VanDerWaalsContact O-CB 3.3Å; D235-A239 WeakPolarHBondContact O-CB 3.36Å; D235-A239 PolarHBondContact O-N 2.74Å; D235-A239 VanDerWaalsContact O-N 3.1Å; K236-A239 PolarHBondContact O-N 2.91Å; A239-S243 WeakPolarHBondContact O-CB 3.23Å; A239-S243 PolarHBondContact O-N 2.97Å; A239-S243 PolarHBondContact O-OG 2.99Å
240	E	94.2	Very high	93	Very high	101 Å²	101	49.3 Å²	49.3	47%	0.472	25%	0.246	S	C	.	.	H	α-helix	trans	-64.9	-45.7	177.2	-73.6	176.7	169	0	0	112.1	K236 P237 F238 S243 F244	K236-E240 WeakPolarHBondContact CE-OE1 3.23Å; K236-E240 HydrophobicContact CG-CG 4.31Å; K236-E240 IonicContact NZ-OE1 2.58Å; K236-E240 WeakPolarHBondContact O-CB 3.01Å; K236-E240 WeakPolarHBondContact O-CG 3.49Å; K236-E240 PolarHBondContact O-N 3.28Å; P237-E240 PolarHBondContact O-N 3.1Å; F238-E240 VanDerWaalsContact C-N 3.33Å; F238-E240 PolarHBondContact O-N 2.99Å; E240-S243 PolarHBondContact O-N 3Å; E240-F244 WeakPolarHBondContact O-CB 3.42Å; E240-F244 PolarHBondContact O-N 3.36Å
241	E	94	Very high	93	Very high	74 Å²	74	54.8 Å²	54.8	35%	0.346	27%	0.27	S	S	.	.	H	α-helix	trans	-61.6	-49.9	178.9	-174.6	67.5	-164.4	0	0	111.3	L168 P237 F238 S243 F244 Y245	L168-E241 HydrophobicContact CD2-CB 4.11Å; L168-E241 HydrophobicContact CD2-CG 4.04Å; P237-E241 VanDerWaalsContact O-CB 3.3Å; P237-E241 WeakPolarHBondContact O-CB 3.45Å; P237-E241 PolarHBondContact O-N 3.47Å; F238-E241 PolarHBondContact O-N 2.92Å; E241-S243 VanDerWaalsContact C-N 3.32Å; E241-S243 PolarHBondContact O-N 3.25Å; E241-F244 WeakPolarHBondContact O-CB 3.49Å; E241-F244 PolarHBondContact O-N 3Å; E241-Y245 HydrophobicContact CG-CE2 4.07Å; E241-Y245 VanDerWaalsContact O-CD2 3.22Å; E241-Y245 WeakPolarHBondContact O-CD2 3.37Å; E241-Y245 PolarHBondContact O-N 3.4Å; E241-Y245 WeakPolarHBondContact OE1-CE2 3.26Å; E241-Y245 PolarHBondContact OE1-OH 2.9Å
242	I	92.5	Very high	93.1	Very high	46 Å²	46	55.3 Å²	55.3	24%	0.236	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-38.6	178.6	-61	-60.4	0	0	0	110.8	L137 F238 F244 Y245 L246	L137-I242 HydrophobicContact CD1-CB 3.91Å; L137-I242 HydrophobicContact CD1-CG2 3.73Å; L137-I242 HydrophobicContact CD2-CB 4.24Å; L137-I242 HydrophobicContact CD2-CG2 3.77Å; L137-I242 HydrophobicContact CG-CG2 4.42Å; F238-I242 HydrophobicContact CD1-CG1 4.49Å; F238-I242 HydrophobicContact CE1-CG1 4.15Å; F238-I242 HydrophobicContact CE2-CD1 4.49Å; F238-I242 HydrophobicContact CE2-CG1 4.17Å; F238-I242 HydrophobicContact CZ-CG1 3.99Å; F238-I242 WeakPolarHBondContact O-CG1 3.37Å; F238-I242 PolarHBondContact O-N 3.41Å; I242-F244 VanDerWaalsContact C-N 3.3Å; I242-F244 PolarHBondContact O-N 3.17Å; I242-Y245 PolarHBondContact O-N 3.48Å; I242-L246 HydrophobicContact CG2-CD1 4.21Å; I242-L246 WeakPolarHBondContact O-CG 3.05Å; I242-L246 PolarHBondContact O-N 2.99Å
243	S	92.5	Very high	93.2	Very high	4 Å²	4	52.7 Å²	52.7	3%	0.028	26%	0.264	C	S	.	.	H	α-helix	trans	-65.9	-33.7	176.8	-64.4	0	0	0	0	112.2	E134 A239 E240 E241 L246 N247	E134-S243 WeakPolarHBondContact CG-OG 3.43Å; A239-S243 WeakPolarHBondContact O-CB 3.23Å; A239-S243 PolarHBondContact O-N 2.97Å; A239-S243 PolarHBondContact O-OG 2.99Å; E240-S243 PolarHBondContact O-N 3Å; E241-S243 VanDerWaalsContact C-N 3.32Å; E241-S243 PolarHBondContact O-N 3.25Å; S243-L246 PolarHBondContact O-N 3.04Å; S243-N247 WeakPolarHBondContact O-CB 3.04Å; S243-N247 VanDerWaalsContact O-CG 3.27Å; S243-N247 PolarHBondContact O-N 2.82Å; S243-N247 PolarHBondContact O-ND2 2.96Å
244	F	93.7	Very high	93.2	Very high	114 Å²	114	54.2 Å²	54.2	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-59.4	-49.3	173.2	175	-101.4	0	0	0	111.3	E240 E241 I242 L246 N247 I248	E240-F244 WeakPolarHBondContact O-CB 3.42Å; E240-F244 PolarHBondContact O-N 3.36Å; E241-F244 WeakPolarHBondContact O-CB 3.49Å; E241-F244 PolarHBondContact O-N 3Å; I242-F244 VanDerWaalsContact C-N 3.3Å; I242-F244 PolarHBondContact O-N 3.17Å; F244-L246 PolarHBondContact O-N 2.03Å; F244-N247 PolarHBondContact O-N 3.47Å; F244-I248 HydrophobicContact CD1-CD1 3.86Å; F244-I248 HydrophobicContact CE1-CD1 3.34Å; F244-I248 HydrophobicContact CE1-CG1 4.41Å; F244-I248 HydrophobicContact CE2-CD1 4.31Å; F244-I248 HydrophobicContact CZ-CD1 3.6Å; F244-I248 HydrophobicContact CZ-CG1 4.4Å; F244-I248 WeakPolarHBondContact O-CG1 3Å; F244-I248 PolarHBondContact O-N 3.2Å
245	Y	91.6	Very high	93.1	Very high	122 Å²	122	57.5 Å²	57.5	48%	0.478	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-41	175.1	-72.2	-71.2	0	0	0	112.8	E241 I242 N247 I248 M249	E241-Y245 HydrophobicContact CG-CE2 4.07Å; E241-Y245 VanDerWaalsContact O-CD2 3.22Å; E241-Y245 WeakPolarHBondContact O-CD2 3.37Å; E241-Y245 PolarHBondContact O-N 3.4Å; E241-Y245 WeakPolarHBondContact OE1-CE2 3.26Å; E241-Y245 PolarHBondContact OE1-OH 2.9Å; I242-Y245 PolarHBondContact O-N 3.48Å; Y245-N247 VanDerWaalsContact C-N 3.34Å; Y245-N247 PolarHBondContact O-N 3.49Å; Y245-I248 WeakPolarHBondContact O-CB 3.5Å; Y245-I248 PolarHBondContact O-N 2.99Å; Y245-M249 VanDerWaalsContact O-CE 3.29Å; Y245-M249 WeakPolarHBondContact O-CE 3.24Å; Y245-M249 PolarHBondContact O-N 3.44Å
246	L	92.1	Very high	93	Very high	30 Å²	30	57.5 Å²	57.5	16%	0.157	29%	0.294	C	S	.	.	H	α-helix	trans	-59	-44.2	174.3	-71.5	170.7	0	0	0	111.8	L75 Y126 T133 I242 S243 F244 I248 M249 V250	L75-L246 HydrophobicContact CD1-CD2 3.78Å; L75-L246 HydrophobicContact CD2-CD2 4.37Å; Y126-L246 HydrophobicContact CE2-CB 4.13Å; Y126-L246 WeakPolarHBondContact OH-CB 3.16Å; T133-L246 HydrophobicContact CG2-CD1 3.94Å; I242-L246 HydrophobicContact CG2-CD1 4.21Å; I242-L246 WeakPolarHBondContact O-CG 3.05Å; I242-L246 PolarHBondContact O-N 2.99Å; S243-L246 PolarHBondContact O-N 3.04Å; F244-L246 PolarHBondContact O-N 2.03Å; L246-I248 PolarHBondContact O-N 3.5Å; L246-M249 HydrophobicContact CD2-CE 3.95Å; L246-M249 HydrophobicContact CG-CE 4.48Å; L246-M249 PolarHBondContact O-N 2.91Å; L246-V250 WeakPolarHBondContact O-CG2 3.33Å; L246-V250 PolarHBondContact O-N 3.43Å
247	N	93	Very high	93.1	Very high	26 Å²	26	52.7 Å²	52.7	14%	0.139	27%	0.274	C	S	.	.	H	α-helix	trans	-61.5	-43.8	175.8	-72.2	-52.7	0	0	0	111.4	Y126 S243 F244 Y245 M249 V250 F251	Y126-N247 PolarHBondContact OH-OD1 3.32Å; S243-N247 WeakPolarHBondContact O-CB 3.04Å; S243-N247 VanDerWaalsContact O-CG 3.27Å; S243-N247 PolarHBondContact O-N 2.82Å; S243-N247 PolarHBondContact O-ND2 2.96Å; F244-N247 PolarHBondContact O-N 3.47Å; Y245-N247 VanDerWaalsContact C-N 3.34Å; Y245-N247 PolarHBondContact O-N 3.49Å; N247-M249 VanDerWaalsContact C-N 3.3Å; N247-M249 PolarHBondContact O-N 3.11Å; N247-V250 PolarHBondContact O-N 3.18Å; N247-F251 HydrophobicContact CB-CD2 4.43Å; N247-F251 HydrophobicContact CB-CE2 4.34Å; N247-F251 WeakPolarHBondContact O-CD2 3.21Å; N247-F251 PolarHBondContact O-N 3.24Å
248	I	92.7	Very high	93.1	Very high	85 Å²	85	56.2 Å²	56.2	44%	0.436	29%	0.291	S	S	.	.	H	α-helix	trans	-56.4	-46.1	175.3	-71	171.9	0	0	0	110.9	F244 Y245 L246 F251 G252	F244-I248 HydrophobicContact CD1-CD1 3.86Å; F244-I248 HydrophobicContact CE1-CD1 3.34Å; F244-I248 HydrophobicContact CE1-CG1 4.41Å; F244-I248 HydrophobicContact CE2-CD1 4.31Å; F244-I248 HydrophobicContact CZ-CD1 3.6Å; F244-I248 HydrophobicContact CZ-CG1 4.4Å; F244-I248 WeakPolarHBondContact O-CG1 3Å; F244-I248 PolarHBondContact O-N 3.2Å; Y245-I248 WeakPolarHBondContact O-CB 3.5Å; Y245-I248 PolarHBondContact O-N 2.99Å; L246-I248 PolarHBondContact O-N 3.5Å; I248-F251 PolarHBondContact O-N 2.95Å; I248-G252 PolarHBondContact O-N 3.01Å
249	M	91.4	Very high	93.1	Very high	70 Å²	70	58.7 Å²	58.7	35%	0.345	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-41.5	178.7	-76.3	-179.6	-82.4	0	0	112.5	L75 Y245 L246 N247 G252 S253	L75-M249 HydrophobicContact CD1-CE 3.82Å; L75-M249 HydrophobicContact CD1-SD 3.69Å; L75-M249 HydrophobicContact CD2-CE 3.29Å; L75-M249 HydrophobicContact CD2-SD 3.61Å; L75-M249 HydrophobicContact CG-CE 4.05Å; L75-M249 HydrophobicContact CG-SD 3.88Å; Y245-M249 VanDerWaalsContact O-CE 3.29Å; Y245-M249 WeakPolarHBondContact O-CE 3.24Å; Y245-M249 PolarHBondContact O-N 3.44Å; L246-M249 HydrophobicContact CD2-CE 3.95Å; L246-M249 HydrophobicContact CG-CE 4.48Å; L246-M249 PolarHBondContact O-N 2.91Å; N247-M249 VanDerWaalsContact C-N 3.3Å; N247-M249 PolarHBondContact O-N 3.11Å; M249-G252 PolarHBondContact O-N 3.22Å; M249-S253 WeakPolarHBondContact O-CB 3.28Å; M249-S253 PolarHBondContact O-N 3.45Å
250	V	93.3	Very high	93.1	Very high	20 Å²	20	58.7 Å²	58.7	12%	0.121	30%	0.304	C	S	.	.	H	α-helix	trans	-63.5	-44.5	176.3	172.6	0	0	0	0	110.7	T123 Y126 Y127 L246 N247 G252 S253 I254	T123-V250 HydrophobicContact CG2-CG1 4.01Å; Y126-V250 HydrophobicContact CD1-CB 4.32Å; Y126-V250 HydrophobicContact CD1-CG1 4.12Å; Y126-V250 HydrophobicContact CD1-CG2 3.67Å; Y126-V250 HydrophobicContact CD2-CG2 4.26Å; Y126-V250 HydrophobicContact CE1-CB 4.31Å; Y126-V250 HydrophobicContact CE1-CG1 4.47Å; Y126-V250 HydrophobicContact CE1-CG2 3.78Å; Y126-V250 HydrophobicContact CE2-CG2 4.36Å; Y126-V250 HydrophobicContact CG-CG2 3.91Å; Y127-V250 HydrophobicContact CE2-CG1 3.95Å; L246-V250 WeakPolarHBondContact O-CG2 3.33Å; L246-V250 PolarHBondContact O-N 3.43Å; N247-V250 PolarHBondContact O-N 3.18Å; V250-G252 PolarHBondContact O-N 3.37Å; V250-S253 WeakPolarHBondContact O-CA 3.07Å; V250-S253 WeakPolarHBondContact O-CB 3.47Å; V250-S253 PolarHBondContact O-N 3.31Å; V250-S253 VanDerWaalsContact O-N 3.09Å; V250-S253 PolarHBondContact O-OG 2.85Å; V250-I254 WeakPolarHBondContact O-CG1 3.15Å; V250-I254 PolarHBondContact O-N 3.26Å
251	F	92.8	Very high	93.2	Very high	125 Å²	125	56.7 Å²	56.7	55%	0.548	30%	0.298	S	S	.	.	H	α-helix	trans	-60.8	-42.3	173.8	-78	-60.1	0	0	0	112.7	N247 I248 S253 I254 S255	N247-F251 HydrophobicContact CB-CD2 4.43Å; N247-F251 HydrophobicContact CB-CE2 4.34Å; N247-F251 WeakPolarHBondContact O-CD2 3.21Å; N247-F251 PolarHBondContact O-N 3.24Å; I248-F251 PolarHBondContact O-N 2.95Å; F251-S253 VanDerWaalsContact C-N 3.28Å; F251-S253 PolarHBondContact O-N 2.68Å; F251-I254 HydrophobicContact CD1-CD1 4.15Å; F251-I254 WeakPolarHBondContact O-CB 3.5Å; F251-I254 PolarHBondContact O-N 2.99Å; F251-S255 PolarHBondContact O-N 3.32Å
252	G	92.5	Very high	93.2	Very high	41 Å²	41	57.6 Å²	57.6	42%	0.423	30%	0.304	S	S	.	.	H	α-helix	trans	-59.6	-40.5	172.4	0	0	0	0	0	111.8	I248 M249 V250 I254 S255 V256	I248-G252 PolarHBondContact O-N 3.01Å; M249-G252 PolarHBondContact O-N 3.22Å; V250-G252 PolarHBondContact O-N 3.37Å; G252-I254 VanDerWaalsContact C-N 3.32Å; G252-I254 PolarHBondContact O-N 3Å; G252-S255 WeakPolarHBondContact O-CB 3.42Å; G252-S255 PolarHBondContact O-N 2.76Å; G252-S255 VanDerWaalsContact O-N 3.15Å; G252-V256 PolarHBondContact O-N 3.32Å
253	S	93.2	Very high	93.3	Very high	26 Å²	26	55.4 Å²	55.4	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-33.6	176.9	90.9	0	0	0	0	112.5	H119 M249 V250 F251 S255 V256 L257	H119-S253 PolarHBondContact CE1-O 2.58Å; H119-S253 WeakPolarHBondContact NE2-CB 3.43Å; H119-S253 PolarHBondContact NE2-OG 3.41Å; H119-S253 VanDerWaalsContact NE2-OG 3.08Å; M249-S253 WeakPolarHBondContact O-CB 3.28Å; M249-S253 PolarHBondContact O-N 3.45Å; V250-S253 WeakPolarHBondContact O-CA 3.07Å; V250-S253 WeakPolarHBondContact O-CB 3.47Å; V250-S253 PolarHBondContact O-N 3.31Å; V250-S253 VanDerWaalsContact O-N 3.09Å; V250-S253 PolarHBondContact O-OG 2.85Å; F251-S253 VanDerWaalsContact C-N 3.28Å; F251-S253 PolarHBondContact O-N 2.68Å; S253-S255 PolarHBondContact O-N 2.81Å; S253-V256 WeakPolarHBondContact O-CA 3.31Å; S253-V256 WeakPolarHBondContact O-CB 3.38Å; S253-V256 PolarHBondContact O-N 3.3Å; S253-L257 PolarHBondContact O-N 3.06Å
254	I	93.4	Very high	93.4	Very high	54 Å²	54	57.4 Å²	57.4	28%	0.277	30%	0.303	S	S	.	.	H	α-helix	trans	-60.9	-34.7	175.3	-68.1	167.9	0	0	0	111	T123 V250 F251 G252 V256 L257 L258	T123-I254 HydrophobicContact CG2-CD1 4.35Å; T123-I254 HydrophobicContact CG2-CG1 4.21Å; V250-I254 WeakPolarHBondContact O-CG1 3.15Å; V250-I254 PolarHBondContact O-N 3.26Å; F251-I254 HydrophobicContact CD1-CD1 4.15Å; F251-I254 WeakPolarHBondContact O-CB 3.5Å; F251-I254 PolarHBondContact O-N 2.99Å; G252-I254 VanDerWaalsContact C-N 3.32Å; G252-I254 PolarHBondContact O-N 3Å; I254-V256 VanDerWaalsContact C-N 3.32Å; I254-V256 PolarHBondContact O-N 3.32Å; I254-L257 WeakPolarHBondContact O-CB 3.45Å; I254-L257 PolarHBondContact O-N 3.49Å; I254-L258 WeakPolarHBondContact O-CG 3.36Å; I254-L258 PolarHBondContact O-N 3.12Å
255	S	91.5	Very high	93.5	Very high	69 Å²	69	55.9 Å²	55.9	48%	0.483	31%	0.306	S	S	.	.	H	α-helix	trans	-64.4	-38.8	174.4	-62.4	0	0	0	0	111.7	F251 G252 S253 L258 I259	F251-S255 PolarHBondContact O-N 3.32Å; G252-S255 WeakPolarHBondContact O-CB 3.42Å; G252-S255 PolarHBondContact O-N 2.76Å; G252-S255 VanDerWaalsContact O-N 3.15Å; S253-S255 PolarHBondContact O-N 2.81Å; S255-L258 PolarHBondContact O-N 3.27Å; S255-I259 WeakPolarHBondContact O-CG1 3.28Å; S255-I259 PolarHBondContact O-N 2.98Å; S255-I259 VanDerWaalsContact O-N 3.09Å
256	V	92.6	Very high	93.6	Very high	38 Å²	38	51 Å²	51	23%	0.23	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-40.2	173.4	-177	0	0	0	0	111.2	F82 G252 S253 I254 L258 I259 N260	F82-V256 HydrophobicContact CE1-CG1 3.96Å; F82-V256 HydrophobicContact CZ-CG1 4.29Å; G252-V256 PolarHBondContact O-N 3.32Å; S253-V256 WeakPolarHBondContact O-CA 3.31Å; S253-V256 WeakPolarHBondContact O-CB 3.38Å; S253-V256 PolarHBondContact O-N 3.3Å; I254-V256 VanDerWaalsContact C-N 3.32Å; I254-V256 PolarHBondContact O-N 3.32Å; V256-L258 VanDerWaalsContact C-N 3.34Å; V256-L258 PolarHBondContact O-N 3.31Å; V256-I259 PolarHBondContact O-N 3.41Å; V256-N260 PolarHBondContact O-N 3.31Å
257	L	94.4	Very high	93.6	Very high	22 Å²	22	49.6 Å²	49.6	12%	0.115	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-45.8	174.9	-176.9	62.4	0	0	0	111.4	V116 H119 L120 S253 I254 I259 N260 V261	V116-L257 HydrophobicContact CB-CD1 4.34Å; V116-L257 HydrophobicContact CG1-CD1 3.89Å; V116-L257 HydrophobicContact CG2-CD1 4.47Å; H119-L257 HydrophobicContact CB-CD1 4.08Å; L120-L257 HydrophobicContact CD1-CD2 4.4Å; S253-L257 PolarHBondContact O-N 3.06Å; I254-L257 WeakPolarHBondContact O-CB 3.45Å; I254-L257 PolarHBondContact O-N 3.49Å; L257-I259 PolarHBondContact O-N 3.37Å; L257-N260 WeakPolarHBondContact O-CB 3.39Å; L257-N260 PolarHBondContact O-N 2.91Å; L257-V261 WeakPolarHBondContact O-CG2 3.4Å; L257-V261 PolarHBondContact O-N 2.61Å
258	L	95.1	Very high	93.6	Very high	105 Å²	105	51.3 Å²	51.3	55%	0.55	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-43.2	176.5	-69.6	173	0	0	0	111.9	I254 S255 V256 N260 V261 I262	I254-L258 WeakPolarHBondContact O-CG 3.36Å; I254-L258 PolarHBondContact O-N 3.12Å; S255-L258 PolarHBondContact O-N 3.27Å; V256-L258 VanDerWaalsContact C-N 3.34Å; V256-L258 PolarHBondContact O-N 3.31Å; L258-N260 VanDerWaalsContact C-N 3.34Å; L258-N260 PolarHBondContact O-N 2.99Å; L258-V261 PolarHBondContact O-N 2.66Å; L258-I262 VanDerWaalsContact O-CG1 3.3Å; L258-I262 WeakPolarHBondContact O-CG1 3.46Å; L258-I262 PolarHBondContact O-N 3.45Å
259	I	94.3	Very high	93.5	Very high	60 Å²	60	53.4 Å²	53.4	31%	0.308	30%	0.298	S	S	.	.	H	α-helix	trans	-60.8	-44.2	175.6	-66.8	165.5	0	0	0	110.5	V13 S255 V256 L257 V261 I262 M263	V13-I259 HydrophobicContact CG1-CG2 4.26Å; S255-I259 WeakPolarHBondContact O-CG1 3.28Å; S255-I259 PolarHBondContact O-N 2.98Å; S255-I259 VanDerWaalsContact O-N 3.09Å; V256-I259 PolarHBondContact O-N 3.41Å; L257-I259 PolarHBondContact O-N 3.37Å; I259-V261 VanDerWaalsContact C-N 3.35Å; I259-V261 PolarHBondContact O-N 3.05Å; I259-I262 PolarHBondContact O-N 2.88Å; I259-M263 HydrophobicContact CG2-CE 4.23Å; I259-M263 WeakPolarHBondContact O-CG 3.33Å; I259-M263 PolarHBondContact O-N 2.03Å
260	N	94.6	Very high	93.4	Very high	1 Å²	1	50 Å²	50	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-40	176.8	-75.9	-22.4	0	0	0	112.5	N86 L112 V116 V256 L257 L258 M263 L264	N86-N260 PolarHBondContact OD1-ND2 2.94Å; N86-N260 PolarHBondContact OD1-OD1 3.5Å; L112-N260 HydrophobicContact CD1-CB 3.99Å; V116-N260 HydrophobicContact CG2-CB 3.69Å; V256-N260 PolarHBondContact O-N 3.31Å; L257-N260 WeakPolarHBondContact O-CB 3.39Å; L257-N260 PolarHBondContact O-N 2.91Å; L258-N260 VanDerWaalsContact C-N 3.34Å; L258-N260 PolarHBondContact O-N 2.99Å; N260-M263 HydrophobicContact CB-CE 4.47Å; N260-M263 PolarHBondContact O-N 2.03Å; N260-M263 WeakPolarHBondContact OD1-CE 3.37Å; N260-L264 WeakPolarHBondContact O-CB 3.32Å; N260-L264 PolarHBondContact O-N 3.02Å
261	V	95.9	Very high	93.2	Very high	59 Å²	59	49.7 Å²	49.7	36%	0.358	28%	0.279	S	S	.	.	H	α-helix	trans	-64.5	-43.3	174	172.1	0	0	0	0	111.3	V116 L257 L258 I259 M263 L264 C265	V116-V261 HydrophobicContact CG1-CG2 3.96Å; V116-V261 HydrophobicContact CG2-CG2 4.44Å; L257-V261 WeakPolarHBondContact O-CG2 3.4Å; L257-V261 PolarHBondContact O-N 2.61Å; L258-V261 PolarHBondContact O-N 2.66Å; I259-V261 VanDerWaalsContact C-N 3.35Å; I259-V261 PolarHBondContact O-N 3.05Å; V261-M263 VanDerWaalsContact C-N 3.35Å; V261-M263 PolarHBondContact O-N 2.78Å; V261-L264 WeakPolarHBondContact O-CB 3.31Å; V261-L264 PolarHBondContact O-N 2.99Å; V261-C265 PolarHBondContact O-N 2.61Å; V261-C265 PolarHBondContact O-SG 2.89Å; V261-C265 VanDerWaalsContact O-SG 3.39Å
262	I	94.7	Very high	93	Very high	92 Å²	92	50 Å²	50	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-60.5	-45.8	175.5	-69.3	164.6	0	0	0	110.3	L258 I259 L264 C265 I266	L258-I262 VanDerWaalsContact O-CG1 3.3Å; L258-I262 WeakPolarHBondContact O-CG1 3.46Å; L258-I262 PolarHBondContact O-N 3.45Å; I259-I262 PolarHBondContact O-N 2.88Å; I262-L264 VanDerWaalsContact C-N 3.3Å; I262-L264 PolarHBondContact O-N 2.79Å; I262-C265 PolarHBondContact O-N 3.02Å; I262-I266 HydrophobicContact CG2-CD1 3.61Å; I262-I266 HydrophobicContact CG2-CG1 4.32Å; I262-I266 VanDerWaalsContact O-CG1 3.27Å; I262-I266 WeakPolarHBondContact O-CG1 3.1Å; I262-I266 PolarHBondContact O-N 3.06Å
263	M	94.1	Very high	92.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-40	175.8	-74.1	-165.5	-64.7	0	0	112.2	L10 V13 T17 L112 I259 N260 V261 I266 G267	L10-M263 HydrophobicContact CD1-CB 4.49Å; V13-M263 HydrophobicContact CB-CG 4.34Å; V13-M263 HydrophobicContact CG1-CG 3.47Å; V13-M263 VanDerWaalsContact CG1-CG 3.47Å; V13-M263 HydrophobicContact CG1-SD 3.84Å; T17-M263 HydrophobicContact CG2-CE 4.39Å; L112-M263 HydrophobicContact CD1-CE 4.45Å; L112-M263 HydrophobicContact CD2-CB 3.85Å; I259-M263 HydrophobicContact CG2-CE 4.23Å; I259-M263 WeakPolarHBondContact O-CG 3.33Å; I259-M263 PolarHBondContact O-N 2.03Å; N260-M263 HydrophobicContact CB-CE 4.47Å; N260-M263 PolarHBondContact O-N 2.03Å; N260-M263 WeakPolarHBondContact OD1-CE 3.37Å; V261-M263 VanDerWaalsContact C-N 3.35Å; V261-M263 PolarHBondContact O-N 2.78Å; M263-I266 PolarHBondContact O-N 2.63Å; M263-G267 PolarHBondContact O-N 3.48Å
264	L	95.2	Very high	92.2	Very high	46 Å²	46	49.6 Å²	49.6	24%	0.241	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-47.1	176.1	-173	66.2	0	0	0	111.1	Q109 L112 N260 V261 I262 G267 V268	Q109-L264 HydrophobicContact CB-CD1 4.09Å; Q109-L264 HydrophobicContact CG-CD1 4.47Å; Q109-L264 WeakPolarHBondContact O-CD1 3.26Å; L112-L264 HydrophobicContact CD2-CB 4Å; L112-L264 HydrophobicContact CD2-CD1 4.32Å; L112-L264 HydrophobicContact CG-CD1 4.48Å; N260-L264 WeakPolarHBondContact O-CB 3.32Å; N260-L264 PolarHBondContact O-N 3.02Å; V261-L264 WeakPolarHBondContact O-CB 3.31Å; V261-L264 PolarHBondContact O-N 2.99Å; I262-L264 VanDerWaalsContact C-N 3.3Å; I262-L264 PolarHBondContact O-N 2.79Å; L264-G267 PolarHBondContact O-N 2.89Å; L264-V268 WeakPolarHBondContact O-CG2 3.05Å; L264-V268 PolarHBondContact O-N 3.23Å
265	C	94.7	Very high	91.6	Very high	82 Å²	82	49.5 Å²	49.5	55%	0.554	27%	0.266	S	S	*	.	H	α-helix	trans	-60.4	-46.1	176.9	-72.3	0	0	0	0	112.6	V261 I262 G267 V268 K269	V261-C265 PolarHBondContact O-N 2.61Å; V261-C265 PolarHBondContact O-SG 2.89Å; V261-C265 VanDerWaalsContact O-SG 3.39Å; I262-C265 PolarHBondContact O-N 3.02Å; C265-G267 VanDerWaalsContact C-N 3.31Å; C265-G267 PolarHBondContact O-N 2.77Å; C265-V268 PolarHBondContact O-N 3.4Å; C265-K269 PolarHBondContact O-N 3.33Å; C265-K269 VanDerWaalsContact O-N 3.14Å
266	I	93.7	Very high	91.1	Very high	20 Å²	20	54.6 Å²	54.6	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-40.6	176.3	-62	162.7	0	0	0	110	S6 L9 L10 V13 I262 M263 V268 K269 A270	S6-I266 WeakPolarHBondContact O-CG2 3.42Å; L9-I266 HydrophobicContact CD2-CD1 3.69Å; L9-I266 HydrophobicContact CD2-CG1 4.02Å; L9-I266 HydrophobicContact CD2-CG2 4.33Å; L9-I266 HydrophobicContact CG-CD1 3.94Å; L9-I266 HydrophobicContact CG-CG2 4.49Å; L10-I266 HydrophobicContact CB-CG2 3.78Å; L10-I266 HydrophobicContact CD1-CB 4.15Å; L10-I266 HydrophobicContact CD1-CG2 4.03Å; L10-I266 HydrophobicContact CG-CG2 4.42Å; V13-I266 HydrophobicContact CG2-CD1 4.44Å; I262-I266 HydrophobicContact CG2-CD1 3.61Å; I262-I266 HydrophobicContact CG2-CG1 4.32Å; I262-I266 VanDerWaalsContact O-CG1 3.27Å; I262-I266 WeakPolarHBondContact O-CG1 3.1Å; I262-I266 PolarHBondContact O-N 3.06Å; M263-I266 PolarHBondContact O-N 2.63Å; I266-V268 VanDerWaalsContact C-N 3.32Å; I266-V268 PolarHBondContact O-N 3.03Å; I266-K269 WeakPolarHBondContact O-CB 3.26Å; I266-K269 PolarHBondContact O-N 3.05Å; I266-A270 WeakPolarHBondContact O-CB 3.42Å; I266-A270 PolarHBondContact O-N 3.21Å
267	G	92.4	Very high	90.2	Very high	1 Å²	1	58 Å²	58	1%	0.01	29%	0.29	C	S	.	.	H	α-helix	trans	-57.2	-42.5	174	0	0	0	0	0	112.7	Q109 M263 L264 C265 K269 A270 V271	Q109-G267 PolarHBondContact NE2-O 3.02Å; M263-G267 PolarHBondContact O-N 3.48Å; L264-G267 PolarHBondContact O-N 2.89Å; C265-G267 VanDerWaalsContact C-N 3.31Å; C265-G267 PolarHBondContact O-N 2.77Å; G267-K269 VanDerWaalsContact C-N 3.32Å; G267-K269 PolarHBondContact O-N 3.05Å; G267-A270 WeakPolarHBondContact O-CB 3.38Å; G267-A270 PolarHBondContact O-N 2.74Å; G267-V271 WeakPolarHBondContact O-CG2 3.43Å; G267-V271 PolarHBondContact O-N 3.04Å
268	V	92.6	Very high	88.9	Confident	61 Å²	61	64.4 Å²	64.4	37%	0.37	32%	0.317	S	S	.	.	H	α-helix	trans	-63.7	-42.6	178	172.7	0	0	0	0	110.2	L264 C265 I266 V271 K272	L264-V268 WeakPolarHBondContact O-CG2 3.05Å; L264-V268 PolarHBondContact O-N 3.23Å; C265-V268 PolarHBondContact O-N 3.4Å; I266-V268 VanDerWaalsContact C-N 3.32Å; I266-V268 PolarHBondContact O-N 3.03Å; V268-V271 PolarHBondContact O-N 3.34Å; V268-K272 HydrophobicContact CG1-CD 4.44Å; V268-K272 WeakPolarHBondContact O-CG 3.43Å; V268-K272 PolarHBondContact O-N 3.02Å; V268-K272 VanDerWaalsContact O-N 3.11Å
269	K	91.7	Very high	87.1	Confident	129 Å²	129	69.1 Å²	69.1	56%	0.561	34%	0.338	S	S	*	.	H	α-helix	trans	-63.2	-44.4	175.1	-172.3	171.9	-179	169.1	0	111.7	C265 I266 G267 V271 K272 D273	C265-K269 PolarHBondContact O-N 3.33Å; C265-K269 VanDerWaalsContact O-N 3.14Å; I266-K269 WeakPolarHBondContact O-CB 3.26Å; I266-K269 PolarHBondContact O-N 3.05Å; G267-K269 VanDerWaalsContact C-N 3.32Å; G267-K269 PolarHBondContact O-N 3.05Å; K269-V271 VanDerWaalsContact C-N 3.33Å; K269-V271 PolarHBondContact O-N 2.93Å; K269-K272 PolarHBondContact O-N 3.19Å; K269-K272 VanDerWaalsContact O-N 3.15Å; K269-D273 VanDerWaalsContact O-CG 3.27Å; K269-D273 PolarHBondContact O-N 2.84Å
270	A	89.7	Confident	86.8	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-59	-40	177.9	0	0	0	0	0	113.2	H7 L10 L105 I266 G267 F274	H7-A270 VanDerWaalsContact CD2-CB 3.47Å; H7-A270 WeakPolarHBondContact CD2-CB 3Å; H7-A270 PolarHBondContact NE2-O 3.42Å; H7-A270 VanDerWaalsContact NE2-O 3.16Å; L10-A270 HydrophobicContact CD2-CB 4.38Å; L105-A270 HydrophobicContact CD2-CB 3.8Å; I266-A270 WeakPolarHBondContact O-CB 3.42Å; I266-A270 PolarHBondContact O-N 3.21Å; G267-A270 WeakPolarHBondContact O-CB 3.38Å; G267-A270 PolarHBondContact O-N 2.74Å; A270-F274 WeakPolarHBondContact O-CB 3.31Å; A270-F274 PolarHBondContact O-N 2.9Å; A270-F274 VanDerWaalsContact O-N 3.11Å
271	V	88.7	Confident	86.3	Confident	12 Å²	12	73.2 Å²	73.2	7%	0.073	36%	0.357	C	S	.	.	H	α-helix	trans	-68.5	-41.5	174.6	172.1	0	0	0	0	111.5	L105 R106 G267 V268 K269 F274 N275	L105-V271 HydrophobicContact CB-CG2 3.6Å; L105-V271 HydrophobicContact CD2-CG2 3.93Å; L105-V271 HydrophobicContact CG-CG2 4.42Å; R106-V271 HydrophobicContact CG-CG1 4.29Å; R106-V271 HydrophobicContact CG-CG2 4.41Å; G267-V271 WeakPolarHBondContact O-CG2 3.43Å; G267-V271 PolarHBondContact O-N 3.04Å; V268-V271 PolarHBondContact O-N 3.34Å; K269-V271 VanDerWaalsContact C-N 3.33Å; K269-V271 PolarHBondContact O-N 2.93Å; V271-F274 PolarHBondContact O-N 3.47Å; V271-N275 VanDerWaalsContact O-CG 3.24Å; V271-N275 PolarHBondContact O-N 2.88Å; V271-N275 PolarHBondContact O-ND2 3.13Å
272	K	88.7	Confident	85.8	Confident	131 Å²	131	73.9 Å²	73.9	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-62.7	-45.5	176.6	-75	179.3	178.9	-179	0	111.8	V268 K269 F274 N275 R276	V268-K272 HydrophobicContact CG1-CD 4.44Å; V268-K272 WeakPolarHBondContact O-CG 3.43Å; V268-K272 PolarHBondContact O-N 3.02Å; V268-K272 VanDerWaalsContact O-N 3.11Å; K269-K272 PolarHBondContact O-N 3.19Å; K269-K272 VanDerWaalsContact O-N 3.15Å; K272-F274 VanDerWaalsContact C-N 3.3Å; K272-F274 PolarHBondContact O-N 2.78Å; K272-N275 PolarHBondContact O-N 2.95Å; K272-R276 PolarHBondContact O-N 3.07Å; K272-R276 VanDerWaalsContact O-N 3.11Å
273	D	85.6	Confident	85.3	Confident	35 Å²	35	72.9 Å²	72.9	19%	0.187	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-40.8	178.2	-67.1	-18.5	0	0	0	110.9	A4 S6 K269 R276 I277	A4-D273 HydrophobicContact CB-CB 4Å; S6-D273 VanDerWaalsContact CB-OD2 3.32Å; S6-D273 WeakPolarHBondContact CB-OD2 3.35Å; S6-D273 PolarHBondContact OG-OD2 2.75Å; K269-D273 VanDerWaalsContact O-CG 3.27Å; K269-D273 PolarHBondContact O-N 2.84Å; D273-R276 PolarHBondContact O-N 2.81Å; D273-I277 WeakPolarHBondContact O-CG1 3.42Å; D273-I277 PolarHBondContact O-N 2.8Å
274	F	82.3	Confident	84.7	Confident	25 Å²	25	77.4 Å²	77.4	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-65.2	-40.6	177	-173.2	-94.7	0	0	0	113.2	Q100 A270 V271 K272 R276 I277 K278	Q100-F274 HydrophobicContact CB-CE2 4.18Å; Q100-F274 WeakPolarHBondContact O-CE2 3.48Å; Q100-F274 WeakPolarHBondContact O-CZ 3.44Å; A270-F274 WeakPolarHBondContact O-CB 3.31Å; A270-F274 PolarHBondContact O-N 2.9Å; A270-F274 VanDerWaalsContact O-N 3.11Å; V271-F274 PolarHBondContact O-N 3.47Å; K272-F274 VanDerWaalsContact C-N 3.3Å; K272-F274 PolarHBondContact O-N 2.78Å; F274-R276 VanDerWaalsContact C-N 3.3Å; F274-R276 PolarHBondContact O-N 3.42Å; F274-I277 PolarHBondContact O-N 3.23Å; F274-K278 HydrophobicContact CD1-CD 4.45Å; F274-K278 HydrophobicContact CE1-CD 3.8Å; F274-K278 HydrophobicContact CE1-CG 4.4Å; F274-K278 HydrophobicContact CZ-CD 4.31Å; F274-K278 VanDerWaalsContact CZ-CE 3.44Å; F274-K278 PolarHBondContact O-N 3.08Å
275	N	81.5	Confident	84	Confident	52 Å²	52	79.5 Å²	79.5	28%	0.278	38%	0.381	S	S	.	.	H	α-helix	trans	-69.1	-29.8	178	-62	-25.5	0	0	0	112.1	S102 V271 K272 I277 K278 M279	S102-N275 PolarHBondContact OG-OD1 2.86Å; V271-N275 VanDerWaalsContact O-CG 3.24Å; V271-N275 PolarHBondContact O-N 2.88Å; V271-N275 PolarHBondContact O-ND2 3.13Å; K272-N275 PolarHBondContact O-N 2.95Å; N275-I277 VanDerWaalsContact C-N 3.35Å; N275-K278 PolarHBondContact O-N 3.41Å; N275-M279 PolarHBondContact O-N 3.04Å
276	R	80	Confident	83.3	Confident	176 Å²	176	79.4 Å²	79.4	66%	0.664	37%	0.369	S	S	*	.	H	α-helix	trans	-68.8	-30.4	174.6	-75.6	-179.6	178	-178.1	-2.3	113.4	K272 D273 F274 K278	K272-R276 PolarHBondContact O-N 3.07Å; K272-R276 VanDerWaalsContact O-N 3.11Å; D273-R276 PolarHBondContact O-N 2.81Å; F274-R276 VanDerWaalsContact C-N 3.3Å; F274-R276 PolarHBondContact O-N 3.42Å; R276-K278 VanDerWaalsContact C-N 3.31Å
277	I	73.8	Confident	82.5	Confident	110 Å²	110	83.9 Å²	83.9	56%	0.564	39%	0.39	S	S	*	.	H	α-helix	trans	-75.8	-23.5	178.5	-65.1	164.3	0	0	0	111.5	D273 F274 N275	D273-I277 WeakPolarHBondContact O-CG1 3.42Å; D273-I277 PolarHBondContact O-N 2.8Å; F274-I277 PolarHBondContact O-N 3.23Å; N275-I277 VanDerWaalsContact C-N 3.35Å
278	K	67	Low	81.6	Confident	156 Å²	156	90.8 Å²	90.8	68%	0.678	42%	0.421	S	S	*	.			trans	-86.7	-14.3	178.9	-77.5	-167.4	168.6	-170.9	0	114.5	F274 N275 R276	F274-K278 HydrophobicContact CD1-CD 4.45Å; F274-K278 HydrophobicContact CE1-CD 3.8Å; F274-K278 HydrophobicContact CE1-CG 4.4Å; F274-K278 HydrophobicContact CZ-CD 4.31Å; F274-K278 VanDerWaalsContact CZ-CE 3.44Å; F274-K278 PolarHBondContact O-N 3.08Å; N275-K278 PolarHBondContact O-N 3.41Å; R276-K278 VanDerWaalsContact C-N 3.31Å
279	M	58.1	Low	80.7	Confident	203 Å²	203	93.5 Å²	93.5	100%	1	43%	0.426	S	S	*	.			trans	-91.1	0	172.1	-70.9	-174.8	-72.8	0	0	109.2	N275	N275-M279 PolarHBondContact O-N 3.04Å

Retrieved 279 of 279 residues in 366.9 ms (Link to these results)

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