A0A5K4F1F9_SCHMA Loading...

Palmitoyltransferase

AlphaFold DB , UniProt , Accession A0A5K4F1F9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 238 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	63.3	Low	85.6	Confident	156 Å²	156	86.9 Å²	86.9	77%	0.768	44%	0.437	S	S	*	.				0	130	0	-179.7	-177.6	77.6	0	0	106.3	C11 V96	M1-C11 HydrophobicContact CG-CB 4.46Å; M1-C11 HydrophobicContact SD-CB 4.32Å; M1-V96 WeakPolarHBondContact O-CG2 3.32Å
2	D	74.8	Confident	85.9	Confident	14 Å²	14	79.8 Å²	79.8	8%	0.075	40%	0.401	C	S	.	.			trans	-81.6	-63.1	-178	-168.5	47.5	0	0	0	110	V12 Q85 A95	D2-V12 WeakPolarHBondContact CA-O 3.46Å; D2-V12 WeakPolarHBondContact CB-O 3.26Å; D2-V12 PolarHBondContact N-O 3.26Å; D2-Q85 PolarHBondContact OD2-NE2 3.47Å; D2-A95 WeakPolarHBondContact OD1-CB 3.32Å; D2-A95 PolarHBondContact OD1-N 3.22Å
3	H	85.8	Confident	85.8	Confident	54 Å²	54	74.5 Å²	74.5	25%	0.25	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	162.7	175.9	63	-82.7	0	0	0	111.9	V12 F20	H3-V12 PolarHBondContact N-O 3.42Å; H3-V12 PolarHBondContact O-N 3.32Å; H3-F20 AromaticContact CE1-CE1 3.92Å
4	H	88.2	Confident	85.3	Confident	106 Å²	106	78.4 Å²	78.4	49%	0.491	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	123.6	167.2	-174.7	79.3	0	0	0	109.4	P6 C11	H4-P6 WeakPolarHBondContact O-CD 3.39Å; H4-C11 PolarHBondContact ND1-SG 3.39Å
5	C	89.2	Confident	85.1	Confident	8 Å²	8	80.5 Å²	80.5	5%	0.054	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	106.7	-178.1	-179	0	0	0	0	109.7	W7 I8 N9 N10 V12	C5-W7 PolarHBondContact O-N 3.43Å; C5-I8 HydrophobicContact CB-CD1 4.13Å; C5-I8 HydrophobicContact CB-CG1 3.78Å; C5-I8 WeakPolarHBondContact O-CG1 3.3Å; C5-I8 PolarHBondContact O-N 3.12Å; C5-N9 PolarHBondContact O-N 3.43Å; C5-N10 PolarHBondContact N-O 3.46Å; C5-N10 PolarHBondContact O-N 3.39Å; C5-V12 HydrophobicContact CB-CG2 3.94Å
6	P	90.7	Very high	85.2	Confident	92 Å²	92	77.6 Å²	77.6	60%	0.597	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-60.3	-28.8	-179	-24.5	34.7	0	0	0	113.2	H4 I8 N9	H4-P6 WeakPolarHBondContact O-CD 3.39Å; P6-I8 VanDerWaalsContact C-N 3.31Å; P6-I8 PolarHBondContact O-N 3.49Å; P6-N9 PolarHBondContact O-N 3.04Å; P6-N9 VanDerWaalsContact O-N 3.11Å
7	W	86.6	Confident	85.4	Confident	191 Å²	191	74.8 Å²	74.8	72%	0.723	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-66.8	-30.1	-176.1	-52.4	113	0	0	0	114	C5 F77	C5-W7 PolarHBondContact O-N 3.43Å; W7-F77 HydrophobicContact CZ2-CZ 4.42Å; W7-F77 AromaticContact NE1-CZ 3.69Å
8	I	89.3	Confident	85.6	Confident	58 Å²	58	71.6 Å²	71.6	30%	0.297	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-104.1	3.6	174.9	63.2	169.3	0	0	0	111.7	C5 P6 N10 V12 F20 F23	C5-I8 HydrophobicContact CB-CD1 4.13Å; C5-I8 HydrophobicContact CB-CG1 3.78Å; C5-I8 WeakPolarHBondContact O-CG1 3.3Å; C5-I8 PolarHBondContact O-N 3.12Å; P6-I8 VanDerWaalsContact C-N 3.31Å; P6-I8 PolarHBondContact O-N 3.49Å; I8-N10 HydrophobicContact CD1-CB 4Å; I8-N10 HydrophobicContact CG1-CB 3.96Å; I8-N10 PolarHBondContact O-N 2.92Å; I8-V12 HydrophobicContact CD1-CG2 3.66Å; I8-F20 HydrophobicContact CD1-CD2 4.25Å; I8-F23 HydrophobicContact CG2-CE1 4.3Å
9	N	92	Very high	85.8	Confident	139 Å²	139	71.8 Å²	71.8	74%	0.743	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.3	42.3	-173.7	-168.4	33.3	0	0	0	112.6	C5 P6	C5-N9 PolarHBondContact O-N 3.43Å; P6-N9 PolarHBondContact O-N 3.04Å; P6-N9 VanDerWaalsContact O-N 3.11Å
10	N	90.5	Very high	86.1	Confident	87 Å²	87	68.7 Å²	68.7	47%	0.465	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	156.6	-173.8	-157.8	-3	0	0	0	111.7	C5 I8	C5-N10 PolarHBondContact N-O 3.46Å; C5-N10 PolarHBondContact O-N 3.39Å; I8-N10 HydrophobicContact CD1-CB 4Å; I8-N10 HydrophobicContact CG1-CB 3.96Å; I8-N10 PolarHBondContact O-N 2.92Å
11	C	91.4	Very high	86.4	Confident	51 Å²	51	65.7 Å²	65.7	35%	0.345	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	134.9	170.4	-64.3	0	0	0	0	110.2	M1 H4 N16	M1-C11 HydrophobicContact CG-CB 4.46Å; M1-C11 HydrophobicContact SD-CB 4.32Å; H4-C11 PolarHBondContact ND1-SG 3.39Å; C11-N16 PolarHBondContact O-ND2 3.35Å
12	V	89.1	Confident	87.8	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	134.8	170.5	-175.9	0	0	0	0	108.9	D2 H3 C5 I8 N16 F20	D2-V12 WeakPolarHBondContact CA-O 3.46Å; D2-V12 WeakPolarHBondContact CB-O 3.26Å; D2-V12 PolarHBondContact N-O 3.26Å; H3-V12 PolarHBondContact N-O 3.42Å; H3-V12 PolarHBondContact O-N 3.32Å; C5-V12 HydrophobicContact CB-CG2 3.94Å; I8-V12 HydrophobicContact CD1-CG2 3.66Å; V12-N16 WeakPolarHBondContact CA-OD1 3.47Å; V12-F20 HydrophobicContact CG1-CB 4.02Å; V12-F20 HydrophobicContact CG1-CD1 3.82Å; V12-F20 HydrophobicContact CG1-CE1 4.46Å; V12-F20 HydrophobicContact CG1-CG 3.94Å; V12-F20 HydrophobicContact CG2-CB 4.48Å; V12-F20 HydrophobicContact CG2-CD1 4.3Å; V12-F20 HydrophobicContact CG2-CD2 3.94Å; V12-F20 HydrophobicContact CG2-CE2 4.21Å; V12-F20 HydrophobicContact CG2-CG 3.99Å; V12-F20 HydrophobicContact CG2-CZ 4.48Å
13	G	84.3	Confident	88.6	Confident	12 Å²	12	62 Å²	62	12%	0.124	32%	0.315	C	S	.	.	S	Bend	trans	-167.4	-173.4	177.9	0	0	0	0	0	111.2	C15 N16 Q17	G13-C15 PolarHBondContact O-N 3.4Å; G13-N16 PolarHBondContact N-OD1 3.34Å; G13-N16 CarbonylContact O-C 3.6Å; G13-N16 PolarHBondContact O-N 3.04Å; G13-N16 PolarHBondContact O-OD1 3.45Å; G13-Q17 WeakPolarHBondContact O-CB 3.45Å; G13-Q17 PolarHBondContact O-N 2.88Å
14	E	79.3	Confident	89	Confident	129 Å²	129	59.6 Å²	59.6	60%	0.603	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-37.7	-172.9	-166.7	-166.8	155.6	0	0	114	N16	E14-N16 VanDerWaalsContact C-N 3.34Å; E14-N16 PolarHBondContact O-N 3.35Å
15	C	82	Confident	89.3	Confident	110 Å²	110	57.2 Å²	57.2	74%	0.743	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-20.1	-177.8	-62.1	0	0	0	0	114.5	G13	G13-C15 PolarHBondContact O-N 3.4Å
16	N	87.5	Confident	89.6	Confident	34 Å²	34	62 Å²	62	18%	0.182	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	2.4	-178.4	69.8	-5.1	0	0	0	114.6	C11 V12 G13 E14 K18 Y19 F20	C11-N16 PolarHBondContact O-ND2 3.35Å; V12-N16 WeakPolarHBondContact CA-OD1 3.47Å; G13-N16 PolarHBondContact N-OD1 3.34Å; G13-N16 CarbonylContact O-C 3.6Å; G13-N16 PolarHBondContact O-N 3.04Å; G13-N16 PolarHBondContact O-OD1 3.45Å; E14-N16 VanDerWaalsContact C-N 3.34Å; E14-N16 PolarHBondContact O-N 3.35Å; N16-K18 PolarHBondContact O-N 2.94Å; N16-Y19 HydrophobicContact CB-CD2 4.27Å; N16-Y19 PolarHBondContact O-N 3.4Å; N16-F20 PolarHBondContact O-N 2.99Å
17	Q	87.9	Confident	89.7	Confident	29 Å²	29	59.1 Å²	59.1	14%	0.136	29%	0.292	C	S	.	.	H	α-helix	trans	-54.6	-41	178.3	-172	178.2	9.7	0	0	111.8	G13 Y19 F20 I21 V141	G13-Q17 WeakPolarHBondContact O-CB 3.45Å; G13-Q17 PolarHBondContact O-N 2.88Å; Q17-Y19 PolarHBondContact O-N 3.46Å; Q17-F20 PolarHBondContact O-N 2.93Å; Q17-I21 HydrophobicContact CG-CD1 3.9Å; Q17-I21 WeakPolarHBondContact O-CD1 3.37Å; Q17-I21 WeakPolarHBondContact O-CG1 3.43Å; Q17-I21 PolarHBondContact O-N 2.76Å; Q17-V141 HydrophobicContact CG-CG1 4.41Å
18	K	88.9	Confident	90.1	Very high	17 Å²	17	51 Å²	51	7%	0.074	27%	0.269	C	S	.	.	H	α-helix	trans	-53.7	-50.6	173.8	176.5	-179.3	173.7	172.7	0	111.8	N16 F20 I21 Q22 V141 F142 S149 C154	N16-K18 PolarHBondContact O-N 2.94Å; K18-F20 VanDerWaalsContact C-N 3.33Å; K18-I21 PolarHBondContact O-N 3.17Å; K18-Q22 WeakPolarHBondContact O-CG 3.46Å; K18-Q22 PolarHBondContact O-N 2.81Å; K18-V141 HydrophobicContact CB-CG1 4.36Å; K18-F142 HydrophobicContact CG-CD1 4.02Å; K18-F142 HydrophobicContact CG-CE1 4.32Å; K18-F142 PolarHBondContact NZ-O 3.21Å; K18-S149 PolarHBondContact NZ-O 3.33Å; K18-C154 PolarHBondContact NZ-O 2.9Å
19	Y	90	Very high	90.4	Very high	76 Å²	76	53.1 Å²	53.1	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-67.9	-36.8	-178	-60.2	-60.2	0	0	0	111.8	N16 Q17 Q22 F23 P153 S155	N16-Y19 HydrophobicContact CB-CD2 4.27Å; N16-Y19 PolarHBondContact O-N 3.4Å; Q17-Y19 PolarHBondContact O-N 3.46Å; Y19-Q22 PolarHBondContact O-N 2.9Å; Y19-F23 WeakPolarHBondContact O-CB 3.38Å; Y19-F23 PolarHBondContact O-N 2.62Å; Y19-P153 HydrophobicContact CD1-CB 4.18Å; Y19-P153 HydrophobicContact CE1-CB 4.09Å; Y19-P153 WeakPolarHBondContact CE1-O 3.19Å; Y19-S155 VanDerWaalsContact OH-CB 3.22Å; Y19-S155 WeakPolarHBondContact OH-CB 3.05Å; Y19-S155 PolarHBondContact OH-OG 3.22Å
20	F	91.7	Very high	90.6	Very high	9 Å²	9	51.7 Å²	51.7	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-46.8	175.8	-176	-117.2	0	0	0	111.6	H3 I8 V12 N16 Q17 K18 Q22 F23 L24 I81 Q85	H3-F20 AromaticContact CE1-CE1 3.92Å; I8-F20 HydrophobicContact CD1-CD2 4.25Å; V12-F20 HydrophobicContact CG1-CB 4.02Å; V12-F20 HydrophobicContact CG1-CD1 3.82Å; V12-F20 HydrophobicContact CG1-CE1 4.46Å; V12-F20 HydrophobicContact CG1-CG 3.94Å; V12-F20 HydrophobicContact CG2-CB 4.48Å; V12-F20 HydrophobicContact CG2-CD1 4.3Å; V12-F20 HydrophobicContact CG2-CD2 3.94Å; V12-F20 HydrophobicContact CG2-CE2 4.21Å; V12-F20 HydrophobicContact CG2-CG 3.99Å; V12-F20 HydrophobicContact CG2-CZ 4.48Å; N16-F20 PolarHBondContact O-N 2.99Å; Q17-F20 PolarHBondContact O-N 2.93Å; K18-F20 VanDerWaalsContact C-N 3.33Å; F20-Q22 PolarHBondContact O-N 3.36Å; F20-F23 HydrophobicContact CD2-CD1 4.31Å; F20-F23 HydrophobicContact CE2-CD1 4.4Å; F20-F23 WeakPolarHBondContact O-CB 3.35Å; F20-F23 PolarHBondContact O-N 2.99Å; F20-L24 HydrophobicContact CD1-CD1 4.09Å; F20-L24 HydrophobicContact CE1-CD1 3.74Å; F20-L24 HydrophobicContact CE1-CG 4.43Å; F20-L24 HydrophobicContact CE2-CD2 4.4Å; F20-L24 HydrophobicContact CE2-CG 4.49Å; F20-L24 HydrophobicContact CZ-CD1 4.02Å; F20-L24 HydrophobicContact CZ-CD2 4.26Å; F20-L24 HydrophobicContact CZ-CG 4.33Å; F20-L24 WeakPolarHBondContact O-CG 3.49Å; F20-L24 PolarHBondContact O-N 3.35Å; F20-I81 HydrophobicContact CE1-CG2 3.99Å; F20-I81 HydrophobicContact CZ-CG2 3.85Å; F20-Q85 HydrophobicContact CD1-CG 4.11Å; F20-Q85 HydrophobicContact CE1-CG 3.77Å
21	I	92.1	Very high	90.8	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-42.1	176.8	-62.1	156.4	0	0	0	111.2	Q17 K18 F23 L24 I25 L82 Q85 I89 V141 F142	Q17-I21 HydrophobicContact CG-CD1 3.9Å; Q17-I21 WeakPolarHBondContact O-CD1 3.37Å; Q17-I21 WeakPolarHBondContact O-CG1 3.43Å; Q17-I21 PolarHBondContact O-N 2.76Å; K18-I21 PolarHBondContact O-N 3.17Å; I21-F23 VanDerWaalsContact C-N 3.34Å; I21-F23 PolarHBondContact O-N 2.89Å; I21-L24 PolarHBondContact O-N 3.18Å; I21-I25 HydrophobicContact CG2-CD1 3.86Å; I21-I25 HydrophobicContact CG2-CG1 4.41Å; I21-I25 WeakPolarHBondContact O-CG1 3.31Å; I21-I25 PolarHBondContact O-N 3.43Å; I21-L82 HydrophobicContact CG2-CD1 4.01Å; I21-Q85 HydrophobicContact CG1-CB 4.31Å; I21-I89 HydrophobicContact CD1-CD1 3.34Å; I21-I89 HydrophobicContact CD1-CG1 4.28Å; I21-I89 HydrophobicContact CG1-CD1 4.4Å; I21-V141 HydrophobicContact CD1-CG1 4.08Å; I21-F142 HydrophobicContact CB-CZ 4.14Å; I21-F142 HydrophobicContact CD1-CE2 4.32Å; I21-F142 HydrophobicContact CD1-CZ 4.13Å; I21-F142 HydrophobicContact CG2-CZ 3.75Å
22	Q	91.8	Very high	91	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.037	26%	0.261	C	S	.	.	H	α-helix	trans	-58.5	-46	174.3	-76	176.1	-11.8	0	0	111.6	K18 Y19 F20 L24 I25 Y26 F142 W150 L151 L152	K18-Q22 WeakPolarHBondContact O-CG 3.46Å; K18-Q22 PolarHBondContact O-N 2.81Å; Y19-Q22 PolarHBondContact O-N 2.9Å; F20-Q22 PolarHBondContact O-N 3.36Å; Q22-L24 PolarHBondContact O-N 3.46Å; Q22-I25 PolarHBondContact O-N 3.43Å; Q22-Y26 HydrophobicContact CB-CD2 4.34Å; Q22-Y26 HydrophobicContact CB-CE2 4.17Å; Q22-Y26 WeakPolarHBondContact O-CD2 3.19Å; Q22-Y26 PolarHBondContact O-N 2.89Å; Q22-F142 HydrophobicContact CG-CE1 4.47Å; Q22-W150 PolarHBondContact NE2-O 2.92Å; Q22-L151 PolarHBondContact NE2-O 2.81Å; Q22-L152 PolarHBondContact NE2-O 2.92Å
23	F	93.2	Very high	91.3	Very high	85 Å²	85	56.1 Å²	56.1	37%	0.373	29%	0.286	S	S	.	.	H	α-helix	trans	-55.5	-49.2	175.1	162.4	-102.9	0	0	0	111.5	I8 Y19 F20 I21 I25 Y26 V27	I8-F23 HydrophobicContact CG2-CE1 4.3Å; Y19-F23 WeakPolarHBondContact O-CB 3.38Å; Y19-F23 PolarHBondContact O-N 2.62Å; F20-F23 HydrophobicContact CD2-CD1 4.31Å; F20-F23 HydrophobicContact CE2-CD1 4.4Å; F20-F23 WeakPolarHBondContact O-CB 3.35Å; F20-F23 PolarHBondContact O-N 2.99Å; I21-F23 VanDerWaalsContact C-N 3.34Å; I21-F23 PolarHBondContact O-N 2.89Å; F23-I25 PolarHBondContact O-N 2.85Å; F23-Y26 PolarHBondContact O-N 3.07Å; F23-V27 HydrophobicContact CD2-CG2 3.84Å; F23-V27 HydrophobicContact CE2-CG2 3.49Å; F23-V27 VanDerWaalsContact CE2-CG2 3.49Å; F23-V27 HydrophobicContact CZ-CG2 3.89Å; F23-V27 VanDerWaalsContact O-CG2 3.31Å; F23-V27 WeakPolarHBondContact O-CG2 3.48Å; F23-V27 PolarHBondContact O-N 3.25Å
24	L	94.3	Very high	91.8	Very high	2 Å²	2	57 Å²	57	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-60.4	-43	178	-65	174.6	0	0	0	112.2	F20 I21 Q22 G28 I78 I81 L82 Q85	F20-L24 HydrophobicContact CD1-CD1 4.09Å; F20-L24 HydrophobicContact CE1-CD1 3.74Å; F20-L24 HydrophobicContact CE1-CG 4.43Å; F20-L24 HydrophobicContact CE2-CD2 4.4Å; F20-L24 HydrophobicContact CE2-CG 4.49Å; F20-L24 HydrophobicContact CZ-CD1 4.02Å; F20-L24 HydrophobicContact CZ-CD2 4.26Å; F20-L24 HydrophobicContact CZ-CG 4.33Å; F20-L24 WeakPolarHBondContact O-CG 3.49Å; F20-L24 PolarHBondContact O-N 3.35Å; I21-L24 PolarHBondContact O-N 3.18Å; Q22-L24 PolarHBondContact O-N 3.46Å; L24-G28 PolarHBondContact O-N 3.08Å; L24-I78 HydrophobicContact CB-CG2 4.18Å; L24-I78 HydrophobicContact CD2-CD1 3.71Å; L24-I78 HydrophobicContact CD2-CG2 4.16Å; L24-I78 VanDerWaalsContact O-CG2 3.22Å; L24-I78 WeakPolarHBondContact O-CG2 3.24Å; L24-I81 HydrophobicContact CD1-CB 4.4Å; L24-I81 HydrophobicContact CD1-CG2 3.66Å; L24-I81 HydrophobicContact CD2-CB 4.4Å; L24-I81 HydrophobicContact CD2-CG2 4.06Å; L24-L82 HydrophobicContact CB-CB 4.42Å; L24-L82 HydrophobicContact CB-CD1 4.08Å; L24-L82 HydrophobicContact CD1-CB 4.34Å; L24-L82 HydrophobicContact CD1-CD1 4.31Å; L24-Q85 HydrophobicContact CD1-CG 4.21Å
25	I	93.9	Very high	92.6	Very high	57 Å²	57	53 Å²	53	29%	0.292	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-47	177.4	-69.5	167.8	0	0	0	110.7	I21 Q22 F23 G28 I29 L82	I21-I25 HydrophobicContact CG2-CD1 3.86Å; I21-I25 HydrophobicContact CG2-CG1 4.41Å; I21-I25 WeakPolarHBondContact O-CG1 3.31Å; I21-I25 PolarHBondContact O-N 3.43Å; Q22-I25 PolarHBondContact O-N 3.43Å; F23-I25 PolarHBondContact O-N 2.85Å; I25-G28 PolarHBondContact O-N 2.97Å; I25-I29 HydrophobicContact CG2-CD1 3.86Å; I25-I29 WeakPolarHBondContact O-CG1 3.48Å; I25-I29 PolarHBondContact O-N 3.13Å; I25-L82 HydrophobicContact CG1-CD1 4.15Å; I25-L82 HydrophobicContact CG1-CD2 4.26Å
26	Y	94.7	Very high	93.3	Very high	107 Å²	107	51.8 Å²	51.8	42%	0.42	26%	0.26	S	S	.	.	H	α-helix	trans	-66.8	-40.9	-178.6	-72.9	-52.1	0	0	0	113	Q22 F23 G28 I29 L30 L151	Q22-Y26 HydrophobicContact CB-CD2 4.34Å; Q22-Y26 HydrophobicContact CB-CE2 4.17Å; Q22-Y26 WeakPolarHBondContact O-CD2 3.19Å; Q22-Y26 PolarHBondContact O-N 2.89Å; F23-Y26 PolarHBondContact O-N 3.07Å; Y26-G28 VanDerWaalsContact C-N 3.34Å; Y26-I29 PolarHBondContact O-N 3.49Å; Y26-L30 WeakPolarHBondContact O-CB 3.49Å; Y26-L30 PolarHBondContact O-N 3.37Å; Y26-L151 PolarHBondContact OH-O 2.88Å
27	V	94	Very high	93.6	Very high	32 Å²	32	53.6 Å²	53.6	19%	0.194	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-40.9	174.1	176.1	0	0	0	0	110.5	F23 I29 L30 C31 I78	F23-V27 HydrophobicContact CD2-CG2 3.84Å; F23-V27 HydrophobicContact CE2-CG2 3.49Å; F23-V27 VanDerWaalsContact CE2-CG2 3.49Å; F23-V27 HydrophobicContact CZ-CG2 3.89Å; F23-V27 VanDerWaalsContact O-CG2 3.31Å; F23-V27 WeakPolarHBondContact O-CG2 3.48Å; F23-V27 PolarHBondContact O-N 3.25Å; V27-I29 PolarHBondContact O-N 3.36Å; V27-L30 WeakPolarHBondContact O-CB 3.48Å; V27-L30 PolarHBondContact O-N 3.39Å; V27-L30 VanDerWaalsContact O-N 3.16Å; V27-C31 PolarHBondContact O-N 2.86Å; V27-C31 PolarHBondContact O-SG 2.88Å; V27-C31 VanDerWaalsContact O-SG 3.33Å; V27-I78 HydrophobicContact CG1-CD1 4.06Å; V27-I78 HydrophobicContact CG1-CG1 3.88Å
28	G	95	Very high	93.8	Very high	22 Å²	22	53.2 Å²	53.2	23%	0.227	27%	0.269	C	S	.	.	H	α-helix	trans	-59.5	-45.2	174.7	0	0	0	0	0	112.7	L24 I25 Y26 L30 C31 V32	L24-G28 PolarHBondContact O-N 3.08Å; I25-G28 PolarHBondContact O-N 2.97Å; Y26-G28 VanDerWaalsContact C-N 3.34Å; G28-L30 VanDerWaalsContact C-N 3.32Å; G28-L30 PolarHBondContact O-N 2.92Å; G28-C31 PolarHBondContact O-N 3.26Å; G28-V32 WeakPolarHBondContact O-CG2 3.28Å; G28-V32 PolarHBondContact O-N 3.12Å; G28-V32 VanDerWaalsContact O-N 3.08Å
29	I	95.1	Very high	94	Very high	101 Å²	101	58.2 Å²	58.2	52%	0.518	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-42.3	174.2	-69	167	0	0	0	110.6	I25 Y26 V27 C31 V32 Y33	I25-I29 HydrophobicContact CG2-CD1 3.86Å; I25-I29 WeakPolarHBondContact O-CG1 3.48Å; I25-I29 PolarHBondContact O-N 3.13Å; Y26-I29 PolarHBondContact O-N 3.49Å; V27-I29 PolarHBondContact O-N 3.36Å; I29-C31 PolarHBondContact O-N 2.99Å; I29-V32 PolarHBondContact O-N 3.5Å; I29-Y33 WeakPolarHBondContact O-CB 3.18Å; I29-Y33 PolarHBondContact O-N 3.22Å
30	L	95.1	Very high	94.1	Very high	109 Å²	109	59.2 Å²	59.2	57%	0.571	31%	0.305	S	S	*	.	H	α-helix	trans	-62.7	-41.5	178.1	-176.2	63.4	0	0	0	112	Y26 V27 G28 Y33 A34	Y26-L30 WeakPolarHBondContact O-CB 3.49Å; Y26-L30 PolarHBondContact O-N 3.37Å; V27-L30 WeakPolarHBondContact O-CB 3.48Å; V27-L30 PolarHBondContact O-N 3.39Å; V27-L30 VanDerWaalsContact O-N 3.16Å; G28-L30 VanDerWaalsContact C-N 3.32Å; G28-L30 PolarHBondContact O-N 2.92Å; L30-Y33 PolarHBondContact O-N 3.45Å; L30-A34 WeakPolarHBondContact O-CB 3.49Å; L30-A34 PolarHBondContact O-N 3.31Å
31	C	95.6	Very high	94	Very high	15 Å²	15	62.2 Å²	62.2	10%	0.101	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-45.7	175.2	-67.4	0	0	0	0	111.8	V27 G28 I29 A34 L35	V27-C31 PolarHBondContact O-N 2.86Å; V27-C31 PolarHBondContact O-SG 2.88Å; V27-C31 VanDerWaalsContact O-SG 3.33Å; G28-C31 PolarHBondContact O-N 3.26Å; I29-C31 PolarHBondContact O-N 2.99Å; C31-A34 PolarHBondContact O-N 3.49Å; C31-L35 WeakPolarHBondContact O-CG 3.46Å; C31-L35 PolarHBondContact O-N 3.35Å; C31-L35 VanDerWaalsContact O-N 3.11Å
32	V	95.7	Very high	93.9	Very high	83 Å²	83	66.4 Å²	66.4	50%	0.503	34%	0.342	S	S	.	.	H	α-helix	trans	-65.1	-42.3	177	174.2	0	0	0	0	111	G28 I29 A34 L35 I36	G28-V32 WeakPolarHBondContact O-CG2 3.28Å; G28-V32 PolarHBondContact O-N 3.12Å; G28-V32 VanDerWaalsContact O-N 3.08Å; I29-V32 PolarHBondContact O-N 3.5Å; V32-A34 PolarHBondContact O-N 2.79Å; V32-L35 PolarHBondContact O-N 2.66Å; V32-I36 HydrophobicContact CG1-CD1 3.82Å; V32-I36 HydrophobicContact CG1-CG1 4.41Å; V32-I36 WeakPolarHBondContact O-CG1 3.43Å; V32-I36 PolarHBondContact O-N 3.31Å
33	Y	96	Very high	93.7	Very high	135 Å²	135	68.9 Å²	68.9	53%	0.529	36%	0.364	S	S	.	.	H	α-helix	trans	-60.4	-44.1	176.9	179.4	-108.6	0	0	0	111.8	I29 L30 L35 I36 L37	I29-Y33 WeakPolarHBondContact O-CB 3.18Å; I29-Y33 PolarHBondContact O-N 3.22Å; L30-Y33 PolarHBondContact O-N 3.45Å; Y33-L35 PolarHBondContact O-N 3.42Å; Y33-I36 PolarHBondContact O-N 3.07Å; Y33-L37 HydrophobicContact CD1-CD1 3.9Å; Y33-L37 HydrophobicContact CD1-CG 4.42Å; Y33-L37 HydrophobicContact CE1-CD1 3.31Å; Y33-L37 HydrophobicContact CE1-CG 4.03Å; Y33-L37 HydrophobicContact CE2-CD1 4.32Å; Y33-L37 HydrophobicContact CE2-CD2 4.38Å; Y33-L37 HydrophobicContact CE2-CG 4.18Å; Y33-L37 WeakPolarHBondContact O-CG 3.48Å; Y33-L37 PolarHBondContact O-N 3.04Å
34	A	94.5	Very high	93.4	Very high	31 Å²	31	71.2 Å²	71.2	26%	0.256	38%	0.378	S	S	.	.	H	α-helix	trans	-60.3	-43.6	175.3	0	0	0	0	0	112.1	L30 C31 V32 L37 V38	L30-A34 WeakPolarHBondContact O-CB 3.49Å; L30-A34 PolarHBondContact O-N 3.31Å; C31-A34 PolarHBondContact O-N 3.49Å; V32-A34 PolarHBondContact O-N 2.79Å; A34-L37 PolarHBondContact O-N 2.87Å; A34-V38 WeakPolarHBondContact O-CB 3.32Å; A34-V38 VanDerWaalsContact O-CG2 3.31Å; A34-V38 WeakPolarHBondContact O-CG2 3.48Å; A34-V38 PolarHBondContact O-N 3.02Å
35	L	95.4	Very high	92.9	Very high	45 Å²	45	74.7 Å²	74.7	24%	0.236	40%	0.396	C	S	.	.	H	α-helix	trans	-61.9	-45.3	175.6	-72.1	171.6	0	0	0	112	C31 V32 Y33 V38 L39 V68	C31-L35 WeakPolarHBondContact O-CG 3.46Å; C31-L35 PolarHBondContact O-N 3.35Å; C31-L35 VanDerWaalsContact O-N 3.11Å; V32-L35 PolarHBondContact O-N 2.66Å; Y33-L35 PolarHBondContact O-N 3.42Å; L35-V38 PolarHBondContact O-N 3.1Å; L35-L39 WeakPolarHBondContact O-CB 3.48Å; L35-L39 VanDerWaalsContact O-CG 3.26Å; L35-L39 WeakPolarHBondContact O-CG 3.28Å; L35-L39 PolarHBondContact O-N 3.26Å; L35-V68 HydrophobicContact CD2-CB 4.37Å; L35-V68 HydrophobicContact CD2-CG1 4.08Å; L35-V68 HydrophobicContact CD2-CG2 4.26Å
36	I	95.8	Very high	92.4	Very high	83 Å²	83	76.7 Å²	76.7	43%	0.426	41%	0.414	S	S	.	.	H	α-helix	trans	-61.5	-46.9	177.9	-69.2	168.1	0	0	0	110.6	V32 Y33 V38 L39 I40	V32-I36 HydrophobicContact CG1-CD1 3.82Å; V32-I36 HydrophobicContact CG1-CG1 4.41Å; V32-I36 WeakPolarHBondContact O-CG1 3.43Å; V32-I36 PolarHBondContact O-N 3.31Å; Y33-I36 PolarHBondContact O-N 3.07Å; I36-V38 VanDerWaalsContact C-N 3.34Å; I36-V38 PolarHBondContact O-N 2.85Å; I36-L39 PolarHBondContact O-N 3.41Å; I36-I40 HydrophobicContact CG2-CD1 3.59Å; I36-I40 HydrophobicContact CG2-CG1 4.28Å; I36-I40 VanDerWaalsContact O-CG1 3.3Å; I36-I40 WeakPolarHBondContact O-CG1 3.36Å; I36-I40 PolarHBondContact O-N 3.2Å
37	L	94.4	Very high	91.9	Very high	72 Å²	72	75.8 Å²	75.8	38%	0.377	43%	0.429	S	S	.	.	H	α-helix	trans	-58.4	-47	177.4	-78	-178.4	0	0	0	111.6	Y33 A34 L39 I40 C41	Y33-L37 HydrophobicContact CD1-CD1 3.9Å; Y33-L37 HydrophobicContact CD1-CG 4.42Å; Y33-L37 HydrophobicContact CE1-CD1 3.31Å; Y33-L37 HydrophobicContact CE1-CG 4.03Å; Y33-L37 HydrophobicContact CE2-CD1 4.32Å; Y33-L37 HydrophobicContact CE2-CD2 4.38Å; Y33-L37 HydrophobicContact CE2-CG 4.18Å; Y33-L37 WeakPolarHBondContact O-CG 3.48Å; Y33-L37 PolarHBondContact O-N 3.04Å; A34-L37 PolarHBondContact O-N 2.87Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 2.7Å; L37-I40 PolarHBondContact O-N 3.09Å; L37-C41 VanDerWaalsContact O-CB 3.32Å; L37-C41 WeakPolarHBondContact O-CB 3.45Å; L37-C41 PolarHBondContact O-N 2.93Å; L37-C41 PolarHBondContact O-SG 3.38Å
38	V	93.3	Very high	91.1	Very high	22 Å²	22	77.3 Å²	77.3	13%	0.133	45%	0.451	C	S	.	.	H	α-helix	trans	-59.8	-45.2	177.7	166.9	0	0	0	0	111.4	A34 L35 I36 C41 R42 T64 L67 V68	A34-V38 WeakPolarHBondContact O-CB 3.32Å; A34-V38 VanDerWaalsContact O-CG2 3.31Å; A34-V38 WeakPolarHBondContact O-CG2 3.48Å; A34-V38 PolarHBondContact O-N 3.02Å; L35-V38 PolarHBondContact O-N 3.1Å; I36-V38 VanDerWaalsContact C-N 3.34Å; I36-V38 PolarHBondContact O-N 2.85Å; V38-C41 PolarHBondContact O-N 2.69Å; V38-R42 HydrophobicContact CG1-CG 4.41Å; V38-R42 WeakPolarHBondContact O-CB 3.38Å; V38-R42 VanDerWaalsContact O-CG 3.25Å; V38-R42 WeakPolarHBondContact O-CG 3.1Å; V38-R42 PolarHBondContact O-N 3.18Å; V38-T64 HydrophobicContact CG1-CG2 3.54Å; V38-L67 HydrophobicContact CG2-CB 4.45Å; V38-L67 HydrophobicContact CG2-CD1 4.22Å; V38-V68 HydrophobicContact CG1-CG2 3.79Å
39	L	92.3	Very high	89.7	Confident	122 Å²	122	81 Å²	81	64%	0.639	47%	0.465	S	S	*	.	H	α-helix	trans	-62.6	-45.8	178.6	-72	172.1	0	0	0	111.9	L35 I36 L37 R42 A43	L35-L39 WeakPolarHBondContact O-CB 3.48Å; L35-L39 VanDerWaalsContact O-CG 3.26Å; L35-L39 WeakPolarHBondContact O-CG 3.28Å; L35-L39 PolarHBondContact O-N 3.26Å; I36-L39 PolarHBondContact O-N 3.41Å; L37-L39 VanDerWaalsContact C-N 3.34Å; L37-L39 PolarHBondContact O-N 2.7Å; L39-R42 PolarHBondContact O-N 3.39Å; L39-A43 WeakPolarHBondContact O-CB 3.44Å; L39-A43 PolarHBondContact O-N 2.82Å
40	I	92.8	Very high	88.1	Confident	96 Å²	96	85.8 Å²	85.8	49%	0.492	48%	0.482	S	S	.	.	H	α-helix	trans	-63	-49.2	177.4	-67.5	170.4	0	0	0	110.1	I36 L37 R42 A43 M44	I36-I40 HydrophobicContact CG2-CD1 3.59Å; I36-I40 HydrophobicContact CG2-CG1 4.28Å; I36-I40 VanDerWaalsContact O-CG1 3.3Å; I36-I40 WeakPolarHBondContact O-CG1 3.36Å; I36-I40 PolarHBondContact O-N 3.2Å; L37-I40 PolarHBondContact O-N 3.09Å; I40-R42 VanDerWaalsContact C-N 3.31Å; I40-R42 PolarHBondContact O-N 2.94Å; I40-A43 PolarHBondContact O-N 3Å; I40-M44 HydrophobicContact CG2-CG 4.23Å; I40-M44 WeakPolarHBondContact O-CB 3.5Å; I40-M44 VanDerWaalsContact O-CG 3.25Å; I40-M44 WeakPolarHBondContact O-CG 3.41Å; I40-M44 PolarHBondContact O-N 3.18Å
41	C	89.7	Confident	86.4	Confident	72 Å²	72	88.8 Å²	88.8	49%	0.486	49%	0.493	S	S	.	.	H	α-helix	trans	-57.6	-43.7	178.7	-72.7	0	0	0	0	111.7	L37 V38 M44 I45	L37-C41 VanDerWaalsContact O-CB 3.32Å; L37-C41 WeakPolarHBondContact O-CB 3.45Å; L37-C41 PolarHBondContact O-N 2.93Å; L37-C41 PolarHBondContact O-SG 3.38Å; V38-C41 PolarHBondContact O-N 2.69Å; C41-M44 PolarHBondContact O-N 2.89Å; C41-I45 VanDerWaalsContact O-CG1 3.28Å; C41-I45 WeakPolarHBondContact O-CG1 3.34Å; C41-I45 PolarHBondContact O-N 2.77Å
42	R	88.4	Confident	84.8	Confident	95 Å²	95	95 Å²	95	36%	0.358	53%	0.526	S	S	.	.	H	α-helix	trans	-68.9	-39.1	178.6	-68.8	-70.7	-95.4	172.1	-7.3	112.4	V38 L39 I40 S46 T64	V38-R42 HydrophobicContact CG1-CG 4.41Å; V38-R42 WeakPolarHBondContact O-CB 3.38Å; V38-R42 VanDerWaalsContact O-CG 3.25Å; V38-R42 WeakPolarHBondContact O-CG 3.1Å; V38-R42 PolarHBondContact O-N 3.18Å; L39-R42 PolarHBondContact O-N 3.39Å; I40-R42 VanDerWaalsContact C-N 3.31Å; I40-R42 PolarHBondContact O-N 2.94Å; R42-S46 VanDerWaalsContact O-CB 3.29Å; R42-S46 WeakPolarHBondContact O-CB 3.47Å; R42-S46 PolarHBondContact O-N 2.78Å; R42-T64 HydrophobicContact CG-CG2 4.05Å
43	A	87.9	Confident	83.4	Confident	61 Å²	61	97.3 Å²	97.3	50%	0.504	54%	0.54	S	S	.	.	H	α-helix	trans	-62.9	-42.9	174.9	0	0	0	0	0	111.8	L39 I40 S46 A47	L39-A43 WeakPolarHBondContact O-CB 3.44Å; L39-A43 PolarHBondContact O-N 2.82Å; I40-A43 PolarHBondContact O-N 3Å; A43-S46 PolarHBondContact O-N 2.73Å; A43-A47 WeakPolarHBondContact O-CB 3.33Å; A43-A47 PolarHBondContact O-N 3.33Å
44	M	87	Confident	82.3	Confident	134 Å²	134	93.6 Å²	93.6	66%	0.66	53%	0.533	S	S	*	.	H	α-helix	trans	-65.1	-44.3	178.2	-69	-60.9	-64.1	0	0	112.2	I40 C41 A47 G48	I40-M44 HydrophobicContact CG2-CG 4.23Å; I40-M44 WeakPolarHBondContact O-CB 3.5Å; I40-M44 VanDerWaalsContact O-CG 3.25Å; I40-M44 WeakPolarHBondContact O-CG 3.41Å; I40-M44 PolarHBondContact O-N 3.18Å; C41-M44 PolarHBondContact O-N 2.89Å; M44-A47 PolarHBondContact O-N 3.02Å; M44-G48 PolarHBondContact O-N 2.81Å
45	I	84.3	Confident	81.4	Confident	75 Å²	75	99.2 Å²	99.2	39%	0.385	56%	0.559	S	S	.	*	H	α-helix	trans	-64	-44.7	176.5	-66.9	165.4	0	0	0	110.2	C41 A47 G48 L49	C41-I45 VanDerWaalsContact O-CG1 3.28Å; C41-I45 WeakPolarHBondContact O-CG1 3.34Å; C41-I45 PolarHBondContact O-N 2.77Å; I45-A47 PolarHBondContact O-N 3.23Å; I45-G48 PolarHBondContact O-N 2.88Å; I45-G48 VanDerWaalsContact O-N 3.11Å; I45-L49 HydrophobicContact CG2-CD2 4.48Å; I45-L49 WeakPolarHBondContact O-CB 3.21Å; I45-L49 PolarHBondContact O-N 2.91Å
46	S	82.8	Confident	80.5	Confident	98 Å²	98	100 Å²	100	69%	0.685	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-25.2	178.4	-173.9	0	0	0	0	113.5	R42 A43	R42-S46 VanDerWaalsContact O-CB 3.29Å; R42-S46 WeakPolarHBondContact O-CB 3.47Å; R42-S46 PolarHBondContact O-N 2.78Å; A43-S46 PolarHBondContact O-N 2.73Å
47	A	85.2	Confident	79.9	Confident	89 Å²	89	98.1 Å²	98.1	74%	0.736	56%	0.563	S	S	*	*	H	α-helix	trans	-81	-26.4	175.9	0	0	0	0	0	113	A43 M44 I45	A43-A47 WeakPolarHBondContact O-CB 3.33Å; A43-A47 PolarHBondContact O-N 3.33Å; M44-A47 PolarHBondContact O-N 3.02Å; I45-A47 PolarHBondContact O-N 3.23Å
48	G	77.7	Confident	79.5	Confident	63 Å²	63	99 Å²	99	65%	0.649	57%	0.571	S	S	*	*	H	α-helix	trans	-101.5	-22.2	-174.4	0	0	0	0	0	115.8	M44 I45	M44-G48 PolarHBondContact O-N 2.81Å; I45-G48 PolarHBondContact O-N 2.88Å; I45-G48 VanDerWaalsContact O-N 3.11Å
49	L	65.8	Low	79.2	Confident	99 Å²	99	102.8 Å²	102.8	52%	0.518	59%	0.594	S	S	.	*			trans	-98.5	111.5	-176.7	-124.3	72.2	0	0	0	110.8	I45	I45-L49 HydrophobicContact CG2-CD2 4.48Å; I45-L49 WeakPolarHBondContact O-CB 3.21Å; I45-L49 PolarHBondContact O-N 2.91Å
50	K	61.4	Low	79	Confident	202 Å²	202	100 Å²	100	88%	0.878	58%	0.582	S	S	*	*			trans	-98.6	-27.6	169.6	-83.5	-169.5	175.2	-173.8	0	114.6
51	E	58.5	Low	78.8	Confident	172 Å²	172	97.7 Å²	97.7	80%	0.804	57%	0.572	S	S	*	*	S	Bend	trans	-149.6	151.5	-171.9	-67.1	-167.3	158.8	0	0	112.7
52	D	62.8	Low	78.8	Confident	146 Å²	146	96.4 Å²	96.4	78%	0.781	57%	0.566	S	S	*	*			trans	74.7	95.4	177.3	-57	-22.1	0	0	0	118.7	S54	D52-S54 PolarHBondContact O-N 2.96Å; D52-S54 VanDerWaalsContact O-N 3.15Å
53	V	65.7	Low	79	Confident	132 Å²	132	97.1 Å²	97.1	80%	0.8	57%	0.574	S	S	*	*			trans	-67.7	106.4	169.1	-177.9	0	0	0	0	109.2	D57	V53-D57 HydrophobicContact CG1-CB 4.45Å
54	S	73.6	Confident	79.2	Confident	56 Å²	56	95.2 Å²	95.2	39%	0.392	56%	0.556	S	S	.	*			trans	-89.3	158	175.2	71.9	0	0	0	0	111.1	D52 A56 D57	D52-S54 PolarHBondContact O-N 2.96Å; D52-S54 VanDerWaalsContact O-N 3.15Å; S54-A56 PolarHBondContact O-N 3.4Å; S54-A56 VanDerWaalsContact O-N 3.1Å; S54-D57 PolarHBondContact N-OD2 3.09Å; S54-D57 WeakPolarHBondContact O-CB 3.34Å; S54-D57 PolarHBondContact O-N 3.31Å; S54-D57 PolarHBondContact OG-OD2 3.19Å
55	N	75.4	Confident	79.5	Confident	149 Å²	149	94 Å²	94	80%	0.797	55%	0.55	S	S	*	*	H	α-helix	trans	-57.4	-25.6	173	-71.9	-57	0	0	0	112.8	D57 V58	N55-D57 VanDerWaalsContact C-N 3.27Å; N55-D57 PolarHBondContact O-N 2.87Å; N55-V58 PolarHBondContact O-N 2.67Å
56	A	75.6	Confident	80.1	Confident	61 Å²	61	94.9 Å²	94.9	50%	0.504	56%	0.555	S	S	.	*	H	α-helix	trans	-65	-31.9	175	0	0	0	0	0	111.9	S54 V58 V59 V60	S54-A56 PolarHBondContact O-N 3.4Å; S54-A56 VanDerWaalsContact O-N 3.1Å; A56-V58 PolarHBondContact O-N 2.95Å; A56-V59 PolarHBondContact O-N 3.07Å; A56-V60 VanDerWaalsContact O-CG2 3.29Å; A56-V60 WeakPolarHBondContact O-CG2 3.47Å; A56-V60 PolarHBondContact O-N 3.32Å
57	D	82.9	Confident	80.6	Confident	44 Å²	44	93.3 Å²	93.3	24%	0.235	54%	0.539	C	S	.	.	H	α-helix	trans	-65.7	-40	179.6	-65.3	-50.8	0	0	0	111.8	V53 S54 N55 V59 V60 V61	V53-D57 HydrophobicContact CG1-CB 4.45Å; S54-D57 PolarHBondContact N-OD2 3.09Å; S54-D57 WeakPolarHBondContact O-CB 3.34Å; S54-D57 PolarHBondContact O-N 3.31Å; S54-D57 PolarHBondContact OG-OD2 3.19Å; N55-D57 VanDerWaalsContact C-N 3.27Å; N55-D57 PolarHBondContact O-N 2.87Å; D57-V59 VanDerWaalsContact C-N 3.33Å; D57-V59 PolarHBondContact O-N 2.71Å; D57-V60 PolarHBondContact O-N 3.26Å; D57-V61 VanDerWaalsContact O-CB 3.31Å; D57-V61 WeakPolarHBondContact O-CB 3.34Å; D57-V61 WeakPolarHBondContact O-CG2 3.35Å; D57-V61 PolarHBondContact O-N 2.86Å
58	V	85.7	Confident	81.1	Confident	92 Å²	92	91.5 Å²	91.5	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-61.9	-43.5	177.5	-178.9	0	0	0	0	110.7	N55 A56 V61 A62	N55-V58 PolarHBondContact O-N 2.67Å; A56-V58 PolarHBondContact O-N 2.95Å; V58-V61 PolarHBondContact O-N 3.12Å; V58-A62 WeakPolarHBondContact O-CB 3.41Å; V58-A62 PolarHBondContact O-N 2.93Å
59	V	87.9	Confident	82	Confident	101 Å²	101	91.2 Å²	91.2	61%	0.612	51%	0.51	S	S	*	.	H	α-helix	trans	-65.5	-44	178.2	178.5	0	0	0	0	111	A56 D57 A62 H63	A56-V59 PolarHBondContact O-N 3.07Å; D57-V59 VanDerWaalsContact C-N 3.33Å; D57-V59 PolarHBondContact O-N 2.71Å; V59-A62 PolarHBondContact O-N 3.11Å; V59-H63 WeakPolarHBondContact O-CB 3.43Å; V59-H63 PolarHBondContact O-N 3.25Å
60	V	87.5	Confident	83.4	Confident	64 Å²	64	90.7 Å²	90.7	39%	0.388	51%	0.507	S	S	.	.	H	α-helix	trans	-64.7	-41.2	177.7	171.9	0	0	0	0	111.3	A56 D57 T64	A56-V60 VanDerWaalsContact O-CG2 3.29Å; A56-V60 WeakPolarHBondContact O-CG2 3.47Å; A56-V60 PolarHBondContact O-N 3.32Å; D57-V60 PolarHBondContact O-N 3.26Å; V60-T64 VanDerWaalsContact O-CB 3.28Å; V60-T64 WeakPolarHBondContact O-CB 3.31Å; V60-T64 PolarHBondContact O-N 2.94Å; V60-T64 PolarHBondContact O-OG1 3.35Å
61	V	88.8	Confident	85	Confident	47 Å²	47	81.7 Å²	81.7	29%	0.285	47%	0.469	S	S	.	.	H	α-helix	trans	-62.7	-47.4	175.6	173.4	0	0	0	0	110.1	D57 V58 T64 I65	D57-V61 VanDerWaalsContact O-CB 3.31Å; D57-V61 WeakPolarHBondContact O-CB 3.34Å; D57-V61 WeakPolarHBondContact O-CG2 3.35Å; D57-V61 PolarHBondContact O-N 2.86Å; V58-V61 PolarHBondContact O-N 3.12Å; V61-T64 WeakPolarHBondContact O-CB 3.47Å; V61-T64 PolarHBondContact O-N 3.26Å; V61-I65 HydrophobicContact CG1-CD1 3.95Å; V61-I65 WeakPolarHBondContact O-CG1 3.25Å; V61-I65 PolarHBondContact O-N 3.34Å
62	A	90.8	Very high	86.8	Confident	44 Å²	44	76 Å²	76	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-61	-48.1	177.8	0	0	0	0	0	111.8	V58 V59 T64 I65 I66	V58-A62 WeakPolarHBondContact O-CB 3.41Å; V58-A62 PolarHBondContact O-N 2.93Å; V59-A62 PolarHBondContact O-N 3.11Å; A62-T64 VanDerWaalsContact C-N 3.29Å; A62-T64 PolarHBondContact O-N 3.38Å; A62-I65 PolarHBondContact O-N 3.01Å; A62-I66 WeakPolarHBondContact O-CG1 3.34Å; A62-I66 PolarHBondContact O-N 3.36Å
63	H	91.2	Very high	88.3	Confident	111 Å²	111	74.5 Å²	74.5	51%	0.514	44%	0.44	S	S	.	.	H	α-helix	trans	-59.3	-40.6	175.7	-177.1	-99.2	0	0	0	111.9	V59 I66 L67	V59-H63 WeakPolarHBondContact O-CB 3.43Å; V59-H63 PolarHBondContact O-N 3.25Å; H63-I66 PolarHBondContact O-N 2.97Å; H63-L67 WeakPolarHBondContact CE1-CD1 3.32Å; H63-L67 WeakPolarHBondContact O-CB 3.43Å; H63-L67 WeakPolarHBondContact O-CG 3.45Å; H63-L67 PolarHBondContact O-N 3.42Å
64	T	92.6	Very high	89.6	Confident	20 Å²	20	73.3 Å²	73.3	12%	0.123	42%	0.424	C	S	.	.	H	α-helix	trans	-60.1	-47.1	175.2	-62.7	0	0	0	0	111.8	V38 R42 V60 V61 A62 I66 L67 V68	V38-T64 HydrophobicContact CG1-CG2 3.54Å; R42-T64 HydrophobicContact CG-CG2 4.05Å; V60-T64 VanDerWaalsContact O-CB 3.28Å; V60-T64 WeakPolarHBondContact O-CB 3.31Å; V60-T64 PolarHBondContact O-N 2.94Å; V60-T64 PolarHBondContact O-OG1 3.35Å; V61-T64 WeakPolarHBondContact O-CB 3.47Å; V61-T64 PolarHBondContact O-N 3.26Å; A62-T64 VanDerWaalsContact C-N 3.29Å; A62-T64 PolarHBondContact O-N 3.38Å; T64-I66 VanDerWaalsContact C-N 3.34Å; T64-I66 PolarHBondContact O-N 3.17Å; T64-L67 PolarHBondContact O-N 2.94Å; T64-V68 HydrophobicContact CG2-CG2 4.49Å; T64-V68 VanDerWaalsContact O-CG2 3.3Å; T64-V68 WeakPolarHBondContact O-CG2 3.44Å; T64-V68 PolarHBondContact O-N 3.12Å
65	I	94.4	Very high	90.6	Very high	108 Å²	108	71.6 Å²	71.6	55%	0.554	42%	0.415	S	S	*	.	H	α-helix	trans	-61.5	-45.4	178.8	-67.6	164.7	0	0	0	110.4	V61 A62 V68 A69	V61-I65 HydrophobicContact CG1-CD1 3.95Å; V61-I65 WeakPolarHBondContact O-CG1 3.25Å; V61-I65 PolarHBondContact O-N 3.34Å; A62-I65 PolarHBondContact O-N 3.01Å; I65-V68 PolarHBondContact O-N 3.05Å; I65-A69 WeakPolarHBondContact O-CB 3.38Å; I65-A69 PolarHBondContact O-N 3.4Å
66	I	95	Very high	91.5	Very high	95 Å²	95	70.2 Å²	70.2	49%	0.487	41%	0.407	S	S	.	.	H	α-helix	trans	-61.3	-47	178.4	-67.5	166.4	0	0	0	110.7	A62 H63 T64 V68 A69 I70	A62-I66 WeakPolarHBondContact O-CG1 3.34Å; A62-I66 PolarHBondContact O-N 3.36Å; H63-I66 PolarHBondContact O-N 2.97Å; T64-I66 VanDerWaalsContact C-N 3.34Å; T64-I66 PolarHBondContact O-N 3.17Å; I66-V68 PolarHBondContact O-N 3.4Å; I66-A69 PolarHBondContact O-N 2.94Å; I66-I70 HydrophobicContact CG2-CD1 3.61Å; I66-I70 HydrophobicContact CG2-CG1 4.33Å; I66-I70 WeakPolarHBondContact O-CB 3.36Å; I66-I70 VanDerWaalsContact O-CG1 3.29Å; I66-I70 WeakPolarHBondContact O-CG1 3.34Å; I66-I70 PolarHBondContact O-N 3.17Å
67	L	94.4	Very high	92.4	Very high	64 Å²	64	71.3 Å²	71.3	34%	0.335	40%	0.4	S	S	.	.	H	α-helix	trans	-61.3	-42.9	178.1	-77.7	-177.1	0	0	0	112.7	V38 H63 T64 S71	V38-L67 HydrophobicContact CG2-CB 4.45Å; V38-L67 HydrophobicContact CG2-CD1 4.22Å; H63-L67 WeakPolarHBondContact CE1-CD1 3.32Å; H63-L67 WeakPolarHBondContact O-CB 3.43Å; H63-L67 WeakPolarHBondContact O-CG 3.45Å; H63-L67 PolarHBondContact O-N 3.42Å; T64-L67 PolarHBondContact O-N 2.94Å; L67-S71 VanDerWaalsContact O-CB 3.24Å; L67-S71 WeakPolarHBondContact O-CB 3.22Å; L67-S71 PolarHBondContact O-N 3.43Å; L67-S71 PolarHBondContact O-OG 3.4Å
68	V	95.9	Very high	93	Very high	52 Å²	52	69.7 Å²	69.7	32%	0.315	39%	0.391	S	S	.	.	H	α-helix	trans	-64.4	-46.2	176.7	171.8	0	0	0	0	110.3	L35 V38 T64 I65 I66 I70 S71 C72	L35-V68 HydrophobicContact CD2-CB 4.37Å; L35-V68 HydrophobicContact CD2-CG1 4.08Å; L35-V68 HydrophobicContact CD2-CG2 4.26Å; V38-V68 HydrophobicContact CG1-CG2 3.79Å; T64-V68 HydrophobicContact CG2-CG2 4.49Å; T64-V68 VanDerWaalsContact O-CG2 3.3Å; T64-V68 WeakPolarHBondContact O-CG2 3.44Å; T64-V68 PolarHBondContact O-N 3.12Å; I65-V68 PolarHBondContact O-N 3.05Å; I66-V68 PolarHBondContact O-N 3.4Å; V68-I70 PolarHBondContact O-N 2.95Å; V68-S71 PolarHBondContact O-N 3.2Å; V68-C72 WeakPolarHBondContact O-CB 3.38Å; V68-C72 PolarHBondContact O-N 3.05Å; V68-C72 PolarHBondContact O-SG 3.33Å
69	A	96.1	Very high	93.4	Very high	57 Å²	57	70 Å²	70	47%	0.471	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-47.5	178.9	0	0	0	0	0	111.9	I65 I66 C72 L73	I65-A69 WeakPolarHBondContact O-CB 3.38Å; I65-A69 PolarHBondContact O-N 3.4Å; I66-A69 PolarHBondContact O-N 2.94Å; A69-C72 PolarHBondContact O-N 3.47Å; A69-L73 VanDerWaalsContact O-CB 3.32Å; A69-L73 WeakPolarHBondContact O-CB 3.44Å; A69-L73 PolarHBondContact O-N 3.39Å
70	I	95.1	Very high	93.7	Very high	87 Å²	87	68 Å²	68	45%	0.446	38%	0.384	S	S	.	.	H	α-helix	trans	-63	-46.2	177.4	-68.4	171.4	0	0	0	110.5	I66 V68 C72 L73 F74	I66-I70 HydrophobicContact CG2-CD1 3.61Å; I66-I70 HydrophobicContact CG2-CG1 4.33Å; I66-I70 WeakPolarHBondContact O-CB 3.36Å; I66-I70 VanDerWaalsContact O-CG1 3.29Å; I66-I70 WeakPolarHBondContact O-CG1 3.34Å; I66-I70 PolarHBondContact O-N 3.17Å; V68-I70 PolarHBondContact O-N 2.95Å; I70-C72 VanDerWaalsContact C-N 3.34Å; I70-C72 PolarHBondContact O-N 3.1Å; I70-L73 PolarHBondContact O-N 3.35Å; I70-F74 HydrophobicContact CG2-CD2 3.96Å; I70-F74 HydrophobicContact CG2-CE2 4.45Å; I70-F74 WeakPolarHBondContact O-CB 3.43Å; I70-F74 PolarHBondContact O-N 3.17Å
71	S	95.8	Very high	94	Very high	13 Å²	13	66.8 Å²	66.8	9%	0.091	37%	0.374	C	S	.	.	H	α-helix	trans	-63.8	-39.2	-178.9	-58.6	0	0	0	0	112.2	L67 V68 G75	L67-S71 VanDerWaalsContact O-CB 3.24Å; L67-S71 WeakPolarHBondContact O-CB 3.22Å; L67-S71 PolarHBondContact O-N 3.43Å; L67-S71 PolarHBondContact O-OG 3.4Å; V68-S71 PolarHBondContact O-N 3.2Å; S71-G75 WeakPolarHBondContact O-CA 3.33Å; S71-G75 PolarHBondContact O-N 3.28Å
72	C	95.6	Very high	94.2	Very high	54 Å²	54	66.6 Å²	66.6	37%	0.365	37%	0.372	S	S	.	.	H	α-helix	trans	-69.6	-45.5	175.5	-71.2	0	0	0	0	111.9	V68 A69 I70 G75 L76	V68-C72 WeakPolarHBondContact O-CB 3.38Å; V68-C72 PolarHBondContact O-N 3.05Å; V68-C72 PolarHBondContact O-SG 3.33Å; A69-C72 PolarHBondContact O-N 3.47Å; I70-C72 VanDerWaalsContact C-N 3.34Å; I70-C72 PolarHBondContact O-N 3.1Å; C72-G75 PolarHBondContact O-N 3.09Å; C72-L76 WeakPolarHBondContact O-CB 3.22Å; C72-L76 VanDerWaalsContact O-CG 3.24Å; C72-L76 WeakPolarHBondContact O-CG 3.41Å; C72-L76 PolarHBondContact O-N 3.02Å
73	L	95	Very high	94.3	Very high	114 Å²	114	67.1 Å²	67.1	60%	0.597	37%	0.373	S	S	*	.	H	α-helix	trans	-61.6	-53.8	179.1	-171.9	169.2	0	0	0	110.7	A69 I70 G75 L76 F77	A69-L73 VanDerWaalsContact O-CB 3.32Å; A69-L73 WeakPolarHBondContact O-CB 3.44Å; A69-L73 PolarHBondContact O-N 3.39Å; I70-L73 PolarHBondContact O-N 3.35Å; L73-G75 VanDerWaalsContact C-N 3.35Å; L73-G75 PolarHBondContact O-N 2.85Å; L73-L76 PolarHBondContact O-N 3.07Å; L73-F77 WeakPolarHBondContact O-CB 3.11Å; L73-F77 PolarHBondContact O-N 3.2Å
74	F	92.4	Very high	94.3	Very high	107 Å²	107	66.1 Å²	66.1	47%	0.469	37%	0.371	S	S	.	.	H	α-helix	trans	-62.7	-42.4	177.1	-95.4	-92.3	0	0	0	111.5	I70 L76 F77 I78	I70-F74 HydrophobicContact CG2-CD2 3.96Å; I70-F74 HydrophobicContact CG2-CE2 4.45Å; I70-F74 WeakPolarHBondContact O-CB 3.43Å; I70-F74 PolarHBondContact O-N 3.17Å; F74-L76 PolarHBondContact O-N 2.81Å; F74-F77 PolarHBondContact O-N 2.79Å; F74-I78 WeakPolarHBondContact O-CB 3.21Å; F74-I78 WeakPolarHBondContact O-CG1 3.38Å; F74-I78 PolarHBondContact O-N 2.86Å
75	G	94.2	Very high	94.2	Very high	19 Å²	19	65.2 Å²	65.2	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-45.5	178.6	0	0	0	0	0	112.7	S71 C72 L73 L79	S71-G75 WeakPolarHBondContact O-CA 3.33Å; S71-G75 PolarHBondContact O-N 3.28Å; C72-G75 PolarHBondContact O-N 3.09Å; L73-G75 VanDerWaalsContact C-N 3.35Å; L73-G75 PolarHBondContact O-N 2.85Å; G75-L79 VanDerWaalsContact O-CB 3.28Å; G75-L79 WeakPolarHBondContact O-CB 3.32Å; G75-L79 PolarHBondContact O-N 3.4Å
76	L	95.1	Very high	93.9	Very high	121 Å²	121	65.3 Å²	65.3	63%	0.634	36%	0.36	S	S	*	.	H	α-helix	trans	-66.2	-41.2	176.6	-71.1	175.1	0	0	0	112.2	C72 L73 F74 L79 A80	C72-L76 WeakPolarHBondContact O-CB 3.22Å; C72-L76 VanDerWaalsContact O-CG 3.24Å; C72-L76 WeakPolarHBondContact O-CG 3.41Å; C72-L76 PolarHBondContact O-N 3.02Å; L73-L76 PolarHBondContact O-N 3.07Å; F74-L76 PolarHBondContact O-N 2.81Å; L76-L79 PolarHBondContact O-N 3.27Å; L76-A80 PolarHBondContact O-N 3.44Å
77	F	95	Very high	93.6	Very high	83 Å²	83	66.7 Å²	66.7	36%	0.364	36%	0.362	S	S	.	.	H	α-helix	trans	-62.3	-47.8	177.3	178.8	-112.5	0	0	0	111.9	W7 L73 F74 L79 A80 I81	W7-F77 HydrophobicContact CZ2-CZ 4.42Å; W7-F77 AromaticContact NE1-CZ 3.69Å; L73-F77 WeakPolarHBondContact O-CB 3.11Å; L73-F77 PolarHBondContact O-N 3.2Å; F74-F77 PolarHBondContact O-N 2.79Å; F77-L79 VanDerWaalsContact C-N 3.33Å; F77-L79 PolarHBondContact O-N 3.46Å; F77-A80 PolarHBondContact O-N 3.25Å; F77-I81 HydrophobicContact CD1-CD1 4.08Å; F77-I81 HydrophobicContact CD2-CD1 4.42Å; F77-I81 HydrophobicContact CE1-CD1 3.5Å; F77-I81 HydrophobicContact CE2-CD1 3.89Å; F77-I81 HydrophobicContact CE2-CG1 4.47Å; F77-I81 HydrophobicContact CZ-CD1 3.41Å; F77-I81 VanDerWaalsContact CZ-CD1 3.41Å; F77-I81 HydrophobicContact CZ-CG1 4.44Å; F77-I81 WeakPolarHBondContact O-CG1 3.24Å; F77-I81 PolarHBondContact O-N 3Å; F77-I81 VanDerWaalsContact O-N 3.12Å
78	I	94.7	Very high	93.1	Very high	10 Å²	10	64.4 Å²	64.4	5%	0.051	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-39.6	176.9	-65.9	-67.8	0	0	0	111	L24 V27 F74 A80 I81 L82	L24-I78 HydrophobicContact CB-CG2 4.18Å; L24-I78 HydrophobicContact CD2-CD1 3.71Å; L24-I78 HydrophobicContact CD2-CG2 4.16Å; L24-I78 VanDerWaalsContact O-CG2 3.22Å; L24-I78 WeakPolarHBondContact O-CG2 3.24Å; V27-I78 HydrophobicContact CG1-CD1 4.06Å; V27-I78 HydrophobicContact CG1-CG1 3.88Å; F74-I78 WeakPolarHBondContact O-CB 3.21Å; F74-I78 WeakPolarHBondContact O-CG1 3.38Å; F74-I78 PolarHBondContact O-N 2.86Å; I78-A80 VanDerWaalsContact C-N 3.34Å; I78-A80 PolarHBondContact O-N 3.43Å; I78-I81 PolarHBondContact O-N 2.96Å; I78-L82 WeakPolarHBondContact O-CB 3.39Å; I78-L82 PolarHBondContact O-N 2.81Å
79	L	94.4	Very high	92.5	Very high	99 Å²	99	62.3 Å²	62.3	52%	0.518	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-39.6	176.6	-176.5	65.2	0	0	0	112.2	G75 L76 F77 L82 S83	G75-L79 VanDerWaalsContact O-CB 3.28Å; G75-L79 WeakPolarHBondContact O-CB 3.32Å; G75-L79 PolarHBondContact O-N 3.4Å; L76-L79 PolarHBondContact O-N 3.27Å; F77-L79 VanDerWaalsContact C-N 3.33Å; F77-L79 PolarHBondContact O-N 3.46Å; L79-L82 PolarHBondContact O-N 3.1Å; L79-S83 VanDerWaalsContact O-CB 3.31Å; L79-S83 WeakPolarHBondContact O-CB 3.23Å; L79-S83 PolarHBondContact O-N 2.98Å; L79-S83 PolarHBondContact O-OG 3.24Å
80	A	94.4	Very high	91.9	Very high	60 Å²	60	61.5 Å²	61.5	50%	0.496	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-48.7	176.4	0	0	0	0	0	111.3	L76 F77 I78 S83 D84	L76-A80 PolarHBondContact O-N 3.44Å; F77-A80 PolarHBondContact O-N 3.25Å; I78-A80 VanDerWaalsContact C-N 3.34Å; I78-A80 PolarHBondContact O-N 3.43Å; A80-S83 WeakPolarHBondContact O-CB 3.3Å; A80-S83 PolarHBondContact O-N 3.45Å; A80-D84 PolarHBondContact O-N 3.47Å
81	I	92.8	Very high	91	Very high	37 Å²	37	62.7 Å²	62.7	19%	0.19	33%	0.331	C	S	.	.	H	α-helix	trans	-64.1	-43.3	177.3	-62.5	175.7	0	0	0	110.9	F20 L24 F77 I78 S83 D84 Q85	F20-I81 HydrophobicContact CE1-CG2 3.99Å; F20-I81 HydrophobicContact CZ-CG2 3.85Å; L24-I81 HydrophobicContact CD1-CB 4.4Å; L24-I81 HydrophobicContact CD1-CG2 3.66Å; L24-I81 HydrophobicContact CD2-CB 4.4Å; L24-I81 HydrophobicContact CD2-CG2 4.06Å; F77-I81 HydrophobicContact CD1-CD1 4.08Å; F77-I81 HydrophobicContact CD2-CD1 4.42Å; F77-I81 HydrophobicContact CE1-CD1 3.5Å; F77-I81 HydrophobicContact CE2-CD1 3.89Å; F77-I81 HydrophobicContact CE2-CG1 4.47Å; F77-I81 HydrophobicContact CZ-CD1 3.41Å; F77-I81 VanDerWaalsContact CZ-CD1 3.41Å; F77-I81 HydrophobicContact CZ-CG1 4.44Å; F77-I81 WeakPolarHBondContact O-CG1 3.24Å; F77-I81 PolarHBondContact O-N 3Å; F77-I81 VanDerWaalsContact O-N 3.12Å; I78-I81 PolarHBondContact O-N 2.96Å; I81-S83 VanDerWaalsContact C-N 3.26Å; I81-S83 PolarHBondContact O-N 3.47Å; I81-D84 WeakPolarHBondContact O-CB 3.16Å; I81-D84 PolarHBondContact O-N 3.43Å; I81-Q85 HydrophobicContact CG2-CG 4.33Å; I81-Q85 WeakPolarHBondContact O-CG 3.34Å; I81-Q85 PolarHBondContact O-N 3.24Å
82	L	93.7	Very high	89.9	Confident	44 Å²	44	65.4 Å²	65.4	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-62.4	-37.2	178.2	-177.6	62.6	0	0	0	111.5	I21 L24 I25 I78 L79 Y86	I21-L82 HydrophobicContact CG2-CD1 4.01Å; L24-L82 HydrophobicContact CB-CB 4.42Å; L24-L82 HydrophobicContact CB-CD1 4.08Å; L24-L82 HydrophobicContact CD1-CB 4.34Å; L24-L82 HydrophobicContact CD1-CD1 4.31Å; I25-L82 HydrophobicContact CG1-CD1 4.15Å; I25-L82 HydrophobicContact CG1-CD2 4.26Å; I78-L82 WeakPolarHBondContact O-CB 3.39Å; I78-L82 PolarHBondContact O-N 2.81Å; L79-L82 PolarHBondContact O-N 3.1Å; L82-Y86 VanDerWaalsContact O-CB 3.25Å; L82-Y86 WeakPolarHBondContact O-CB 3.29Å; L82-Y86 PolarHBondContact O-N 2.93Å
83	S	92.8	Very high	88.7	Confident	54 Å²	54	64.4 Å²	64.4	38%	0.378	34%	0.337	S	S	.	.	H	α-helix	trans	-66.1	-38.6	175.8	-60.5	0	0	0	0	111.9	L79 A80 I81 K87	L79-S83 VanDerWaalsContact O-CB 3.31Å; L79-S83 WeakPolarHBondContact O-CB 3.23Å; L79-S83 PolarHBondContact O-N 2.98Å; L79-S83 PolarHBondContact O-OG 3.24Å; A80-S83 WeakPolarHBondContact O-CB 3.3Å; A80-S83 PolarHBondContact O-N 3.45Å; I81-S83 VanDerWaalsContact C-N 3.26Å; I81-S83 PolarHBondContact O-N 3.47Å; S83-K87 WeakPolarHBondContact O-CG 3.31Å; S83-K87 PolarHBondContact O-N 3.49Å
84	D	90.4	Very high	87.6	Confident	91 Å²	91	61.5 Å²	61.5	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-63.8	-50.2	174.7	-177.6	68.7	0	0	0	111.4	A80 I81 Y86 K87 S88	A80-D84 PolarHBondContact O-N 3.47Å; I81-D84 WeakPolarHBondContact O-CB 3.16Å; I81-D84 PolarHBondContact O-N 3.43Å; D84-Y86 VanDerWaalsContact C-N 3.31Å; D84-Y86 PolarHBondContact O-N 2.79Å; D84-K87 WeakPolarHBondContact O-CB 3.45Å; D84-K87 PolarHBondContact O-N 3.43Å; D84-K87 VanDerWaalsContact O-N 3.1Å; D84-S88 PolarHBondContact O-N 2.87Å
85	Q	90.4	Very high	86.3	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-37.9	176.7	-63.5	-66	-67.6	0	0	112	D2 F20 I21 L24 I81 S88 I89	D2-Q85 PolarHBondContact OD2-NE2 3.47Å; F20-Q85 HydrophobicContact CD1-CG 4.11Å; F20-Q85 HydrophobicContact CE1-CG 3.77Å; I21-Q85 HydrophobicContact CG1-CB 4.31Å; L24-Q85 HydrophobicContact CD1-CG 4.21Å; I81-Q85 HydrophobicContact CG2-CG 4.33Å; I81-Q85 WeakPolarHBondContact O-CG 3.34Å; I81-Q85 PolarHBondContact O-N 3.24Å; Q85-S88 PolarHBondContact O-N 2.94Å; Q85-I89 WeakPolarHBondContact O-CD1 3.22Å; Q85-I89 WeakPolarHBondContact O-CG1 3.44Å; Q85-I89 PolarHBondContact O-N 3.46Å
86	Y	89.3	Confident	85	Confident	109 Å²	109	60.8 Å²	60.8	43%	0.427	33%	0.329	S	S	.	.	H	α-helix	trans	-60.5	-44.6	173.4	176.3	-91.9	0	0	0	111.9	L82 D84 I89 V90 F138	L82-Y86 VanDerWaalsContact O-CB 3.25Å; L82-Y86 WeakPolarHBondContact O-CB 3.29Å; L82-Y86 PolarHBondContact O-N 2.93Å; D84-Y86 VanDerWaalsContact C-N 3.31Å; D84-Y86 PolarHBondContact O-N 2.79Å; Y86-I89 PolarHBondContact O-N 3.26Å; Y86-V90 HydrophobicContact CD1-CG2 4.29Å; Y86-V90 HydrophobicContact CE1-CG2 3.83Å; Y86-V90 HydrophobicContact CE2-CG2 4.25Å; Y86-V90 WeakPolarHBondContact O-CG2 3.23Å; Y86-V90 PolarHBondContact O-N 2.81Å; Y86-F138 AromaticContact CD2-CZ 3.71Å; Y86-F138 HydrophobicContact CD2-CZ 3.71Å; Y86-F138 HydrophobicContact CE2-CE2 4.05Å; Y86-F138 AromaticContact CE2-CZ 3.6Å; Y86-F138 HydrophobicContact CE2-CZ 3.6Å
87	K	87.4	Confident	83.9	Confident	124 Å²	124	59.8 Å²	59.8	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-45.8	177	-74.8	176.2	-178.5	-179.6	0	111.4	S83 D84 I89 V90 E91	S83-K87 WeakPolarHBondContact O-CG 3.31Å; S83-K87 PolarHBondContact O-N 3.49Å; D84-K87 WeakPolarHBondContact O-CB 3.45Å; D84-K87 PolarHBondContact O-N 3.43Å; D84-K87 VanDerWaalsContact O-N 3.1Å; K87-I89 VanDerWaalsContact C-N 3.3Å; K87-I89 PolarHBondContact O-N 3.44Å; K87-V90 PolarHBondContact O-N 3.03Å; K87-E91 WeakPolarHBondContact O-CB 3.32Å; K87-E91 PolarHBondContact O-N 3.5Å
88	S	83.8	Confident	82.7	Confident	16 Å²	16	58 Å²	58	11%	0.112	32%	0.321	C	S	.	.	H	α-helix	trans	-55.5	-43.2	176.1	169.1	0	0	0	0	112.1	D84 Q85 D92 T93	D84-S88 PolarHBondContact O-N 2.87Å; Q85-S88 PolarHBondContact O-N 2.94Å; S88-D92 PolarHBondContact O-N 3.27Å; S88-D92 VanDerWaalsContact O-N 3.12Å; S88-T93 WeakPolarHBondContact CB-O 3.39Å; S88-T93 PolarHBondContact O-N 2.94Å; S88-T93 PolarHBondContact OG-O 3.47Å
89	I	84.7	Confident	81.6	Confident	9 Å²	9	65.5 Å²	65.5	5%	0.046	35%	0.349	C	S	.	.	H	α-helix	trans	-64.8	-41.8	175.9	-62.1	162.7	0	0	0	111.7	I21 Q85 Y86 K87 L137 F138 V141	I21-I89 HydrophobicContact CD1-CD1 3.34Å; I21-I89 HydrophobicContact CD1-CG1 4.28Å; I21-I89 HydrophobicContact CG1-CD1 4.4Å; Q85-I89 WeakPolarHBondContact O-CD1 3.22Å; Q85-I89 WeakPolarHBondContact O-CG1 3.44Å; Q85-I89 PolarHBondContact O-N 3.46Å; Y86-I89 PolarHBondContact O-N 3.26Å; K87-I89 VanDerWaalsContact C-N 3.3Å; K87-I89 PolarHBondContact O-N 3.44Å; I89-L137 HydrophobicContact CG2-CB 4.26Å; I89-L137 WeakPolarHBondContact O-CB 3.27Å; I89-L137 WeakPolarHBondContact O-CD1 3.31Å; I89-F138 HydrophobicContact CD1-CE1 4.03Å; I89-F138 HydrophobicContact CD1-CZ 4.5Å; I89-F138 HydrophobicContact CG2-CD1 4.2Å; I89-F138 HydrophobicContact CG2-CD2 4.32Å; I89-F138 HydrophobicContact CG2-CE1 4.1Å; I89-F138 HydrophobicContact CG2-CE2 4.21Å; I89-F138 HydrophobicContact CG2-CG 4.27Å; I89-F138 HydrophobicContact CG2-CZ 4.08Å; I89-V141 HydrophobicContact CG1-CG2 4.33Å; I89-V141 HydrophobicContact CG2-CG2 4.37Å
90	V	83	Confident	80.8	Confident	40 Å²	40	64.8 Å²	64.8	24%	0.242	35%	0.345	C	S	.	.	H	α-helix	trans	-73.7	-31.6	-176.6	170.3	0	0	0	0	112.2	Y86 K87 L137 F138	Y86-V90 HydrophobicContact CD1-CG2 4.29Å; Y86-V90 HydrophobicContact CE1-CG2 3.83Å; Y86-V90 HydrophobicContact CE2-CG2 4.25Å; Y86-V90 WeakPolarHBondContact O-CG2 3.23Å; Y86-V90 PolarHBondContact O-N 2.81Å; K87-V90 PolarHBondContact O-N 3.03Å; V90-L137 VanDerWaalsContact O-CD1 3.28Å; V90-L137 WeakPolarHBondContact O-CD1 3.04Å; V90-F138 HydrophobicContact CG2-CE2 4.3Å
91	E	76.9	Confident	79.5	Confident	112 Å²	112	65.8 Å²	65.8	52%	0.523	35%	0.349	S	S	.	.	H	α-helix	trans	-88.2	-8.9	-179.6	-69	178.7	-170.8	0	0	113.1	K87 T93	K87-E91 WeakPolarHBondContact O-CB 3.32Å; K87-E91 PolarHBondContact O-N 3.5Å; E91-T93 HydrophobicContact CB-CG2 4.23Å; E91-T93 WeakPolarHBondContact CB-OG1 3.35Å; E91-T93 PolarHBondContact O-N 3.37Å
92	D	73	Confident	78.5	Confident	70 Å²	70	67 Å²	67	37%	0.374	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	37	-172.6	-156.1	27.2	0	0	0	111.1	S88 R130 L137	S88-D92 PolarHBondContact O-N 3.27Å; S88-D92 VanDerWaalsContact O-N 3.12Å; D92-R130 IonicContact OD2-CZ 3.63Å; D92-R130 IonicContact OD2-NH2 3.98Å; D92-R130 PolarHBondContact OD2-NH2 2.85Å; D92-L137 HydrophobicContact CB-CD2 3.8Å
93	T	69.9	Low	77.3	Confident	33 Å²	33	69.5 Å²	69.5	20%	0.202	38%	0.384	C	S	.	.			trans	-117	127.6	179	53.4	0	0	0	0	109.1	S88 E91	S88-T93 WeakPolarHBondContact CB-O 3.39Å; S88-T93 PolarHBondContact O-N 2.94Å; S88-T93 PolarHBondContact OG-O 3.47Å; E91-T93 HydrophobicContact CB-CG2 4.23Å; E91-T93 WeakPolarHBondContact CB-OG1 3.35Å; E91-T93 PolarHBondContact O-N 3.37Å
94	T	71	Confident	75.8	Confident	53 Å²	53	71.7 Å²	71.7	33%	0.325	39%	0.39	S	S	.	.			trans	-68.7	154	163.9	61.3	0	0	0	0	109.5	V96 E97 A98	T94-V96 PolarHBondContact O-N 2.7Å; T94-V96 VanDerWaalsContact O-N 3.09Å; T94-E97 WeakPolarHBondContact CB-OE2 3.4Å; T94-E97 PolarHBondContact N-OE2 3.39Å; T94-E97 PolarHBondContact O-N 3.31Å; T94-E97 WeakPolarHBondContact OG1-CB 3.35Å; T94-E97 WeakPolarHBondContact OG1-CG 3.46Å; T94-E97 PolarHBondContact OG1-N 2.81Å; T94-E97 PolarHBondContact OG1-OE2 2.75Å; T94-A98 PolarHBondContact O-N 2.85Å
95	A	64.7	Low	74	Confident	41 Å²	41	72.3 Å²	72.3	34%	0.339	40%	0.399	S	S	.	.	H	α-helix	trans	-55.4	-31.2	177.1	0	0	0	0	0	112.5	D2 W99	D2-A95 WeakPolarHBondContact OD1-CB 3.32Å; D2-A95 PolarHBondContact OD1-N 3.22Å; A95-W99 PolarHBondContact O-N 2.98Å; A95-W99 VanDerWaalsContact O-N 3.1Å
96	V	67.9	Low	72.3	Confident	70 Å²	70	80.7 Å²	80.7	42%	0.424	44%	0.438	S	S	.	.	H	α-helix	trans	-67.9	-45	175.1	-179.5	0	0	0	0	111.6	M1 T94 W99 L100	M1-V96 WeakPolarHBondContact O-CG2 3.32Å; T94-V96 PolarHBondContact O-N 2.7Å; T94-V96 VanDerWaalsContact O-N 3.09Å; V96-W99 PolarHBondContact O-N 2.91Å; V96-L100 HydrophobicContact CG1-CD1 3.99Å; V96-L100 HydrophobicContact CG1-CG 4.45Å; V96-L100 WeakPolarHBondContact O-CB 3.28Å; V96-L100 VanDerWaalsContact O-CG 3.31Å; V96-L100 WeakPolarHBondContact O-CG 3.24Å; V96-L100 PolarHBondContact O-N 3.5Å
97	E	72.6	Confident	70	Confident	100 Å²	100	80.3 Å²	80.3	47%	0.467	45%	0.451	S	S	.	.	H	α-helix	trans	-67.4	-36.4	177.4	-71.8	160.3	162.2	0	0	112	T94 W99 L100 S101	T94-E97 WeakPolarHBondContact CB-OE2 3.4Å; T94-E97 PolarHBondContact N-OE2 3.39Å; T94-E97 PolarHBondContact O-N 3.31Å; T94-E97 WeakPolarHBondContact OG1-CB 3.35Å; T94-E97 WeakPolarHBondContact OG1-CG 3.46Å; T94-E97 PolarHBondContact OG1-N 2.81Å; T94-E97 PolarHBondContact OG1-OE2 2.75Å; E97-W99 VanDerWaalsContact C-N 3.33Å; E97-W99 PolarHBondContact O-N 2.9Å; E97-L100 PolarHBondContact O-N 3.46Å; E97-S101 VanDerWaalsContact O-CB 3.28Å; E97-S101 WeakPolarHBondContact O-CB 3.36Å; E97-S101 PolarHBondContact O-N 3.47Å; E97-S101 PolarHBondContact O-OG 2.92Å
98	A	69.5	Low	68	Low	44 Å²	44	79 Å²	79	36%	0.364	46%	0.457	S	S	.	.	H	α-helix	trans	-62.1	-41.3	173.5	0	0	0	0	0	111.4	T94 S101 G102	T94-A98 PolarHBondContact O-N 2.85Å; A98-S101 WeakPolarHBondContact CA-OG 3.44Å; A98-S101 PolarHBondContact O-OG 2.73Å; A98-G102 PolarHBondContact O-N 3.33Å; A98-G102 VanDerWaalsContact O-N 3.12Å
99	W	71.2	Confident	66.1	Low	169 Å²	169	82.5 Å²	82.5	64%	0.64	48%	0.482	S	S	*	.	H	α-helix	trans	-70.1	-42.7	176.6	-173.7	85.7	0	0	0	112.7	A95 V96 E97 G102 N103	A95-W99 PolarHBondContact O-N 2.98Å; A95-W99 VanDerWaalsContact O-N 3.1Å; V96-W99 PolarHBondContact O-N 2.91Å; E97-W99 VanDerWaalsContact C-N 3.33Å; E97-W99 PolarHBondContact O-N 2.9Å; W99-G102 PolarHBondContact O-N 2.93Å; W99-N103 WeakPolarHBondContact CZ2-ND2 3.45Å; W99-N103 PolarHBondContact NE1-ND2 2.95Å; W99-N103 PolarHBondContact O-N 2.91Å
100	L	76.5	Confident	64	Low	83 Å²	83	88.2 Å²	88.2	44%	0.435	51%	0.513	S	S	.	.	H	α-helix	trans	-64	-42.5	177.2	-72.4	171.7	0	0	0	111.6	V96 E97 G102 N103 I104	V96-L100 HydrophobicContact CG1-CD1 3.99Å; V96-L100 HydrophobicContact CG1-CG 4.45Å; V96-L100 WeakPolarHBondContact O-CB 3.28Å; V96-L100 VanDerWaalsContact O-CG 3.31Å; V96-L100 WeakPolarHBondContact O-CG 3.24Å; V96-L100 PolarHBondContact O-N 3.5Å; E97-L100 PolarHBondContact O-N 3.46Å; L100-G102 VanDerWaalsContact C-N 3.33Å; L100-G102 PolarHBondContact O-N 3.16Å; L100-N103 PolarHBondContact O-N 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3.25Å; L100-I104 PolarHBondContact O-N 3.42Å; L100-I104 VanDerWaalsContact O-N 3.07Å
101	S	68.2	Low	62.1	Low	82 Å²	82	92.6 Å²	92.6	57%	0.573	54%	0.54	S	S	*	.	H	α-helix	trans	-68.6	-29.2	177.8	58.1	0	0	0	0	113.4	E97 A98	E97-S101 VanDerWaalsContact O-CB 3.28Å; E97-S101 WeakPolarHBondContact O-CB 3.36Å; E97-S101 PolarHBondContact O-N 3.47Å; E97-S101 PolarHBondContact O-OG 2.92Å; A98-S101 WeakPolarHBondContact CA-OG 3.44Å; A98-S101 PolarHBondContact O-OG 2.73Å
102	G	70.9	Confident	60.3	Low	62 Å²	62	95.7 Å²	95.7	64%	0.639	55%	0.554	S	S	*	*	H	α-helix	trans	-74.5	-28.6	174.2	0	0	0	0	0	114.4	A98 W99 L100	A98-G102 PolarHBondContact O-N 3.33Å; A98-G102 VanDerWaalsContact O-N 3.12Å; W99-G102 PolarHBondContact O-N 2.93Å; L100-G102 VanDerWaalsContact C-N 3.33Å; L100-G102 PolarHBondContact O-N 3.16Å
103	N	70.2	Confident	58.7	Low	96 Å²	96	97.1 Å²	97.1	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-96.9	-13.6	-177	-73.5	-22.2	0	0	0	114.5	W99 L100 P105	W99-N103 WeakPolarHBondContact CZ2-ND2 3.45Å; W99-N103 PolarHBondContact NE1-ND2 2.95Å; W99-N103 PolarHBondContact O-N 2.91Å; L100-N103 PolarHBondContact O-N 3.29Å; N103-P105 WeakPolarHBondContact O-CD 3.22Å
104	I	60.9	Low	57.4	Low	100 Å²	100	105.5 Å²	105.5	51%	0.513	61%	0.605	S	S	.	*	S	Bend	trans	-87.8	112.1	169.2	-64.8	-168.8	0	0	0	107.4	L100 H106	L100-I104 WeakPolarHBondContact O-CG1 3.25Å; L100-I104 PolarHBondContact O-N 3.42Å; L100-I104 VanDerWaalsContact O-N 3.07Å; I104-H106 PolarHBondContact O-N 2.92Å
105	P	52.4	Low	56.2	Low	104 Å²	104	107.9 Å²	107.9	68%	0.675	62%	0.621	S	S	*	*			trans	-52.3	140.8	170.8	-18.7	30.1	0	0	0	108.3	N103 S107	N103-P105 WeakPolarHBondContact O-CD 3.22Å; P105-S107 PolarHBondContact O-N 3.25Å
106	H	54	Low	55	Low	177 Å²	177	113.1 Å²	113.1	82%	0.819	64%	0.643	S	S	*	*	S	Bend	trans	-61.3	45.7	-170.4	-149.8	-66.6	0	0	0	115.5	I104	I104-H106 PolarHBondContact O-N 2.92Å
107	S	41.2	Very low	54	Low	101 Å²	101	113.2 Å²	113.2	71%	0.706	66%	0.659	S	S	*	*			trans	-131.9	63.1	-165.6	167.5	0	0	0	0	108.6	P105	P105-S107 PolarHBondContact O-N 3.25Å
108	S	45.6	Very low	52.6	Low	96 Å²	96	114.1 Å²	114.1	67%	0.671	68%	0.676	S	S	*	*	S	Bend	trans	-175.7	11.6	156.9	61.3	0	0	0	0	115.5
109	S	44.2	Very low	51.3	Low	90 Å²	90	115.3 Å²	115.3	63%	0.629	69%	0.693	S	S	*	*	S	Bend	trans	-96.9	1.3	174.3	54.6	0	0	0	0	114.6
110	D	40.2	Very low	49.7	Very low	129 Å²	129	114.5 Å²	114.5	69%	0.69	70%	0.701	S	S	*	*	S	Bend	trans	-124.5	127.7	170.6	-56.9	-41	0	0	0	107.5
111	T	42.4	Very low	48.2	Very low	132 Å²	132	117.8 Å²	117.8	81%	0.81	72%	0.719	S	S	*	*			trans	81.9	103.9	180	-20.3	0	0	0	0	113
112	E	40	Very low	46.5	Very low	178 Å²	178	117.7 Å²	117.7	83%	0.832	73%	0.731	S	S	*	*				-135.7	113.6	58.4	-59.4	-159.7	140.1	0	0	112.8	Y114	E112-Y114 PolarHBondContact O-N 3.27Å
113	A	40	Very low	45.1	Very low	99 Å²	99	121.2 Å²	121.2	82%	0.818	74%	0.74	S	S	*	*			trans	-70.5	106.3	155.9	0	0	0	0	0	107.2
114	Y	42.4	Very low	43.8	Very low	210 Å²	210	123.2 Å²	123.2	82%	0.824	76%	0.755	S	S	*	*			trans	-58.3	134.2	170.8	-147.6	-90.2	0	0	0	108.8	E112 D116	E112-Y114 PolarHBondContact O-N 3.27Å; Y114-D116 PolarHBondContact O-N 3.33Å
115	P	45	Very low	42.5	Very low	102 Å²	102	122.2 Å²	122.2	66%	0.662	77%	0.77	S	S	*	*			trans	-71.8	129.6	-177	29	-32.1	0	0	0	110	G117	P115-G117 PolarHBondContact O-N 3.04Å
116	D	40.4	Very low	41.7	Very low	151 Å²	151	119.5 Å²	119.5	81%	0.807	76%	0.761	S	S	*	*			trans	18.9	94.9	152.7	-177.3	3.6	0	0	0	116	Y114 S118	Y114-D116 PolarHBondContact O-N 3.33Å; D116-S118 PolarHBondContact OD1-N 2.6Å
117	G	47.4	Very low	41	Very low	73 Å²	73	115.4 Å²	115.4	75%	0.753	77%	0.766	S	S	*	*			trans	-122.3	77.9	160.9	0	0	0	0	0	109	P115 G119	P115-G117 PolarHBondContact O-N 3.04Å; G117-G119 PolarHBondContact O-N 3.47Å
118	S	42.5	Very low	41.3	Very low	118 Å²	118	118.4 Å²	118.4	83%	0.825	77%	0.767	S	S	*	*			trans	-13.5	116.4	156.7	-179	0	0	0	0	115	D116	D116-S118 PolarHBondContact OD1-N 2.6Å
119	G	42.3	Very low	41.6	Very low	69 Å²	69	124 Å²	124	71%	0.711	77%	0.773	S	S	*	*			trans	151.1	98.7	166.6	0	0	0	0	0	114.1	G117	G117-G119 PolarHBondContact O-N 3.47Å
120	N	37.4	Very low	42.2	Very low	153 Å²	153	124.5 Å²	124.5	82%	0.818	76%	0.761	S	S	*	*	S	Bend	trans	8.9	138.7	156.7	-70.3	-17.2	0	0	0	120.5
121	D	44	Very low	43.3	Very low	151 Å²	151	128 Å²	128	81%	0.807	77%	0.77	S	S	*	*			trans	97.8	78.5	164.9	-50.1	-18.4	0	0	0	114.3	V123	D121-V123 PolarHBondContact O-N 3.49Å
122	G	33.8	Very low	44.6	Very low	80 Å²	80	124.2 Å²	124.2	83%	0.825	75%	0.745	S	S	*	*			trans	-62.3	86	-178	0	0	0	0	0	114.1	V124	G122-V124 PolarHBondContact O-N 2.9Å
123	V	41.2	Very low	46.5	Very low	137 Å²	137	119.4 Å²	119.4	83%	0.83	73%	0.731	S	S	*	*			trans	-89.9	88.2	156.5	177.1	0	0	0	0	107.1	D121 G125	D121-V123 PolarHBondContact O-N 3.49Å; V123-G125 VanDerWaalsContact C-N 3.26Å; V123-G125 PolarHBondContact O-N 2.93Å
124	V	42.7	Very low	48.5	Very low	138 Å²	138	120.3 Å²	120.3	84%	0.836	72%	0.716	S	S	*	*			trans	-74.5	82.9	174.8	-178.4	0	0	0	0	108.5	G122 G126	G122-V124 PolarHBondContact O-N 2.9Å; V124-G126 PolarHBondContact O-N 3.47Å; V124-G126 VanDerWaalsContact O-N 3.08Å
125	G	33.7	Very low	50.3	Low	79 Å²	79	114 Å²	114	81%	0.814	70%	0.697	S	S	*	*			trans	-78.4	61.4	168.9	0	0	0	0	0	111.3	V123	V123-G125 VanDerWaalsContact C-N 3.26Å; V123-G125 PolarHBondContact O-N 2.93Å
126	G	35.9	Very low	52	Low	47 Å²	47	112 Å²	112	49%	0.485	68%	0.682	S	S	.	*			trans	-101.3	129.4	164.3	0	0	0	0	0	107.9	V124 F128	V124-G126 PolarHBondContact O-N 3.47Å; V124-G126 VanDerWaalsContact O-N 3.08Å; G126-F128 PolarHBondContact O-N 3.35Å
127	G	38.3	Very low	54	Low	91 Å²	91	105.3 Å²	105.3	94%	0.938	65%	0.647	S	S	*	*			trans	-58.2	81.1	174.2	0	0	0	0	0	110.6	R129	G127-R129 PolarHBondContact O-N 2.88Å
128	F	47.4	Very low	55.7	Low	164 Å²	164	103.7 Å²	103.7	72%	0.719	62%	0.619	S	S	*	*			trans	-71.8	104.2	-177	-166.7	-101.8	0	0	0	105.6	G126 R130	G126-F128 PolarHBondContact O-N 3.35Å; F128-R130 HydrophobicContact CD1-CB 4.28Å; F128-R130 HydrophobicContact CD1-CG 3.85Å; F128-R130 PolarHBondContact O-N 2.89Å
129	R	53.5	Low	57.6	Low	212 Å²	212	103 Å²	103	80%	0.8	60%	0.598	S	S	*	*			trans	-53.7	94	159	-177.7	-165.9	-79.6	-124.7	4.4	105.2	G127 K131	G127-R129 PolarHBondContact O-N 2.88Å; R129-K131 PolarHBondContact O-N 3.44Å
130	R	55.7	Low	59.4	Low	101 Å²	101	104.1 Å²	104.1	38%	0.381	59%	0.585	S	S	.	*			trans	-62.7	107	-176.1	-73.8	178.8	-64.3	142.8	5.3	104.9	D92 F128 L132 E140	D92-R130 IonicContact OD2-CZ 3.63Å; D92-R130 IonicContact OD2-NH2 3.98Å; D92-R130 PolarHBondContact OD2-NH2 2.85Å; F128-R130 HydrophobicContact CD1-CB 4.28Å; F128-R130 HydrophobicContact CD1-CG 3.85Å; F128-R130 PolarHBondContact O-N 2.89Å; R130-L132 HydrophobicContact CB-CB 4.36Å; R130-L132 HydrophobicContact CB-CD1 4.23Å; R130-L132 PolarHBondContact O-N 3.33Å; R130-E140 IonicContact CZ-OE2 3.4Å; R130-E140 IonicContact NH1-OE2 2.95Å; R130-E140 PolarHBondContact NH1-OE2 2.99Å; R130-E140 IonicContact NH2-OE1 3.56Å; R130-E140 IonicContact NH2-OE2 3.8Å
131	K	62.5	Low	61.5	Low	203 Å²	203	97.9 Å²	97.9	88%	0.883	55%	0.553	S	S	*	*			trans	-68.1	69	162.5	-78.5	-171.6	179.9	179.2	0	107.5	R129	R129-K131 PolarHBondContact O-N 3.44Å
132	L	70.9	Confident	63.4	Low	53 Å²	53	91.5 Å²	91.5	28%	0.277	52%	0.518	S	S	.	.			trans	-79.3	143.1	176.8	-136.1	66.8	0	0	0	107.3	R130 T136 L137	R130-L132 HydrophobicContact CB-CB 4.36Å; R130-L132 HydrophobicContact CB-CD1 4.23Å; R130-L132 PolarHBondContact O-N 3.33Å; L132-T136 HydrophobicContact CD1-CG2 4.25Å; L132-T136 HydrophobicContact CD2-CG2 3.26Å; L132-T136 HydrophobicContact CG-CG2 3.54Å; L132-L137 HydrophobicContact CB-CD2 4.1Å; L132-L137 HydrophobicContact CB-CG 4.18Å; L132-L137 HydrophobicContact CD2-CD2 4.17Å
133	S	78.9	Confident	65.6	Low	76 Å²	76	88 Å²	88	53%	0.531	48%	0.482	S	S	.	.			trans	-57.9	143.1	171.5	176.5	0	0	0	0	109.1	L135 T136 L137	S133-L135 PolarHBondContact O-N 2.9Å; S133-L135 VanDerWaalsContact O-N 3.09Å; S133-T136 WeakPolarHBondContact O-CA 3.45Å; S133-T136 WeakPolarHBondContact O-CB 3.34Å; S133-T136 PolarHBondContact O-N 3.42Å; S133-L137 PolarHBondContact O-N 2.9Å
134	K	82.1	Confident	67.3	Low	118 Å²	118	86.2 Å²	86.2	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-48.8	-41.6	177.1	-65.5	-175.8	178.9	-175.2	0	111.4	T136 L137 F138	K134-T136 VanDerWaalsContact C-N 3.26Å; K134-T136 PolarHBondContact O-N 3.29Å; K134-L137 WeakPolarHBondContact O-CB 3.4Å; K134-L137 PolarHBondContact O-N 2.89Å; K134-L137 VanDerWaalsContact O-N 3.17Å; K134-F138 VanDerWaalsContact O-CD2 3.23Å; K134-F138 WeakPolarHBondContact O-CD2 3.33Å; K134-F138 PolarHBondContact O-N 3.46Å
135	L	80.6	Confident	68.8	Low	78 Å²	78	80.1 Å²	80.1	41%	0.408	43%	0.433	S	S	.	.	H	α-helix	trans	-61	-36.4	178.8	-169.6	75.1	0	0	0	112.2	S133 F138 R139 F147 W150	S133-L135 PolarHBondContact O-N 2.9Å; S133-L135 VanDerWaalsContact O-N 3.09Å; L135-F138 PolarHBondContact O-N 3.38Å; L135-R139 HydrophobicContact CG-CG 4.5Å; L135-R139 WeakPolarHBondContact O-CB 3.38Å; L135-R139 WeakPolarHBondContact O-CG 3.28Å; L135-R139 PolarHBondContact O-N 3.33Å; L135-F147 HydrophobicContact CD1-CE1 4.01Å; L135-F147 HydrophobicContact CD1-CZ 3.99Å; L135-W150 HydrophobicContact CD1-CH2 4.11Å
136	T	81	Confident	71	Confident	60 Å²	60	78.6 Å²	78.6	37%	0.368	41%	0.409	S	S	.	.	H	α-helix	trans	-69	-39.2	177.8	-45.9	0	0	0	0	111.1	L132 S133 K134 R139 E140	L132-T136 HydrophobicContact CD1-CG2 4.25Å; L132-T136 HydrophobicContact CD2-CG2 3.26Å; L132-T136 HydrophobicContact CG-CG2 3.54Å; S133-T136 WeakPolarHBondContact O-CA 3.45Å; S133-T136 WeakPolarHBondContact O-CB 3.34Å; S133-T136 PolarHBondContact O-N 3.42Å; K134-T136 VanDerWaalsContact C-N 3.26Å; K134-T136 PolarHBondContact O-N 3.29Å; T136-R139 PolarHBondContact O-N 2.9Å; T136-E140 PolarHBondContact O-N 2.83Å
137	L	82.4	Confident	73.1	Confident	10 Å²	10	82.9 Å²	82.9	5%	0.052	41%	0.414	C	S	.	.	H	α-helix	trans	-61.8	-46.3	173.5	-63.6	168	0	0	0	111.2	I89 V90 D92 L132 S133 K134 R139 E140 V141	I89-L137 HydrophobicContact CG2-CB 4.26Å; I89-L137 WeakPolarHBondContact O-CB 3.27Å; I89-L137 WeakPolarHBondContact O-CD1 3.31Å; V90-L137 VanDerWaalsContact O-CD1 3.28Å; V90-L137 WeakPolarHBondContact O-CD1 3.04Å; D92-L137 HydrophobicContact CB-CD2 3.8Å; L132-L137 HydrophobicContact CB-CD2 4.1Å; L132-L137 HydrophobicContact CB-CG 4.18Å; L132-L137 HydrophobicContact CD2-CD2 4.17Å; S133-L137 PolarHBondContact O-N 2.9Å; K134-L137 WeakPolarHBondContact O-CB 3.4Å; K134-L137 PolarHBondContact O-N 2.89Å; K134-L137 VanDerWaalsContact O-N 3.17Å; L137-R139 VanDerWaalsContact C-N 3.31Å; L137-R139 PolarHBondContact O-N 3.39Å; L137-E140 WeakPolarHBondContact O-CB 3.34Å; L137-E140 PolarHBondContact O-N 2.93Å; L137-E140 VanDerWaalsContact O-N 3.17Å; L137-V141 PolarHBondContact O-N 3.48Å
138	F	83.7	Confident	75	Confident	39 Å²	39	86.8 Å²	86.8	17%	0.171	40%	0.401	C	S	.	.	H	α-helix	trans	-61.5	-38.8	173.6	-83.9	-78.9	0	0	0	112.4	Y86 I89 V90 K134 L135 E140 V141 F142 W150	Y86-F138 AromaticContact CD2-CZ 3.71Å; Y86-F138 HydrophobicContact CD2-CZ 3.71Å; Y86-F138 HydrophobicContact CE2-CE2 4.05Å; Y86-F138 AromaticContact CE2-CZ 3.6Å; Y86-F138 HydrophobicContact CE2-CZ 3.6Å; I89-F138 HydrophobicContact CD1-CE1 4.03Å; I89-F138 HydrophobicContact CD1-CZ 4.5Å; I89-F138 HydrophobicContact CG2-CD1 4.2Å; I89-F138 HydrophobicContact CG2-CD2 4.32Å; I89-F138 HydrophobicContact CG2-CE1 4.1Å; I89-F138 HydrophobicContact CG2-CE2 4.21Å; I89-F138 HydrophobicContact CG2-CG 4.27Å; I89-F138 HydrophobicContact CG2-CZ 4.08Å; V90-F138 HydrophobicContact CG2-CE2 4.3Å; K134-F138 VanDerWaalsContact O-CD2 3.23Å; K134-F138 WeakPolarHBondContact O-CD2 3.33Å; K134-F138 PolarHBondContact O-N 3.46Å; L135-F138 PolarHBondContact O-N 3.38Å; F138-E140 VanDerWaalsContact C-N 3.29Å; F138-E140 PolarHBondContact O-N 3.02Å; F138-V141 PolarHBondContact O-N 3.2Å; F138-F142 AromaticContact CD1-CD2 3.82Å; F138-F142 HydrophobicContact CD1-CD2 3.82Å; F138-F142 AromaticContact CD1-CE2 3.61Å; F138-F142 HydrophobicContact CD1-CE2 3.61Å; F138-F142 HydrophobicContact CE1-CE2 4.03Å; F138-F142 WeakPolarHBondContact O-CB 3.3Å; F138-F142 WeakPolarHBondContact O-CD2 3.31Å; F138-F142 PolarHBondContact O-N 3.37Å; F138-W150 HydrophobicContact CB-CH2 3.66Å; F138-W150 HydrophobicContact CB-CZ3 3.99Å; F138-W150 HydrophobicContact CD1-CZ3 4.46Å; F138-W150 HydrophobicContact CG-CZ3 4.46Å
139	R	81.2	Confident	76.6	Confident	104 Å²	104	79.6 Å²	79.6	39%	0.392	37%	0.372	S	S	.	.	H	α-helix	trans	-67.5	-27.8	176.7	-76	169.3	67.8	158	5.2	112.9	L135 T136 L137 V141 G143 N144 W150	L135-R139 HydrophobicContact CG-CG 4.5Å; L135-R139 WeakPolarHBondContact O-CB 3.38Å; L135-R139 WeakPolarHBondContact O-CG 3.28Å; L135-R139 PolarHBondContact O-N 3.33Å; T136-R139 PolarHBondContact O-N 2.9Å; L137-R139 VanDerWaalsContact C-N 3.31Å; L137-R139 PolarHBondContact O-N 3.39Å; R139-V141 VanDerWaalsContact C-N 3.34Å; R139-G143 CarbonylContact O-C 3.32Å; R139-G143 WeakPolarHBondContact O-CA 3.49Å; R139-G143 PolarHBondContact O-N 3.31Å; R139-N144 VanDerWaalsContact CZ-OD1 3.28Å; R139-N144 PolarHBondContact NE-OD1 3.38Å; R139-N144 VanDerWaalsContact NH2-CG 3.35Å; R139-N144 PolarHBondContact NH2-OD1 2.97Å; R139-W150 HydrophobicContact CG-CZ2 3.9Å
140	E	81.4	Confident	78	Confident	92 Å²	92	71.3 Å²	71.3	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-64.8	-40.4	173.4	-166.2	159.2	174.9	0	0	111	R130 T136 L137 F138	R130-E140 IonicContact CZ-OE2 3.4Å; R130-E140 IonicContact NH1-OE2 2.95Å; R130-E140 PolarHBondContact NH1-OE2 2.99Å; R130-E140 IonicContact NH2-OE1 3.56Å; R130-E140 IonicContact NH2-OE2 3.8Å; T136-E140 PolarHBondContact O-N 2.83Å; L137-E140 WeakPolarHBondContact O-CB 3.34Å; L137-E140 PolarHBondContact O-N 2.93Å; L137-E140 VanDerWaalsContact O-N 3.17Å; F138-E140 VanDerWaalsContact C-N 3.29Å; F138-E140 PolarHBondContact O-N 3.02Å
141	V	81.5	Confident	79.3	Confident	23 Å²	23	71 Å²	71	14%	0.139	35%	0.346	C	S	.	.	H	α-helix	trans	-81.5	-52.3	179	-179.3	0	0	0	0	112.8	Q17 K18 I21 I89 L137 F138 R139	Q17-V141 HydrophobicContact CG-CG1 4.41Å; K18-V141 HydrophobicContact CB-CG1 4.36Å; I21-V141 HydrophobicContact CD1-CG1 4.08Å; I89-V141 HydrophobicContact CG1-CG2 4.33Å; I89-V141 HydrophobicContact CG2-CG2 4.37Å; L137-V141 PolarHBondContact O-N 3.48Å; F138-V141 PolarHBondContact O-N 3.2Å; R139-V141 VanDerWaalsContact C-N 3.34Å
142	F	83.7	Confident	80.2	Confident	17 Å²	17	65.9 Å²	65.9	8%	0.075	33%	0.328	C	S	.	.	H	α-helix	trans	-88.9	-19.9	-171.5	-70.8	-87	0	0	0	114.2	K18 I21 Q22 F138 W150	K18-F142 HydrophobicContact CG-CD1 4.02Å; K18-F142 HydrophobicContact CG-CE1 4.32Å; K18-F142 PolarHBondContact NZ-O 3.21Å; I21-F142 HydrophobicContact CB-CZ 4.14Å; I21-F142 HydrophobicContact CD1-CE2 4.32Å; I21-F142 HydrophobicContact CD1-CZ 4.13Å; I21-F142 HydrophobicContact CG2-CZ 3.75Å; Q22-F142 HydrophobicContact CG-CE1 4.47Å; F138-F142 AromaticContact CD1-CD2 3.82Å; F138-F142 HydrophobicContact CD1-CD2 3.82Å; F138-F142 AromaticContact CD1-CE2 3.61Å; F138-F142 HydrophobicContact CD1-CE2 3.61Å; F138-F142 HydrophobicContact CE1-CE2 4.03Å; F138-F142 WeakPolarHBondContact O-CB 3.3Å; F138-F142 WeakPolarHBondContact O-CD2 3.31Å; F138-F142 PolarHBondContact O-N 3.37Å; F142-W150 HydrophobicContact CB-CB 4.19Å; F142-W150 HydrophobicContact CB-CD2 3.6Å; F142-W150 HydrophobicContact CB-CE3 4.23Å; F142-W150 HydrophobicContact CB-CG 3.58Å; F142-W150 HydrophobicContact CB-CZ2 4.35Å; F142-W150 HydrophobicContact CD1-CB 3.83Å; F142-W150 HydrophobicContact CD1-CD2 4.46Å; F142-W150 HydrophobicContact CD1-CG 4.15Å; F142-W150 HydrophobicContact CD2-CE3 4.4Å; F142-W150 HydrophobicContact CG-CB 4.24Å; F142-W150 AromaticContact CG-CD2 3.99Å; F142-W150 HydrophobicContact CG-CD2 3.99Å; F142-W150 HydrophobicContact CG-CE3 4.19Å; F142-W150 HydrophobicContact CG-CG 4.05Å
143	G	79.7	Confident	80.6	Confident	7 Å²	7	67.3 Å²	67.3	7%	0.072	34%	0.34	C	S	.	.			trans	99.9	164.8	-176.2	0	0	0	0	0	113.6	R139 G145 W150	R139-G143 CarbonylContact O-C 3.32Å; R139-G143 WeakPolarHBondContact O-CA 3.49Å; R139-G143 PolarHBondContact O-N 3.31Å; G143-G145 PolarHBondContact O-N 2.89Å; G143-W150 PolarHBondContact O-NE1 3.46Å; G143-W150 VanDerWaalsContact O-NE1 3.1Å
144	N	76.5	Confident	80.3	Confident	98 Å²	98	67 Å²	67	52%	0.524	34%	0.338	S	S	.	.	S	Bend	trans	-77	2.8	178.8	-74.7	-30.5	0	0	0	114.3	R139	R139-N144 VanDerWaalsContact CZ-OD1 3.28Å; R139-N144 PolarHBondContact NE-OD1 3.38Å; R139-N144 VanDerWaalsContact NH2-CG 3.35Å; R139-N144 PolarHBondContact NH2-OD1 2.97Å
145	G	74.1	Confident	79.4	Confident	11 Å²	11	63 Å²	63	11%	0.113	32%	0.324	C	S	.	.	S	Bend	trans	-67.6	167.9	179.9	0	0	0	0	0	112.9	G143 W150	G143-G145 PolarHBondContact O-N 2.89Å; G145-W150 PolarHBondContact O-NE1 3.49Å
146	P	79.6	Confident	78.3	Confident	47 Å²	47	69.7 Å²	69.7	31%	0.305	35%	0.345	S	S	.	.			trans	-61.4	152.6	174.9	27.8	-35.1	0	0	0	111	Y148 S149	P146-Y148 HydrophobicContact CB-CD1 3.83Å; P146-Y148 HydrophobicContact CB-CE1 3.35Å; P146-Y148 HydrophobicContact CB-CE2 4.14Å; P146-Y148 HydrophobicContact CB-CG 4.43Å; P146-Y148 HydrophobicContact CG-CD1 4.16Å; P146-Y148 HydrophobicContact CG-CD2 4.04Å; P146-Y148 HydrophobicContact CG-CE1 3.54Å; P146-Y148 HydrophobicContact CG-CE2 3.37Å; P146-Y148 HydrophobicContact CG-CG 4.4Å; P146-Y148 VanDerWaalsContact CG-OH 3.25Å; P146-Y148 WeakPolarHBondContact CG-OH 3.35Å; P146-Y148 PolarHBondContact O-N 2.71Å; P146-S149 VanDerWaalsContact O-CB 3.3Å; P146-S149 WeakPolarHBondContact O-CB 3.26Å; P146-S149 PolarHBondContact O-N 3.37Å; P146-S149 PolarHBondContact O-OG 3.08Å
147	F	79.8	Confident	77	Confident	137 Å²	137	73.2 Å²	73.2	60%	0.601	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-54.1	-31.6	-172.2	-69.3	-74.8	0	0	0	114.9	L135 S149 W150	L135-F147 HydrophobicContact CD1-CE1 4.01Å; L135-F147 HydrophobicContact CD1-CZ 3.99Å; F147-S149 PolarHBondContact O-N 3.29Å; F147-W150 HydrophobicContact CD1-CD2 4.12Å; F147-W150 AromaticContact CD1-CE3 3.88Å; F147-W150 HydrophobicContact CD1-CE3 3.88Å; F147-W150 HydrophobicContact CD1-CH2 4.02Å; F147-W150 HydrophobicContact CD1-CZ2 4.24Å; F147-W150 AromaticContact CD1-CZ3 3.83Å; F147-W150 HydrophobicContact CD1-CZ3 3.83Å; F147-W150 HydrophobicContact CE1-CE3 4.36Å; F147-W150 AromaticContact CE1-CH2 3.71Å; F147-W150 HydrophobicContact CE1-CH2 3.71Å; F147-W150 HydrophobicContact CE1-CZ2 4.15Å; F147-W150 AromaticContact CE1-CZ3 3.82Å; F147-W150 HydrophobicContact CE1-CZ3 3.82Å; F147-W150 VanDerWaalsContact O-CB 3.23Å; F147-W150 WeakPolarHBondContact O-CB 3.48Å; F147-W150 PolarHBondContact O-N 3.43Å
148	Y	79.5	Confident	75.6	Confident	172 Å²	172	77.8 Å²	77.8	68%	0.675	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-65	-28	175.9	54	-101.4	0	0	0	113.2	P146 W150 L151	P146-Y148 HydrophobicContact CB-CD1 3.83Å; P146-Y148 HydrophobicContact CB-CE1 3.35Å; P146-Y148 HydrophobicContact CB-CE2 4.14Å; P146-Y148 HydrophobicContact CB-CG 4.43Å; P146-Y148 HydrophobicContact CG-CD1 4.16Å; P146-Y148 HydrophobicContact CG-CD2 4.04Å; P146-Y148 HydrophobicContact CG-CE1 3.54Å; P146-Y148 HydrophobicContact CG-CE2 3.37Å; P146-Y148 HydrophobicContact CG-CG 4.4Å; P146-Y148 VanDerWaalsContact CG-OH 3.25Å; P146-Y148 WeakPolarHBondContact CG-OH 3.35Å; P146-Y148 PolarHBondContact O-N 2.71Å; Y148-W150 PolarHBondContact O-N 3.11Å; Y148-L151 PolarHBondContact O-N 3.31Å
149	S	81	Confident	74.3	Confident	14 Å²	14	81 Å²	81	10%	0.098	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-70.3	-16.6	174.2	73.1	0	0	0	0	112.9	K18 P146 F147 L151	K18-S149 PolarHBondContact NZ-O 3.33Å; P146-S149 VanDerWaalsContact O-CB 3.3Å; P146-S149 WeakPolarHBondContact O-CB 3.26Å; P146-S149 PolarHBondContact O-N 3.37Å; P146-S149 PolarHBondContact O-OG 3.08Å; F147-S149 PolarHBondContact O-N 3.29Å; S149-L151 VanDerWaalsContact C-N 3.3Å
150	W	82.4	Confident	73	Confident	38 Å²	38	81.1 Å²	81.1	14%	0.144	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-75.8	-21.8	175.5	-64	6.9	0	0	0	112.4	Q22 L135 F138 R139 F142 G143 G145 F147 Y148	Q22-W150 PolarHBondContact NE2-O 2.92Å; L135-W150 HydrophobicContact CD1-CH2 4.11Å; F138-W150 HydrophobicContact CB-CH2 3.66Å; F138-W150 HydrophobicContact CB-CZ3 3.99Å; F138-W150 HydrophobicContact CD1-CZ3 4.46Å; F138-W150 HydrophobicContact CG-CZ3 4.46Å; R139-W150 HydrophobicContact CG-CZ2 3.9Å; F142-W150 HydrophobicContact CB-CB 4.19Å; F142-W150 HydrophobicContact CB-CD2 3.6Å; F142-W150 HydrophobicContact CB-CE3 4.23Å; F142-W150 HydrophobicContact CB-CG 3.58Å; F142-W150 HydrophobicContact CB-CZ2 4.35Å; F142-W150 HydrophobicContact CD1-CB 3.83Å; F142-W150 HydrophobicContact CD1-CD2 4.46Å; F142-W150 HydrophobicContact CD1-CG 4.15Å; F142-W150 HydrophobicContact CD2-CE3 4.4Å; F142-W150 HydrophobicContact CG-CB 4.24Å; F142-W150 AromaticContact CG-CD2 3.99Å; F142-W150 HydrophobicContact CG-CD2 3.99Å; F142-W150 HydrophobicContact CG-CE3 4.19Å; F142-W150 HydrophobicContact CG-CG 4.05Å; G143-W150 PolarHBondContact O-NE1 3.46Å; G143-W150 VanDerWaalsContact O-NE1 3.1Å; G145-W150 PolarHBondContact O-NE1 3.49Å; F147-W150 HydrophobicContact CD1-CD2 4.12Å; F147-W150 AromaticContact CD1-CE3 3.88Å; F147-W150 HydrophobicContact CD1-CE3 3.88Å; F147-W150 HydrophobicContact CD1-CH2 4.02Å; F147-W150 HydrophobicContact CD1-CZ2 4.24Å; F147-W150 AromaticContact CD1-CZ3 3.83Å; F147-W150 HydrophobicContact CD1-CZ3 3.83Å; F147-W150 HydrophobicContact CE1-CE3 4.36Å; F147-W150 AromaticContact CE1-CH2 3.71Å; F147-W150 HydrophobicContact CE1-CH2 3.71Å; F147-W150 HydrophobicContact CE1-CZ2 4.15Å; F147-W150 AromaticContact CE1-CZ3 3.82Å; F147-W150 HydrophobicContact CE1-CZ3 3.82Å; F147-W150 VanDerWaalsContact O-CB 3.23Å; F147-W150 WeakPolarHBondContact O-CB 3.48Å; F147-W150 PolarHBondContact O-N 3.43Å; Y148-W150 PolarHBondContact O-N 3.11Å
151	L	83.7	Confident	71.3	Confident	95 Å²	95	87.1 Å²	87.1	50%	0.497	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-36.4	175.5	-62.7	178.4	0	0	0	110.9	Q22 Y26 Y148 S149	Q22-L151 PolarHBondContact NE2-O 2.81Å; Y26-L151 PolarHBondContact OH-O 2.88Å; Y148-L151 PolarHBondContact O-N 3.31Å; S149-L151 VanDerWaalsContact C-N 3.3Å
152	L	81.3	Confident	70	Confident	95 Å²	95	89 Å²	89	50%	0.497	44%	0.441	S	S	.	.	S	Bend	trans	-71.7	138	-177.4	-62.2	174.7	0	0	0	111.6	Q22 C154	Q22-L152 PolarHBondContact NE2-O 2.92Å; L152-C154 HydrophobicContact CB-CB 4.5Å; L152-C154 PolarHBondContact O-N 3.36Å
153	P	78.9	Confident	68.4	Low	82 Å²	82	96.6 Å²	96.6	53%	0.532	48%	0.475	S	S	.	.	S	Bend	trans	-74.8	42	173.9	33.1	-36.3	0	0	0	112	Y19	Y19-P153 HydrophobicContact CD1-CB 4.18Å; Y19-P153 HydrophobicContact CE1-CB 4.09Å; Y19-P153 WeakPolarHBondContact CE1-O 3.19Å
154	C	72.1	Confident	66.9	Low	71 Å²	71	105.4 Å²	105.4	48%	0.48	51%	0.507	S	S	.	.			trans	-112.4	111.8	176.9	-61.5	0	0	0	0	108.2	K18 L152	K18-C154 PolarHBondContact NZ-O 2.9Å; L152-C154 HydrophobicContact CB-CB 4.5Å; L152-C154 PolarHBondContact O-N 3.36Å
155	S	63.3	Low	65.4	Low	32 Å²	32	107.7 Å²	107.7	22%	0.224	51%	0.509	C	S	.	.			trans	-98.8	-16.6	178.2	-63.8	0	0	0	0	113.1	Y19 L157	Y19-S155 VanDerWaalsContact OH-CB 3.22Å; Y19-S155 WeakPolarHBondContact OH-CB 3.05Å; Y19-S155 PolarHBondContact OH-OG 3.22Å; S155-L157 PolarHBondContact O-N 3.37Å
156	Y	57.5	Low	64.3	Low	220 Å²	220	111 Å²	111	86%	0.863	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-6.3	-165.8	-64.8	-72.7	0	0	0	115.7
157	L	53.5	Low	63	Low	133 Å²	133	111.1 Å²	111.1	70%	0.696	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-15.1	-175.8	-77.4	165.7	0	0	0	114.6	S155	S155-L157 PolarHBondContact O-N 3.37Å
158	F	54.3	Low	61.7	Low	107 Å²	107	109.8 Å²	109.8	47%	0.469	53%	0.531	S	S	.	.	S	Bend	trans	-143.8	11.1	-167.4	-64.6	-75.2	0	0	0	117	P160	F158-P160 WeakPolarHBondContact O-CD 3.29Å
159	K	56.3	Low	60.5	Low	106 Å²	106	104.3 Å²	104.3	46%	0.461	52%	0.518	S	S	.	.			trans	-95.6	111.3	166.4	-86.9	-171.1	174.9	-174.3	0	109.4	Y161	K159-Y161 PolarHBondContact O-N 3.44Å
160	P	52.3	Low	59.4	Low	106 Å²	106	107.9 Å²	107.9	69%	0.688	54%	0.536	S	S	*	.			trans	-56.7	129.2	152.2	-10.2	24.6	0	0	0	106.6	F158	F158-P160 WeakPolarHBondContact O-CD 3.29Å
161	Y	46.7	Very low	58.6	Low	219 Å²	219	110 Å²	110	86%	0.859	55%	0.553	S	S	*	*			trans	-44.2	128.1	172	-80.1	-92.4	0	0	0	109.6	K159 K163	K159-Y161 PolarHBondContact O-N 3.44Å; Y161-K163 PolarHBondContact O-N 2.96Å; Y161-K163 VanDerWaalsContact O-N 3.09Å
162	P	54.6	Low	57.4	Low	61 Å²	61	109.9 Å²	109.9	40%	0.396	55%	0.552	S	S	.	*			trans	-62.1	119	177.3	-6.9	16.5	0	0	0	108.4	Y164 Y165	P162-Y164 PolarHBondContact O-N 2.9Å; P162-Y165 HydrophobicContact CB-CD2 4.26Å; P162-Y165 HydrophobicContact CG-CD2 4.07Å; P162-Y165 HydrophobicContact CG-CE2 4.32Å; P162-Y165 PolarHBondContact O-N 3.26Å
163	K	49	Very low	56.6	Low	178 Å²	178	109.2 Å²	109.2	77%	0.774	55%	0.549	S	S	*	.	H	α-helix	trans	-55.8	-14.2	174.8	-72.1	-173.4	176.2	-178.2	0	113.3	Y161 T166 A167	Y161-K163 PolarHBondContact O-N 2.96Å; Y161-K163 VanDerWaalsContact O-N 3.09Å; K163-T166 WeakPolarHBondContact CA-OG1 3.46Å; K163-T166 PolarHBondContact O-N 2.87Å; K163-T166 PolarHBondContact O-OG1 2.71Å; K163-A167 PolarHBondContact O-N 3.47Å; K163-A167 VanDerWaalsContact O-N 3.07Å
164	Y	47.8	Very low	56	Low	191 Å²	191	110.3 Å²	110.3	75%	0.749	55%	0.55	S	S	*	*	H	α-helix	trans	-68.9	-31.6	178.4	-70.5	-75.2	0	0	0	113.8	P162 A167 L168	P162-Y164 PolarHBondContact O-N 2.9Å; Y164-A167 PolarHBondContact O-N 3.25Å; Y164-L168 PolarHBondContact O-N 2.99Å
165	Y	45.5	Very low	55.9	Low	146 Å²	146	110.6 Å²	110.6	57%	0.573	55%	0.55	S	S	*	.	H	α-helix	trans	-71.3	-34.3	174.8	-78.6	-81.7	0	0	0	112	P162 S169	P162-Y165 HydrophobicContact CB-CD2 4.26Å; P162-Y165 HydrophobicContact CG-CD2 4.07Å; P162-Y165 HydrophobicContact CG-CE2 4.32Å; P162-Y165 PolarHBondContact O-N 3.26Å; Y165-S169 WeakPolarHBondContact O-CB 2.97Å; Y165-S169 PolarHBondContact O-N 3.42Å
166	T	51.5	Low	55.8	Low	82 Å²	82	113.1 Å²	113.1	50%	0.503	56%	0.561	S	S	.	*	H	α-helix	trans	-68.4	-35.9	171.2	40.1	0	0	0	0	112	K163 N170	K163-T166 WeakPolarHBondContact CA-OG1 3.46Å; K163-T166 PolarHBondContact O-N 2.87Å; K163-T166 PolarHBondContact O-OG1 2.71Å; T166-N170 VanDerWaalsContact O-CB 3.24Å; T166-N170 WeakPolarHBondContact O-CB 3.32Å; T166-N170 PolarHBondContact O-N 3.3Å; T166-N170 PolarHBondContact O-ND2 2.92Å; T166-N170 PolarHBondContact O-OD1 2.94Å
167	A	52.4	Low	55.8	Low	49 Å²	49	111.8 Å²	111.8	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-66.6	-47.6	176.3	0	0	0	0	0	111.7	K163 Y164 N170 T171	K163-A167 PolarHBondContact O-N 3.47Å; K163-A167 VanDerWaalsContact O-N 3.07Å; Y164-A167 PolarHBondContact O-N 3.25Å; A167-N170 PolarHBondContact O-N 2.95Å; A167-T171 PolarHBondContact O-N 3.47Å; A167-T171 PolarHBondContact O-OG1 3.32Å
168	L	51.3	Low	56.2	Low	108 Å²	108	108.4 Å²	108.4	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-65.8	-39.1	176	-105.8	149.1	0	0	0	112.5	Y164 N170 T171 I172	Y164-L168 PolarHBondContact O-N 2.99Å; L168-N170 VanDerWaalsContact C-N 3.32Å; L168-N170 PolarHBondContact O-N 3.48Å; L168-T171 PolarHBondContact O-N 3.45Å; L168-I172 HydrophobicContact CD2-CD1 4.41Å; L168-I172 WeakPolarHBondContact O-CB 3.25Å; L168-I172 WeakPolarHBondContact O-CG1 3.41Å; L168-I172 PolarHBondContact O-N 3.44Å
169	S	55.2	Low	56.3	Low	57 Å²	57	106.9 Å²	106.9	40%	0.399	54%	0.542	S	S	.	.	H	α-helix	trans	-64	-38.6	173.6	-174.1	0	0	0	0	111.8	Y165 N173	Y165-S169 WeakPolarHBondContact O-CB 2.97Å; Y165-S169 PolarHBondContact O-N 3.42Å; S169-N173 WeakPolarHBondContact O-CB 3.3Å; S169-N173 PolarHBondContact O-N 3.47Å; S169-N173 PolarHBondContact O-ND2 3.1Å; S169-N173 VanDerWaalsContact O-ND2 3.13Å
170	N	58.5	Low	56.2	Low	90 Å²	90	106.6 Å²	106.6	48%	0.481	55%	0.546	S	S	.	.	H	α-helix	trans	-68.7	-43.3	176.1	-69.5	-12.9	0	0	0	110.9	T166 A167 L168 I172 N173 D174	T166-N170 VanDerWaalsContact O-CB 3.24Å; T166-N170 WeakPolarHBondContact O-CB 3.32Å; T166-N170 PolarHBondContact O-N 3.3Å; T166-N170 PolarHBondContact O-ND2 2.92Å; T166-N170 PolarHBondContact O-OD1 2.94Å; A167-N170 PolarHBondContact O-N 2.95Å; L168-N170 VanDerWaalsContact C-N 3.32Å; L168-N170 PolarHBondContact O-N 3.48Å; N170-I172 PolarHBondContact O-N 2.94Å; N170-N173 CarbonylContact O-C 3.59Å; N170-N173 PolarHBondContact O-N 2.97Å; N170-N173 VanDerWaalsContact O-N 3.17Å; N170-D174 WeakPolarHBondContact O-CB 3.33Å; N170-D174 PolarHBondContact O-N 3.33Å
171	T	64.4	Low	56.5	Low	82 Å²	82	104.8 Å²	104.8	50%	0.503	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-40.8	175.6	-50.9	0	0	0	0	112.1	A167 L168 N173 D174 V175	A167-T171 PolarHBondContact O-N 3.47Å; A167-T171 PolarHBondContact O-OG1 3.32Å; L168-T171 PolarHBondContact O-N 3.45Å; T171-N173 VanDerWaalsContact C-N 3.34Å; T171-D174 PolarHBondContact O-N 2.82Å; T171-V175 VanDerWaalsContact O-CG2 3.26Å; T171-V175 WeakPolarHBondContact O-CG2 3.35Å; T171-V175 PolarHBondContact O-N 3.34Å
172	I	59.3	Low	56.4	Low	92 Å²	92	98.4 Å²	98.4	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-65.8	-38.9	175.7	-67.6	168.3	0	0	0	110.8	L168 N170 N176	L168-I172 HydrophobicContact CD2-CD1 4.41Å; L168-I172 WeakPolarHBondContact O-CB 3.25Å; L168-I172 WeakPolarHBondContact O-CG1 3.41Å; L168-I172 PolarHBondContact O-N 3.44Å; N170-I172 PolarHBondContact O-N 2.94Å; I172-N176 WeakPolarHBondContact O-CB 3.28Å; I172-N176 PolarHBondContact O-N 3.22Å; I172-N176 PolarHBondContact O-ND2 2.85Å
173	N	64.6	Low	56.3	Low	81 Å²	81	100.6 Å²	100.6	43%	0.433	53%	0.531	S	S	.	.	H	α-helix	trans	-67	-38.8	175.3	-71.6	-22.9	0	0	0	112.2	S169 N170 T171 N176 Y177	S169-N173 WeakPolarHBondContact O-CB 3.3Å; S169-N173 PolarHBondContact O-N 3.47Å; S169-N173 PolarHBondContact O-ND2 3.1Å; S169-N173 VanDerWaalsContact O-ND2 3.13Å; N170-N173 CarbonylContact O-C 3.59Å; N170-N173 PolarHBondContact O-N 2.97Å; N170-N173 VanDerWaalsContact O-N 3.17Å; T171-N173 VanDerWaalsContact C-N 3.34Å; N173-N176 PolarHBondContact O-N 3.45Å; N173-Y177 WeakPolarHBondContact O-CB 3.25Å; N173-Y177 PolarHBondContact O-N 3.36Å
174	D	66.9	Low	56.3	Low	106 Å²	106	98.2 Å²	98.2	57%	0.567	53%	0.526	S	S	*	.	H	α-helix	trans	-66.7	-41.7	176.5	-68.4	-28.8	0	0	0	111.4	N170 T171 Y177 S178	N170-D174 WeakPolarHBondContact O-CB 3.33Å; N170-D174 PolarHBondContact O-N 3.33Å; T171-D174 PolarHBondContact O-N 2.82Å; D174-Y177 PolarHBondContact O-N 3.44Å; D174-S178 WeakPolarHBondContact O-CB 3.49Å; D174-S178 PolarHBondContact O-N 3.44Å; D174-S178 PolarHBondContact O-OG 3.26Å
175	V	69.4	Low	56.4	Low	76 Å²	76	95.2 Å²	95.2	46%	0.461	52%	0.523	S	S	.	.	H	α-helix	trans	-62.2	-47.3	174.1	173.1	0	0	0	0	110.1	T171 Y177 S178 V179	T171-V175 VanDerWaalsContact O-CG2 3.26Å; T171-V175 WeakPolarHBondContact O-CG2 3.35Å; T171-V175 PolarHBondContact O-N 3.34Å; V175-Y177 VanDerWaalsContact C-N 3.34Å; V175-Y177 PolarHBondContact O-N 3.35Å; V175-S178 PolarHBondContact O-N 3.42Å; V175-S178 PolarHBondContact O-OG 2.94Å; V175-V179 HydrophobicContact CG1-CG2 4.35Å; V175-V179 VanDerWaalsContact O-CG2 3.3Å; V175-V179 WeakPolarHBondContact O-CG2 3.29Å; V175-V179 PolarHBondContact O-N 2.91Å
176	N	60.1	Low	56.5	Low	85 Å²	85	94.5 Å²	94.5	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-63.6	-36.2	177.6	-74.7	-30.6	0	0	0	112.9	I172 N173 N180	I172-N176 WeakPolarHBondContact O-CB 3.28Å; I172-N176 PolarHBondContact O-N 3.22Å; I172-N176 PolarHBondContact O-ND2 2.85Å; N173-N176 PolarHBondContact O-N 3.45Å; N176-N180 WeakPolarHBondContact O-CB 3.49Å; N176-N180 VanDerWaalsContact O-CG 3.31Å; N176-N180 PolarHBondContact O-N 3.15Å; N176-N180 PolarHBondContact O-ND2 3.45Å
177	Y	57.6	Low	56.1	Low	192 Å²	192	97.2 Å²	97.2	75%	0.753	54%	0.541	S	S	*	.	H	α-helix	trans	-66.6	-41.6	173.5	-114.9	-86.2	0	0	0	112	N173 D174 V175 N180 S181	N173-Y177 WeakPolarHBondContact O-CB 3.25Å; N173-Y177 PolarHBondContact O-N 3.36Å; D174-Y177 PolarHBondContact O-N 3.44Å; V175-Y177 VanDerWaalsContact C-N 3.34Å; V175-Y177 PolarHBondContact O-N 3.35Å; Y177-N180 PolarHBondContact O-N 2.81Å; Y177-S181 WeakPolarHBondContact O-CB 3.5Å; Y177-S181 PolarHBondContact O-N 3.42Å
178	S	62.4	Low	55.6	Low	62 Å²	62	102.3 Å²	102.3	43%	0.434	56%	0.561	S	S	.	*	H	α-helix	trans	-65.7	-40.3	177.7	73.5	0	0	0	0	112.3	D174 V175 S181 C182	D174-S178 WeakPolarHBondContact O-CB 3.49Å; D174-S178 PolarHBondContact O-N 3.44Å; D174-S178 PolarHBondContact O-OG 3.26Å; V175-S178 PolarHBondContact O-N 3.42Å; V175-S178 PolarHBondContact O-OG 2.94Å; S178-S181 PolarHBondContact O-N 2.94Å; S178-C182 PolarHBondContact O-N 2.9Å; S178-C182 PolarHBondContact O-SG 2.9Å
179	V	57.5	Low	55.3	Low	75 Å²	75	102.8 Å²	102.8	46%	0.455	57%	0.574	S	S	.	*	H	α-helix	trans	-66.9	-41.5	177.1	173.3	0	0	0	0	111.2	V175 C182 N183	V175-V179 HydrophobicContact CG1-CG2 4.35Å; V175-V179 VanDerWaalsContact O-CG2 3.3Å; V175-V179 WeakPolarHBondContact O-CG2 3.29Å; V175-V179 PolarHBondContact O-N 2.91Å; V179-C182 PolarHBondContact O-N 2.92Å; V179-N183 PolarHBondContact O-N 3.05Å; V179-N183 VanDerWaalsContact O-N 3.12Å
180	N	53.9	Low	54.7	Low	100 Å²	100	107.3 Å²	107.3	54%	0.535	59%	0.593	S	S	.	*	H	α-helix	trans	-70.5	-32.7	176.8	-73.8	-20.6	0	0	0	112.8	N176 Y177 N183 N184	N176-N180 WeakPolarHBondContact O-CB 3.49Å; N176-N180 VanDerWaalsContact O-CG 3.31Å; N176-N180 PolarHBondContact O-N 3.15Å; N176-N180 PolarHBondContact O-ND2 3.45Å; Y177-N180 PolarHBondContact O-N 2.81Å; N180-N183 PolarHBondContact O-N 3.03Å; N180-N184 PolarHBondContact O-N 2.97Å
181	S	57.4	Low	53.6	Low	69 Å²	69	109.8 Å²	109.8	48%	0.483	61%	0.606	S	S	.	*	H	α-helix	trans	-67	-40.1	174	-168.8	0	0	0	0	111.8	Y177 S178 N183 N184	Y177-S181 WeakPolarHBondContact O-CB 3.5Å; Y177-S181 PolarHBondContact O-N 3.42Å; S178-S181 PolarHBondContact O-N 2.94Å; S181-N183 PolarHBondContact O-N 3.23Å; S181-N184 PolarHBondContact O-N 3.11Å
182	C	45.3	Very low	52.2	Low	85 Å²	85	110.9 Å²	110.9	57%	0.574	61%	0.614	S	S	*	*	H	α-helix	trans	-67.9	-32.3	174.9	-73.7	0	0	0	0	113.2	S178 V179	S178-C182 PolarHBondContact O-N 2.9Å; S178-C182 PolarHBondContact O-SG 2.9Å; V179-C182 PolarHBondContact O-N 2.92Å
183	N	51.9	Low	51.1	Low	107 Å²	107	113.1 Å²	113.1	57%	0.572	63%	0.626	S	S	*	*	H	α-helix	trans	-76.8	-24.9	178.6	-100.4	-5.9	0	0	0	113.9	V179 N180 S181	V179-N183 PolarHBondContact O-N 3.05Å; V179-N183 VanDerWaalsContact O-N 3.12Å; N180-N183 PolarHBondContact O-N 3.03Å; S181-N183 PolarHBondContact O-N 3.23Å
184	N	50	Low	49.8	Very low	127 Å²	127	117.3 Å²	117.3	68%	0.679	65%	0.648	S	S	*	*	H	α-helix	trans	-81.6	-12.3	178.7	-82.8	-14.4	0	0	0	114.1	N180 S181	N180-N184 PolarHBondContact O-N 2.97Å; S181-N184 PolarHBondContact O-N 3.11Å
185	N	49.9	Very low	48.4	Very low	128 Å²	128	120 Å²	120	68%	0.684	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	2.7	-179.5	-71.7	-15.4	0	0	0	114.6
186	N	47.3	Very low	46.9	Very low	131 Å²	131	125.5 Å²	125.5	70%	0.701	68%	0.678	S	S	*	*	S	Bend	trans	-104.3	14	-177.3	-81	-21.7	0	0	0	115
187	N	43.7	Very low	45.8	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	69%	0.692	S	S	*	*	S	Bend	trans	-107.5	4.5	179.7	-79.5	-22.4	0	0	0	115.7
188	D	42.3	Very low	44.9	Very low	156 Å²	156	128.6 Å²	128.6	83%	0.834	70%	0.695	S	S	*	*			trans	-115.3	81.8	179.2	-73.6	-31.3	0	0	0	112.2
189	S	44.7	Very low	43.8	Very low	118 Å²	118	134 Å²	134	83%	0.825	71%	0.714	S	S	*	*			trans	-158.3	87.3	154	32.9	0	0	0	0	111.6
190	N	41.6	Very low	42.8	Very low	151 Å²	151	135.3 Å²	135.3	81%	0.807	72%	0.723	S	S	*	*			trans	-68.4	119.6	164.7	-85.9	-51.5	0	0	0	111
191	L	35.9	Very low	42.1	Very low	143 Å²	143	140 Å²	140	75%	0.749	74%	0.742	S	S	*	*			trans	63.5	160.8	139.8	-74.7	144.8	0	0	0	119.9
192	P	35.8	Very low	41.1	Very low	105 Å²	105	139.6 Å²	139.6	68%	0.682	75%	0.748	S	S	*	*			cis	-134.3	151.8	-16.6	28.2	-6.7	0	0	0	115.6
193	I	34.8	Very low	41	Very low	138 Å²	138	143.1 Å²	143.1	71%	0.708	76%	0.76	S	S	*	*			trans	30.7	114.5	133.7	-54.5	173.3	0	0	0	118.1
194	N	37.6	Very low	40.5	Very low	169 Å²	169	145.5 Å²	145.5	90%	0.904	77%	0.772	S	S	*	*			trans	-143.2	132.8	141.1	-118.4	-14.8	0	0	0	111.5
195	Q	36.7	Very low	39.9	Very low	163 Å²	163	149.3 Å²	149.3	76%	0.762	78%	0.783	S	S	*	*			trans	-76.5	145.9	-171.2	-64.4	171.5	-22.8	0	0	112.4
196	H	38.1	Very low	39.3	Very low	192 Å²	192	153.3 Å²	153.3	89%	0.889	79%	0.794	S	S	*	*			trans	-161.7	139.9	135.2	-104.4	-64.9	0	0	0	112.4
197	H	38.2	Very low	38.8	Very low	161 Å²	161	152.1 Å²	152.1	75%	0.745	80%	0.796	S	S	*	*			trans	-55.8	143.5	-173.9	-64.4	-36.5	0	0	0	116.9
198	H	38.5	Very low	38.2	Very low	180 Å²	180	151.6 Å²	151.6	83%	0.833	80%	0.799	S	S	*	*				-179.3	152.3	100.1	-105.1	-83.6	0	0	0	113.3
199	H	38	Very low	37.7	Very low	177 Å²	177	149.6 Å²	149.6	82%	0.819	80%	0.797	S	S	*	*			trans	-43.6	162.1	-165.9	-109.4	-98.6	0	0	0	123
200	P	38	Very low	37.2	Very low	101 Å²	101	149.9 Å²	149.9	66%	0.656	79%	0.794	S	S	*	*			trans	-115.7	163.8	-171.8	40.6	-25.3	0	0	0	116.2
201	H	38.9	Very low	36.9	Very low	200 Å²	200	149.1 Å²	149.1	93%	0.926	79%	0.794	S	S	*	*			trans	-173.1	134.6	157.7	-107.3	-81.3	0	0	0	106.2
202	G	37	Very low	36.7	Very low	60 Å²	60	149.1 Å²	149.1	62%	0.619	80%	0.795	S	S	*	*			cis	171.8	150.3	-4.8	0	0	0	0	0	107.3
203	I	42.6	Very low	36.6	Very low	158 Å²	158	151.8 Å²	151.8	81%	0.81	80%	0.802	S	S	*	*			trans	75.3	121.5	154.9	-51.5	176.9	0	0	0	114.9
204	D	41.9	Very low	36.6	Very low	157 Å²	157	149.8 Å²	149.8	84%	0.84	80%	0.801	S	S	*	*			cis	-155.2	151.8	26.8	-101.8	-34.5	0	0	0	112.3
205	K	36.3	Very low	36.3	Very low	208 Å²	208	147.3 Å²	147.3	90%	0.904	80%	0.797	S	S	*	*			trans	-114.2	132.6	175.5	-75	-178.5	177	179.3	0	111.1
206	K	38.3	Very low	36.2	Very low	211 Å²	211	145 Å²	145	92%	0.917	80%	0.798	S	S	*	*			trans	175.5	141	145.8	-114.9	-179.3	171.6	179.5	0	108.6
207	S	36.3	Very low	36.1	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	79%	0.793	S	S	*	*			cis	-160.8	146.2	-16.6	45.5	0	0	0	0	106.8
208	T	29.8	Very low	36.5	Very low	129 Å²	129	139.4 Å²	139.4	79%	0.791	80%	0.796	S	S	*	*			trans	-65.8	144.5	178.9	-34.7	0	0	0	0	113.5
209	S	33.7	Very low	36.4	Very low	114 Å²	114	137.8 Å²	137.8	80%	0.797	79%	0.792	S	S	*	*			trans	-159.6	101	140.3	62.8	0	0	0	0	111.1
210	T	32.9	Very low	36.6	Very low	124 Å²	124	135.6 Å²	135.6	76%	0.761	79%	0.791	S	S	*	*			trans	-79.5	131.1	163.3	10.5	0	0	0	0	109.3
211	T	36.2	Very low	36.4	Very low	134 Å²	134	136 Å²	136	82%	0.822	79%	0.792	S	S	*	*			trans	-130.4	104.9	160.9	36	0	0	0	0	108.9
212	N	31.4	Very low	36.1	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	78%	0.783	S	S	*	*			trans	-76.2	151.9	154.8	-74.9	-27.9	0	0	0	108.4
213	I	34.3	Very low	36.1	Very low	161 Å²	161	138.6 Å²	138.6	83%	0.826	79%	0.791	S	S	*	*				146.2	129.6	129.7	-72	159.1	0	0	0	113
214	S	33.1	Very low	35.7	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	79%	0.788	S	S	*	*			trans	73.4	108.2	152.4	74.9	0	0	0	0	121.4
215	S	31.3	Very low	35.4	Very low	117 Å²	117	136.6 Å²	136.6	82%	0.818	79%	0.787	S	S	*	*			trans	-40.4	136.9	139.1	52.2	0	0	0	0	114.5
216	S	35.3	Very low	35.4	Very low	114 Å²	114	131.3 Å²	131.3	80%	0.797	78%	0.776	S	S	*	*			trans	-152.3	106.5	155.5	50	0	0	0	0	109.7
217	S	37.2	Very low	35.3	Very low	111 Å²	111	128.8 Å²	128.8	78%	0.776	77%	0.771	S	S	*	*			trans	-72.8	146.6	166	-53.4	0	0	0	0	110	I219	S217-I219 PolarHBondContact O-N 3.24Å
218	P	46.5	Very low	35.3	Very low	124 Å²	124	129 Å²	129	81%	0.805	77%	0.772	S	S	*	*			trans	-84.6	112.5	171.9	31.8	-27	0	0	0	109.8
219	I	36	Very low	35.7	Very low	146 Å²	146	128.6 Å²	128.6	75%	0.749	77%	0.774	S	S	*	*			trans	-78	123.2	160.9	-70.4	172.5	0	0	0	106.9	S217 T221	S217-I219 PolarHBondContact O-N 3.24Å; I219-T221 PolarHBondContact O-N 3.25Å
220	V	41.1	Very low	36	Very low	132 Å²	132	129 Å²	129	80%	0.8	78%	0.777	S	S	*	*			trans	-81.9	101.4	165.9	175.3	0	0	0	0	107
221	T	33.9	Very low	36.3	Very low	110 Å²	110	128.8 Å²	128.8	68%	0.675	78%	0.781	S	S	*	*			trans	-90.6	121	170.7	-32.7	0	0	0	0	108.3	I219 E223	I219-T221 PolarHBondContact O-N 3.25Å; T221-E223 PolarHBondContact O-N 3.29Å
222	I	33.5	Very low	36.6	Very low	146 Å²	146	128.2 Å²	128.2	75%	0.749	78%	0.783	S	S	*	*			trans	-81.9	105	166.7	-64.2	173.9	0	0	0	106.1	T224	I222-T224 HydrophobicContact CG2-CG2 4.42Å
223	E	35.7	Very low	37.1	Very low	167 Å²	167	126.6 Å²	126.6	78%	0.78	78%	0.782	S	S	*	*			trans	-88.4	111.2	167.3	-110.4	170.9	-178.7	0	0	108.7	T221	T221-E223 PolarHBondContact O-N 3.29Å
224	T	34.2	Very low	37.9	Very low	123 Å²	123	124.3 Å²	124.3	76%	0.755	78%	0.781	S	S	*	*			trans	-91.9	103.7	161.4	47.2	0	0	0	0	107.7	I222	I222-T224 HydrophobicContact CG2-CG2 4.42Å
225	D	37.2	Very low	38.5	Very low	151 Å²	151	125.9 Å²	125.9	81%	0.807	78%	0.782	S	S	*	*			trans	-108.1	130.5	164.8	-88.1	-18.5	0	0	0	111.1
226	S	35.1	Very low	39.1	Very low	96 Å²	96	126.7 Å²	126.7	67%	0.671	78%	0.777	S	S	*	*			trans	-103.4	165.8	177.9	48.4	0	0	0	0	108.5
227	I	35.8	Very low	39.8	Very low	158 Å²	158	129.7 Å²	129.7	81%	0.81	78%	0.778	S	S	*	*			trans	89.9	102.3	163.5	-46.6	159.7	0	0	0	115.4
228	S	37.6	Very low	40.6	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	80%	0.797	S	S	*	*				178.8	128.4	100.5	42.8	0	0	0	0	111.8
229	S	37.1	Very low	40.3	Very low	120 Å²	120	139.4 Å²	139.4	84%	0.839	80%	0.796	S	S	*	*			trans	-62.5	136.1	172	47.5	0	0	0	0	112.9
230	S	40.7	Very low	40.5	Very low	122 Å²	122	139.1 Å²	139.1	85%	0.853	80%	0.799	S	S	*	*			trans	-144.8	117.7	143.4	51.3	0	0	0	0	109.9
231	S	39.7	Very low	40.5	Very low	121 Å²	121	139.4 Å²	139.4	85%	0.846	80%	0.799	S	S	*	*			trans	-83.5	131.3	176	48.5	0	0	0	0	110.3
232	S	43.1	Very low	40.9	Very low	122 Å²	122	141.2 Å²	141.2	85%	0.853	81%	0.806	S	S	*	*			trans	-152	107.6	154	48.9	0	0	0	0	109.8
233	S	41.9	Very low	41.3	Very low	108 Å²	108	140.9 Å²	140.9	76%	0.755	81%	0.81	S	S	*	*			trans	-69.1	139.6	172.6	-173.5	0	0	0	0	110.9
234	S	50	Low	41.7	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	81%	0.811	S	S	*	*			trans	-166.8	100.4	150.8	-83	0	0	0	0	111.7
235	N	45.9	Very low	42.3	Very low	131 Å²	131	140.3 Å²	140.3	70%	0.701	82%	0.816	S	S	*	*				42.6	119.1	128.2	-66.7	-16.1	0	0	0	121.7
236	N	44.3	Very low	42.6	Very low	133 Å²	133	139.5 Å²	139.5	71%	0.711	82%	0.816	S	S	*	*				78.4	141.4	121.3	-69	-11.5	0	0	0	122.9
237	H	49.3	Very low	43.3	Very low	177 Å²	177	143.1 Å²	143.1	82%	0.819	83%	0.828	S	S	*	*			trans	85.6	93	152.2	-81.2	-68.9	0	0	0	119.5
238	Y	54	Low	44	Very low	300 Å²	300	141.7 Å²	141.7	100%	1.176	83%	0.83	S	S	*	*				-155.2	0	105.2	-137.1	-91.2	0	0	0	110.6

Retrieved 238 of 238 residues in 39 ms (Link to these results)

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