A0A096N9S6_PAPAN Loading...

Claudin

Claudins function as major constituents of the tight junction complexes that regulate the permeability of epithelia.

AlphaFold DB , UniProt , Accession A0A096N9S6, Species PAPAN (Papio anubis, Olive baboon), Gene CLDN14, Length 239 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	46.4	Very low	81.7	Confident	214 Å²	214	64.7 Å²	64.7	100%	1.054	38%	0.382	S	S	*	.				0	-39.4	0	-63.3	-153.9	-71.7	0	0	113	S3 T4	M1-S3 PolarHBondContact O-N 3.21Å; M1-T4 PolarHBondContact O-N 3.42Å
2	A	54.6	Low	82.9	Confident	76 Å²	76	65.9 Å²	65.9	63%	0.628	38%	0.384	S	S	*	.	H	α-helix	trans	-56.1	-43.2	179.6	0	0	0	0	0	114.8	T4 A5 V6	A2-T4 VanDerWaalsContact C-N 3.31Å; A2-T4 PolarHBondContact O-N 3.12Å; A2-A5 PolarHBondContact O-N 3.17Å; A2-A5 VanDerWaalsContact O-N 3.14Å; A2-V6 WeakPolarHBondContact O-CG2 3.25Å; A2-V6 PolarHBondContact O-N 2.98Å; A2-V6 VanDerWaalsContact O-N 3.09Å
3	S	75.9	Confident	84	Confident	25 Å²	25	63.6 Å²	63.6	18%	0.175	37%	0.369	C	S	.	.	H	α-helix	trans	-56.9	-38.4	179.6	165.9	0	0	0	0	113.5	M1 Q7 K103	M1-S3 PolarHBondContact O-N 3.21Å; S3-Q7 WeakPolarHBondContact O-CB 3.19Å; S3-Q7 PolarHBondContact O-N 3.43Å; S3-K103 PolarHBondContact OG-NZ 2.7Å
4	T	82.7	Confident	84.9	Confident	60 Å²	60	59.1 Å²	59.1	37%	0.368	34%	0.343	S	S	.	.	H	α-helix	trans	-69	-38.8	178.8	-45.9	0	0	0	0	112	M1 A2 L8	M1-T4 PolarHBondContact O-N 3.42Å; A2-T4 VanDerWaalsContact C-N 3.31Å; A2-T4 PolarHBondContact O-N 3.12Å; T4-L8 WeakPolarHBondContact O-CB 3.04Å; T4-L8 PolarHBondContact O-N 3.37Å
5	A	86.4	Confident	85.7	Confident	63 Å²	63	60.9 Å²	60.9	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-67.4	-43.3	178.9	0	0	0	0	0	111.6	A2 L8 L9	A2-A5 PolarHBondContact O-N 3.17Å; A2-A5 VanDerWaalsContact O-N 3.14Å; A5-L8 PolarHBondContact O-N 3.28Å; A5-L9 WeakPolarHBondContact O-CB 3.45Å; A5-L9 PolarHBondContact O-N 3.34Å
6	V	89.3	Confident	86.5	Confident	58 Å²	58	63.3 Å²	63.3	35%	0.352	36%	0.356	S	S	.	.	H	α-helix	trans	-65.8	-40.5	176.9	-177.1	0	0	0	0	111.1	A2 L9 G10 L180 S184	A2-V6 WeakPolarHBondContact O-CG2 3.25Å; A2-V6 PolarHBondContact O-N 2.98Å; A2-V6 VanDerWaalsContact O-N 3.09Å; V6-L9 PolarHBondContact O-N 3.33Å; V6-G10 PolarHBondContact O-N 3.16Å; V6-L180 HydrophobicContact CG1-CB 4.47Å; V6-L180 HydrophobicContact CG1-CD2 4.12Å; V6-S184 VanDerWaalsContact CG1-OG 3.26Å; V6-S184 WeakPolarHBondContact CG1-OG 3.43Å
7	Q	89.7	Confident	87.1	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-43.7	175.8	-172.8	173.7	19.6	0	0	112	S3 F11 M102 L181	S3-Q7 WeakPolarHBondContact O-CB 3.19Å; S3-Q7 PolarHBondContact O-N 3.43Å; Q7-F11 WeakPolarHBondContact O-CB 3.36Å; Q7-F11 PolarHBondContact O-N 3.37Å; Q7-M102 HydrophobicContact CG-CG 4.5Å; Q7-L181 HydrophobicContact CG-CD2 4.09Å; Q7-L181 WeakPolarHBondContact O-CD2 3.43Å
8	L	91.3	Very high	87.7	Confident	86 Å²	86	58.6 Å²	58.6	45%	0.45	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-44.7	176.8	-165.6	96.7	0	0	0	111.1	T4 A5 F11 L12	T4-L8 WeakPolarHBondContact O-CB 3.04Å; T4-L8 PolarHBondContact O-N 3.37Å; A5-L8 PolarHBondContact O-N 3.28Å; L8-F11 PolarHBondContact O-N 3.12Å; L8-L12 HydrophobicContact CD2-CD1 4.14Å; L8-L12 HydrophobicContact CG-CD1 4.35Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 2.75Å
9	L	93.9	Very high	88.2	Confident	91 Å²	91	58.3 Å²	58.3	48%	0.476	33%	0.328	S	S	.	.	H	α-helix	trans	-60	-48.8	176.9	-178.1	64.6	0	0	0	111	A5 V6 F11 L12 L13	A5-L9 WeakPolarHBondContact O-CB 3.45Å; A5-L9 PolarHBondContact O-N 3.34Å; V6-L9 PolarHBondContact O-N 3.33Å; L9-F11 VanDerWaalsContact C-N 3.3Å; L9-F11 PolarHBondContact O-N 2.77Å; L9-L12 PolarHBondContact O-N 2.86Å; L9-L13 HydrophobicContact CD1-CD1 3.49Å; L9-L13 VanDerWaalsContact CD1-CD1 3.49Å; L9-L13 HydrophobicContact CG-CD1 3.89Å; L9-L13 WeakPolarHBondContact O-CD1 3.04Å; L9-L13 PolarHBondContact O-N 2.89Å
10	G	94.4	Very high	88.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-58.8	-40.6	176.9	0	0	0	0	0	112.7	V6 S14 G177	V6-G10 PolarHBondContact O-N 3.16Å; G10-S14 WeakPolarHBondContact O-CB 3.24Å; G10-S14 PolarHBondContact O-N 3.06Å; G10-S14 PolarHBondContact O-OG 3.29Å; G10-G177 CarbonylContact O-C 3.18Å; G10-G177 VanDerWaalsContact O-CA 3.27Å; G10-G177 WeakPolarHBondContact O-CA 3.19Å
11	F	94.6	Very high	89	Confident	29 Å²	29	53.2 Å²	53.2	13%	0.127	30%	0.302	C	S	.	.	H	α-helix	trans	-63.9	-46.8	174.2	179.7	-103.1	0	0	0	112.3	Q7 L8 L9 S14 F15 A98 V99 M102 L181	Q7-F11 WeakPolarHBondContact O-CB 3.36Å; Q7-F11 PolarHBondContact O-N 3.37Å; L8-F11 PolarHBondContact O-N 3.12Å; L9-F11 VanDerWaalsContact C-N 3.3Å; L9-F11 PolarHBondContact O-N 2.77Å; F11-S14 PolarHBondContact O-N 3.18Å; F11-F15 WeakPolarHBondContact O-CB 2.95Å; F11-F15 PolarHBondContact O-N 2.75Å; F11-A98 HydrophobicContact CD2-CB 3.96Å; F11-A98 HydrophobicContact CE2-CB 4.12Å; F11-V99 HydrophobicContact CE2-CG2 3.78Å; F11-V99 HydrophobicContact CZ-CG2 3.7Å; F11-M102 HydrophobicContact CB-SD 4.02Å; F11-M102 HydrophobicContact CD1-CE 3.94Å; F11-M102 HydrophobicContact CD1-SD 4.02Å; F11-M102 HydrophobicContact CD2-CE 3.86Å; F11-M102 HydrophobicContact CD2-SD 4.08Å; F11-M102 HydrophobicContact CE1-CE 3.88Å; F11-M102 HydrophobicContact CE2-CE 3.8Å; F11-M102 HydrophobicContact CG-CE 3.93Å; F11-M102 HydrophobicContact CG-SD 3.75Å; F11-M102 HydrophobicContact CZ-CE 3.81Å; F11-L181 HydrophobicContact CB-CD2 4.23Å
12	L	96.1	Very high	91.4	Very high	79 Å²	79	47.4 Å²	47.4	41%	0.414	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-46.4	178.5	-70.3	172.6	0	0	0	111.4	L8 L9 S14 F15 L16	L8-L12 HydrophobicContact CD2-CD1 4.14Å; L8-L12 HydrophobicContact CG-CD1 4.35Å; L8-L12 VanDerWaalsContact O-CG 3.3Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 2.75Å; L9-L12 PolarHBondContact O-N 2.86Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 3.49Å; L12-F15 PolarHBondContact O-N 2.89Å; L12-L16 WeakPolarHBondContact O-CD1 3.32Å; L12-L16 PolarHBondContact O-N 3.4Å
13	L	97.1	Very high	93.4	Very high	36 Å²	36	47.6 Å²	47.6	19%	0.188	26%	0.264	C	S	.	.	H	α-helix	trans	-59.2	-44.8	175.8	-92.2	70.7	0	0	0	111.5	L9 F15 L16 G17 L173 I176 L180	L9-L13 HydrophobicContact CD1-CD1 3.49Å; L9-L13 VanDerWaalsContact CD1-CD1 3.49Å; L9-L13 HydrophobicContact CG-CD1 3.89Å; L9-L13 WeakPolarHBondContact O-CD1 3.04Å; L9-L13 PolarHBondContact O-N 2.89Å; L13-F15 VanDerWaalsContact C-N 3.35Å; L13-F15 PolarHBondContact O-N 2.96Å; L13-L16 PolarHBondContact O-N 2.83Å; L13-G17 PolarHBondContact O-N 2.9Å; L13-L173 HydrophobicContact CG-CD2 4.06Å; L13-I176 HydrophobicContact CD2-CB 4.26Å; L13-I176 HydrophobicContact CD2-CG2 3.66Å; L13-L180 HydrophobicContact CD2-CD1 4.41Å
14	S	96.8	Very high	94.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-40.5	177.9	-56.2	0	0	0	0	112.2	G10 F11 L12 G17 M18 G177 G178	G10-S14 WeakPolarHBondContact O-CB 3.24Å; G10-S14 PolarHBondContact O-N 3.06Å; G10-S14 PolarHBondContact O-OG 3.29Å; F11-S14 PolarHBondContact O-N 3.18Å; L12-S14 VanDerWaalsContact C-N 3.33Å; L12-S14 PolarHBondContact O-N 3.49Å; S14-G17 PolarHBondContact O-N 3.34Å; S14-M18 PolarHBondContact O-N 3.38Å; S14-G177 VanDerWaalsContact OG-CA 3.23Å; S14-G177 WeakPolarHBondContact OG-CA 3.49Å; S14-G177 PolarHBondContact OG-O 3.42Å; S14-G178 PolarHBondContact OG-N 3.44Å
15	F	96.9	Very high	94.9	Very high	87 Å²	87	43.9 Å²	43.9	38%	0.382	24%	0.24	S	C	.	.	H	α-helix	trans	-66.3	-44.9	177.6	-177.8	-101	0	0	0	111.7	F11 L12 L13 G17 M18 V19	F11-F15 WeakPolarHBondContact O-CB 2.95Å; F11-F15 PolarHBondContact O-N 2.75Å; L12-F15 PolarHBondContact O-N 2.89Å; L13-F15 VanDerWaalsContact C-N 3.35Å; L13-F15 PolarHBondContact O-N 2.96Å; F15-G17 VanDerWaalsContact C-N 3.31Å; F15-G17 PolarHBondContact O-N 3.45Å; F15-M18 HydrophobicContact CD2-CE 3.9Å; F15-M18 HydrophobicContact CE2-CE 3.72Å; F15-M18 WeakPolarHBondContact O-CB 3.47Å; F15-M18 PolarHBondContact O-N 2.96Å; F15-V19 HydrophobicContact CD1-CG2 4.41Å; F15-V19 HydrophobicContact CE1-CG2 4.02Å; F15-V19 HydrophobicContact CZ-CG2 4.08Å; F15-V19 WeakPolarHBondContact O-CG2 3.36Å; F15-V19 PolarHBondContact O-N 3.47Å
16	L	97.8	Very high	95.2	Very high	99 Å²	99	45.5 Å²	45.5	52%	0.518	24%	0.239	S	C	.	.	H	α-helix	trans	-61.1	-41.4	173.3	-90.1	79	0	0	0	111.3	L12 L13 V19 G20	L12-L16 WeakPolarHBondContact O-CD1 3.32Å; L12-L16 PolarHBondContact O-N 3.4Å; L13-L16 PolarHBondContact O-N 2.83Å; L16-V19 PolarHBondContact O-N 2.86Å; L16-G20 PolarHBondContact O-N 3.44Å
17	G	97.4	Very high	95.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-40.4	174.8	0	0	0	0	0	113	L13 S14 F15 G20 T21 S170 S174	L13-G17 PolarHBondContact O-N 2.9Å; S14-G17 PolarHBondContact O-N 3.34Å; F15-G17 VanDerWaalsContact C-N 3.31Å; F15-G17 PolarHBondContact O-N 3.45Å; G17-G20 PolarHBondContact O-N 3.36Å; G17-T21 WeakPolarHBondContact O-CB 3.39Å; G17-T21 PolarHBondContact O-N 3.25Å; G17-T21 PolarHBondContact O-OG1 3.17Å; G17-S170 WeakPolarHBondContact CA-O 3.36Å; G17-S174 WeakPolarHBondContact CA-OG 3.32Å
18	M	97.4	Very high	95.4	Very high	41 Å²	41	45.6 Å²	45.6	20%	0.202	24%	0.238	C	C	.	.	H	α-helix	trans	-61.2	-48.9	173.8	179.9	-169.6	84.2	0	0	111.7	S14 F15 G20 T21 L22 C95 F125	S14-M18 PolarHBondContact O-N 3.38Å; F15-M18 HydrophobicContact CD2-CE 3.9Å; F15-M18 HydrophobicContact CE2-CE 3.72Å; F15-M18 WeakPolarHBondContact O-CB 3.47Å; F15-M18 PolarHBondContact O-N 2.96Å; M18-G20 VanDerWaalsContact C-N 3.34Å; M18-T21 PolarHBondContact O-N 3.42Å; M18-L22 PolarHBondContact O-N 3.41Å; M18-C95 HydrophobicContact SD-CB 4.01Å; M18-F125 HydrophobicContact CB-CE1 4.32Å
19	V	97.8	Very high	95.4	Very high	54 Å²	54	44.1 Å²	44.1	33%	0.327	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-43.8	178.4	173.4	0	0	0	0	110.4	F15 L16 T21 L22 I23	F15-V19 HydrophobicContact CD1-CG2 4.41Å; F15-V19 HydrophobicContact CE1-CG2 4.02Å; F15-V19 HydrophobicContact CZ-CG2 4.08Å; F15-V19 WeakPolarHBondContact O-CG2 3.36Å; F15-V19 PolarHBondContact O-N 3.47Å; L16-V19 PolarHBondContact O-N 2.86Å; V19-T21 VanDerWaalsContact C-N 3.35Å; V19-T21 PolarHBondContact O-N 3.12Å; V19-L22 WeakPolarHBondContact O-CB 3.41Å; V19-L22 PolarHBondContact O-N 3.33Å; V19-I23 HydrophobicContact CG1-CD1 3.83Å; V19-I23 HydrophobicContact CG1-CG1 4.43Å; V19-I23 VanDerWaalsContact O-CG1 3.3Å; V19-I23 WeakPolarHBondContact O-CG1 3.37Å; V19-I23 PolarHBondContact O-N 3.37Å
20	G	96.8	Very high	95.3	Very high	10 Å²	10	40 Å²	40	10%	0.103	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-43.7	174.7	0	0	0	0	0	112.5	L16 G17 M18 L22 I23 T24	L16-G20 PolarHBondContact O-N 3.44Å; G17-G20 PolarHBondContact O-N 3.36Å; M18-G20 VanDerWaalsContact C-N 3.34Å; G20-L22 VanDerWaalsContact C-N 3.33Å; G20-L22 PolarHBondContact O-N 3.18Å; G20-I23 PolarHBondContact O-N 3.25Å; G20-T24 WeakPolarHBondContact O-CB 3.49Å; G20-T24 PolarHBondContact O-N 2.86Å; G20-T24 PolarHBondContact O-OG1 2.76Å; G20-T24 VanDerWaalsContact O-OG1 3.07Å
21	T	96.7	Very high	95.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.3	-39.2	177.3	-57.6	0	0	0	0	111.4	G17 M18 V19 T25 M84 C132 S170	G17-T21 WeakPolarHBondContact O-CB 3.39Å; G17-T21 PolarHBondContact O-N 3.25Å; G17-T21 PolarHBondContact O-OG1 3.17Å; M18-T21 PolarHBondContact O-N 3.42Å; V19-T21 VanDerWaalsContact C-N 3.35Å; V19-T21 PolarHBondContact O-N 3.12Å; T21-T25 WeakPolarHBondContact O-CB 3.32Å; T21-T25 PolarHBondContact O-N 3.18Å; T21-T25 PolarHBondContact O-OG1 3.4Å; T21-M84 HydrophobicContact CG2-CE 3.93Å; T21-C132 HydrophobicContact CG2-CB 4.23Å; T21-S170 PolarHBondContact OG1-OG 2.94Å
22	L	96.7	Very high	94.7	Very high	91 Å²	91	46.7 Å²	46.7	48%	0.476	23%	0.231	S	C	.	.	H	α-helix	trans	-64	-47.3	175.1	-174.9	69.9	0	0	0	111.4	M18 V19 G20 T25 I26	M18-L22 PolarHBondContact O-N 3.41Å; V19-L22 WeakPolarHBondContact O-CB 3.41Å; V19-L22 PolarHBondContact O-N 3.33Å; G20-L22 VanDerWaalsContact C-N 3.33Å; G20-L22 PolarHBondContact O-N 3.18Å; L22-T25 WeakPolarHBondContact O-CB 3.5Å; L22-T25 PolarHBondContact O-N 2.84Å; L22-I26 HydrophobicContact CD1-CD1 4.22Å; L22-I26 HydrophobicContact CG-CD1 4.08Å; L22-I26 WeakPolarHBondContact O-CG1 3.16Å; L22-I26 PolarHBondContact O-N 2.91Å; L22-I26 VanDerWaalsContact O-N 3.16Å
23	I	96.5	Very high	94.2	Very high	80 Å²	80	43.5 Å²	43.5	41%	0.41	22%	0.216	S	C	.	.	H	α-helix	trans	-60.5	-49.7	177.7	-66.1	166.2	0	0	0	109.9	V19 G20 T25 I26 L27 L166	V19-I23 HydrophobicContact CG1-CD1 3.83Å; V19-I23 HydrophobicContact CG1-CG1 4.43Å; V19-I23 VanDerWaalsContact O-CG1 3.3Å; V19-I23 WeakPolarHBondContact O-CG1 3.37Å; V19-I23 PolarHBondContact O-N 3.37Å; G20-I23 PolarHBondContact O-N 3.25Å; I23-T25 PolarHBondContact O-N 3.24Å; I23-I26 PolarHBondContact O-N 3.33Å; I23-I26 VanDerWaalsContact O-N 3.12Å; I23-L27 VanDerWaalsContact O-CB 3.28Å; I23-L27 WeakPolarHBondContact O-CB 3.44Å; I23-L27 PolarHBondContact O-N 3.44Å; I23-L166 HydrophobicContact CB-CD2 4.04Å; I23-L166 HydrophobicContact CG2-CD2 3.55Å
24	T	95.6	Very high	92.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56	-39.7	176.9	-65.5	0	0	0	0	111.8	G20 I26 W30 M84 A163 L166 G167	G20-T24 WeakPolarHBondContact O-CB 3.49Å; G20-T24 PolarHBondContact O-N 2.86Å; G20-T24 PolarHBondContact O-OG1 2.76Å; G20-T24 VanDerWaalsContact O-OG1 3.07Å; T24-I26 PolarHBondContact O-N 3.5Å; T24-W30 HydrophobicContact CG2-CH2 4.28Å; T24-W30 HydrophobicContact CG2-CZ2 3.61Å; T24-W30 PolarHBondContact O-NE1 2.83Å; T24-M84 HydrophobicContact CG2-CE 3.95Å; T24-A163 HydrophobicContact CG2-CB 4.42Å; T24-A163 VanDerWaalsContact CG2-O 3.24Å; T24-A163 WeakPolarHBondContact CG2-O 3.27Å; T24-A163 PolarHBondContact OG1-O 3.35Å; T24-L166 WeakPolarHBondContact OG1-CG 3.32Å; T24-G167 PolarHBondContact OG1-N 2.95Å
25	T	94.1	Very high	91.3	Very high	8 Å²	8	48.2 Å²	48.2	5%	0.049	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-38.1	178.7	-58.5	0	0	0	0	112.7	T21 L22 I23 L50 W51 M84	T21-T25 WeakPolarHBondContact O-CB 3.32Å; T21-T25 PolarHBondContact O-N 3.18Å; T21-T25 PolarHBondContact O-OG1 3.4Å; L22-T25 WeakPolarHBondContact O-CB 3.5Å; L22-T25 PolarHBondContact O-N 2.84Å; I23-T25 PolarHBondContact O-N 3.24Å; T25-L50 HydrophobicContact CG2-CD2 4.43Å; T25-W51 HydrophobicContact CG2-CZ2 4.39Å; T25-W51 PolarHBondContact O-NE1 3.39Å; T25-M84 HydrophobicContact CG2-CB 4.23Å; T25-M84 WeakPolarHBondContact OG1-CE 3.27Å
26	I	93.1	Very high	89.7	Confident	97 Å²	97	47.1 Å²	47.1	50%	0.497	24%	0.24	S	C	.	.	H	α-helix	trans	-84.4	-33.3	-176	-63	167.5	0	0	0	111.5	L22 I23 T24	L22-I26 HydrophobicContact CD1-CD1 4.22Å; L22-I26 HydrophobicContact CG-CD1 4.08Å; L22-I26 WeakPolarHBondContact O-CG1 3.16Å; L22-I26 PolarHBondContact O-N 2.91Å; L22-I26 VanDerWaalsContact O-N 3.16Å; I23-I26 PolarHBondContact O-N 3.33Å; I23-I26 VanDerWaalsContact O-N 3.12Å; T24-I26 PolarHBondContact O-N 3.5Å
27	L	92.8	Very high	87.9	Confident	53 Å²	53	44.5 Å²	44.5	28%	0.277	24%	0.237	S	C	.	.			trans	-64.6	133.5	-171.2	-163.8	69.7	0	0	0	111.8	I23 H29 W30 A163	I23-L27 VanDerWaalsContact O-CB 3.28Å; I23-L27 WeakPolarHBondContact O-CB 3.44Å; I23-L27 PolarHBondContact O-N 3.44Å; L27-H29 HydrophobicContact CD2-CB 4.16Å; L27-H29 HydrophobicContact CG-CB 4.21Å; L27-H29 PolarHBondContact O-N 3.27Å; L27-W30 PolarHBondContact O-NE1 3.41Å; L27-A163 HydrophobicContact CB-CB 4.26Å; L27-A163 HydrophobicContact CD2-CB 3.95Å; L27-A163 HydrophobicContact CG-CB 4.44Å
28	P	90	Very high	86	Confident	16 Å²	16	51 Å²	51	10%	0.104	28%	0.277	C	S	.	.	S	Bend	trans	-81.3	6	-177.4	32.4	-35.5	0	0	0	114.5	W30 K48 G49 M52	P28-W30 PolarHBondContact O-N 3.03Å; P28-K48 CarbonylContact O-C 3.45Å; P28-K48 VanDerWaalsContact O-O 3.13Å; P28-G49 VanDerWaalsContact O-CA 3.25Å; P28-G49 WeakPolarHBondContact O-CA 3.33Å; P28-G49 PolarHBondContact O-N 3.47Å; P28-M52 HydrophobicContact CB-CG 3.61Å; P28-M52 HydrophobicContact CB-SD 4.06Å; P28-M52 HydrophobicContact CG-CG 4.44Å; P28-M52 HydrophobicContact CG-SD 4.25Å
29	H	90.8	Very high	84	Confident	55 Å²	55	54.1 Å²	54.1	26%	0.255	29%	0.294	S	S	.	.			trans	-98.8	49.8	-171.3	-63.9	-85.6	0	0	0	112.7	L27 L47 G161 Q162 A163	L27-H29 HydrophobicContact CD2-CB 4.16Å; L27-H29 HydrophobicContact CG-CB 4.21Å; L27-H29 PolarHBondContact O-N 3.27Å; H29-L47 WeakPolarHBondContact CE1-CD2 3.3Å; H29-L47 WeakPolarHBondContact ND1-CD2 3.48Å; H29-G161 CarbonylContact O-C 3.56Å; H29-G161 WeakPolarHBondContact O-CA 3.19Å; H29-Q162 HydrophobicContact CB-CB 4.46Å; H29-Q162 PolarHBondContact O-N 3.49Å; H29-Q162 VanDerWaalsContact O-N 3.17Å; H29-A163 HydrophobicContact CB-CB 4.49Å; H29-A163 WeakPolarHBondContact O-CB 3.43Å; H29-A163 PolarHBondContact O-N 3.2Å
30	W	92.2	Very high	82	Confident	6 Å²	6	58.7 Å²	58.7	2%	0.023	32%	0.315	C	S	.	.	S	Bend	trans	-84.6	-42.2	177.7	-79	62.6	0	0	0	112.5	T24 L27 P28 K48 L50 M84 V136 T139 G161 A163 L164	T24-W30 HydrophobicContact CG2-CH2 4.28Å; T24-W30 HydrophobicContact CG2-CZ2 3.61Å; T24-W30 PolarHBondContact O-NE1 2.83Å; L27-W30 PolarHBondContact O-NE1 3.41Å; P28-W30 PolarHBondContact O-N 3.03Å; W30-K48 WeakPolarHBondContact CB-O 3.3Å; W30-K48 PolarHBondContact N-O 2.83Å; W30-L50 HydrophobicContact CD2-CD1 3.67Å; W30-L50 HydrophobicContact CE3-CD1 3.78Å; W30-L50 HydrophobicContact CG-CD1 4.29Å; W30-L50 HydrophobicContact CH2-CD1 3.98Å; W30-L50 HydrophobicContact CH2-CD2 4.46Å; W30-L50 HydrophobicContact CZ2-CD1 3.84Å; W30-L50 HydrophobicContact CZ2-CD2 4.07Å; W30-L50 HydrophobicContact CZ2-CG 4.47Å; W30-L50 HydrophobicContact CZ3-CD1 3.94Å; W30-M84 HydrophobicContact CH2-CE 4.1Å; W30-M84 HydrophobicContact CH2-CG 3.7Å; W30-M84 HydrophobicContact CH2-SD 3.78Å; W30-M84 HydrophobicContact CZ2-CE 3.99Å; W30-M84 HydrophobicContact CZ2-CG 4.07Å; W30-M84 HydrophobicContact CZ2-SD 4.26Å; W30-V136 HydrophobicContact CH2-CG2 4.29Å; W30-T139 HydrophobicContact CE3-CG2 4.18Å; W30-T139 HydrophobicContact CZ3-CG2 3.96Å; W30-G161 WeakPolarHBondContact O-CA 3.39Å; W30-G161 PolarHBondContact O-N 3.03Å; W30-A163 HydrophobicContact CG-CB 4.13Å; W30-L164 HydrophobicContact CD2-CD2 4.16Å; W30-L164 HydrophobicContact CE3-CD2 3.41Å; W30-L164 VanDerWaalsContact CE3-CD2 3.41Å; W30-L164 HydrophobicContact CE3-CG 4.34Å; W30-L164 HydrophobicContact CZ3-CD2 3.65Å; W30-L164 VanDerWaalsContact O-CD1 3.23Å; W30-L164 WeakPolarHBondContact O-CD1 3.25Å
31	R	89.5	Confident	80.1	Confident	33 Å²	33	66 Å²	66	13%	0.125	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.8	176.6	-50.7	-178.5	-176.9	-166.5	-4.5	109.3	L47 K48 D142 V143 F158	R31-L47 WeakPolarHBondContact O-CA 3.26Å; R31-K48 HydrophobicContact CB-CB 4.29Å; R31-K48 PolarHBondContact N-O 3.22Å; R31-K48 PolarHBondContact O-N 3.25Å; R31-D142 IonicContact CZ-OD2 3.08Å; R31-D142 IonicContact NH1-OD2 2.78Å; R31-D142 PolarHBondContact NH1-OD2 3.32Å; R31-D142 IonicContact NH2-OD2 2.68Å; R31-D142 PolarHBondContact NH2-OD2 3.49Å; R31-V143 HydrophobicContact CG-CG2 3.76Å; R31-F158 HydrophobicContact CB-CB 4.24Å; R31-F158 HydrophobicContact CB-CD1 3.94Å; R31-F158 HydrophobicContact CB-CG 4.28Å
32	R	87.7	Confident	78.4	Confident	135 Å²	135	70.3 Å²	70.3	51%	0.509	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	139.9	177.4	-172.1	-174.5	-174.5	-151.9	2.5	109.2	A34 L47 F158 E159	R32-A34 PolarHBondContact O-N 2.97Å; R32-L47 HydrophobicContact CG-CD1 4.32Å; R32-F158 CarbonylContact O-C 3.56Å; R32-F158 VanDerWaalsContact O-CA 3.25Å; R32-F158 WeakPolarHBondContact O-CA 3.44Å; R32-E159 PolarHBondContact N-O 3.38Å; R32-E159 VanDerWaalsContact N-O 3.08Å; R32-E159 PolarHBondContact O-N 3.43Å
33	T	84.4	Confident	76.9	Confident	13 Å²	13	67.1 Å²	67.1	8%	0.08	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	132.8	176.1	45.8	0	0	0	0	112.2	S45 Y46 F158	T33-S45 WeakPolarHBondContact OG1-CA 3.2Å; T33-Y46 HydrophobicContact CG2-CD2 4.16Å; T33-Y46 HydrophobicContact CG2-CG 4.39Å; T33-Y46 PolarHBondContact N-O 2.89Å; T33-Y46 PolarHBondContact OG1-N 3.37Å; T33-Y46 PolarHBondContact OG1-O 3.4Å; T33-F158 HydrophobicContact CG2-CD1 3.92Å; T33-F158 HydrophobicContact CG2-CE1 3.46Å; T33-F158 VanDerWaalsContact CG2-CE1 3.46Å; T33-F158 HydrophobicContact CG2-CZ 4.03Å
34	A	68.4	Low	75.9	Confident	21 Å²	21	64.6 Å²	64.6	17%	0.174	35%	0.353	C	S	.	.	S	Bend	trans	-81.3	-22.8	-176.9	0	0	0	0	0	113.8	R32 F147 K157 E159	R32-A34 PolarHBondContact O-N 2.97Å; A34-F147 HydrophobicContact CB-CD2 4.5Å; A34-F147 HydrophobicContact CB-CE2 3.97Å; A34-K157 HydrophobicContact CB-CB 4.17Å; A34-K157 WeakPolarHBondContact CB-O 3.17Å; A34-K157 PolarHBondContact N-O 2.93Å; A34-E159 HydrophobicContact CB-CG 3.65Å
35	H	65	Low	75.3	Confident	114 Å²	114	65.6 Å²	65.6	53%	0.528	36%	0.36	S	S	.	.			trans	-134.9	123.4	-175.4	-111.5	47.5	0	0	0	110.8	S154	H35-S154 WeakPolarHBondContact CB-O 3.48Å
36	V	63.5	Low	74.8	Confident	64 Å²	64	70.3 Å²	70.3	39%	0.388	38%	0.377	S	S	.	.			trans	-87.7	118.7	165.7	-174.2	0	0	0	0	105.2	A43	V36-A43 HydrophobicContact CG1-CB 3.4Å
37	G	60.3	Low	74.6	Confident	43 Å²	43	66.3 Å²	66.3	44%	0.443	36%	0.357	S	S	.	.			trans	-51.9	153.7	-177	0	0	0	0	0	112.5	N39	G37-N39 PolarHBondContact O-N 3Å
38	T	56	Low	74.4	Confident	137 Å²	137	67.1 Å²	67.1	84%	0.84	36%	0.358	S	S	*	.	S	Bend	trans	-61.5	-7.7	-177.4	43.9	0	0	0	0	114.7	I40	T38-I40 PolarHBondContact O-N 2.89Å
39	N	56.7	Low	74.4	Confident	107 Å²	107	66.4 Å²	66.4	57%	0.572	35%	0.353	S	S	*	.			trans	-80.3	98.5	175	-65.5	-33.4	0	0	0	110.2	G37 L41 T42 A43	G37-N39 PolarHBondContact O-N 3Å; N39-L41 PolarHBondContact O-N 3.02Å; N39-L41 VanDerWaalsContact O-N 3.11Å; N39-T42 WeakPolarHBondContact CB-OG1 3.26Å; N39-T42 CarbonylContact O-C 3.51Å; N39-T42 PolarHBondContact O-N 3.29Å; N39-A43 PolarHBondContact O-N 2.96Å
40	I	55.4	Low	74.3	Confident	149 Å²	149	63.8 Å²	63.8	76%	0.764	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-53	-29.9	176.7	-73.3	165.7	0	0	0	112.6	T38 T42	T38-I40 PolarHBondContact O-N 2.89Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 3.24Å
41	L	57	Low	74.2	Confident	165 Å²	165	68.6 Å²	68.6	86%	0.864	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-76.4	-14.6	178.8	-84.3	77.5	0	0	0	114.2	N39	N39-L41 PolarHBondContact O-N 3.02Å; N39-L41 VanDerWaalsContact O-N 3.11Å
42	T	61.3	Low	74.2	Confident	89 Å²	89	69.3 Å²	69.3	55%	0.546	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-132.6	37.1	-179.5	62.7	0	0	0	0	111.7	N39 I40 V44	N39-T42 WeakPolarHBondContact CB-OG1 3.26Å; N39-T42 CarbonylContact O-C 3.51Å; N39-T42 PolarHBondContact O-N 3.29Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 3.24Å; T42-V44 PolarHBondContact O-N 3.14Å
43	A	64.6	Low	74.3	Confident	25 Å²	25	65.2 Å²	65.2	21%	0.207	35%	0.352	C	S	.	.			trans	-65.8	100.3	173.8	0	0	0	0	0	110	V36 N39 S58	V36-A43 HydrophobicContact CG1-CB 3.4Å; N39-A43 PolarHBondContact O-N 2.96Å; A43-S58 PolarHBondContact O-N 2.76Å
44	V	76.4	Confident	74.5	Confident	27 Å²	27	64.6 Å²	64.6	16%	0.164	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.2	-177	-177.1	0	0	0	0	109.6	T42 Y46 V55 W56 H57	T42-V44 PolarHBondContact O-N 3.14Å; V44-Y46 HydrophobicContact CB-CE2 4.32Å; V44-Y46 HydrophobicContact CG1-CD2 4.25Å; V44-Y46 HydrophobicContact CG1-CE2 3.77Å; V44-V55 HydrophobicContact CG1-CG1 3.09Å; V44-W56 WeakPolarHBondContact CA-O 3.36Å; V44-H57 WeakPolarHBondContact CG2-ND1 3.43Å
45	S	81.2	Confident	75.4	Confident	21 Å²	21	64.7 Å²	64.7	15%	0.147	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.9	173.3	-63	0	0	0	0	110.3	T33 W56	T33-S45 WeakPolarHBondContact OG1-CA 3.2Å; S45-W56 PolarHBondContact N-O 2.66Å; S45-W56 PolarHBondContact O-N 3.02Å
46	Y	85.4	Confident	76.4	Confident	106 Å²	106	65.3 Å²	65.3	42%	0.416	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.9	175.8	-63.8	-97	0	0	0	110.4	T33 V44 V55	T33-Y46 HydrophobicContact CG2-CD2 4.16Å; T33-Y46 HydrophobicContact CG2-CG 4.39Å; T33-Y46 PolarHBondContact N-O 2.89Å; T33-Y46 PolarHBondContact OG1-N 3.37Å; T33-Y46 PolarHBondContact OG1-O 3.4Å; V44-Y46 HydrophobicContact CB-CE2 4.32Å; V44-Y46 HydrophobicContact CG1-CD2 4.25Å; V44-Y46 HydrophobicContact CG1-CE2 3.77Å; Y46-V55 HydrophobicContact CD1-CB 4.5Å; Y46-V55 HydrophobicContact CD1-CG1 4.33Å; Y46-V55 HydrophobicContact CD1-CG2 3.54Å; Y46-V55 HydrophobicContact CE1-CG1 4.09Å; Y46-V55 HydrophobicContact CE1-CG2 3.58Å
47	L	87.9	Confident	77.4	Confident	14 Å²	14	65 Å²	65	7%	0.073	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.3	173.9	-78.8	62.1	0	0	0	107.1	H29 R31 R32 E53 C54 Y62	H29-L47 WeakPolarHBondContact CE1-CD2 3.3Å; H29-L47 WeakPolarHBondContact ND1-CD2 3.48Å; R31-L47 WeakPolarHBondContact O-CA 3.26Å; R32-L47 HydrophobicContact CG-CD1 4.32Å; L47-E53 CarbonylContact O-C 3.58Å; L47-E53 WeakPolarHBondContact O-CA 3.47Å; L47-C54 HydrophobicContact CB-CB 4.26Å; L47-C54 PolarHBondContact N-O 2.91Å; L47-C54 PolarHBondContact O-N 3.49Å; L47-Y62 HydrophobicContact CD2-CE2 4.49Å
48	K	88.6	Confident	78.3	Confident	70 Å²	70	66.7 Å²	66.7	30%	0.304	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.2	177.9	-67.2	-177.3	175.9	174.3	0	109.3	P28 W30 R31 F158	P28-K48 CarbonylContact O-C 3.45Å; P28-K48 VanDerWaalsContact O-O 3.13Å; W30-K48 WeakPolarHBondContact CB-O 3.3Å; W30-K48 PolarHBondContact N-O 2.83Å; R31-K48 HydrophobicContact CB-CB 4.29Å; R31-K48 PolarHBondContact N-O 3.22Å; R31-K48 PolarHBondContact O-N 3.25Å; K48-F158 HydrophobicContact CD-CE1 3.92Å; K48-F158 HydrophobicContact CD-CZ 3.88Å; K48-F158 HydrophobicContact CG-CE1 4.27Å
49	G	90.5	Very high	79.5	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.335	C	S	.	.			trans	-98.4	179.8	171.1	0	0	0	0	0	112.6	P28 M52	P28-G49 VanDerWaalsContact O-CA 3.25Å; P28-G49 WeakPolarHBondContact O-CA 3.33Å; P28-G49 PolarHBondContact O-N 3.47Å; G49-M52 WeakPolarHBondContact CA-O 3.48Å; G49-M52 PolarHBondContact N-O 2.97Å
50	L	88.3	Confident	80.6	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	33%	0.332	C	S	.	.	S	Bend	trans	-67.2	-48.6	169.6	-123	65.1	0	0	0	110.7	T25 W30 A80 R81 M84	T25-L50 HydrophobicContact CG2-CD2 4.43Å; W30-L50 HydrophobicContact CD2-CD1 3.67Å; W30-L50 HydrophobicContact CE3-CD1 3.78Å; W30-L50 HydrophobicContact CG-CD1 4.29Å; W30-L50 HydrophobicContact CH2-CD1 3.98Å; W30-L50 HydrophobicContact CH2-CD2 4.46Å; W30-L50 HydrophobicContact CZ2-CD1 3.84Å; W30-L50 HydrophobicContact CZ2-CD2 4.07Å; W30-L50 HydrophobicContact CZ2-CG 4.47Å; W30-L50 HydrophobicContact CZ3-CD1 3.94Å; L50-A80 HydrophobicContact CD1-CB 4.32Å; L50-R81 HydrophobicContact CB-CG 4.42Å; L50-R81 HydrophobicContact CD2-CB 4.44Å; L50-R81 HydrophobicContact CD2-CG 3.99Å; L50-R81 HydrophobicContact CG-CG 3.66Å; L50-R81 PolarHBondContact O-NE 2.79Å; L50-R81 PolarHBondContact O-NH2 2.92Å; L50-M84 HydrophobicContact CD2-CB 3.95Å; L50-M84 HydrophobicContact CD2-CG 3.89Å
51	W	89.9	Confident	82	Confident	107 Å²	107	60 Å²	60	41%	0.405	32%	0.318	S	S	.	.	S	Bend	trans	-104.4	-20.9	-171.1	-56.1	95.5	0	0	0	115.4	T25 Y67 V85	T25-W51 HydrophobicContact CG2-CZ2 4.39Å; T25-W51 PolarHBondContact O-NE1 3.39Å; W51-Y67 VanDerWaalsContact O-CD2 3.24Å; W51-Y67 WeakPolarHBondContact O-CD2 3.35Å; W51-Y67 PolarHBondContact O-N 2.97Å; W51-V85 HydrophobicContact CH2-CG2 3.9Å; W51-V85 HydrophobicContact CZ2-CG2 3.68Å
52	M	89.4	Confident	83.5	Confident	47 Å²	47	56.7 Å²	56.7	23%	0.232	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	154.8	-177.2	68.2	-170.2	93.4	0	0	109.7	P28 G49 Q65 I66	P28-M52 HydrophobicContact CB-CG 3.61Å; P28-M52 HydrophobicContact CB-SD 4.06Å; P28-M52 HydrophobicContact CG-CG 4.44Å; P28-M52 HydrophobicContact CG-SD 4.25Å; G49-M52 WeakPolarHBondContact CA-O 3.48Å; G49-M52 PolarHBondContact N-O 2.97Å; M52-Q65 WeakPolarHBondContact CA-O 3.36Å; M52-Q65 WeakPolarHBondContact CB-O 3.49Å; M52-I66 HydrophobicContact CB-CG1 4.31Å
53	E	89.3	Confident	84.8	Confident	50 Å²	50	57.8 Å²	57.8	23%	0.234	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.7	166.1	60.5	-170.6	162.2	0	0	108.7	L47 C64 Q65 Y67	L47-E53 CarbonylContact O-C 3.58Å; L47-E53 WeakPolarHBondContact O-CA 3.47Å; E53-C64 CarbonylContact O-C 3.56Å; E53-C64 WeakPolarHBondContact O-CA 3.33Å; E53-Q65 HydrophobicContact CG-CB 4.41Å; E53-Q65 PolarHBondContact N-O 3.01Å; E53-Q65 PolarHBondContact O-N 3.4Å; E53-Y67 HydrophobicContact CB-CE1 4.14Å; E53-Y67 HydrophobicContact CG-CE1 4.06Å
54	C	89.1	Confident	86	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	145.4	178.1	-60.2	0	0	0	0	109.7	L47 Y62 Q63 C64	L47-C54 HydrophobicContact CB-CB 4.26Å; L47-C54 PolarHBondContact N-O 2.91Å; L47-C54 PolarHBondContact O-N 3.49Å; C54-Y62 HydrophobicContact CB-CE1 4.39Å; C54-Y62 HydrophobicContact CB-CE2 3.81Å; C54-Y62 WeakPolarHBondContact CB-OH 3.4Å; C54-Y62 PolarHBondContact SG-OH 3.37Å; C54-Q63 CarbonylContact C-O 3.08Å; C54-Q63 WeakPolarHBondContact CA-O 3.48Å; C54-C64 HydrophobicContact CB-CB 4.14Å; C54-C64 WeakPolarHBondContact CB-SG 3.47Å; C54-C64 WeakPolarHBondContact SG-CB 3.28Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.4Å
55	V	88.4	Confident	86.6	Confident	22 Å²	22	63.2 Å²	63.2	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.6	-177.3	-173.7	0	0	0	0	108.1	V44 Y46 Q63	V44-V55 HydrophobicContact CG1-CG1 3.09Å; Y46-V55 HydrophobicContact CD1-CB 4.5Å; Y46-V55 HydrophobicContact CD1-CG1 4.33Å; Y46-V55 HydrophobicContact CD1-CG2 3.54Å; Y46-V55 HydrophobicContact CE1-CG1 4.09Å; Y46-V55 HydrophobicContact CE1-CG2 3.58Å; V55-Q63 PolarHBondContact N-O 2.87Å; V55-Q63 PolarHBondContact O-N 3.17Å
56	W	84.7	Confident	86.9	Confident	128 Å²	128	67.9 Å²	67.9	49%	0.485	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	114.4	174.4	-171.9	-79.6	0	0	0	109.2	V44 S45 Y62	V44-W56 WeakPolarHBondContact CA-O 3.36Å; S45-W56 PolarHBondContact N-O 2.66Å; S45-W56 PolarHBondContact O-N 3.02Å; W56-Y62 HydrophobicContact CB-CD2 4.31Å; W56-Y62 HydrophobicContact CD2-CD2 4.19Å; W56-Y62 AromaticContact CE3-CD2 3.22Å; W56-Y62 HydrophobicContact CE3-CD2 3.22Å; W56-Y62 AromaticContact CE3-CE2 3.87Å; W56-Y62 HydrophobicContact CE3-CE2 3.87Å; W56-Y62 AromaticContact CE3-CG 3.85Å; W56-Y62 HydrophobicContact CE3-CG 3.85Å; W56-Y62 AromaticContact CZ3-CD2 3.79Å; W56-Y62 HydrophobicContact CZ3-CD2 3.79Å; W56-Y62 AromaticContact CZ3-CG 3.95Å; W56-Y62 HydrophobicContact CZ3-CG 3.95Å
57	H	84.5	Confident	86.8	Confident	58 Å²	58	64.7 Å²	64.7	27%	0.269	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	147.3	175.8	-65.8	-79.3	0	0	0	111.2	V44 T59 G60 I61	V44-H57 WeakPolarHBondContact CG2-ND1 3.43Å; H57-T59 WeakPolarHBondContact CB-OG1 3.32Å; H57-T59 PolarHBondContact O-N 3.47Å; H57-T59 VanDerWaalsContact O-N 3.15Å; H57-G60 PolarHBondContact O-N 3.33Å; H57-I61 HydrophobicContact CB-CB 4.32Å; H57-I61 PolarHBondContact N-O 2.93Å
58	S	80.1	Confident	86	Confident	78 Å²	78	75.2 Å²	75.2	55%	0.545	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.1	174.1	55.8	0	0	0	0	114	A43 G60	A43-S58 PolarHBondContact O-N 2.76Å; S58-G60 PolarHBondContact O-N 3.44Å
59	T	80.7	Confident	85.2	Confident	109 Å²	109	75.7 Å²	75.7	67%	0.669	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-0.3	173	53.8	0	0	0	0	113.9	H57 I61	H57-T59 WeakPolarHBondContact CB-OG1 3.32Å; H57-T59 PolarHBondContact O-N 3.47Å; H57-T59 VanDerWaalsContact O-N 3.15Å; T59-I61 VanDerWaalsContact C-N 3.35Å
60	G	80.3	Confident	83.7	Confident	49 Å²	49	81.1 Å²	81.1	51%	0.505	41%	0.408	S	S	.	.	S	Bend	trans	84.7	5.7	-179.5	0	0	0	0	0	114.2	H57 S58	H57-G60 PolarHBondContact O-N 3.33Å; S58-G60 PolarHBondContact O-N 3.44Å
61	I	85.2	Confident	82.3	Confident	94 Å²	94	89.7 Å²	89.7	48%	0.482	45%	0.453	S	S	.	.			trans	-81.2	125.9	177.3	-57.8	173.4	0	0	0	109.3	H57 T59	H57-I61 HydrophobicContact CB-CB 4.32Å; H57-I61 PolarHBondContact N-O 2.93Å; T59-I61 VanDerWaalsContact C-N 3.35Å
62	Y	88	Confident	80.7	Confident	96 Å²	96	88.8 Å²	88.8	38%	0.376	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.1	171.9	-170.9	-116	0	0	0	110.4	L47 C54 W56 C64	L47-Y62 HydrophobicContact CD2-CE2 4.49Å; C54-Y62 HydrophobicContact CB-CE1 4.39Å; C54-Y62 HydrophobicContact CB-CE2 3.81Å; C54-Y62 WeakPolarHBondContact CB-OH 3.4Å; C54-Y62 PolarHBondContact SG-OH 3.37Å; W56-Y62 HydrophobicContact CB-CD2 4.31Å; W56-Y62 HydrophobicContact CD2-CD2 4.19Å; W56-Y62 AromaticContact CE3-CD2 3.22Å; W56-Y62 HydrophobicContact CE3-CD2 3.22Å; W56-Y62 AromaticContact CE3-CE2 3.87Å; W56-Y62 HydrophobicContact CE3-CE2 3.87Å; W56-Y62 AromaticContact CE3-CG 3.85Å; W56-Y62 HydrophobicContact CE3-CG 3.85Å; W56-Y62 AromaticContact CZ3-CD2 3.79Å; W56-Y62 HydrophobicContact CZ3-CD2 3.79Å; W56-Y62 AromaticContact CZ3-CG 3.95Å; W56-Y62 HydrophobicContact CZ3-CG 3.95Å; Y62-C64 WeakPolarHBondContact CE1-SG 3.41Å
63	Q	88.3	Confident	79.7	Confident	111 Å²	111	87.5 Å²	87.5	52%	0.519	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.8	-177.3	-175.1	169.9	-26.6	0	0	110.1	C54 V55	C54-Q63 CarbonylContact C-O 3.08Å; C54-Q63 WeakPolarHBondContact CA-O 3.48Å; V55-Q63 PolarHBondContact N-O 2.87Å; V55-Q63 PolarHBondContact O-N 3.17Å
64	C	90.8	Very high	79.1	Confident	61 Å²	61	88.9 Å²	88.9	41%	0.412	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	131.9	174.9	-67.2	0	0	0	0	110.6	E53 C54 Y62	E53-C64 CarbonylContact O-C 3.56Å; E53-C64 WeakPolarHBondContact O-CA 3.33Å; C54-C64 HydrophobicContact CB-CB 4.14Å; C54-C64 WeakPolarHBondContact CB-SG 3.47Å; C54-C64 WeakPolarHBondContact SG-CB 3.28Å; C54-C64 CovalentContact SG-SG 2.05Å; C54-C64 PolarHBondContact SG-SG 3.4Å; Y62-C64 WeakPolarHBondContact CE1-SG 3.41Å
65	Q	88.6	Confident	78.6	Confident	106 Å²	106	96.9 Å²	96.9	50%	0.495	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.6	176.8	-171	170.9	-83.2	0	0	109.9	M52 E53	M52-Q65 WeakPolarHBondContact CA-O 3.36Å; M52-Q65 WeakPolarHBondContact CB-O 3.49Å; E53-Q65 HydrophobicContact CG-CB 4.41Å; E53-Q65 PolarHBondContact N-O 3.01Å; E53-Q65 PolarHBondContact O-N 3.4Å
66	I	87.7	Confident	78.2	Confident	119 Å²	119	99 Å²	99	61%	0.61	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	139	174.4	-61.9	168.4	0	0	0	108.6	M52 R68	M52-I66 HydrophobicContact CB-CG1 4.31Å; I66-R68 PolarHBondContact O-N 3.44Å
67	Y	83.2	Confident	78	Confident	38 Å²	38	93.6 Å²	93.6	15%	0.149	50%	0.504	C	S	.	.			trans	-67	104.2	175.4	-59.9	-71.4	0	0	0	110.3	W51 E53 L73 L77	W51-Y67 VanDerWaalsContact O-CD2 3.24Å; W51-Y67 WeakPolarHBondContact O-CD2 3.35Å; W51-Y67 PolarHBondContact O-N 2.97Å; E53-Y67 HydrophobicContact CB-CE1 4.14Å; E53-Y67 HydrophobicContact CG-CE1 4.06Å; Y67-L73 HydrophobicContact CD1-CD1 3.86Å; Y67-L73 HydrophobicContact CD2-CD1 4.29Å; Y67-L73 HydrophobicContact CE1-CD1 4.05Å; Y67-L73 HydrophobicContact CE2-CD1 4.43Å; Y67-L73 HydrophobicContact CG-CD1 3.97Å; Y67-L77 HydrophobicContact CE2-CD2 4.34Å
68	R	70.6	Confident	78.1	Confident	235 Å²	235	96 Å²	96	89%	0.887	52%	0.515	S	S	*	.			trans	-76.9	-27	-176.4	-67.3	-172.6	180	179.4	0.7	114.1	I66	I66-R68 PolarHBondContact O-N 3.44Å
69	S	70.9	Confident	78.4	Confident	80 Å²	80	94.6 Å²	94.6	56%	0.559	51%	0.509	S	S	*	.			trans	-119.3	113.4	-177.3	-61.4	0	0	0	0	110.4	L71	S69-L71 VanDerWaalsContact C-N 3.26Å; S69-L71 PolarHBondContact O-N 3.41Å
70	L	60.2	Low	78.9	Confident	115 Å²	115	89.5 Å²	89.5	60%	0.602	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-67.6	-26.9	176.3	-63.8	177.2	0	0	0	112.5	A72 L73	L70-A72 VanDerWaalsContact C-N 3.31Å; L70-A72 PolarHBondContact O-N 3.32Å; L70-L73 WeakPolarHBondContact O-CB 3.28Å; L70-L73 PolarHBondContact O-N 3.04Å
71	L	59.3	Low	79.4	Confident	180 Å²	180	88 Å²	88	94%	0.942	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-73.9	-18.6	-176.4	-139.6	74.8	0	0	0	114.1	S69	S69-L71 VanDerWaalsContact C-N 3.26Å; S69-L71 PolarHBondContact O-N 3.41Å
72	A	55.6	Low	79.7	Confident	89 Å²	89	85.9 Å²	85.9	74%	0.736	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-97.7	5.1	179.9	0	0	0	0	0	112.8	L70	L70-A72 VanDerWaalsContact C-N 3.31Å; L70-A72 PolarHBondContact O-N 3.32Å
73	L	68.8	Low	80	Confident	19 Å²	19	83.6 Å²	83.6	10%	0.099	45%	0.448	C	S	.	.	S	Bend	trans	-92.2	139.7	-175.2	-161.4	78.5	0	0	0	110.8	Y67 L70 Q75 L77 R81	Y67-L73 HydrophobicContact CD1-CD1 3.86Å; Y67-L73 HydrophobicContact CD2-CD1 4.29Å; Y67-L73 HydrophobicContact CE1-CD1 4.05Å; Y67-L73 HydrophobicContact CE2-CD1 4.43Å; Y67-L73 HydrophobicContact CG-CD1 3.97Å; L70-L73 WeakPolarHBondContact O-CB 3.28Å; L70-L73 PolarHBondContact O-N 3.04Å; L73-Q75 PolarHBondContact O-N 3.26Å; L73-L77 HydrophobicContact CD1-CD2 3.72Å; L73-L77 HydrophobicContact CD2-CB 4.03Å; L73-L77 HydrophobicContact CD2-CD2 3.95Å; L73-L77 HydrophobicContact CD2-CG 4.39Å; L73-L77 HydrophobicContact CG-CB 4.15Å; L73-L77 HydrophobicContact CG-CD2 3.96Å; L73-R81 VanDerWaalsContact CD2-NH2 3.26Å
74	P	75.8	Confident	80.3	Confident	79 Å²	79	78.3 Å²	78.3	51%	0.513	42%	0.423	S	S	.	.			trans	-56.7	137.6	174.8	19.5	-31.5	0	0	0	111.9	D76 L77 Q78	P74-D76 PolarHBondContact O-N 2.94Å; P74-L77 HydrophobicContact CG-CB 4.06Å; P74-L77 WeakPolarHBondContact O-CB 3.35Å; P74-L77 PolarHBondContact O-N 3.33Å; P74-Q78 PolarHBondContact O-N 3.21Å
75	Q	78.6	Confident	80.6	Confident	168 Å²	168	77.9 Å²	77.9	79%	0.785	42%	0.419	S	S	*	.	H	α-helix	trans	-56.4	-36.5	-175.8	-70.2	179.3	-48.6	0	0	112.4	L73 L77 Q78 A79	L73-Q75 PolarHBondContact O-N 3.26Å; Q75-L77 VanDerWaalsContact C-N 3.3Å; Q75-L77 PolarHBondContact O-N 3.17Å; Q75-Q78 PolarHBondContact O-N 3.05Å; Q75-A79 PolarHBondContact O-N 3.13Å
76	D	79.8	Confident	80.9	Confident	67 Å²	67	77 Å²	77	36%	0.358	42%	0.416	S	S	.	.	H	α-helix	trans	-60.9	-37.6	176.6	-62.2	-56.1	0	0	0	112.8	P74 A80	P74-D76 PolarHBondContact O-N 2.94Å; D76-A80 WeakPolarHBondContact O-CB 3.46Å; D76-A80 PolarHBondContact O-N 2.94Å
77	L	81.3	Confident	81.4	Confident	14 Å²	14	71.4 Å²	71.4	7%	0.073	39%	0.387	C	S	.	.	H	α-helix	trans	-74.1	-34.4	178.5	-149.1	81.6	0	0	0	111	Y67 L73 P74 Q75 A80 R81	Y67-L77 HydrophobicContact CE2-CD2 4.34Å; L73-L77 HydrophobicContact CD1-CD2 3.72Å; L73-L77 HydrophobicContact CD2-CB 4.03Å; L73-L77 HydrophobicContact CD2-CD2 3.95Å; L73-L77 HydrophobicContact CD2-CG 4.39Å; L73-L77 HydrophobicContact CG-CB 4.15Å; L73-L77 HydrophobicContact CG-CD2 3.96Å; P74-L77 HydrophobicContact CG-CB 4.06Å; P74-L77 WeakPolarHBondContact O-CB 3.35Å; P74-L77 PolarHBondContact O-N 3.33Å; Q75-L77 VanDerWaalsContact C-N 3.3Å; Q75-L77 PolarHBondContact O-N 3.17Å; L77-A80 PolarHBondContact O-N 3.47Å; L77-R81 WeakPolarHBondContact O-CG 3.46Å; L77-R81 PolarHBondContact O-N 2.95Å
78	Q	86.7	Confident	82	Confident	108 Å²	108	70.9 Å²	70.9	51%	0.505	39%	0.389	S	S	.	.	H	α-helix	trans	-66.3	-42.1	174.5	-173.7	175.2	-9.7	0	0	111.7	P74 Q75 R81 A82	P74-Q78 PolarHBondContact O-N 3.21Å; Q75-Q78 PolarHBondContact O-N 3.05Å; Q78-R81 WeakPolarHBondContact O-CB 3.4Å; Q78-R81 PolarHBondContact O-N 3.34Å; Q78-A82 PolarHBondContact O-N 3.31Å
79	A	86.9	Confident	83.3	Confident	49 Å²	49	65.1 Å²	65.1	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-45.6	174.7	0	0	0	0	0	111.6	Q75 R81 A82 L83	Q75-A79 PolarHBondContact O-N 3.13Å; A79-R81 VanDerWaalsContact C-N 3.35Å; A79-R81 PolarHBondContact O-N 3.45Å; A79-A82 PolarHBondContact O-N 3.34Å; A79-L83 WeakPolarHBondContact O-CG 3.3Å; A79-L83 PolarHBondContact O-N 3.43Å
80	A	89.6	Confident	84.5	Confident	3 Å²	3	62.7 Å²	62.7	3%	0.025	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-41.2	176.3	0	0	0	0	0	112.5	L50 D76 L77 L83 M84 T139	L50-A80 HydrophobicContact CD1-CB 4.32Å; D76-A80 WeakPolarHBondContact O-CB 3.46Å; D76-A80 PolarHBondContact O-N 2.94Å; L77-A80 PolarHBondContact O-N 3.47Å; A80-L83 PolarHBondContact O-N 2.89Å; A80-M84 WeakPolarHBondContact O-CB 3.33Å; A80-M84 VanDerWaalsContact O-CG 3.28Å; A80-M84 WeakPolarHBondContact O-CG 3.43Å; A80-M84 PolarHBondContact O-N 3.49Å; A80-T139 HydrophobicContact CB-CG2 3.71Å
81	R	91.8	Very high	86.3	Confident	16 Å²	16	57.2 Å²	57.2	6%	0.06	33%	0.327	C	S	.	.	H	α-helix	trans	-57.7	-49.8	173.2	-76	176.4	-174.2	-176.1	7.7	111.8	L50 L73 L77 Q78 A79 L83 M84 V85	L50-R81 HydrophobicContact CB-CG 4.42Å; L50-R81 HydrophobicContact CD2-CB 4.44Å; L50-R81 HydrophobicContact CD2-CG 3.99Å; L50-R81 HydrophobicContact CG-CG 3.66Å; L50-R81 PolarHBondContact O-NE 2.79Å; L50-R81 PolarHBondContact O-NH2 2.92Å; L73-R81 VanDerWaalsContact CD2-NH2 3.26Å; L77-R81 WeakPolarHBondContact O-CG 3.46Å; L77-R81 PolarHBondContact O-N 2.95Å; Q78-R81 WeakPolarHBondContact O-CB 3.4Å; Q78-R81 PolarHBondContact O-N 3.34Å; A79-R81 VanDerWaalsContact C-N 3.35Å; A79-R81 PolarHBondContact O-N 3.45Å; R81-L83 PolarHBondContact O-N 3.03Å; R81-M84 PolarHBondContact O-N 2.91Å; R81-V85 WeakPolarHBondContact O-CB 3.23Å; R81-V85 VanDerWaalsContact O-CG2 3.25Å; R81-V85 WeakPolarHBondContact O-CG2 3.26Å; R81-V85 PolarHBondContact O-N 2.99Å
82	A	92.1	Very high	88	Confident	50 Å²	50	50.3 Å²	50.3	41%	0.413	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-47.4	-178.6	0	0	0	0	0	111.1	Q78 A79 M84 V85 I86	Q78-A82 PolarHBondContact O-N 3.31Å; A79-A82 PolarHBondContact O-N 3.34Å; A82-M84 PolarHBondContact O-N 3.47Å; A82-V85 PolarHBondContact O-N 3.38Å; A82-I86 WeakPolarHBondContact O-CB 3.24Å; A82-I86 WeakPolarHBondContact O-CD1 3.45Å; A82-I86 WeakPolarHBondContact O-CG1 3.48Å; A82-I86 PolarHBondContact O-N 3.03Å
83	L	93.9	Very high	90	Very high	49 Å²	49	50.6 Å²	50.6	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-61.2	-44.6	178.8	-69	172.6	0	0	0	112.5	A79 A80 R81 S87 L131 V134 A135	A79-L83 WeakPolarHBondContact O-CG 3.3Å; A79-L83 PolarHBondContact O-N 3.43Å; A80-L83 PolarHBondContact O-N 2.89Å; R81-L83 PolarHBondContact O-N 3.03Å; L83-S87 VanDerWaalsContact O-CB 3.28Å; L83-S87 WeakPolarHBondContact O-CB 3.36Å; L83-S87 PolarHBondContact O-N 3.01Å; L83-L131 HydrophobicContact CD2-CD2 4.19Å; L83-V134 HydrophobicContact CD1-CG1 4.43Å; L83-A135 HydrophobicContact CB-CB 3.78Å; L83-A135 HydrophobicContact CD1-CB 4.08Å
84	M	95.3	Very high	91.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-43	178.3	-69.6	-61	-65.3	0	0	112.1	T21 T24 T25 W30 L50 A80 R81 A82 S87 C88 A135 V136	T21-M84 HydrophobicContact CG2-CE 3.93Å; T24-M84 HydrophobicContact CG2-CE 3.95Å; T25-M84 HydrophobicContact CG2-CB 4.23Å; T25-M84 WeakPolarHBondContact OG1-CE 3.27Å; W30-M84 HydrophobicContact CH2-CE 4.1Å; W30-M84 HydrophobicContact CH2-CG 3.7Å; W30-M84 HydrophobicContact CH2-SD 3.78Å; W30-M84 HydrophobicContact CZ2-CE 3.99Å; W30-M84 HydrophobicContact CZ2-CG 4.07Å; W30-M84 HydrophobicContact CZ2-SD 4.26Å; L50-M84 HydrophobicContact CD2-CB 3.95Å; L50-M84 HydrophobicContact CD2-CG 3.89Å; A80-M84 WeakPolarHBondContact O-CB 3.33Å; A80-M84 VanDerWaalsContact O-CG 3.28Å; A80-M84 WeakPolarHBondContact O-CG 3.43Å; A80-M84 PolarHBondContact O-N 3.49Å; R81-M84 PolarHBondContact O-N 2.91Å; A82-M84 PolarHBondContact O-N 3.47Å; M84-S87 WeakPolarHBondContact O-CB 3.45Å; M84-S87 PolarHBondContact O-N 3.36Å; M84-C88 PolarHBondContact O-N 3.43Å; M84-C88 PolarHBondContact O-SG 2.95Å; M84-A135 HydrophobicContact CG-CB 4.12Å; M84-A135 HydrophobicContact SD-CB 3.87Å; M84-V136 HydrophobicContact SD-CG2 4.49Å
85	V	95.8	Very high	92.3	Very high	52 Å²	52	46.8 Å²	46.8	32%	0.315	27%	0.265	S	S	.	.	H	α-helix	trans	-63.6	-46.5	177.6	171.6	0	0	0	0	110.9	W51 R81 A82 S87 C88 L89	W51-V85 HydrophobicContact CH2-CG2 3.9Å; W51-V85 HydrophobicContact CZ2-CG2 3.68Å; R81-V85 WeakPolarHBondContact O-CB 3.23Å; R81-V85 VanDerWaalsContact O-CG2 3.25Å; R81-V85 WeakPolarHBondContact O-CG2 3.26Å; R81-V85 PolarHBondContact O-N 2.99Å; A82-V85 PolarHBondContact O-N 3.38Å; V85-S87 VanDerWaalsContact C-N 3.3Å; V85-S87 PolarHBondContact O-N 3.26Å; V85-C88 PolarHBondContact O-N 3.32Å; V85-L89 HydrophobicContact CG1-CD1 4.13Å; V85-L89 HydrophobicContact CG1-CG 4.44Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 3.01Å
86	I	96.3	Very high	93	Very high	88 Å²	88	41.4 Å²	41.4	45%	0.451	25%	0.249	S	C	.	.	H	α-helix	trans	-60.7	-43.2	176.8	-66.1	165.1	0	0	0	110	A82 C88 L89 L90 L131	A82-I86 WeakPolarHBondContact O-CB 3.24Å; A82-I86 WeakPolarHBondContact O-CD1 3.45Å; A82-I86 WeakPolarHBondContact O-CG1 3.48Å; A82-I86 PolarHBondContact O-N 3.03Å; I86-C88 PolarHBondContact O-N 3.43Å; I86-L89 PolarHBondContact O-N 3Å; I86-L90 VanDerWaalsContact O-CB 3.26Å; I86-L90 WeakPolarHBondContact O-CB 3.45Å; I86-L90 PolarHBondContact O-N 3.42Å; I86-L131 HydrophobicContact CG2-CD1 3.82Å
87	S	96.8	Very high	93.6	Very high	0 Å²	0	39 Å²	39	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.8	-43.7	175.3	-179.7	0	0	0	0	112.6	L83 M84 V85 S91 A128	L83-S87 VanDerWaalsContact O-CB 3.28Å; L83-S87 WeakPolarHBondContact O-CB 3.36Å; L83-S87 PolarHBondContact O-N 3.01Å; M84-S87 WeakPolarHBondContact O-CB 3.45Å; M84-S87 PolarHBondContact O-N 3.36Å; V85-S87 VanDerWaalsContact C-N 3.3Å; V85-S87 PolarHBondContact O-N 3.26Å; S87-S91 WeakPolarHBondContact O-CB 3.42Å; S87-S91 PolarHBondContact O-N 2.92Å; S87-S91 PolarHBondContact O-OG 3.18Å; S87-A128 PolarHBondContact OG-O 3.2Å
88	C	96.6	Very high	94.1	Very high	28 Å²	28	38.5 Å²	38.5	19%	0.189	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-46.2	176.9	-75.9	0	0	0	0	112	M84 V85 I86 L90 S91 G92	M84-C88 PolarHBondContact O-N 3.43Å; M84-C88 PolarHBondContact O-SG 2.95Å; V85-C88 PolarHBondContact O-N 3.32Å; I86-C88 PolarHBondContact O-N 3.43Å; C88-L90 VanDerWaalsContact C-N 3.34Å; C88-L90 PolarHBondContact O-N 3.37Å; C88-S91 PolarHBondContact O-N 3.05Å; C88-G92 PolarHBondContact O-N 3.21Å
89	L	97.4	Very high	94.3	Very high	113 Å²	113	36.1 Å²	36.1	59%	0.592	23%	0.228	S	C	*	.	H	α-helix	trans	-61.1	-45.6	177.9	-68.9	175.6	0	0	0	111.1	V85 I86 S91 G92 I93	V85-L89 HydrophobicContact CG1-CD1 4.13Å; V85-L89 HydrophobicContact CG1-CG 4.44Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 3.01Å; I86-L89 PolarHBondContact O-N 3Å; L89-S91 PolarHBondContact O-N 3.5Å; L89-G92 PolarHBondContact O-N 3.22Å; L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.06Å
90	L	96.9	Very high	94.3	Very high	29 Å²	29	37.2 Å²	37.2	15%	0.152	23%	0.226	C	C	.	.	H	α-helix	trans	-64.7	-40.6	179.2	-163.1	66.6	0	0	0	111.7	I86 C88 G92 I93 A94 L124 L127 A128 L131	I86-L90 VanDerWaalsContact O-CB 3.26Å; I86-L90 WeakPolarHBondContact O-CB 3.45Å; I86-L90 PolarHBondContact O-N 3.42Å; C88-L90 VanDerWaalsContact C-N 3.34Å; C88-L90 PolarHBondContact O-N 3.37Å; L90-G92 VanDerWaalsContact C-N 3.33Å; L90-G92 PolarHBondContact O-N 3.01Å; L90-I93 PolarHBondContact O-N 3.46Å; L90-A94 VanDerWaalsContact O-CB 3.26Å; L90-A94 WeakPolarHBondContact O-CB 3.21Å; L90-A94 PolarHBondContact O-N 3.49Å; L90-L124 HydrophobicContact CD1-CD2 3.59Å; L90-L124 HydrophobicContact CG-CB 4.44Å; L90-L124 HydrophobicContact CG-CD2 4.25Å; L90-L127 HydrophobicContact CD2-CB 3.81Å; L90-L127 HydrophobicContact CD2-CD2 3.7Å; L90-L127 HydrophobicContact CD2-CG 3.54Å; L90-A128 HydrophobicContact CB-CB 4.05Å; L90-A128 HydrophobicContact CD2-CB 4.1Å; L90-A128 HydrophobicContact CG-CB 4.25Å; L90-L131 HydrophobicContact CD2-CD1 4.24Å
91	S	96.8	Very high	94.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.3	-37.5	173.8	-59.6	0	0	0	0	112.4	S87 C88 L89 A94 C95 A128	S87-S91 WeakPolarHBondContact O-CB 3.42Å; S87-S91 PolarHBondContact O-N 2.92Å; S87-S91 PolarHBondContact O-OG 3.18Å; C88-S91 PolarHBondContact O-N 3.05Å; L89-S91 PolarHBondContact O-N 3.5Å; S91-A94 WeakPolarHBondContact O-CB 3.33Å; S91-A94 PolarHBondContact O-N 2.97Å; S91-C95 WeakPolarHBondContact O-CB 3.45Å; S91-C95 PolarHBondContact O-N 3.49Å; S91-A128 WeakPolarHBondContact OG-CB 3.46Å
92	G	96.4	Very high	93.7	Very high	36 Å²	36	37.5 Å²	37.5	37%	0.371	23%	0.229	S	C	.	.	H	α-helix	trans	-63.9	-45.8	175.6	0	0	0	0	0	112.4	C88 L89 L90 C95 A96	C88-G92 PolarHBondContact O-N 3.21Å; L89-G92 PolarHBondContact O-N 3.22Å; L90-G92 VanDerWaalsContact C-N 3.33Å; L90-G92 PolarHBondContact O-N 3.01Å; G92-C95 WeakPolarHBondContact O-CB 3.36Å; G92-C95 PolarHBondContact O-N 3.45Å; G92-A96 PolarHBondContact O-N 3.03Å; G92-A96 VanDerWaalsContact O-N 3.14Å
93	I	96.8	Very high	92.9	Very high	94 Å²	94	38.7 Å²	38.7	48%	0.482	23%	0.225	S	C	.	.	H	α-helix	trans	-63.9	-43.8	174.8	-62	166.3	0	0	0	110.2	L89 L90 C95 A96 C97 L124	L89-I93 WeakPolarHBondContact O-CG1 3.33Å; L89-I93 PolarHBondContact O-N 3.06Å; L90-I93 PolarHBondContact O-N 3.46Å; I93-C95 VanDerWaalsContact C-N 3.31Å; I93-C95 PolarHBondContact O-N 3Å; I93-A96 PolarHBondContact O-N 2.9Å; I93-C97 PolarHBondContact O-N 3.48Å; I93-C97 PolarHBondContact O-SG 2.87Å; I93-C97 VanDerWaalsContact O-SG 3.38Å; I93-L124 HydrophobicContact CG2-CD1 4.07Å
94	A	96	Very high	91.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.1	-43.8	176.6	0	0	0	0	0	112	L90 S91 C97 A98 L124 F125	L90-A94 VanDerWaalsContact O-CB 3.26Å; L90-A94 WeakPolarHBondContact O-CB 3.21Å; L90-A94 PolarHBondContact O-N 3.49Å; S91-A94 WeakPolarHBondContact O-CB 3.33Å; S91-A94 PolarHBondContact O-N 2.97Å; A94-C97 PolarHBondContact O-N 3.17Å; A94-A98 VanDerWaalsContact O-CB 3.27Å; A94-A98 WeakPolarHBondContact O-CB 3.3Å; A94-A98 PolarHBondContact O-N 3.22Å; A94-L124 HydrophobicContact CB-CB 3.54Å; A94-F125 HydrophobicContact CB-CB 4.36Å; A94-F125 HydrophobicContact CB-CD1 3.88Å; A94-F125 HydrophobicContact CB-CD2 3.62Å; A94-F125 HydrophobicContact CB-CE1 4.03Å; A94-F125 HydrophobicContact CB-CE2 3.78Å; A94-F125 HydrophobicContact CB-CG 3.66Å; A94-F125 HydrophobicContact CB-CZ 3.99Å
95	C	95.9	Very high	90.8	Very high	19 Å²	19	42.4 Å²	42.4	13%	0.128	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-47.7	176.9	-171.4	0	0	0	0	111.4	M18 S91 G92 I93 C97 A98 V99 F125	M18-C95 HydrophobicContact SD-CB 4.01Å; S91-C95 WeakPolarHBondContact O-CB 3.45Å; S91-C95 PolarHBondContact O-N 3.49Å; G92-C95 WeakPolarHBondContact O-CB 3.36Å; G92-C95 PolarHBondContact O-N 3.45Å; I93-C95 VanDerWaalsContact C-N 3.31Å; I93-C95 PolarHBondContact O-N 3Å; C95-C97 PolarHBondContact O-N 3.03Å; C95-A98 PolarHBondContact O-N 2.88Å; C95-V99 VanDerWaalsContact O-CG2 3.32Å; C95-V99 WeakPolarHBondContact O-CG2 3.46Å; C95-V99 PolarHBondContact O-N 3.36Å; C95-F125 HydrophobicContact CB-CZ 3.83Å
96	A	94.1	Very high	89.3	Confident	55 Å²	55	50.1 Å²	50.1	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-60	-46.2	177.1	0	0	0	0	0	112	G92 I93 A98 V99 I100	G92-A96 PolarHBondContact O-N 3.03Å; G92-A96 VanDerWaalsContact O-N 3.14Å; I93-A96 PolarHBondContact O-N 2.9Å; A96-A98 PolarHBondContact O-N 3.32Å; A96-V99 PolarHBondContact O-N 2.91Å; A96-I100 WeakPolarHBondContact O-CG1 3.4Å; A96-I100 PolarHBondContact O-N 3.23Å
97	C	92.1	Very high	87.5	Confident	16 Å²	16	49.3 Å²	49.3	11%	0.108	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-43.4	175.6	-67.4	0	0	0	0	112.1	I93 A94 C95 I100 G101	I93-C97 PolarHBondContact O-N 3.48Å; I93-C97 PolarHBondContact O-SG 2.87Å; I93-C97 VanDerWaalsContact O-SG 3.38Å; A94-C97 PolarHBondContact O-N 3.17Å; C95-C97 PolarHBondContact O-N 3.03Å; C97-I100 PolarHBondContact O-N 2.89Å; C97-G101 PolarHBondContact O-N 2.97Å
98	A	91.4	Very high	85.6	Confident	3 Å²	3	51.9 Å²	51.9	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-42.5	178.7	0	0	0	0	0	111.8	F11 A94 C95 A96 I100 G101 M102 F125	F11-A98 HydrophobicContact CD2-CB 3.96Å; F11-A98 HydrophobicContact CE2-CB 4.12Å; A94-A98 VanDerWaalsContact O-CB 3.27Å; A94-A98 WeakPolarHBondContact O-CB 3.3Å; A94-A98 PolarHBondContact O-N 3.22Å; C95-A98 PolarHBondContact O-N 2.88Å; A96-A98 PolarHBondContact O-N 3.32Å; A98-I100 VanDerWaalsContact C-N 3.33Å; A98-I100 PolarHBondContact O-N 2.87Å; A98-G101 PolarHBondContact O-N 3.35Å; A98-M102 WeakPolarHBondContact O-CG 3.3Å; A98-M102 PolarHBondContact O-N 3.14Å; A98-F125 HydrophobicContact CB-CE2 4.09Å
99	V	90.8	Very high	83.8	Confident	58 Å²	58	58.4 Å²	58.4	35%	0.352	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-41.5	176.4	172.1	0	0	0	0	111.8	F11 C95 A96 M102 T105	F11-V99 HydrophobicContact CE2-CG2 3.78Å; F11-V99 HydrophobicContact CZ-CG2 3.7Å; C95-V99 VanDerWaalsContact O-CG2 3.32Å; C95-V99 WeakPolarHBondContact O-CG2 3.46Å; C95-V99 PolarHBondContact O-N 3.36Å; A96-V99 PolarHBondContact O-N 2.91Å; V99-M102 HydrophobicContact CB-CE 4.28Å; V99-M102 HydrophobicContact CG2-CE 3.96Å; V99-T105 VanDerWaalsContact O-CB 3.3Å; V99-T105 WeakPolarHBondContact O-CB 3.24Å; V99-T105 PolarHBondContact O-OG1 3.44Å
100	I	88.6	Confident	82.1	Confident	73 Å²	73	57.3 Å²	57.3	37%	0.374	34%	0.339	S	S	.	.	H	α-helix	trans	-68.1	-38.9	176.3	-63.6	165.7	0	0	0	111.1	A96 C97 A98 F117	A96-I100 WeakPolarHBondContact O-CG1 3.4Å; A96-I100 PolarHBondContact O-N 3.23Å; C97-I100 PolarHBondContact O-N 2.89Å; A98-I100 VanDerWaalsContact C-N 3.33Å; A98-I100 PolarHBondContact O-N 2.87Å; I100-F117 HydrophobicContact CG2-CB 4.5Å; I100-F117 HydrophobicContact CG2-CD2 4.19Å; I100-F117 HydrophobicContact CG2-CG 4.29Å
101	G	83.9	Confident	80.9	Confident	4 Å²	4	59.3 Å²	59.3	4%	0.041	35%	0.353	C	S	.	.	H	α-helix	trans	-74	-20.8	-179	0	0	0	0	0	115.4	C97 A98 K114	C97-G101 PolarHBondContact O-N 2.97Å; A98-G101 PolarHBondContact O-N 3.35Å; G101-K114 VanDerWaalsContact O-CE 3.32Å; G101-K114 WeakPolarHBondContact O-CE 3.3Å
102	M	84.7	Confident	79.8	Confident	20 Å²	20	64.3 Å²	64.3	10%	0.099	39%	0.386	C	S	.	.	S	Bend	trans	-63.6	137.6	-176.6	-83.3	-168.6	-71.8	0	0	113.7	Q7 F11 A98 V99 C104 T105 K114	Q7-M102 HydrophobicContact CG-CG 4.5Å; F11-M102 HydrophobicContact CB-SD 4.02Å; F11-M102 HydrophobicContact CD1-CE 3.94Å; F11-M102 HydrophobicContact CD1-SD 4.02Å; F11-M102 HydrophobicContact CD2-CE 3.86Å; F11-M102 HydrophobicContact CD2-SD 4.08Å; F11-M102 HydrophobicContact CE1-CE 3.88Å; F11-M102 HydrophobicContact CE2-CE 3.8Å; F11-M102 HydrophobicContact CG-CE 3.93Å; F11-M102 HydrophobicContact CG-SD 3.75Å; F11-M102 HydrophobicContact CZ-CE 3.81Å; A98-M102 WeakPolarHBondContact O-CG 3.3Å; A98-M102 PolarHBondContact O-N 3.14Å; V99-M102 HydrophobicContact CB-CE 4.28Å; V99-M102 HydrophobicContact CG2-CE 3.96Å; M102-C104 PolarHBondContact O-N 3.48Å; M102-C104 VanDerWaalsContact O-N 3.17Å; M102-T105 WeakPolarHBondContact O-CB 3.07Å; M102-T105 PolarHBondContact O-N 2.67Å; M102-K114 VanDerWaalsContact C-CE 3.47Å; M102-K114 WeakPolarHBondContact O-CE 3.47Å; M102-K114 PolarHBondContact O-NZ 3.48Å
103	K	74.9	Confident	78.9	Confident	76 Å²	76	64.2 Å²	64.2	33%	0.33	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-33.1	177.6	-73.5	177.6	176	174.2	0	112.9	S3 T105 K114 E188	S3-K103 PolarHBondContact OG-NZ 2.7Å; K103-T105 PolarHBondContact O-N 3.39Å; K103-K114 PolarHBondContact O-NZ 2.71Å; K103-E188 WeakPolarHBondContact CE-OE2 3.49Å; K103-E188 IonicContact NZ-OE1 2.76Å; K103-E188 PolarHBondContact NZ-OE1 3.35Å; K103-E188 IonicContact NZ-OE2 2.96Å; K103-E188 PolarHBondContact NZ-OE2 3.1Å
104	C	70.9	Confident	78.2	Confident	95 Å²	95	61.4 Å²	61.4	64%	0.642	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.5	178.4	-54.4	0	0	0	0	114.1	M102	M102-C104 PolarHBondContact O-N 3.48Å; M102-C104 VanDerWaalsContact O-N 3.17Å
105	T	74.6	Confident	77.5	Confident	31 Å²	31	63.6 Å²	63.6	19%	0.19	38%	0.379	C	S	.	.			trans	-88	126.8	-179	-52.2	0	0	0	0	110.6	V99 M102 K103 C107 K114	V99-T105 VanDerWaalsContact O-CB 3.3Å; V99-T105 WeakPolarHBondContact O-CB 3.24Å; V99-T105 PolarHBondContact O-OG1 3.44Å; M102-T105 WeakPolarHBondContact O-CB 3.07Å; M102-T105 PolarHBondContact O-N 2.67Å; K103-T105 PolarHBondContact O-N 3.39Å; T105-C107 HydrophobicContact CG2-CB 3.97Å; T105-C107 PolarHBondContact O-N 3.3Å; T105-K114 PolarHBondContact O-NZ 3.01Å
106	R	63.8	Low	77	Confident	214 Å²	214	66.9 Å²	66.9	81%	0.808	40%	0.399	S	S	*	.			trans	-72.9	-9.7	-176.6	-163.3	177.9	178.1	-174.7	1.9	113.6
107	C	58.1	Low	76.8	Confident	71 Å²	71	68.2 Å²	68.2	48%	0.48	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	134	176.2	-58.9	0	0	0	0	111	T105 K109	T105-C107 HydrophobicContact CG2-CB 3.97Å; T105-C107 PolarHBondContact O-N 3.3Å; C107-K109 PolarHBondContact O-N 3.26Å
108	A	56.6	Low	76.6	Confident	55 Å²	55	67.8 Å²	67.8	46%	0.455	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	54.3	173.4	0	0	0	0	0	115.9	G110	A108-G110 PolarHBondContact O-N 2.86Å
109	K	59.3	Low	76.5	Confident	165 Å²	165	71.1 Å²	71.1	72%	0.717	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	125.9	170.6	-86.2	-174.2	172.4	-175.2	0	110.9	C107	C107-K109 PolarHBondContact O-N 3.26Å
110	G	62	Low	76.6	Confident	89 Å²	89	71.8 Å²	71.8	92%	0.918	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	6.4	168.4	0	0	0	0	0	116.4	A108	A108-G110 PolarHBondContact O-N 2.86Å
111	T	71	Confident	76.9	Confident	72 Å²	72	68.3 Å²	68.3	44%	0.442	39%	0.392	S	S	.	.			trans	-106.1	139.3	-179.6	-44.3	0	0	0	0	111.3	A113 K114	T111-A113 HydrophobicContact CG2-CB 3.81Å; T111-A113 PolarHBondContact O-N 3.39Å; T111-K114 PolarHBondContact O-N 2.81Å
112	P	74.3	Confident	77.4	Confident	105 Å²	105	68.1 Å²	68.1	68%	0.682	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.8	174.9	24.5	-35.8	0	0	0	113.5	K114 T115 T116	P112-K114 PolarHBondContact O-N 3.42Å; P112-T115 PolarHBondContact O-N 3.29Å; P112-T116 PolarHBondContact O-N 2.99Å; P112-T116 PolarHBondContact O-OG1 3.22Å
113	A	77.8	Confident	77.9	Confident	34 Å²	34	69.7 Å²	69.7	28%	0.281	40%	0.403	S	S	.	.	H	α-helix	trans	-55	-32.3	175.5	0	0	0	0	0	113.2	T111 T115 T116 F117	T111-A113 HydrophobicContact CG2-CB 3.81Å; T111-A113 PolarHBondContact O-N 3.39Å; A113-T115 PolarHBondContact O-N 2.99Å; A113-T116 WeakPolarHBondContact O-CB 3.34Å; A113-T116 PolarHBondContact O-N 3.16Å; A113-F117 HydrophobicContact CB-CD2 4.44Å; A113-F117 HydrophobicContact CB-CE2 4.23Å; A113-F117 WeakPolarHBondContact O-CD2 3.49Å; A113-F117 PolarHBondContact O-N 2.99Å
114	K	81	Confident	79	Confident	34 Å²	34	67.4 Å²	67.4	15%	0.148	39%	0.394	C	S	.	.	H	α-helix	trans	-63.8	-42.3	-179	-173.1	168	-176.9	164.2	0	112.3	G101 M102 K103 T105 T111 P112 F117 A118	G101-K114 VanDerWaalsContact O-CE 3.32Å; G101-K114 WeakPolarHBondContact O-CE 3.3Å; M102-K114 VanDerWaalsContact C-CE 3.47Å; M102-K114 WeakPolarHBondContact O-CE 3.47Å; M102-K114 PolarHBondContact O-NZ 3.48Å; K103-K114 PolarHBondContact O-NZ 2.71Å; T105-K114 PolarHBondContact O-NZ 3.01Å; T111-K114 PolarHBondContact O-N 2.81Å; P112-K114 PolarHBondContact O-N 3.42Å; K114-F117 PolarHBondContact O-N 2.97Å; K114-A118 PolarHBondContact O-N 3Å; K114-A118 VanDerWaalsContact O-N 3.12Å
115	T	81.6	Confident	80.2	Confident	46 Å²	46	62.9 Å²	62.9	28%	0.282	36%	0.364	S	S	.	.	H	α-helix	trans	-66.7	-39.3	175.9	-50.6	0	0	0	0	110.9	P112 A113 A118 I119 C185	P112-T115 PolarHBondContact O-N 3.29Å; A113-T115 PolarHBondContact O-N 2.99Å; T115-A118 PolarHBondContact O-N 3.43Å; T115-I119 HydrophobicContact CG2-CD1 3.97Å; T115-I119 WeakPolarHBondContact O-CG1 3.4Å; T115-I119 PolarHBondContact O-N 3.43Å; T115-C185 HydrophobicContact CG2-CB 4.3Å
116	T	86.6	Confident	81.3	Confident	89 Å²	89	63.5 Å²	63.5	55%	0.546	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-45.4	175	-52.4	0	0	0	0	112	P112 A113 A118 I119 L120	P112-T116 PolarHBondContact O-N 2.99Å; P112-T116 PolarHBondContact O-OG1 3.22Å; A113-T116 WeakPolarHBondContact O-CB 3.34Å; A113-T116 PolarHBondContact O-N 3.16Å; T116-A118 VanDerWaalsContact C-N 3.32Å; T116-A118 PolarHBondContact O-N 3.47Å; T116-I119 PolarHBondContact O-N 3.12Å; T116-L120 WeakPolarHBondContact O-CB 3.47Å; T116-L120 PolarHBondContact O-N 2.75Å
117	F	88.6	Confident	83	Confident	82 Å²	82	57.5 Å²	57.5	36%	0.36	35%	0.349	S	S	.	.	H	α-helix	trans	-65	-35.1	177.4	-76.8	-65.4	0	0	0	112.9	I100 A113 K114 G121	I100-F117 HydrophobicContact CG2-CB 4.5Å; I100-F117 HydrophobicContact CG2-CD2 4.19Å; I100-F117 HydrophobicContact CG2-CG 4.29Å; A113-F117 HydrophobicContact CB-CD2 4.44Å; A113-F117 HydrophobicContact CB-CE2 4.23Å; A113-F117 WeakPolarHBondContact O-CD2 3.49Å; A113-F117 PolarHBondContact O-N 2.99Å; K114-F117 PolarHBondContact O-N 2.97Å; F117-G121 PolarHBondContact O-N 3.36Å
118	A	87.9	Confident	84.8	Confident	7 Å²	7	54.1 Å²	54.1	6%	0.058	33%	0.326	C	S	.	.	H	α-helix	trans	-68.4	-45.3	176.7	0	0	0	0	0	112.2	K114 T115 T116 G121 G122 C185	K114-A118 PolarHBondContact O-N 3Å; K114-A118 VanDerWaalsContact O-N 3.12Å; T115-A118 PolarHBondContact O-N 3.43Å; T116-A118 VanDerWaalsContact C-N 3.32Å; T116-A118 PolarHBondContact O-N 3.47Å; A118-G121 PolarHBondContact O-N 3.48Å; A118-G122 PolarHBondContact O-N 3.24Å; A118-C185 WeakPolarHBondContact CB-SG 3.33Å
119	I	89.6	Confident	86.8	Confident	73 Å²	73	51.5 Å²	51.5	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-43.7	175.7	-65.7	168.9	0	0	0	110.5	T115 T116 G121 G122 S123 C185	T115-I119 HydrophobicContact CG2-CD1 3.97Å; T115-I119 WeakPolarHBondContact O-CG1 3.4Å; T115-I119 PolarHBondContact O-N 3.43Å; T116-I119 PolarHBondContact O-N 3.12Å; I119-G121 PolarHBondContact O-N 2.82Å; I119-G122 PolarHBondContact O-N 3.27Å; I119-S123 WeakPolarHBondContact O-CB 3.29Å; I119-S123 PolarHBondContact O-N 2.87Å; I119-S123 PolarHBondContact O-OG 3.28Å; I119-C185 HydrophobicContact CD1-CB 4.38Å; I119-C185 HydrophobicContact CG1-CB 3.82Å
120	L	93.8	Very high	88.6	Confident	73 Å²	73	47.7 Å²	47.7	38%	0.382	29%	0.292	S	S	.	.	H	α-helix	trans	-58.5	-50	175.9	-179.3	63.4	0	0	0	110.7	T116 G122 S123 L124	T116-L120 WeakPolarHBondContact O-CB 3.47Å; T116-L120 PolarHBondContact O-N 2.75Å; L120-G122 PolarHBondContact O-N 3.24Å; L120-S123 PolarHBondContact O-N 2.86Å; L120-S123 PolarHBondContact O-OG 3.43Å; L120-L124 HydrophobicContact CD1-CD1 4.08Å; L120-L124 HydrophobicContact CD1-CG 4.16Å; L120-L124 HydrophobicContact CG-CD1 3.89Å; L120-L124 HydrophobicContact CG-CG 4.39Å; L120-L124 VanDerWaalsContact O-CG 3.24Å; L120-L124 WeakPolarHBondContact O-CG 3.16Å; L120-L124 PolarHBondContact O-N 3.41Å
121	G	93.8	Very high	90.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.6	-46.3	176.9	0	0	0	0	0	112.9	F117 A118 I119 L124 F125	F117-G121 PolarHBondContact O-N 3.36Å; A118-G121 PolarHBondContact O-N 3.48Å; I119-G121 PolarHBondContact O-N 2.82Å; G121-L124 PolarHBondContact O-N 3Å; G121-F125 VanDerWaalsContact O-CD2 3.3Å; G121-F125 WeakPolarHBondContact O-CD2 3.37Å; G121-F125 PolarHBondContact O-N 2.9Å
122	G	94.4	Very high	91.5	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.1	-45.9	176	0	0	0	0	0	113	A118 I119 L120 L124 F125 I126 C182	A118-G122 PolarHBondContact O-N 3.24Å; I119-G122 PolarHBondContact O-N 3.27Å; L120-G122 PolarHBondContact O-N 3.24Å; G122-L124 VanDerWaalsContact C-N 3.35Å; G122-L124 PolarHBondContact O-N 3.42Å; G122-F125 PolarHBondContact O-N 2.84Å; G122-I126 WeakPolarHBondContact O-CG1 3.25Å; G122-I126 PolarHBondContact O-N 3.26Å; G122-C182 VanDerWaalsContact C-SG 3.51Å
123	S	95.5	Very high	92.6	Very high	52 Å²	52	39.6 Å²	39.6	36%	0.364	22%	0.218	S	C	.	.	H	α-helix	trans	-63.3	-38.6	178.7	70.4	0	0	0	0	112.9	I119 L120 I126 L127	I119-S123 WeakPolarHBondContact O-CB 3.29Å; I119-S123 PolarHBondContact O-N 2.87Å; I119-S123 PolarHBondContact O-OG 3.28Å; L120-S123 PolarHBondContact O-N 2.86Å; L120-S123 PolarHBondContact O-OG 3.43Å; S123-I126 PolarHBondContact O-N 2.73Å; S123-L127 PolarHBondContact O-N 2.91Å
124	L	97	Very high	93.4	Very high	29 Å²	29	41.8 Å²	41.8	15%	0.152	23%	0.227	C	C	.	.	H	α-helix	trans	-68.7	-37.2	176.7	-66.8	171	0	0	0	111.5	L90 I93 A94 L120 G121 G122 I126 L127 A128	L90-L124 HydrophobicContact CD1-CD2 3.59Å; L90-L124 HydrophobicContact CG-CB 4.44Å; L90-L124 HydrophobicContact CG-CD2 4.25Å; I93-L124 HydrophobicContact CG2-CD1 4.07Å; A94-L124 HydrophobicContact CB-CB 3.54Å; L120-L124 HydrophobicContact CD1-CD1 4.08Å; L120-L124 HydrophobicContact CD1-CG 4.16Å; L120-L124 HydrophobicContact CG-CD1 3.89Å; L120-L124 HydrophobicContact CG-CG 4.39Å; L120-L124 VanDerWaalsContact O-CG 3.24Å; L120-L124 WeakPolarHBondContact O-CG 3.16Å; L120-L124 PolarHBondContact O-N 3.41Å; G121-L124 PolarHBondContact O-N 3Å; G122-L124 VanDerWaalsContact C-N 3.35Å; G122-L124 PolarHBondContact O-N 3.42Å; L124-I126 VanDerWaalsContact C-N 3.35Å; L124-L127 PolarHBondContact O-N 3.38Å; L124-A128 VanDerWaalsContact O-CB 3.3Å; L124-A128 WeakPolarHBondContact O-CB 3.42Å; L124-A128 PolarHBondContact O-N 3.3Å
125	F	97.4	Very high	94.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-39	172.6	-88.6	-58.2	0	0	0	112.5	M18 A94 C95 A98 G121 G122 G129 L181	M18-F125 HydrophobicContact CB-CE1 4.32Å; A94-F125 HydrophobicContact CB-CB 4.36Å; A94-F125 HydrophobicContact CB-CD1 3.88Å; A94-F125 HydrophobicContact CB-CD2 3.62Å; A94-F125 HydrophobicContact CB-CE1 4.03Å; A94-F125 HydrophobicContact CB-CE2 3.78Å; A94-F125 HydrophobicContact CB-CG 3.66Å; A94-F125 HydrophobicContact CB-CZ 3.99Å; C95-F125 HydrophobicContact CB-CZ 3.83Å; A98-F125 HydrophobicContact CB-CE2 4.09Å; G121-F125 VanDerWaalsContact O-CD2 3.3Å; G121-F125 WeakPolarHBondContact O-CD2 3.37Å; G121-F125 PolarHBondContact O-N 2.9Å; G122-F125 PolarHBondContact O-N 2.84Å; F125-G129 PolarHBondContact O-N 2.91Å; F125-L181 HydrophobicContact CD2-CD1 4.09Å; F125-L181 HydrophobicContact CE2-CD1 4.43Å
126	I	97.9	Very high	94.8	Very high	44 Å²	44	38 Å²	38	23%	0.226	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-49.9	174.6	-65.8	167.8	0	0	0	110	G122 S123 L124 A128 G129 L130 L175 T179	G122-I126 WeakPolarHBondContact O-CG1 3.25Å; G122-I126 PolarHBondContact O-N 3.26Å; S123-I126 PolarHBondContact O-N 2.73Å; L124-I126 VanDerWaalsContact C-N 3.35Å; I126-A128 VanDerWaalsContact C-N 3.32Å; I126-A128 PolarHBondContact O-N 2.85Å; I126-G129 PolarHBondContact O-N 3.39Å; I126-L130 HydrophobicContact CG2-CD1 4.28Å; I126-L130 HydrophobicContact CG2-CG 4.49Å; I126-L130 WeakPolarHBondContact O-CG 3.34Å; I126-L130 PolarHBondContact O-N 2.99Å; I126-L175 HydrophobicContact CG2-CD2 3.95Å; I126-L175 WeakPolarHBondContact O-CD2 3.24Å; I126-T179 HydrophobicContact CD1-CG2 3.73Å; I126-T179 HydrophobicContact CG1-CG2 4.17Å
127	L	97.8	Very high	95.2	Very high	87 Å²	87	36 Å²	36	46%	0.455	20%	0.196	S	C	.	.	H	α-helix	trans	-61.1	-41.5	179.8	-178.8	58.5	0	0	0	111.6	L90 S123 L124 L130 L131	L90-L127 HydrophobicContact CD2-CB 3.81Å; L90-L127 HydrophobicContact CD2-CD2 3.7Å; L90-L127 HydrophobicContact CD2-CG 3.54Å; S123-L127 PolarHBondContact O-N 2.91Å; L124-L127 PolarHBondContact O-N 3.38Å; L127-L130 PolarHBondContact O-N 3.09Å; L127-L131 WeakPolarHBondContact O-CG 3.25Å; L127-L131 PolarHBondContact O-N 2.93Å
128	A	97.6	Very high	95.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.4	-46.9	175.2	0	0	0	0	0	111.8	S87 L90 S91 L124 I126 L130 L131 C132	S87-A128 PolarHBondContact OG-O 3.2Å; L90-A128 HydrophobicContact CB-CB 4.05Å; L90-A128 HydrophobicContact CD2-CB 4.1Å; L90-A128 HydrophobicContact CG-CB 4.25Å; S91-A128 WeakPolarHBondContact OG-CB 3.46Å; L124-A128 VanDerWaalsContact O-CB 3.3Å; L124-A128 WeakPolarHBondContact O-CB 3.42Å; L124-A128 PolarHBondContact O-N 3.3Å; I126-A128 VanDerWaalsContact C-N 3.32Å; I126-A128 PolarHBondContact O-N 2.85Å; A128-L130 VanDerWaalsContact C-N 3.29Å; A128-L130 PolarHBondContact O-N 3.38Å; A128-L131 PolarHBondContact O-N 2.97Å; A128-L131 VanDerWaalsContact O-N 3.17Å; A128-C132 PolarHBondContact O-N 3.45Å
129	G	97.3	Very high	95.7	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-56.1	-41.5	175.1	0	0	0	0	0	112.7	F125 I126 C132 M133 S171	F125-G129 PolarHBondContact O-N 2.91Å; I126-G129 PolarHBondContact O-N 3.39Å; G129-C132 PolarHBondContact O-N 3.21Å; G129-M133 WeakPolarHBondContact O-CB 3.41Å; G129-M133 PolarHBondContact O-N 3.39Å; G129-S171 WeakPolarHBondContact O-CB 3.24Å
130	L	98	Very high	95.8	Very high	85 Å²	85	36.2 Å²	36.2	45%	0.445	19%	0.191	S	C	.	.	H	α-helix	trans	-64.4	-44.8	175.6	-71.1	177	0	0	0	112.4	I126 L127 A128 C132 M133 V134 L175	I126-L130 HydrophobicContact CG2-CD1 4.28Å; I126-L130 HydrophobicContact CG2-CG 4.49Å; I126-L130 WeakPolarHBondContact O-CG 3.34Å; I126-L130 PolarHBondContact O-N 2.99Å; L127-L130 PolarHBondContact O-N 3.09Å; A128-L130 VanDerWaalsContact C-N 3.29Å; A128-L130 PolarHBondContact O-N 3.38Å; L130-C132 PolarHBondContact O-N 2.86Å; L130-M133 WeakPolarHBondContact O-CB 3.19Å; L130-M133 PolarHBondContact O-N 3.14Å; L130-V134 VanDerWaalsContact O-CG2 3.3Å; L130-V134 WeakPolarHBondContact O-CG2 3.23Å; L130-V134 PolarHBondContact O-N 3.38Å; L130-L175 HydrophobicContact CD2-CD1 4.42Å; L130-L175 HydrophobicContact CD2-CD2 3.85Å; L130-L175 HydrophobicContact CG-CD2 3.81Å
131	L	96.6	Very high	95.8	Very high	40 Å²	40	36.5 Å²	36.5	21%	0.209	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-43.8	177.7	-69.6	173.6	0	0	0	111.7	L83 I86 L90 L127 A128 V134 A135	L83-L131 HydrophobicContact CD2-CD2 4.19Å; I86-L131 HydrophobicContact CG2-CD1 3.82Å; L90-L131 HydrophobicContact CD2-CD1 4.24Å; L127-L131 WeakPolarHBondContact O-CG 3.25Å; L127-L131 PolarHBondContact O-N 2.93Å; A128-L131 PolarHBondContact O-N 2.97Å; A128-L131 VanDerWaalsContact O-N 3.17Å; L131-V134 PolarHBondContact O-N 2.89Å; L131-A135 PolarHBondContact O-N 2.91Å
132	C	96.6	Very high	95.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-47.2	173	-176.1	0	0	0	0	111.1	T21 A128 G129 L130 V134 A135 V136	T21-C132 HydrophobicContact CG2-CB 4.23Å; A128-C132 PolarHBondContact O-N 3.45Å; G129-C132 PolarHBondContact O-N 3.21Å; L130-C132 PolarHBondContact O-N 2.86Å; C132-V134 PolarHBondContact O-N 2.83Å; C132-A135 PolarHBondContact O-N 2.66Å; C132-V136 VanDerWaalsContact O-CG2 3.29Å; C132-V136 WeakPolarHBondContact O-CG2 3.24Å; C132-V136 PolarHBondContact O-N 2.88Å
133	M	97.3	Very high	95.5	Very high	56 Å²	56	37.9 Å²	37.9	28%	0.276	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-44.7	178.8	-165.7	66.2	152.5	0	0	112.2	G129 L130 S137 F168 S171	G129-M133 WeakPolarHBondContact O-CB 3.41Å; G129-M133 PolarHBondContact O-N 3.39Å; L130-M133 WeakPolarHBondContact O-CB 3.19Å; L130-M133 PolarHBondContact O-N 3.14Å; M133-S137 WeakPolarHBondContact O-CB 3.39Å; M133-S137 PolarHBondContact O-N 3.48Å; M133-S137 PolarHBondContact O-OG 2.98Å; M133-F168 HydrophobicContact CE-CD1 3.86Å; M133-F168 HydrophobicContact CE-CE1 4.17Å; M133-F168 HydrophobicContact SD-CD1 3.5Å; M133-F168 WeakPolarHBondContact SD-CD1 3.35Å; M133-F168 HydrophobicContact SD-CE1 3.84Å; M133-S171 PolarHBondContact SD-OG 2.96Å
134	V	96.2	Very high	95.3	Very high	80 Å²	80	38.1 Å²	38.1	49%	0.485	20%	0.2	S	C	.	.	H	α-helix	trans	-62.4	-46.3	176.6	170.9	0	0	0	0	110.8	L83 L130 L131 C132 V136 S137 W138	L83-V134 HydrophobicContact CD1-CG1 4.43Å; L130-V134 VanDerWaalsContact O-CG2 3.3Å; L130-V134 WeakPolarHBondContact O-CG2 3.23Å; L130-V134 PolarHBondContact O-N 3.38Å; L131-V134 PolarHBondContact O-N 2.89Å; C132-V134 PolarHBondContact O-N 2.83Å; V134-V136 PolarHBondContact O-N 3.06Å; V134-S137 PolarHBondContact O-N 3.23Å; V134-W138 VanDerWaalsContact O-CB 3.24Å; V134-W138 WeakPolarHBondContact O-CB 3.28Å; V134-W138 PolarHBondContact O-N 3.41Å
135	A	94.8	Very high	95	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-45.7	179.4	0	0	0	0	0	112.6	L83 M84 L131 C132 T139	L83-A135 HydrophobicContact CB-CB 3.78Å; L83-A135 HydrophobicContact CD1-CB 4.08Å; M84-A135 HydrophobicContact CG-CB 4.12Å; M84-A135 HydrophobicContact SD-CB 3.87Å; L131-A135 PolarHBondContact O-N 2.91Å; C132-A135 PolarHBondContact O-N 2.66Å; A135-T139 WeakPolarHBondContact O-CB 3.43Å; A135-T139 WeakPolarHBondContact O-CG2 3.17Å; A135-T139 PolarHBondContact O-N 2.87Å; A135-T139 PolarHBondContact O-OG1 2.9Å
136	V	95.5	Very high	94.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.5	-39.5	179.6	176.6	0	0	0	0	111	W30 M84 C132 V134 T139 T140 L164 F168	W30-V136 HydrophobicContact CH2-CG2 4.29Å; M84-V136 HydrophobicContact SD-CG2 4.49Å; C132-V136 VanDerWaalsContact O-CG2 3.29Å; C132-V136 WeakPolarHBondContact O-CG2 3.24Å; C132-V136 PolarHBondContact O-N 2.88Å; V134-V136 PolarHBondContact O-N 3.06Å; V136-T139 WeakPolarHBondContact CA-OG1 3.29Å; V136-T139 PolarHBondContact O-OG1 3.38Å; V136-T140 WeakPolarHBondContact O-CB 3.48Å; V136-T140 PolarHBondContact O-N 3.13Å; V136-T140 PolarHBondContact O-OG1 2.98Å; V136-L164 HydrophobicContact CB-CD2 4.44Å; V136-L164 HydrophobicContact CG1-CB 4.21Å; V136-L164 HydrophobicContact CG1-CD2 3.84Å; V136-L164 WeakPolarHBondContact CG1-O 3.09Å; V136-F168 HydrophobicContact CG1-CD1 4.28Å; V136-F168 HydrophobicContact CG1-CD2 3.54Å; V136-F168 HydrophobicContact CG1-CE1 4.18Å; V136-F168 HydrophobicContact CG1-CE2 3.44Å; V136-F168 VanDerWaalsContact CG1-CE2 3.44Å; V136-F168 HydrophobicContact CG1-CG 3.97Å; V136-F168 HydrophobicContact CG1-CZ 3.77Å
137	S	95.4	Very high	94	Very high	47 Å²	47	46.1 Å²	46.1	33%	0.329	24%	0.236	S	C	.	.	H	α-helix	trans	-68.1	-42.6	178.1	-58	0	0	0	0	111.8	M133 V134 T140 N141	M133-S137 WeakPolarHBondContact O-CB 3.39Å; M133-S137 PolarHBondContact O-N 3.48Å; M133-S137 PolarHBondContact O-OG 2.98Å; V134-S137 PolarHBondContact O-N 3.23Å; S137-T140 PolarHBondContact O-N 2.74Å; S137-N141 WeakPolarHBondContact O-CB 3.33Å; S137-N141 PolarHBondContact O-N 3.4Å
138	W	94.3	Very high	93.5	Very high	143 Å²	143	50.5 Å²	50.5	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-60.5	-50.1	176.1	-173.9	-83.9	0	0	0	111.3	V134 T140 N141 D142	V134-W138 VanDerWaalsContact O-CB 3.24Å; V134-W138 WeakPolarHBondContact O-CB 3.28Å; V134-W138 PolarHBondContact O-N 3.41Å; W138-T140 VanDerWaalsContact C-N 3.31Å; W138-T140 PolarHBondContact O-N 3.22Å; W138-N141 PolarHBondContact O-N 3.18Å; W138-D142 PolarHBondContact O-N 3.5Å
139	T	92.3	Very high	93.1	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-35.3	179.2	49.1	0	0	0	0	112.6	W30 A80 A135 V136 V143 L164	W30-T139 HydrophobicContact CE3-CG2 4.18Å; W30-T139 HydrophobicContact CZ3-CG2 3.96Å; A80-T139 HydrophobicContact CB-CG2 3.71Å; A135-T139 WeakPolarHBondContact O-CB 3.43Å; A135-T139 WeakPolarHBondContact O-CG2 3.17Å; A135-T139 PolarHBondContact O-N 2.87Å; A135-T139 PolarHBondContact O-OG1 2.9Å; V136-T139 WeakPolarHBondContact CA-OG1 3.29Å; V136-T139 PolarHBondContact O-OG1 3.38Å; T139-V143 VanDerWaalsContact O-CG2 3.29Å; T139-V143 WeakPolarHBondContact O-CG2 3.44Å; T139-V143 PolarHBondContact O-N 2.88Å; T139-V143 VanDerWaalsContact O-N 3.08Å; T139-L164 VanDerWaalsContact OG1-CD2 3.23Å; T139-L164 WeakPolarHBondContact OG1-CD2 3.4Å
140	T	93.3	Very high	92.5	Very high	22 Å²	22	58.9 Å²	58.9	14%	0.135	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-46.1	174.2	-58.2	0	0	0	0	111.2	V136 S137 W138 D142 V143 V144 I160	V136-T140 WeakPolarHBondContact O-CB 3.48Å; V136-T140 PolarHBondContact O-N 3.13Å; V136-T140 PolarHBondContact O-OG1 2.98Å; S137-T140 PolarHBondContact O-N 2.74Å; W138-T140 VanDerWaalsContact C-N 3.31Å; W138-T140 PolarHBondContact O-N 3.22Å; T140-D142 VanDerWaalsContact C-N 3.35Å; T140-D142 PolarHBondContact O-N 2.98Å; T140-V143 PolarHBondContact O-N 2.97Å; T140-V144 WeakPolarHBondContact O-CG2 3.23Å; T140-V144 PolarHBondContact O-N 2.91Å; T140-I160 HydrophobicContact CG2-CD1 3.95Å; T140-I160 HydrophobicContact CG2-CG1 4.42Å
141	N	93.5	Very high	92	Very high	80 Å²	80	62 Å²	62	43%	0.428	32%	0.316	S	S	.	.	H	α-helix	trans	-60.1	-44.3	176.8	-179.2	39	0	0	0	111.6	S137 W138 V143 V144 Q145	S137-N141 WeakPolarHBondContact O-CB 3.33Å; S137-N141 PolarHBondContact O-N 3.4Å; W138-N141 PolarHBondContact O-N 3.18Å; N141-V143 PolarHBondContact O-N 2.9Å; N141-V144 PolarHBondContact O-N 3.25Å; N141-Q145 PolarHBondContact ND2-NE2 2.76Å; N141-Q145 VanDerWaalsContact ND2-NE2 3.2Å; N141-Q145 WeakPolarHBondContact O-CB 3.23Å; N141-Q145 WeakPolarHBondContact O-CG 3.37Å; N141-Q145 PolarHBondContact O-N 2.88Å; N141-Q145 PolarHBondContact OD1-NE2 3.23Å; N141-Q145 VanDerWaalsContact OD1-NE2 3.13Å
142	D	91	Very high	91.3	Very high	24 Å²	24	62.1 Å²	62.1	13%	0.128	32%	0.316	C	S	.	.	H	α-helix	trans	-58.9	-44.1	175.4	178.7	56.1	0	0	0	112	R31 W138 T140 V144 Q145 N146	R31-D142 IonicContact CZ-OD2 3.08Å; R31-D142 IonicContact NH1-OD2 2.78Å; R31-D142 PolarHBondContact NH1-OD2 3.32Å; R31-D142 IonicContact NH2-OD2 2.68Å; R31-D142 PolarHBondContact NH2-OD2 3.49Å; W138-D142 PolarHBondContact O-N 3.5Å; T140-D142 VanDerWaalsContact C-N 3.35Å; T140-D142 PolarHBondContact O-N 2.98Å; D142-V144 PolarHBondContact O-N 3.4Å; D142-Q145 PolarHBondContact O-N 3.47Å; D142-N146 VanDerWaalsContact CG-ND2 3.32Å; D142-N146 WeakPolarHBondContact O-CB 3.33Å; D142-N146 VanDerWaalsContact O-CG 3.29Å; D142-N146 PolarHBondContact O-N 3.27Å; D142-N146 PolarHBondContact O-ND2 3.07Å; D142-N146 PolarHBondContact OD1-ND2 2.93Å; D142-N146 PolarHBondContact OD2-ND2 3.2Å
143	V	90.1	Very high	90.5	Very high	4 Å²	4	66 Å²	66	2%	0.024	34%	0.341	C	S	.	.	H	α-helix	trans	-62	-44.3	176.7	171.5	0	0	0	0	111.4	R31 T139 T140 N141 N146 F147 F158 I160	R31-V143 HydrophobicContact CG-CG2 3.76Å; T139-V143 VanDerWaalsContact O-CG2 3.29Å; T139-V143 WeakPolarHBondContact O-CG2 3.44Å; T139-V143 PolarHBondContact O-N 2.88Å; T139-V143 VanDerWaalsContact O-N 3.08Å; T140-V143 PolarHBondContact O-N 2.97Å; N141-V143 PolarHBondContact O-N 2.9Å; V143-N146 PolarHBondContact O-N 2.86Å; V143-F147 PolarHBondContact O-N 3.46Å; V143-F158 HydrophobicContact CG1-CB 4.45Å; V143-F158 WeakPolarHBondContact CG1-O 3.5Å; V143-I160 HydrophobicContact CG1-CG1 4.26Å
144	V	91.4	Very high	89.3	Confident	57 Å²	57	66.7 Å²	66.7	35%	0.345	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-47.1	179.3	172.5	0	0	0	0	111	T140 N141 D142 N146 F147 Y148	T140-V144 WeakPolarHBondContact O-CG2 3.23Å; T140-V144 PolarHBondContact O-N 2.91Å; N141-V144 PolarHBondContact O-N 3.25Å; D142-V144 PolarHBondContact O-N 3.4Å; V144-N146 VanDerWaalsContact C-N 3.33Å; V144-N146 PolarHBondContact O-N 3.13Å; V144-F147 WeakPolarHBondContact O-CB 3.35Å; V144-F147 PolarHBondContact O-N 3.45Å; V144-F147 VanDerWaalsContact O-N 3.14Å; V144-Y148 HydrophobicContact CG1-CD2 3.93Å; V144-Y148 HydrophobicContact CG1-CE2 3.86Å; V144-Y148 VanDerWaalsContact O-CD2 3.24Å; V144-Y148 WeakPolarHBondContact O-CD2 3.43Å; V144-Y148 PolarHBondContact O-N 3.46Å
145	Q	90.7	Very high	88	Confident	114 Å²	114	65.2 Å²	65.2	53%	0.533	35%	0.352	S	S	.	.	H	α-helix	trans	-60.5	-43.5	178.1	-72	-175.8	9.8	0	0	111.8	N141 D142 F147 Y148 N149	N141-Q145 PolarHBondContact ND2-NE2 2.76Å; N141-Q145 VanDerWaalsContact ND2-NE2 3.2Å; N141-Q145 WeakPolarHBondContact O-CB 3.23Å; N141-Q145 WeakPolarHBondContact O-CG 3.37Å; N141-Q145 PolarHBondContact O-N 2.88Å; N141-Q145 PolarHBondContact OD1-NE2 3.23Å; N141-Q145 VanDerWaalsContact OD1-NE2 3.13Å; D142-Q145 PolarHBondContact O-N 3.47Å; Q145-F147 VanDerWaalsContact C-N 3.28Å; Q145-F147 PolarHBondContact O-N 3.28Å; Q145-Y148 PolarHBondContact O-N 3.38Å; Q145-N149 WeakPolarHBondContact O-CB 3.43Å; Q145-N149 PolarHBondContact O-N 2.85Å; Q145-N149 VanDerWaalsContact O-N 3.1Å
146	N	87.7	Confident	87	Confident	49 Å²	49	70.7 Å²	70.7	26%	0.262	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-30.5	177	-74.1	-50.2	0	0	0	112.7	D142 V143 V144 L152	D142-N146 VanDerWaalsContact CG-ND2 3.32Å; D142-N146 WeakPolarHBondContact O-CB 3.33Å; D142-N146 VanDerWaalsContact O-CG 3.29Å; D142-N146 PolarHBondContact O-N 3.27Å; D142-N146 PolarHBondContact O-ND2 3.07Å; D142-N146 PolarHBondContact OD1-ND2 2.93Å; D142-N146 PolarHBondContact OD2-ND2 3.2Å; V143-N146 PolarHBondContact O-N 2.86Å; V144-N146 VanDerWaalsContact C-N 3.33Å; V144-N146 PolarHBondContact O-N 3.13Å; N146-L152 HydrophobicContact CB-CD1 4.03Å; N146-L152 WeakPolarHBondContact O-CD1 3.35Å
147	F	87.1	Confident	86.4	Confident	78 Å²	78	73 Å²	73	34%	0.342	39%	0.389	S	S	.	.	H	α-helix	trans	-67.4	-40.1	176.8	-170.2	-90.5	0	0	0	112.7	A34 V143 V144 Q145 K157	A34-F147 HydrophobicContact CB-CD2 4.5Å; A34-F147 HydrophobicContact CB-CE2 3.97Å; V143-F147 PolarHBondContact O-N 3.46Å; V144-F147 WeakPolarHBondContact O-CB 3.35Å; V144-F147 PolarHBondContact O-N 3.45Å; V144-F147 VanDerWaalsContact O-N 3.14Å; Q145-F147 VanDerWaalsContact C-N 3.28Å; Q145-F147 PolarHBondContact O-N 3.28Å; F147-K157 HydrophobicContact CD2-CB 4.1Å; F147-K157 HydrophobicContact CD2-CD 4.39Å; F147-K157 HydrophobicContact CE2-CB 4.41Å; F147-K157 HydrophobicContact CE2-CD 4.49Å; F147-K157 WeakPolarHBondContact O-CE 3.25Å; F147-K157 PolarHBondContact O-NZ 2.84Å
148	Y	87.7	Confident	85.9	Confident	180 Å²	180	72.1 Å²	72.1	71%	0.706	38%	0.379	S	S	*	.	H	α-helix	trans	-87.1	-8.2	-179	-70.9	-70.8	0	0	0	114.5	V144 Q145 P150	V144-Y148 HydrophobicContact CG1-CD2 3.93Å; V144-Y148 HydrophobicContact CG1-CE2 3.86Å; V144-Y148 VanDerWaalsContact O-CD2 3.24Å; V144-Y148 WeakPolarHBondContact O-CD2 3.43Å; V144-Y148 PolarHBondContact O-N 3.46Å; Q145-Y148 PolarHBondContact O-N 3.38Å; Y148-P150 WeakPolarHBondContact O-CD 3.35Å
149	N	88.1	Confident	85.7	Confident	54 Å²	54	69.3 Å²	69.3	29%	0.289	37%	0.372	S	S	.	.			trans	-69.9	120.7	-179.9	-173.2	-20.2	0	0	0	111	Q145 L151 L152	Q145-N149 WeakPolarHBondContact O-CB 3.43Å; Q145-N149 PolarHBondContact O-N 2.85Å; Q145-N149 VanDerWaalsContact O-N 3.1Å; N149-L151 PolarHBondContact O-N 2.8Å; N149-L151 WeakPolarHBondContact OD1-CB 3.35Å; N149-L151 PolarHBondContact OD1-N 2.9Å; N149-L152 HydrophobicContact CB-CD1 3.86Å; N149-L152 PolarHBondContact O-N 2.92Å
150	P	85.2	Confident	85.7	Confident	122 Å²	122	72 Å²	72	79%	0.792	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.1	-177.7	29.9	-36.1	0	0	0	113.5	Y148 L152	Y148-P150 WeakPolarHBondContact O-CD 3.35Å; P150-L152 VanDerWaalsContact C-N 3.29Å
151	L	87.6	Confident	85.6	Confident	152 Å²	152	71.1 Å²	71.1	80%	0.796	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-14.1	179.3	-57	174.8	0	0	0	112.6	N149	N149-L151 PolarHBondContact O-N 2.8Å; N149-L151 WeakPolarHBondContact OD1-CB 3.35Å; N149-L151 PolarHBondContact OD1-N 2.9Å
152	L	81.4	Confident	85.6	Confident	42 Å²	42	74.2 Å²	74.2	22%	0.22	39%	0.393	C	S	.	.	S	Bend	trans	-92	119.6	-178.1	-88.7	150.5	0	0	0	110.9	N146 N149 P150 M156	N146-L152 HydrophobicContact CB-CD1 4.03Å; N146-L152 WeakPolarHBondContact O-CD1 3.35Å; N149-L152 HydrophobicContact CB-CD1 3.86Å; N149-L152 PolarHBondContact O-N 2.92Å; P150-L152 VanDerWaalsContact C-N 3.29Å; L152-M156 HydrophobicContact CD2-CB 4.21Å
153	P	80.4	Confident	85.7	Confident	81 Å²	81	73 Å²	73	53%	0.526	39%	0.387	S	S	.	.			trans	-57.4	145.8	175.1	-23	32.6	0	0	0	111.6	G155 M156	P153-G155 PolarHBondContact O-N 2.95Å; P153-M156 PolarHBondContact O-N 3.46Å
154	S	71.2	Confident	85.9	Confident	71 Å²	71	72.9 Å²	72.9	50%	0.497	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-54.2	-32.4	-177.6	-50.8	0	0	0	0	113.5	H35 M156 K157	H35-S154 WeakPolarHBondContact CB-O 3.48Å; S154-M156 PolarHBondContact O-N 3.26Å; S154-K157 PolarHBondContact O-N 3.4Å
155	G	69.7	Low	86.2	Confident	48 Å²	48	76.5 Å²	76.5	50%	0.495	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-72.6	-7.1	177.6	0	0	0	0	0	115.7	P153	P153-G155 PolarHBondContact O-N 2.95Å
156	M	73.5	Confident	86.4	Confident	115 Å²	115	73.8 Å²	73.8	57%	0.567	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-111.6	8.1	178.4	-69.4	-174.5	65.8	0	0	113.3	L152 P153 S154 F158	L152-M156 HydrophobicContact CD2-CB 4.21Å; P153-M156 PolarHBondContact O-N 3.46Å; S154-M156 PolarHBondContact O-N 3.26Å; M156-F158 WeakPolarHBondContact O-CD2 3.4Å; M156-F158 WeakPolarHBondContact O-CE2 3.19Å
157	K	83.3	Confident	86.9	Confident	48 Å²	48	71.5 Å²	71.5	21%	0.209	37%	0.371	C	S	.	.			trans	-79.6	138.3	178.8	-66	-175.7	177.7	-176	0	111	A34 F147 S154	A34-K157 HydrophobicContact CB-CB 4.17Å; A34-K157 WeakPolarHBondContact CB-O 3.17Å; A34-K157 PolarHBondContact N-O 2.93Å; F147-K157 HydrophobicContact CD2-CB 4.1Å; F147-K157 HydrophobicContact CD2-CD 4.39Å; F147-K157 HydrophobicContact CE2-CB 4.41Å; F147-K157 HydrophobicContact CE2-CD 4.49Å; F147-K157 WeakPolarHBondContact O-CE 3.25Å; F147-K157 PolarHBondContact O-NZ 2.84Å; S154-K157 PolarHBondContact O-N 3.4Å
158	F	85.3	Confident	87.4	Confident	29 Å²	29	70.6 Å²	70.6	13%	0.127	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.5	177.7	-67.4	-87.5	0	0	0	110.9	R31 R32 T33 K48 V143 M156	R31-F158 HydrophobicContact CB-CB 4.24Å; R31-F158 HydrophobicContact CB-CD1 3.94Å; R31-F158 HydrophobicContact CB-CG 4.28Å; R32-F158 CarbonylContact O-C 3.56Å; R32-F158 VanDerWaalsContact O-CA 3.25Å; R32-F158 WeakPolarHBondContact O-CA 3.44Å; T33-F158 HydrophobicContact CG2-CD1 3.92Å; T33-F158 HydrophobicContact CG2-CE1 3.46Å; T33-F158 VanDerWaalsContact CG2-CE1 3.46Å; T33-F158 HydrophobicContact CG2-CZ 4.03Å; K48-F158 HydrophobicContact CD-CE1 3.92Å; K48-F158 HydrophobicContact CD-CZ 3.88Å; K48-F158 HydrophobicContact CG-CE1 4.27Å; V143-F158 HydrophobicContact CG1-CB 4.45Å; V143-F158 WeakPolarHBondContact CG1-O 3.5Å; M156-F158 WeakPolarHBondContact O-CD2 3.4Å; M156-F158 WeakPolarHBondContact O-CE2 3.19Å
159	E	90.4	Very high	87.9	Confident	84 Å²	84	66.7 Å²	66.7	39%	0.393	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	161.5	167.9	-76.4	169.6	-173.5	0	0	110.8	R32 A34 G161	R32-E159 PolarHBondContact N-O 3.38Å; R32-E159 VanDerWaalsContact N-O 3.08Å; R32-E159 PolarHBondContact O-N 3.43Å; A34-E159 HydrophobicContact CB-CG 3.65Å; E159-G161 PolarHBondContact O-N 3.37Å
160	I	91.7	Very high	88.3	Confident	57 Å²	57	64.2 Å²	64.2	29%	0.292	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	122.6	176.5	-56.9	173.5	0	0	0	108.9	T140 V143 L164 Y165	T140-I160 HydrophobicContact CG2-CD1 3.95Å; T140-I160 HydrophobicContact CG2-CG1 4.42Å; V143-I160 HydrophobicContact CG1-CG1 4.26Å; I160-L164 HydrophobicContact CG2-CB 3.97Å; I160-L164 HydrophobicContact CG2-CD1 3.72Å; I160-L164 HydrophobicContact CG2-CG 4.46Å; I160-Y165 HydrophobicContact CB-CE2 4.47Å; I160-Y165 HydrophobicContact CG2-CD2 4.45Å; I160-Y165 HydrophobicContact CG2-CE2 3.81Å
161	G	91.3	Very high	88.9	Confident	4 Å²	4	58.4 Å²	58.4	4%	0.041	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-81.1	160	178.3	0	0	0	0	0	113.7	H29 W30 E159 A163 L164	H29-G161 CarbonylContact O-C 3.56Å; H29-G161 WeakPolarHBondContact O-CA 3.19Å; W30-G161 WeakPolarHBondContact O-CA 3.39Å; W30-G161 PolarHBondContact O-N 3.03Å; E159-G161 PolarHBondContact O-N 3.37Å; G161-A163 PolarHBondContact O-N 2.78Å; G161-L164 PolarHBondContact O-N 2.95Å; G161-L164 VanDerWaalsContact O-N 3.14Å
162	Q	92.8	Very high	89.4	Confident	145 Å²	145	53.4 Å²	53.4	68%	0.678	29%	0.285	S	S	*	.	H	α-helix	trans	-59.4	-31.2	-179.8	-67.9	177.2	-11.3	0	0	113.6	H29 L164 Y165 L166	H29-Q162 HydrophobicContact CB-CB 4.46Å; H29-Q162 PolarHBondContact O-N 3.49Å; H29-Q162 VanDerWaalsContact O-N 3.17Å; Q162-L164 VanDerWaalsContact C-N 3.26Å; Q162-L164 PolarHBondContact O-N 2.97Å; Q162-Y165 PolarHBondContact O-N 2.99Å; Q162-L166 PolarHBondContact O-N 2.68Å
163	A	94.1	Very high	90.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-33.6	178.6	0	0	0	0	0	112.1	T24 L27 H29 W30 G161 L166 G167	T24-A163 HydrophobicContact CG2-CB 4.42Å; T24-A163 VanDerWaalsContact CG2-O 3.24Å; T24-A163 WeakPolarHBondContact CG2-O 3.27Å; T24-A163 PolarHBondContact OG1-O 3.35Å; L27-A163 HydrophobicContact CB-CB 4.26Å; L27-A163 HydrophobicContact CD2-CB 3.95Å; L27-A163 HydrophobicContact CG-CB 4.44Å; H29-A163 HydrophobicContact CB-CB 4.49Å; H29-A163 WeakPolarHBondContact O-CB 3.43Å; H29-A163 PolarHBondContact O-N 3.2Å; W30-A163 HydrophobicContact CG-CB 4.13Å; G161-A163 PolarHBondContact O-N 2.78Å; A163-L166 PolarHBondContact O-N 3.08Å; A163-G167 PolarHBondContact O-N 2.72Å
164	L	94.6	Very high	90.9	Very high	1 Å²	1	50 Å²	50	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-41.3	-179.6	-68.4	173.4	0	0	0	111.6	W30 V136 T139 I160 G161 Q162 L166 G167 F168	W30-L164 HydrophobicContact CD2-CD2 4.16Å; W30-L164 HydrophobicContact CE3-CD2 3.41Å; W30-L164 VanDerWaalsContact CE3-CD2 3.41Å; W30-L164 HydrophobicContact CE3-CG 4.34Å; W30-L164 HydrophobicContact CZ3-CD2 3.65Å; W30-L164 VanDerWaalsContact O-CD1 3.23Å; W30-L164 WeakPolarHBondContact O-CD1 3.25Å; V136-L164 HydrophobicContact CB-CD2 4.44Å; V136-L164 HydrophobicContact CG1-CB 4.21Å; V136-L164 HydrophobicContact CG1-CD2 3.84Å; V136-L164 WeakPolarHBondContact CG1-O 3.09Å; T139-L164 VanDerWaalsContact OG1-CD2 3.23Å; T139-L164 WeakPolarHBondContact OG1-CD2 3.4Å; I160-L164 HydrophobicContact CG2-CB 3.97Å; I160-L164 HydrophobicContact CG2-CD1 3.72Å; I160-L164 HydrophobicContact CG2-CG 4.46Å; G161-L164 PolarHBondContact O-N 2.95Å; G161-L164 VanDerWaalsContact O-N 3.14Å; Q162-L164 VanDerWaalsContact C-N 3.26Å; Q162-L164 PolarHBondContact O-N 2.97Å; L164-L166 PolarHBondContact O-N 3.14Å; L164-G167 WeakPolarHBondContact O-CA 3.34Å; L164-G167 PolarHBondContact O-N 2.98Å; L164-G167 VanDerWaalsContact O-N 3.16Å; L164-F168 VanDerWaalsContact O-CD2 3.25Å; L164-F168 WeakPolarHBondContact O-CD2 3.36Å; L164-F168 PolarHBondContact O-N 3.49Å
165	Y	95.9	Very high	92.2	Very high	132 Å²	132	48.4 Å²	48.4	52%	0.518	25%	0.248	S	C	.	.	H	α-helix	trans	-61.9	-43.8	174.3	-63.5	-72.6	0	0	0	111.8	I160 Q162 G167 F168 I169	I160-Y165 HydrophobicContact CB-CE2 4.47Å; I160-Y165 HydrophobicContact CG2-CD2 4.45Å; I160-Y165 HydrophobicContact CG2-CE2 3.81Å; Q162-Y165 PolarHBondContact O-N 2.99Å; Y165-G167 VanDerWaalsContact C-N 3.27Å; Y165-G167 PolarHBondContact O-N 3.36Å; Y165-F168 PolarHBondContact O-N 2.73Å; Y165-I169 WeakPolarHBondContact O-CG1 3.35Å; Y165-I169 PolarHBondContact O-N 3.35Å
166	L	96.6	Very high	93.5	Very high	58 Å²	58	50.2 Å²	50.2	30%	0.304	25%	0.245	S	C	.	.	H	α-helix	trans	-62.2	-38.4	174.9	-172.7	65.4	0	0	0	111.3	I23 T24 Q162 A163 L164 I169 S170	I23-L166 HydrophobicContact CB-CD2 4.04Å; I23-L166 HydrophobicContact CG2-CD2 3.55Å; T24-L166 WeakPolarHBondContact OG1-CG 3.32Å; Q162-L166 PolarHBondContact O-N 2.68Å; A163-L166 PolarHBondContact O-N 3.08Å; L164-L166 PolarHBondContact O-N 3.14Å; L166-I169 PolarHBondContact O-N 3.05Å; L166-S170 VanDerWaalsContact O-CB 3.23Å; L166-S170 WeakPolarHBondContact O-CB 3.48Å; L166-S170 PolarHBondContact O-N 3.04Å; L166-S170 PolarHBondContact O-OG 2.79Å; L166-S170 VanDerWaalsContact O-OG 3.13Å
167	G	96.6	Very high	94.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-53.7	-54.3	171.4	0	0	0	0	0	112.7	T24 A163 L164 Y165 I169 S170 S171	T24-G167 PolarHBondContact OG1-N 2.95Å; A163-G167 PolarHBondContact O-N 2.72Å; L164-G167 WeakPolarHBondContact O-CA 3.34Å; L164-G167 PolarHBondContact O-N 2.98Å; L164-G167 VanDerWaalsContact O-N 3.16Å; Y165-G167 VanDerWaalsContact C-N 3.27Å; Y165-G167 PolarHBondContact O-N 3.36Å; G167-I169 VanDerWaalsContact C-N 3.34Å; G167-I169 PolarHBondContact O-N 3.14Å; G167-S170 WeakPolarHBondContact CA-OG 3.08Å; G167-S170 PolarHBondContact O-N 3.35Å; G167-S170 PolarHBondContact O-OG 2.98Å; G167-S171 PolarHBondContact O-N 3.29Å; G167-S171 PolarHBondContact O-OG 3.16Å
168	F	97.8	Very high	95.2	Very high	59 Å²	59	42.5 Å²	42.5	26%	0.259	21%	0.208	S	C	.	.	H	α-helix	trans	-59	-41.8	177.1	-79.9	-66.8	0	0	0	113.5	M133 V136 L164 Y165 S171 S172	M133-F168 HydrophobicContact CE-CD1 3.86Å; M133-F168 HydrophobicContact CE-CE1 4.17Å; M133-F168 HydrophobicContact SD-CD1 3.5Å; M133-F168 WeakPolarHBondContact SD-CD1 3.35Å; M133-F168 HydrophobicContact SD-CE1 3.84Å; V136-F168 HydrophobicContact CG1-CD1 4.28Å; V136-F168 HydrophobicContact CG1-CD2 3.54Å; V136-F168 HydrophobicContact CG1-CE1 4.18Å; V136-F168 HydrophobicContact CG1-CE2 3.44Å; V136-F168 VanDerWaalsContact CG1-CE2 3.44Å; V136-F168 HydrophobicContact CG1-CG 3.97Å; V136-F168 HydrophobicContact CG1-CZ 3.77Å; L164-F168 VanDerWaalsContact O-CD2 3.25Å; L164-F168 WeakPolarHBondContact O-CD2 3.36Å; L164-F168 PolarHBondContact O-N 3.49Å; Y165-F168 PolarHBondContact O-N 2.73Å; F168-S171 PolarHBondContact O-OG 2.85Å; F168-S172 WeakPolarHBondContact O-CB 3.33Å; F168-S172 PolarHBondContact O-N 3.33Å; F168-S172 VanDerWaalsContact O-N 3.13Å; F168-S172 PolarHBondContact O-OG 3.28Å
169	I	97.9	Very high	95.6	Very high	98 Å²	98	44 Å²	44	50%	0.503	22%	0.22	S	C	.	.	H	α-helix	trans	-65.2	-46.7	177.5	-66.8	165.7	0	0	0	109.7	Y165 L166 G167 S172 L173	Y165-I169 WeakPolarHBondContact O-CG1 3.35Å; Y165-I169 PolarHBondContact O-N 3.35Å; L166-I169 PolarHBondContact O-N 3.05Å; G167-I169 VanDerWaalsContact C-N 3.34Å; G167-I169 PolarHBondContact O-N 3.14Å; I169-S172 PolarHBondContact O-N 3.24Å; I169-L173 HydrophobicContact CG2-CD1 3.66Å; I169-L173 WeakPolarHBondContact O-CB 3.45Å; I169-L173 WeakPolarHBondContact O-CD1 3.32Å; I169-L173 WeakPolarHBondContact O-CG 3.35Å; I169-L173 PolarHBondContact O-N 3.42Å
170	S	97.2	Very high	95.8	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.014	21%	0.212	C	C	.	.	H	α-helix	trans	-64.6	-42.7	-178.4	70.7	0	0	0	0	113.1	G17 T21 L166 G167 L173 S174	G17-S170 WeakPolarHBondContact CA-O 3.36Å; T21-S170 PolarHBondContact OG1-OG 2.94Å; L166-S170 VanDerWaalsContact O-CB 3.23Å; L166-S170 WeakPolarHBondContact O-CB 3.48Å; L166-S170 PolarHBondContact O-N 3.04Å; L166-S170 PolarHBondContact O-OG 2.79Å; L166-S170 VanDerWaalsContact O-OG 3.13Å; G167-S170 WeakPolarHBondContact CA-OG 3.08Å; G167-S170 PolarHBondContact O-N 3.35Å; G167-S170 PolarHBondContact O-OG 2.98Å; S170-L173 PolarHBondContact O-N 3.17Å; S170-S174 PolarHBondContact O-N 2.85Å; S170-S174 PolarHBondContact O-OG 2.05Å
171	S	97.4	Very high	95.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-42.8	176.7	59.9	0	0	0	0	111.1	G129 M133 G167 F168 L173 S174 L175	G129-S171 WeakPolarHBondContact O-CB 3.24Å; M133-S171 PolarHBondContact SD-OG 2.96Å; G167-S171 PolarHBondContact O-N 3.29Å; G167-S171 PolarHBondContact O-OG 3.16Å; F168-S171 PolarHBondContact O-OG 2.85Å; S171-L173 PolarHBondContact O-N 3.37Å; S171-S174 PolarHBondContact O-N 3.17Å; S171-L175 VanDerWaalsContact O-CG 3.25Å; S171-L175 WeakPolarHBondContact O-CG 3.35Å; S171-L175 PolarHBondContact O-N 2.92Å
172	S	97.8	Very high	95.7	Very high	48 Å²	48	40.7 Å²	40.7	34%	0.336	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-44.4	176.9	-57.7	0	0	0	0	111.8	F168 I169 S174 L175 I176	F168-S172 WeakPolarHBondContact O-CB 3.33Å; F168-S172 PolarHBondContact O-N 3.33Å; F168-S172 VanDerWaalsContact O-N 3.13Å; F168-S172 PolarHBondContact O-OG 3.28Å; I169-S172 PolarHBondContact O-N 3.24Å; S172-S174 PolarHBondContact O-N 2.82Å; S172-L175 PolarHBondContact O-N 3.48Å; S172-I176 WeakPolarHBondContact O-CB 3.39Å; S172-I176 VanDerWaalsContact O-CG1 3.24Å; S172-I176 WeakPolarHBondContact O-CG1 3.12Å; S172-I176 PolarHBondContact O-N 3.41Å
173	L	97.7	Very high	95.5	Very high	50 Å²	50	38.5 Å²	38.5	26%	0.262	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-43.7	174.5	-77.8	156.1	0	0	0	111.9	L13 I169 S170 S171 G177	L13-L173 HydrophobicContact CG-CD2 4.06Å; I169-L173 HydrophobicContact CG2-CD1 3.66Å; I169-L173 WeakPolarHBondContact O-CB 3.45Å; I169-L173 WeakPolarHBondContact O-CD1 3.32Å; I169-L173 WeakPolarHBondContact O-CG 3.35Å; I169-L173 PolarHBondContact O-N 3.42Å; S170-L173 PolarHBondContact O-N 3.17Å; S171-L173 PolarHBondContact O-N 3.37Å; L173-G177 PolarHBondContact O-N 2.79Å
174	S	97.3	Very high	95.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66	-38.5	176.7	-70.1	0	0	0	0	112.9	G17 S170 S171 S172 G178	G17-S174 WeakPolarHBondContact CA-OG 3.32Å; S170-S174 PolarHBondContact O-N 2.85Å; S170-S174 PolarHBondContact O-OG 2.05Å; S171-S174 PolarHBondContact O-N 3.17Å; S172-S174 PolarHBondContact O-N 2.82Å; S174-G178 PolarHBondContact O-N 2.99Å
175	L	97.9	Very high	94	Very high	38 Å²	38	39.2 Å²	39.2	20%	0.199	20%	0.203	C	C	.	.	H	α-helix	trans	-66.4	-48.5	176.3	-70	170.8	0	0	0	111.6	I126 L130 S171 S172 T179	I126-L175 HydrophobicContact CG2-CD2 3.95Å; I126-L175 WeakPolarHBondContact O-CD2 3.24Å; L130-L175 HydrophobicContact CD2-CD1 4.42Å; L130-L175 HydrophobicContact CD2-CD2 3.85Å; L130-L175 HydrophobicContact CG-CD2 3.81Å; S171-L175 VanDerWaalsContact O-CG 3.25Å; S171-L175 WeakPolarHBondContact O-CG 3.35Å; S171-L175 PolarHBondContact O-N 2.92Å; S172-L175 PolarHBondContact O-N 3.48Å; L175-T179 WeakPolarHBondContact O-CB 3.25Å; L175-T179 VanDerWaalsContact O-CG2 3.3Å; L175-T179 WeakPolarHBondContact O-CG2 3.45Å; L175-T179 PolarHBondContact O-N 3.13Å; L175-T179 PolarHBondContact O-OG1 3.2Å
176	I	97.4	Very high	92.6	Very high	87 Å²	87	39.3 Å²	39.3	45%	0.446	21%	0.209	S	C	.	.	H	α-helix	trans	-64.9	-45.3	178.1	-63.8	166.1	0	0	0	110.2	L13 S172 T179 L180	L13-I176 HydrophobicContact CD2-CB 4.26Å; L13-I176 HydrophobicContact CD2-CG2 3.66Å; S172-I176 WeakPolarHBondContact O-CB 3.39Å; S172-I176 VanDerWaalsContact O-CG1 3.24Å; S172-I176 WeakPolarHBondContact O-CG1 3.12Å; S172-I176 PolarHBondContact O-N 3.41Å; I176-T179 WeakPolarHBondContact CA-OG1 3.42Å; I176-T179 PolarHBondContact O-N 3.46Å; I176-T179 PolarHBondContact O-OG1 3.24Å; I176-L180 HydrophobicContact CG2-CD1 4.04Å; I176-L180 HydrophobicContact CG2-CG 4.45Å; I176-L180 WeakPolarHBondContact O-CB 3.49Å; I176-L180 VanDerWaalsContact O-CG 3.24Å; I176-L180 WeakPolarHBondContact O-CG 3.44Å; I176-L180 PolarHBondContact O-N 3.43Å
177	G	95.9	Very high	90.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-45.3	177.5	0	0	0	0	0	112.8	G10 S14 L173 L180 L181	G10-G177 CarbonylContact O-C 3.18Å; G10-G177 VanDerWaalsContact O-CA 3.27Å; G10-G177 WeakPolarHBondContact O-CA 3.19Å; S14-G177 VanDerWaalsContact OG-CA 3.23Å; S14-G177 WeakPolarHBondContact OG-CA 3.49Å; S14-G177 PolarHBondContact OG-O 3.42Å; L173-G177 PolarHBondContact O-N 2.79Å; G177-L180 PolarHBondContact O-N 2.98Å; G177-L181 WeakPolarHBondContact O-CG 3.24Å; G177-L181 PolarHBondContact O-N 3.23Å
178	G	95.1	Very high	88.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65.2	-40.4	179	0	0	0	0	0	112.8	S14 S174 L181 C182	S14-G178 PolarHBondContact OG-N 3.44Å; S174-G178 PolarHBondContact O-N 2.99Å; G178-L181 PolarHBondContact O-N 2.7Å; G178-C182 PolarHBondContact O-N 3.48Å; G178-C182 PolarHBondContact O-SG 2.99Å
179	T	94.8	Very high	86.8	Confident	61 Å²	61	48.8 Å²	48.8	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-65.3	-45.5	174.6	49	0	0	0	0	112.1	I126 L175 I176 L181 C182 L183	I126-T179 HydrophobicContact CD1-CG2 3.73Å; I126-T179 HydrophobicContact CG1-CG2 4.17Å; L175-T179 WeakPolarHBondContact O-CB 3.25Å; L175-T179 VanDerWaalsContact O-CG2 3.3Å; L175-T179 WeakPolarHBondContact O-CG2 3.45Å; L175-T179 PolarHBondContact O-N 3.13Å; L175-T179 PolarHBondContact O-OG1 3.2Å; I176-T179 WeakPolarHBondContact CA-OG1 3.42Å; I176-T179 PolarHBondContact O-N 3.46Å; I176-T179 PolarHBondContact O-OG1 3.24Å; T179-L181 VanDerWaalsContact C-N 3.28Å; T179-L181 PolarHBondContact O-N 2.87Å; T179-C182 PolarHBondContact O-N 3.46Å; T179-C182 VanDerWaalsContact O-N 3.14Å; T179-L183 WeakPolarHBondContact O-CG 3.32Å; T179-L183 PolarHBondContact O-N 2.79Å
180	L	93.6	Very high	84.4	Confident	44 Å²	44	49.4 Å²	49.4	23%	0.23	28%	0.278	C	S	.	.	H	α-helix	trans	-59.3	-39	175.1	-70.7	174.6	0	0	0	112.3	V6 L13 I176 G177 S184	V6-L180 HydrophobicContact CG1-CB 4.47Å; V6-L180 HydrophobicContact CG1-CD2 4.12Å; L13-L180 HydrophobicContact CD2-CD1 4.41Å; I176-L180 HydrophobicContact CG2-CD1 4.04Å; I176-L180 HydrophobicContact CG2-CG 4.45Å; I176-L180 WeakPolarHBondContact O-CB 3.49Å; I176-L180 VanDerWaalsContact O-CG 3.24Å; I176-L180 WeakPolarHBondContact O-CG 3.44Å; I176-L180 PolarHBondContact O-N 3.43Å; G177-L180 PolarHBondContact O-N 2.98Å; L180-S184 WeakPolarHBondContact O-CB 3.46Å; L180-S184 PolarHBondContact O-N 2.9Å; L180-S184 PolarHBondContact O-OG 3.05Å
181	L	91.3	Very high	82.1	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.031	31%	0.314	C	S	.	.	H	α-helix	trans	-64	-41.1	174.9	-76.8	170.8	0	0	0	112.4	Q7 F11 F125 G177 G178 T179 C185	Q7-L181 HydrophobicContact CG-CD2 4.09Å; Q7-L181 WeakPolarHBondContact O-CD2 3.43Å; F11-L181 HydrophobicContact CB-CD2 4.23Å; F125-L181 HydrophobicContact CD2-CD1 4.09Å; F125-L181 HydrophobicContact CE2-CD1 4.43Å; G177-L181 WeakPolarHBondContact O-CG 3.24Å; G177-L181 PolarHBondContact O-N 3.23Å; G178-L181 PolarHBondContact O-N 2.7Å; T179-L181 VanDerWaalsContact C-N 3.28Å; T179-L181 PolarHBondContact O-N 2.87Å; L181-C185 PolarHBondContact O-SG 3.01Å
182	C	90.3	Very high	79.6	Confident	25 Å²	25	69.2 Å²	69.2	17%	0.169	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-46.6	176.9	-65.7	0	0	0	0	111.8	G122 G178 T179 C185 Q186	G122-C182 VanDerWaalsContact C-SG 3.51Å; G178-C182 PolarHBondContact O-N 3.48Å; G178-C182 PolarHBondContact O-SG 2.99Å; T179-C182 PolarHBondContact O-N 3.46Å; T179-C182 VanDerWaalsContact O-N 3.14Å; C182-C185 PolarHBondContact O-N 3.08Å; C182-Q186 PolarHBondContact O-N 3.37Å
183	L	88.7	Confident	77	Confident	99 Å²	99	71.6 Å²	71.6	52%	0.518	37%	0.368	S	S	.	.	H	α-helix	trans	-66.9	-39.8	-177.5	-66.8	173.6	0	0	0	112.2	T179 C185 Q186	T179-L183 WeakPolarHBondContact O-CG 3.32Å; T179-L183 PolarHBondContact O-N 2.79Å; L183-C185 PolarHBondContact O-N 2.99Å; L183-Q186 PolarHBondContact O-N 3.47Å; L183-Q186 VanDerWaalsContact O-N 3.13Å
184	S	85.2	Confident	74.7	Confident	6 Å²	6	77.8 Å²	77.8	4%	0.042	39%	0.389	C	S	.	.	H	α-helix	trans	-60.7	-20.5	179	-60	0	0	0	0	113.8	V6 L180	V6-S184 VanDerWaalsContact CG1-OG 3.26Å; V6-S184 WeakPolarHBondContact CG1-OG 3.43Å; L180-S184 WeakPolarHBondContact O-CB 3.46Å; L180-S184 PolarHBondContact O-N 2.9Å; L180-S184 PolarHBondContact O-OG 3.05Å
185	C	72.3	Confident	72.6	Confident	10 Å²	10	86.3 Å²	86.3	7%	0.068	43%	0.429	C	S	.	.	H	α-helix	trans	-95.3	-22.3	-179.4	-61	0	0	0	0	113.1	T115 A118 I119 L181 C182 L183 E188	T115-C185 HydrophobicContact CG2-CB 4.3Å; A118-C185 WeakPolarHBondContact CB-SG 3.33Å; I119-C185 HydrophobicContact CD1-CB 4.38Å; I119-C185 HydrophobicContact CG1-CB 3.82Å; L181-C185 PolarHBondContact O-SG 3.01Å; C182-C185 PolarHBondContact O-N 3.08Å; L183-C185 PolarHBondContact O-N 2.99Å; C185-E188 PolarHBondContact O-N 2.97Å
186	Q	66.4	Low	70.8	Confident	135 Å²	135	87.7 Å²	87.7	63%	0.631	45%	0.446	S	S	*	.	H	α-helix	trans	-72.3	-31.4	176.4	-73.9	-174.9	-31.3	0	0	112.2	C182 L183 E188 A189	C182-Q186 PolarHBondContact O-N 3.37Å; L183-Q186 PolarHBondContact O-N 3.47Å; L183-Q186 VanDerWaalsContact O-N 3.13Å; Q186-E188 PolarHBondContact O-N 3.3Å; Q186-A189 PolarHBondContact O-N 3.34Å
187	D	59.2	Low	69.2	Low	142 Å²	142	87.8 Å²	87.8	76%	0.759	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.7	171.3	-84.9	-30.5	0	0	0	113.2
188	E	56.2	Low	67	Low	112 Å²	112	94 Å²	94	52%	0.523	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	6.6	-173.3	-65.3	-98.2	150.1	0	0	114.7	K103 C185 Q186	K103-E188 WeakPolarHBondContact CE-OE2 3.49Å; K103-E188 IonicContact NZ-OE1 2.76Å; K103-E188 PolarHBondContact NZ-OE1 3.35Å; K103-E188 IonicContact NZ-OE2 2.96Å; K103-E188 PolarHBondContact NZ-OE2 3.1Å; C185-E188 PolarHBondContact O-N 2.97Å; Q186-E188 PolarHBondContact O-N 3.3Å
189	A	53	Low	65.1	Low	61 Å²	61	104.8 Å²	104.8	50%	0.504	53%	0.533	S	S	.	.			trans	-147.7	142.9	176.8	0	0	0	0	0	116	Q186	Q186-A189 PolarHBondContact O-N 3.34Å
190	P	48.8	Very low	63	Low	112 Å²	112	106 Å²	106	73%	0.727	55%	0.549	S	S	*	.			cis	-107.7	154.3	-18.8	32.8	-18.3	0	0	0	112.2	R192	P190-R192 PolarHBondContact O-N 3.26Å
191	Y	48	Very low	60.8	Low	198 Å²	198	110 Å²	110	78%	0.776	58%	0.576	S	S	*	*			trans	-44.2	107.4	149.9	177.7	-98.2	0	0	0	107.5	P193	Y191-P193 VanDerWaalsContact O-CD 3.25Å; Y191-P193 WeakPolarHBondContact O-CD 3.33Å; Y191-P193 VanDerWaalsContact O-N 3.11Å
192	R	43.9	Very low	58.7	Low	219 Å²	219	115.9 Å²	115.9	83%	0.826	61%	0.612	S	S	*	*			trans	-55.6	118	161.6	-77.4	-173.8	175.1	-178.5	-1.1	104.3	P190 Y194	P190-R192 PolarHBondContact O-N 3.26Å; R192-Y194 PolarHBondContact O-N 3.39Å
193	P	45.2	Very low	56.7	Low	99 Å²	99	119.2 Å²	119.2	64%	0.643	64%	0.641	S	S	*	*			trans	-54.1	121.5	162.2	23.8	-28.7	0	0	0	104.4	Y191 Q195	Y191-P193 VanDerWaalsContact O-CD 3.25Å; Y191-P193 WeakPolarHBondContact O-CD 3.33Å; Y191-P193 VanDerWaalsContact O-N 3.11Å; P193-Q195 PolarHBondContact O-N 3.39Å
194	Y	49.1	Very low	54.4	Low	180 Å²	180	119.9 Å²	119.9	71%	0.706	65%	0.65	S	S	*	*			trans	-52.3	101.8	168.6	179.2	-94.7	0	0	0	105.5	R192 A196	R192-Y194 PolarHBondContact O-N 3.39Å; Y194-A196 HydrophobicContact CD1-CB 4.35Å; Y194-A196 HydrophobicContact CE1-CB 4.24Å; Y194-A196 PolarHBondContact O-N 3.01Å
195	Q	52.8	Low	52.9	Low	179 Å²	179	124.9 Å²	124.9	84%	0.836	69%	0.692	S	S	*	*			trans	-64.9	100.2	165.6	-114.8	168.5	-34.8	0	0	103.1	P193	P193-Q195 PolarHBondContact O-N 3.39Å
196	A	60.5	Low	51.7	Low	67 Å²	67	129.9 Å²	129.9	55%	0.554	72%	0.722	S	S	*	*			trans	-48.6	133.2	166.9	0	0	0	0	0	106.7	Y194	Y194-A196 HydrophobicContact CD1-CB 4.35Å; Y194-A196 HydrophobicContact CE1-CB 4.24Å; Y194-A196 PolarHBondContact O-N 3.01Å
197	P	62.2	Low	50.9	Low	89 Å²	89	129.6 Å²	129.6	58%	0.578	73%	0.73	S	S	*	*			trans	-50.7	139.1	178.5	20.5	-30.7	0	0	0	108.1	R199	P197-R199 PolarHBondContact O-N 3.14Å
198	P	50.9	Low	50.4	Low	130 Å²	130	127.4 Å²	127.4	84%	0.844	73%	0.731	S	S	*	*			trans	-53.5	111.4	-177.7	19.6	-29.9	0	0	0	108	A200	P198-A200 VanDerWaalsContact C-N 3.29Å; P198-A200 PolarHBondContact O-N 3.47Å
199	R	55.3	Low	50.4	Low	226 Å²	226	128 Å²	128	85%	0.853	75%	0.745	S	S	*	*			trans	-63	102.7	167.8	-166.9	176.7	-169.3	163.7	2.5	103.9	P197 T201	P197-R199 PolarHBondContact O-N 3.14Å; R199-T201 VanDerWaalsContact C-N 3.25Å; R199-T201 PolarHBondContact O-N 3.05Å
200	A	49.9	Very low	50.4	Low	87 Å²	87	129.4 Å²	129.4	72%	0.719	76%	0.756	S	S	*	*			trans	-53.5	99.7	173	0	0	0	0	0	106.7	P198 T202	P198-A200 VanDerWaalsContact C-N 3.29Å; P198-A200 PolarHBondContact O-N 3.47Å; A200-T202 VanDerWaalsContact C-N 3.27Å; A200-T202 PolarHBondContact O-N 2.9Å; A200-T202 VanDerWaalsContact O-N 3.12Å
201	T	47.9	Very low	50.7	Low	129 Å²	129	133.5 Å²	133.5	79%	0.791	76%	0.759	S	S	*	*			trans	-78.3	91.5	169.3	22.6	0	0	0	0	103.8	R199 A203	R199-T201 VanDerWaalsContact C-N 3.25Å; R199-T201 PolarHBondContact O-N 3.05Å; T201-A203 PolarHBondContact O-N 3.31Å
202	T	46	Very low	50.9	Low	128 Å²	128	132.3 Å²	132.3	79%	0.785	76%	0.76	S	S	*	*			trans	-61.3	89.8	162.1	26.8	0	0	0	0	107.5	A200 T204	A200-T202 VanDerWaalsContact C-N 3.27Å; A200-T202 PolarHBondContact O-N 2.9Å; A200-T202 VanDerWaalsContact O-N 3.12Å; T202-T204 VanDerWaalsContact C-N 3.32Å; T202-T204 PolarHBondContact O-N 2.87Å; T202-T204 VanDerWaalsContact O-N 3.16Å
203	A	49.3	Very low	51.4	Low	95 Å²	95	126.3 Å²	126.3	79%	0.785	75%	0.75	S	S	*	*			trans	-77	88.5	162.7	0	0	0	0	0	108.3	T201	T201-A203 PolarHBondContact O-N 3.31Å
204	T	41.1	Very low	51.7	Low	114 Å²	114	127.3 Å²	127.3	70%	0.699	76%	0.756	S	S	*	*			trans	-137	103	149.5	33.7	0	0	0	0	107.2	T202 T206	T202-T204 VanDerWaalsContact C-N 3.32Å; T202-T204 PolarHBondContact O-N 2.87Å; T202-T204 VanDerWaalsContact O-N 3.16Å; T204-T206 PolarHBondContact O-N 3.17Å; T204-T206 PolarHBondContact O-OG1 2.97Å
205	A	52.4	Low	51.9	Low	111 Å²	111	123.5 Å²	123.5	92%	0.917	76%	0.762	S	S	*	*			trans	-50.2	107.9	164.6	0	0	0	0	0	108.7
206	T	46.8	Very low	51.8	Low	115 Å²	115	119.7 Å²	119.7	71%	0.706	76%	0.761	S	S	*	*			trans	-138.3	117.5	165.4	-23.7	0	0	0	0	106.5	T204	T204-T206 PolarHBondContact O-N 3.17Å; T204-T206 PolarHBondContact O-OG1 2.97Å
207	T	50.9	Low	50.9	Low	129 Å²	129	125.3 Å²	125.3	79%	0.791	77%	0.769	S	S	*	*			trans	-22.8	130.1	173.3	45.8	0	0	0	0	115.2
208	A	49	Very low	50.2	Low	95 Å²	95	130 Å²	130	79%	0.785	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-57.3	132.8	170.3	0	0	0	0	0	110.8
209	P	56	Low	49.8	Very low	126 Å²	126	128 Å²	128	82%	0.818	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-71.4	140.1	171.6	28	-30.3	0	0	0	110.1
210	A	52.6	Low	49.6	Very low	89 Å²	89	124.4 Å²	124.4	74%	0.736	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-63.9	139	177.8	0	0	0	0	0	111.3	Q212	A210-Q212 PolarHBondContact O-N 2.96Å
211	Y	55	Low	49.3	Very low	199 Å²	199	130.7 Å²	130.7	78%	0.78	77%	0.765	S	S	*	*			trans	-66	112.8	173.7	176.4	-97.9	0	0	0	110.2	P213	Y211-P213 HydrophobicContact CE1-CB 4.34Å
212	Q	52.7	Low	49.3	Very low	173 Å²	173	128.9 Å²	128.9	81%	0.808	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-99.1	122.3	168.2	-95.2	170.5	-85.4	0	0	109.5	A210	A210-Q212 PolarHBondContact O-N 2.96Å
213	P	54.5	Low	49.1	Very low	93 Å²	93	128.7 Å²	128.7	60%	0.604	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-70.5	145.9	171.4	29	-31.8	0	0	0	110.1	Y211 A215	Y211-P213 HydrophobicContact CE1-CB 4.34Å; P213-A215 PolarHBondContact O-N 3.23Å
214	P	51.3	Low	48.5	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-66.7	131.8	179.7	25.1	-31	0	0	0	110.9	A216	P214-A216 PolarHBondContact O-N 3.15Å
215	A	51.8	Low	48.8	Very low	101 Å²	101	130.6 Å²	130.6	84%	0.835	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-63.2	128.7	171.1	0	0	0	0	0	109.6	P213 Y217	P213-A215 PolarHBondContact O-N 3.23Å; A215-Y217 PolarHBondContact O-N 2.99Å
216	A	51.1	Low	48.2	Very low	98 Å²	98	131.2 Å²	131.2	81%	0.81	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-57.4	117.6	175.7	0	0	0	0	0	110.4	P214 K218	P214-A216 PolarHBondContact O-N 3.15Å; A216-K218 PolarHBondContact O-N 2.95Å; A216-K218 VanDerWaalsContact O-N 3.12Å
217	Y	41.8	Very low	47.8	Very low	186 Å²	186	131.1 Å²	131.1	73%	0.729	77%	0.767	S	S	*	*			trans	-72.4	103.2	171.2	-178.5	-106.3	0	0	0	108.7	A215 D219	A215-Y217 PolarHBondContact O-N 2.99Å; Y217-D219 HydrophobicContact CD1-CB 3.95Å; Y217-D219 HydrophobicContact CE1-CB 3.4Å; Y217-D219 WeakPolarHBondContact CE1-OD2 3.47Å; Y217-D219 VanDerWaalsContact CZ-CG 3.44Å; Y217-D219 VanDerWaalsContact CZ-OD2 3.28Å; Y217-D219 PolarHBondContact O-N 2.97Å; Y217-D219 PolarHBondContact OH-OD1 3.39Å; Y217-D219 PolarHBondContact OH-OD2 3.49Å
218	K	46.8	Very low	47.1	Very low	188 Å²	188	129.2 Å²	129.2	82%	0.817	76%	0.764	S	S	*	*			trans	-89.7	89.8	178.7	-156.1	179.8	-169.3	-177	0	107.8	A216	A216-K218 PolarHBondContact O-N 2.95Å; A216-K218 VanDerWaalsContact O-N 3.12Å
219	D	42.8	Very low	46.8	Very low	86 Å²	86	131.3 Å²	131.3	46%	0.46	77%	0.767	S	S	.	*			trans	-90.8	125	175	-133.3	-6.9	0	0	0	111.2	Y217 R221	Y217-D219 HydrophobicContact CD1-CB 3.95Å; Y217-D219 HydrophobicContact CE1-CB 3.4Å; Y217-D219 WeakPolarHBondContact CE1-OD2 3.47Å; Y217-D219 VanDerWaalsContact CZ-CG 3.44Å; Y217-D219 VanDerWaalsContact CZ-OD2 3.28Å; Y217-D219 PolarHBondContact O-N 2.97Å; Y217-D219 PolarHBondContact OH-OD1 3.39Å; Y217-D219 PolarHBondContact OH-OD2 3.49Å; D219-R221 PolarHBondContact O-N 3.11Å
220	N	52.3	Low	46	Very low	151 Å²	151	134 Å²	134	81%	0.807	77%	0.769	S	S	*	*			trans	-80.3	100.7	178.5	-74.3	-31.3	0	0	0	109.4
221	R	43.5	Very low	45.4	Very low	219 Å²	219	134.6 Å²	134.6	83%	0.826	77%	0.767	S	S	*	*			trans	-119.8	128.6	162.6	-73.3	-169.9	-174.8	131.1	6.2	111.4	D219	D219-R221 PolarHBondContact O-N 3.11Å
222	A	47.6	Very low	45	Very low	92 Å²	92	127.9 Å²	127.9	76%	0.76	76%	0.759	S	S	*	*			trans	-62.9	155	173.2	0	0	0	0	0	111.5
223	P	41.5	Very low	44.5	Very low	124 Å²	124	130.9 Å²	130.9	81%	0.805	77%	0.765	S	S	*	*			trans	-81	125.8	-164.2	31.5	-31.9	0	0	0	111.7
224	S	37.7	Very low	43.9	Very low	112 Å²	112	138 Å²	138	78%	0.783	78%	0.78	S	S	*	*			trans	-94.9	112.9	162.5	54.5	0	0	0	0	109.2	T226	S224-T226 PolarHBondContact O-N 3.21Å
225	V	46.6	Very low	43.9	Very low	137 Å²	137	139.9 Å²	139.9	83%	0.83	78%	0.782	S	S	*	*			trans	-67.2	111	173.5	-179.9	0	0	0	0	108.7
226	T	39	Very low	43.7	Very low	123 Å²	123	142.1 Å²	142.1	76%	0.755	78%	0.78	S	S	*	*			trans	-170.7	116.5	150.5	10.8	0	0	0	0	111.8	S224	S224-T226 PolarHBondContact O-N 3.21Å
227	S	38.1	Very low	43.4	Very low	114 Å²	114	144.5 Å²	144.5	80%	0.797	78%	0.779	S	S	*	*			trans	72	106.5	143.6	-60.4	0	0	0	0	121.9
228	A	38.2	Very low	43.6	Very low	88 Å²	88	146.6 Å²	146.6	73%	0.727	79%	0.787	S	S	*	*				69.1	96.2	125.5	0	0	0	0	0	119.4
229	T	41.8	Very low	43.7	Very low	139 Å²	139	148.1 Å²	148.1	85%	0.853	81%	0.812	S	S	*	*				9.3	115.5	127.8	39.6	0	0	0	0	117.1
230	H	39	Very low	43.8	Very low	183 Å²	183	151.2 Å²	151.2	85%	0.847	83%	0.83	S	S	*	*			trans	-146.4	132.6	131.6	-157.6	-89.4	0	0	0	112
231	S	40.7	Very low	43.3	Very low	101 Å²	101	151.2 Å²	151.2	71%	0.706	83%	0.831	S	S	*	*			trans	-69.9	149.7	178.9	-179.7	0	0	0	0	112.3
232	G	46	Very low	43.3	Very low	59 Å²	59	147.4 Å²	147.4	61%	0.608	83%	0.831	S	S	*	*			trans	80.4	126.9	145.1	0	0	0	0	0	117.2
233	Y	42	Very low	43	Very low	236 Å²	236	150.7 Å²	150.7	93%	0.925	84%	0.835	S	S	*	*				-169.6	117.1	117.5	-101.7	-79.2	0	0	0	108.2
234	R	42.9	Very low	43.1	Very low	243 Å²	243	152.4 Å²	152.4	92%	0.917	84%	0.837	S	S	*	*			trans	-86.1	131.6	167.9	-89.5	-173.4	171.3	179.3	-1.8	107.8
235	L	49.7	Very low	43.5	Very low	157 Å²	157	155.1 Å²	155.1	82%	0.822	84%	0.841	S	S	*	*			trans	-108.6	71.6	179.7	-152.7	106.9	0	0	0	109.4
236	N	48.3	Very low	43.3	Very low	149 Å²	149	156.4 Å²	156.4	80%	0.797	84%	0.841	S	S	*	*			trans	-129.1	85.3	167	-89	-0.4	0	0	0	107.2
237	D	45.9	Very low	43.6	Very low	148 Å²	148	158.9 Å²	158.9	79%	0.791	85%	0.848	S	S	*	*			trans	-165.8	85.6	162.1	-93.4	-31.4	0	0	0	108.8
238	Y	45.2	Very low	44.1	Very low	229 Å²	229	162.7 Å²	162.7	90%	0.898	85%	0.852	S	S	*	*			trans	-155.2	86.7	152.1	-70.6	-64	0	0	0	108.3
239	V	49.2	Very low	44.6	Very low	220 Å²	220	169.5 Å²	169.5	100%	1.333	86%	0.864	S	S	*	*			trans	-129.4	0	150.6	176.7	0	0	0	0	106.5

Retrieved 239 of 239 residues in 411.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).