A0A077Z1R6_TRITR Loading...

MARVEL domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z1R6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 171 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	42.5	Very low	61.2	Low	238 Å²	238	100.5 Å²	100.5	100%	1.172	52%	0.523	S	S	*	.				0	121.4	0	-77.1	163.1	167.9	0	0	107.2
2	K	49.6	Very low	62.1	Low	151 Å²	151	100.3 Å²	100.3	66%	0.657	52%	0.517	S	S	*	.			trans	-71.9	130.2	-169.4	-72.7	169.2	175.5	170.3	0	109.1	G4 E5 S6	K2-G4 PolarHBondContact O-N 3.45Å; K2-E5 HydrophobicContact CB-CG 4.19Å; K2-E5 PolarHBondContact O-N 3.21Å; K2-S6 PolarHBondContact O-N 3.22Å
3	V	56.8	Low	62.7	Low	127 Å²	127	100.2 Å²	100.2	77%	0.77	51%	0.511	S	S	*	.	H	α-helix	trans	-50.9	-32.6	176.8	176.7	0	0	0	0	111.8	F7	V3-F7 PolarHBondContact O-N 3.18Å; V3-F7 VanDerWaalsContact O-N 3.07Å
4	G	57.7	Low	63.1	Low	53 Å²	53	95.2 Å²	95.2	55%	0.546	49%	0.487	S	S	.	.	H	α-helix	trans	-69.7	-29.2	176.1	0	0	0	0	0	115.8	K2 F7 R8	K2-G4 PolarHBondContact O-N 3.45Å; G4-F7 PolarHBondContact O-N 3.29Å; G4-R8 PolarHBondContact O-N 3.5Å
5	E	60.9	Low	63.6	Low	96 Å²	96	90.5 Å²	90.5	45%	0.449	47%	0.469	S	S	.	.	H	α-helix	trans	-71.9	-45.9	176.4	-73	169.3	159.7	0	0	110.3	K2 F7 R8 D9	K2-E5 HydrophobicContact CB-CG 4.19Å; K2-E5 PolarHBondContact O-N 3.21Å; E5-F7 PolarHBondContact O-N 2.79Å; E5-R8 PolarHBondContact O-N 3.25Å; E5-R8 VanDerWaalsContact O-N 3.12Å; E5-D9 PolarHBondContact O-N 3.05Å
6	S	64.2	Low	64.4	Low	55 Å²	55	87.8 Å²	87.8	39%	0.385	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-35.1	173.3	-177.2	0	0	0	0	111.8	K2 I10	K2-S6 PolarHBondContact O-N 3.22Å; S6-I10 WeakPolarHBondContact O-CB 3.29Å; S6-I10 WeakPolarHBondContact O-CD1 3.25Å; S6-I10 WeakPolarHBondContact O-CG1 3.35Å; S6-I10 PolarHBondContact O-N 3.14Å
7	F	62.4	Low	64.8	Low	83 Å²	83	83.8 Å²	83.8	36%	0.364	44%	0.442	S	S	.	.	H	α-helix	trans	-63.7	-44.6	175	-174.6	-98.4	0	0	0	111.6	V3 G4 E5 I10 S11 T68	V3-F7 PolarHBondContact O-N 3.18Å; V3-F7 VanDerWaalsContact O-N 3.07Å; G4-F7 PolarHBondContact O-N 3.29Å; E5-F7 PolarHBondContact O-N 2.79Å; F7-I10 PolarHBondContact O-N 3.07Å; F7-S11 WeakPolarHBondContact O-CB 3.36Å; F7-S11 PolarHBondContact O-N 3.45Å; F7-S11 PolarHBondContact O-OG 3.19Å; F7-T68 HydrophobicContact CZ-CG2 4.38Å
8	R	67.7	Low	64.9	Low	155 Å²	155	80.3 Å²	80.3	59%	0.585	43%	0.426	S	S	*	.	H	α-helix	trans	-64.3	-45.6	178.6	-155.2	173	70.1	-156.8	0.5	111.2	G4 E5 I10 S11 E12	G4-R8 PolarHBondContact O-N 3.5Å; E5-R8 PolarHBondContact O-N 3.25Å; E5-R8 VanDerWaalsContact O-N 3.12Å; R8-I10 VanDerWaalsContact C-N 3.32Å; R8-I10 PolarHBondContact O-N 3.3Å; R8-S11 WeakPolarHBondContact CA-OG 3.5Å; R8-S11 PolarHBondContact O-N 3Å; R8-S11 VanDerWaalsContact O-N 3.17Å; R8-S11 PolarHBondContact O-OG 3.38Å; R8-E12 WeakPolarHBondContact O-CG 3.37Å; R8-E12 PolarHBondContact O-N 3.11Å
9	D	75.2	Confident	65.4	Low	99 Å²	99	83.7 Å²	83.7	53%	0.529	43%	0.432	S	S	.	.	H	α-helix	trans	-59.2	-41.8	176.7	-64.6	-27.7	0	0	0	112.3	E5 E12 F13	E5-D9 PolarHBondContact O-N 3.05Å; D9-E12 PolarHBondContact O-N 3.02Å; D9-F13 WeakPolarHBondContact O-CB 3.47Å; D9-F13 PolarHBondContact O-N 3.42Å
10	I	66.5	Low	66	Low	26 Å²	26	85.5 Å²	85.5	13%	0.133	44%	0.438	C	S	.	.	H	α-helix	trans	-68.4	-42.3	177.1	-66.9	161.6	0	0	0	110.7	S6 F7 R8 E12 F13 V14 F141 N144	S6-I10 WeakPolarHBondContact O-CB 3.29Å; S6-I10 WeakPolarHBondContact O-CD1 3.25Å; S6-I10 WeakPolarHBondContact O-CG1 3.35Å; S6-I10 PolarHBondContact O-N 3.14Å; F7-I10 PolarHBondContact O-N 3.07Å; R8-I10 VanDerWaalsContact C-N 3.32Å; R8-I10 PolarHBondContact O-N 3.3Å; I10-E12 VanDerWaalsContact C-N 3.32Å; I10-E12 PolarHBondContact O-N 2.84Å; I10-F13 PolarHBondContact O-N 3.35Å; I10-V14 WeakPolarHBondContact O-CG2 3.46Å; I10-V14 PolarHBondContact O-N 3.48Å; I10-F141 HydrophobicContact CG2-CD1 3.93Å; I10-F141 HydrophobicContact CG2-CE1 3.09Å; I10-F141 HydrophobicContact CG2-CE2 4.12Å; I10-F141 HydrophobicContact CG2-CZ 3.17Å; I10-N144 WeakPolarHBondContact CD1-ND2 3.1Å
11	S	69.5	Low	66.4	Low	23 Å²	23	81.5 Å²	81.5	16%	0.161	42%	0.418	C	S	.	.	H	α-helix	trans	-65.5	-35.9	176.8	72.2	0	0	0	0	112	F7 R8 V14 A15	F7-S11 WeakPolarHBondContact O-CB 3.36Å; F7-S11 PolarHBondContact O-N 3.45Å; F7-S11 PolarHBondContact O-OG 3.19Å; R8-S11 WeakPolarHBondContact CA-OG 3.5Å; R8-S11 PolarHBondContact O-N 3Å; R8-S11 VanDerWaalsContact O-N 3.17Å; R8-S11 PolarHBondContact O-OG 3.38Å; S11-V14 PolarHBondContact O-N 3.33Å; S11-A15 VanDerWaalsContact O-CB 3.29Å; S11-A15 WeakPolarHBondContact O-CB 3.32Å; S11-A15 PolarHBondContact O-N 2.87Å
12	E	72.5	Confident	68.1	Low	98 Å²	98	73 Å²	73	46%	0.458	38%	0.375	S	S	.	.	H	α-helix	trans	-70.2	-37.3	172.8	-73.2	-162.2	168.5	0	0	111.5	R8 D9 I10 A15 T16	R8-E12 WeakPolarHBondContact O-CG 3.37Å; R8-E12 PolarHBondContact O-N 3.11Å; D9-E12 PolarHBondContact O-N 3.02Å; I10-E12 VanDerWaalsContact C-N 3.32Å; I10-E12 PolarHBondContact O-N 2.84Å; E12-A15 PolarHBondContact O-N 3.44Å; E12-T16 VanDerWaalsContact O-CB 3.22Å; E12-T16 WeakPolarHBondContact O-CB 3.23Å; E12-T16 PolarHBondContact O-N 3.45Å; E12-T16 PolarHBondContact O-OG1 2.89Å
13	F	70.4	Confident	69.7	Low	99 Å²	99	68 Å²	68	43%	0.434	36%	0.363	S	S	.	.	H	α-helix	trans	-64.8	-41.5	172.8	-174.3	-99.7	0	0	0	111.4	D9 I10 T16 G17 C137 Y140	D9-F13 WeakPolarHBondContact O-CB 3.47Å; D9-F13 PolarHBondContact O-N 3.42Å; I10-F13 PolarHBondContact O-N 3.35Å; F13-T16 PolarHBondContact O-N 3.35Å; F13-G17 WeakPolarHBondContact O-CA 3.46Å; F13-G17 PolarHBondContact O-N 3.03Å; F13-C137 HydrophobicContact CE1-CB 4.46Å; F13-C137 VanDerWaalsContact CE1-SG 3.53Å; F13-Y140 HydrophobicContact CE1-CD2 4.3Å
14	V	68.1	Low	70.9	Confident	30 Å²	30	63.4 Å²	63.4	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-64.2	-46.6	171.9	169.6	0	0	0	0	110.7	I10 S11 T16 G17 C18 E82 F141	I10-V14 WeakPolarHBondContact O-CG2 3.46Å; I10-V14 PolarHBondContact O-N 3.48Å; S11-V14 PolarHBondContact O-N 3.33Å; V14-T16 VanDerWaalsContact C-N 3.28Å; V14-T16 PolarHBondContact O-N 3.34Å; V14-G17 CarbonylContact O-C 3.6Å; V14-G17 PolarHBondContact O-N 2.68Å; V14-C18 WeakPolarHBondContact O-CA 3.41Å; V14-C18 WeakPolarHBondContact O-CB 3.5Å; V14-C18 PolarHBondContact O-N 3.07Å; V14-E82 WeakPolarHBondContact CG1-OE1 3.35Å; V14-E82 HydrophobicContact CG2-CG 4.44Å; V14-F141 HydrophobicContact CG2-CE2 3.47Å; V14-F141 VanDerWaalsContact CG2-CE2 3.47Å; V14-F141 HydrophobicContact CG2-CZ 3.4Å; V14-F141 VanDerWaalsContact CG2-CZ 3.4Å
15	A	69.7	Low	72	Confident	25 Å²	25	61 Å²	61	21%	0.207	31%	0.309	C	S	.	.	H	α-helix	trans	-61.3	-39.7	178.1	0	0	0	0	0	111.3	S11 E12 C18 R19	S11-A15 VanDerWaalsContact O-CB 3.29Å; S11-A15 WeakPolarHBondContact O-CB 3.32Å; S11-A15 PolarHBondContact O-N 2.87Å; E12-A15 PolarHBondContact O-N 3.44Å; A15-C18 PolarHBondContact O-N 2.95Å; A15-R19 WeakPolarHBondContact O-CG 3.33Å; A15-R19 PolarHBondContact O-N 3.44Å
16	T	76.4	Confident	73.1	Confident	46 Å²	46	60.5 Å²	60.5	28%	0.282	31%	0.308	S	S	.	.	H	α-helix	trans	-69	-47.5	176.5	-55.2	0	0	0	0	111.3	E12 F13 V14 C18 R19 H20	E12-T16 VanDerWaalsContact O-CB 3.22Å; E12-T16 WeakPolarHBondContact O-CB 3.23Å; E12-T16 PolarHBondContact O-N 3.45Å; E12-T16 PolarHBondContact O-OG1 2.89Å; F13-T16 PolarHBondContact O-N 3.35Å; V14-T16 VanDerWaalsContact C-N 3.28Å; V14-T16 PolarHBondContact O-N 3.34Å; T16-C18 VanDerWaalsContact C-N 3.25Å; T16-C18 PolarHBondContact O-N 2.91Å; T16-R19 PolarHBondContact O-N 3.06Å; T16-R19 PolarHBondContact OG1-NH2 3.03Å; T16-H20 PolarHBondContact O-CD2 3.4Å; T16-H20 PolarHBondContact O-N 2.91Å
17	G	71.3	Confident	74.1	Confident	20 Å²	20	60.8 Å²	60.8	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-34.9	174.2	0	0	0	0	0	112.3	F13 V14 H20 A21	F13-G17 WeakPolarHBondContact O-CA 3.46Å; F13-G17 PolarHBondContact O-N 3.03Å; V14-G17 CarbonylContact O-C 3.6Å; V14-G17 PolarHBondContact O-N 2.68Å; G17-H20 PolarHBondContact O-N 3.16Å; G17-A21 VanDerWaalsContact O-CB 3.25Å; G17-A21 WeakPolarHBondContact O-CB 3.05Å; G17-A21 PolarHBondContact O-N 3.37Å
18	C	66.9	Low	75.1	Confident	21 Å²	21	56.9 Å²	56.9	14%	0.142	29%	0.288	C	S	.	.	H	α-helix	trans	-67.8	-47.3	175.7	-170.7	0	0	0	0	110.6	V14 A15 T16 H20 A21 E22 T56	V14-C18 WeakPolarHBondContact O-CA 3.41Å; V14-C18 WeakPolarHBondContact O-CB 3.5Å; V14-C18 PolarHBondContact O-N 3.07Å; A15-C18 PolarHBondContact O-N 2.95Å; T16-C18 VanDerWaalsContact C-N 3.25Å; T16-C18 PolarHBondContact O-N 2.91Å; C18-H20 VanDerWaalsContact C-N 3.26Å; C18-H20 PolarHBondContact O-N 3.07Å; C18-A21 CarbonylContact O-C 3.6Å; C18-A21 PolarHBondContact O-N 2.94Å; C18-E22 WeakPolarHBondContact O-CG 3.13Å; C18-E22 PolarHBondContact O-N 3.13Å; C18-T56 WeakPolarHBondContact SG-CB 3.33Å; C18-T56 WeakPolarHBondContact SG-CG2 3.32Å
19	R	74.2	Confident	75.9	Confident	146 Å²	146	51.1 Å²	51.1	55%	0.551	27%	0.268	S	S	*	.	H	α-helix	trans	-55.6	-41.8	171.6	-73	-172.8	-60.2	-102.6	4.7	112	A15 T16 A23	A15-R19 WeakPolarHBondContact O-CG 3.33Å; A15-R19 PolarHBondContact O-N 3.44Å; T16-R19 PolarHBondContact O-N 3.06Å; T16-R19 PolarHBondContact OG1-NH2 3.03Å; R19-A23 PolarHBondContact O-N 3.27Å
20	H	77.6	Confident	76.3	Confident	118 Å²	118	51.3 Å²	51.3	55%	0.546	27%	0.268	S	S	.	.	H	α-helix	trans	-69.1	-39.7	175.7	-65.1	-48.7	0	0	0	112.3	T16 G17 C18 A23 L24	T16-H20 PolarHBondContact O-CD2 3.4Å; T16-H20 PolarHBondContact O-N 2.91Å; G17-H20 PolarHBondContact O-N 3.16Å; C18-H20 VanDerWaalsContact C-N 3.26Å; C18-H20 PolarHBondContact O-N 3.07Å; H20-A23 WeakPolarHBondContact O-CB 3.41Å; H20-A23 PolarHBondContact O-N 3.46Å; H20-L24 WeakPolarHBondContact O-CG 3.19Å; H20-L24 PolarHBondContact O-N 3.43Å
21	A	75.1	Confident	76.9	Confident	3 Å²	3	51.1 Å²	51.1	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-66.4	-38.4	178.5	0	0	0	0	0	112.4	G17 C18 A23 L24 C25 F134	G17-A21 VanDerWaalsContact O-CB 3.25Å; G17-A21 WeakPolarHBondContact O-CB 3.05Å; G17-A21 PolarHBondContact O-N 3.37Å; C18-A21 CarbonylContact O-C 3.6Å; C18-A21 PolarHBondContact O-N 2.94Å; A21-A23 VanDerWaalsContact C-N 3.33Å; A21-A23 PolarHBondContact O-N 2.9Å; A21-L24 CarbonylContact O-C 3.57Å; A21-L24 PolarHBondContact O-N 3.27Å; A21-C25 PolarHBondContact O-N 3.04Å; A21-C25 PolarHBondContact O-SG 3.41Å; A21-F134 HydrophobicContact CB-CE1 3.9Å; A21-F134 HydrophobicContact CB-CE2 3.65Å; A21-F134 HydrophobicContact CB-CZ 3.18Å
22	E	78.1	Confident	77.3	Confident	58 Å²	58	51 Å²	51	27%	0.271	27%	0.266	S	S	.	.	H	α-helix	trans	-59.2	-46	173.2	-74.1	179.7	169	0	0	111	C18 L24 C25 I26 T56	C18-E22 WeakPolarHBondContact O-CG 3.13Å; C18-E22 PolarHBondContact O-N 3.13Å; E22-L24 VanDerWaalsContact C-N 3.31Å; E22-L24 PolarHBondContact O-N 3.33Å; E22-C25 WeakPolarHBondContact O-CB 3.25Å; E22-C25 PolarHBondContact O-N 2.95Å; E22-I26 VanDerWaalsContact O-CG1 3.28Å; E22-I26 WeakPolarHBondContact O-CG1 3.31Å; E22-I26 PolarHBondContact O-N 2.81Å; E22-T56 PolarHBondContact OE1-OG1 2.78Å
23	A	82.6	Confident	77.5	Confident	48 Å²	48	48.4 Å²	48.4	40%	0.397	27%	0.266	S	S	.	.	H	α-helix	trans	-59.5	-43	174.9	0	0	0	0	0	111.5	R19 H20 A21 I26 I27	R19-A23 PolarHBondContact O-N 3.27Å; H20-A23 WeakPolarHBondContact O-CB 3.41Å; H20-A23 PolarHBondContact O-N 3.46Å; A21-A23 VanDerWaalsContact C-N 3.33Å; A21-A23 PolarHBondContact O-N 2.9Å; A23-I26 PolarHBondContact O-N 3.11Å; A23-I27 WeakPolarHBondContact O-CB 3.45Å; A23-I27 WeakPolarHBondContact O-CD1 3.24Å; A23-I27 WeakPolarHBondContact O-CG1 3.41Å; A23-I27 PolarHBondContact O-N 3.07Å
24	L	82.5	Confident	77.7	Confident	29 Å²	29	48.3 Å²	48.3	15%	0.152	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-41	175.6	-65.7	175.5	0	0	0	112.1	H20 A21 E22 I27 V28 F126 A130	H20-L24 WeakPolarHBondContact O-CG 3.19Å; H20-L24 PolarHBondContact O-N 3.43Å; A21-L24 CarbonylContact O-C 3.57Å; A21-L24 PolarHBondContact O-N 3.27Å; E22-L24 VanDerWaalsContact C-N 3.31Å; E22-L24 PolarHBondContact O-N 3.33Å; L24-I27 PolarHBondContact O-N 2.97Å; L24-V28 WeakPolarHBondContact O-CB 3.41Å; L24-V28 VanDerWaalsContact O-CG2 3.24Å; L24-V28 WeakPolarHBondContact O-CG2 3.38Å; L24-V28 PolarHBondContact O-N 2.95Å; L24-F126 HydrophobicContact CD2-CD1 3.9Å; L24-A130 HydrophobicContact CB-CB 4.34Å; L24-A130 HydrophobicContact CD1-CB 3.89Å
25	C	80.4	Confident	77.7	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.027	27%	0.267	C	S	.	.	H	α-helix	trans	-61.5	-45.6	175.9	-66.4	0	0	0	0	111.3	A21 E22 V28 L29 T49 S52 F93	A21-C25 PolarHBondContact O-N 3.04Å; A21-C25 PolarHBondContact O-SG 3.41Å; E22-C25 WeakPolarHBondContact O-CB 3.25Å; E22-C25 PolarHBondContact O-N 2.95Å; C25-V28 PolarHBondContact O-N 3.15Å; C25-L29 WeakPolarHBondContact O-CG 3.4Å; C25-L29 PolarHBondContact O-N 2.74Å; C25-T49 HydrophobicContact CB-CG2 3.65Å; C25-T49 WeakPolarHBondContact O-CG2 3.11Å; C25-S52 PolarHBondContact SG-OG 3.34Å; C25-F93 VanDerWaalsContact SG-CZ 3.57Å
26	I	83.9	Confident	77.4	Confident	85 Å²	85	53.3 Å²	53.3	44%	0.436	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-43.6	177.9	-66.9	165	0	0	0	110.3	E22 A23 V28 L29 I30	E22-I26 VanDerWaalsContact O-CG1 3.28Å; E22-I26 WeakPolarHBondContact O-CG1 3.31Å; E22-I26 PolarHBondContact O-N 2.81Å; A23-I26 PolarHBondContact O-N 3.11Å; I26-V28 VanDerWaalsContact C-N 3.33Å; I26-V28 PolarHBondContact O-N 2.92Å; I26-L29 PolarHBondContact O-N 2.89Å; I26-I30 HydrophobicContact CG2-CD1 3.75Å; I26-I30 HydrophobicContact CG2-CG1 4.36Å; I26-I30 VanDerWaalsContact O-CG1 3.24Å; I26-I30 WeakPolarHBondContact O-CG1 3.43Å; I26-I30 PolarHBondContact O-N 3.06Å
27	I	85.5	Confident	76.6	Confident	60 Å²	60	54.3 Å²	54.3	31%	0.308	30%	0.302	S	S	.	.	H	α-helix	trans	-59.4	-45.7	175.4	-68.7	162	0	0	0	110.3	A23 L24 I30 C31 F126	A23-I27 WeakPolarHBondContact O-CB 3.45Å; A23-I27 WeakPolarHBondContact O-CD1 3.24Å; A23-I27 WeakPolarHBondContact O-CG1 3.41Å; A23-I27 PolarHBondContact O-N 3.07Å; L24-I27 PolarHBondContact O-N 2.97Å; I27-I30 PolarHBondContact O-N 2.96Å; I27-C31 WeakPolarHBondContact O-CB 3.41Å; I27-C31 PolarHBondContact O-N 3.17Å; I27-C31 PolarHBondContact O-SG 2.92Å; I27-F126 HydrophobicContact CG2-CD2 3.76Å; I27-F126 HydrophobicContact CG2-CE2 3.98Å; I27-F126 HydrophobicContact CG2-CG 4.09Å; I27-F126 HydrophobicContact CG2-CZ 4.44Å
28	V	83	Confident	76.1	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.006	33%	0.333	C	S	.	.	H	α-helix	trans	-62.9	-42.7	177.3	171.2	0	0	0	0	111.3	L24 C25 I26 I30 C31 L32 I45 F126	L24-V28 WeakPolarHBondContact O-CB 3.41Å; L24-V28 VanDerWaalsContact O-CG2 3.24Å; L24-V28 WeakPolarHBondContact O-CG2 3.38Å; L24-V28 PolarHBondContact O-N 2.95Å; C25-V28 PolarHBondContact O-N 3.15Å; I26-V28 VanDerWaalsContact C-N 3.33Å; I26-V28 PolarHBondContact O-N 2.92Å; V28-I30 PolarHBondContact O-N 2.87Å; V28-C31 PolarHBondContact O-N 3.26Å; V28-L32 HydrophobicContact CG1-CD1 3.81Å; V28-L32 HydrophobicContact CG1-CG 4.36Å; V28-L32 WeakPolarHBondContact O-CB 3.32Å; V28-L32 VanDerWaalsContact O-CG 3.24Å; V28-L32 WeakPolarHBondContact O-CG 3.34Å; V28-L32 PolarHBondContact O-N 3.42Å; V28-I45 HydrophobicContact CG1-CG2 4.24Å; V28-F126 HydrophobicContact CG2-CB 4.19Å
29	L	83.7	Confident	76	Confident	35 Å²	35	61.7 Å²	61.7	18%	0.183	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-41.9	174.5	-75.2	173.5	0	0	0	112.1	C25 I26 L32 G33 W46 T49	C25-L29 WeakPolarHBondContact O-CG 3.4Å; C25-L29 PolarHBondContact O-N 2.74Å; I26-L29 PolarHBondContact O-N 2.89Å; L29-L32 PolarHBondContact O-N 3.49Å; L29-G33 PolarHBondContact O-N 2.89Å; L29-W46 HydrophobicContact CD2-CD2 4.22Å; L29-W46 HydrophobicContact CD2-CE3 3.6Å; L29-W46 HydrophobicContact CD2-CH2 4.09Å; L29-W46 HydrophobicContact CD2-CZ3 3.54Å; L29-T49 HydrophobicContact CD1-CG2 4.09Å; L29-T49 HydrophobicContact CD2-CG2 3.95Å; L29-T49 HydrophobicContact CG-CG2 3.61Å
30	I	84.8	Confident	75.8	Confident	103 Å²	103	58.7 Å²	58.7	53%	0.528	35%	0.345	S	S	.	.	H	α-helix	trans	-64	-46.3	175.9	-67.7	164.9	0	0	0	109.7	I26 I27 V28 L32 G33 V34	I26-I30 HydrophobicContact CG2-CD1 3.75Å; I26-I30 HydrophobicContact CG2-CG1 4.36Å; I26-I30 VanDerWaalsContact O-CG1 3.24Å; I26-I30 WeakPolarHBondContact O-CG1 3.43Å; I26-I30 PolarHBondContact O-N 3.06Å; I27-I30 PolarHBondContact O-N 2.96Å; V28-I30 PolarHBondContact O-N 2.87Å; I30-L32 VanDerWaalsContact C-N 3.3Å; I30-L32 PolarHBondContact O-N 3.04Å; I30-G33 PolarHBondContact O-N 3.25Å; I30-V34 VanDerWaalsContact O-CG2 3.28Å; I30-V34 WeakPolarHBondContact O-CG2 3.34Å; I30-V34 PolarHBondContact O-N 3.5Å
31	C	79.5	Confident	75.6	Confident	22 Å²	22	54.5 Å²	54.5	15%	0.149	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-40.3	177.1	-68.1	0	0	0	0	112	I27 V28 V35 A123	I27-C31 WeakPolarHBondContact O-CB 3.41Å; I27-C31 PolarHBondContact O-N 3.17Å; I27-C31 PolarHBondContact O-SG 2.92Å; V28-C31 PolarHBondContact O-N 3.26Å; C31-V35 WeakPolarHBondContact O-CG2 3.44Å; C31-V35 PolarHBondContact O-N 3.27Å; C31-A123 HydrophobicContact CB-CB 3.85Å
32	L	76.5	Confident	75.7	Confident	19 Å²	19	55.8 Å²	55.8	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-72.9	-38.2	177.5	-68.3	167.7	0	0	0	112.4	V28 L29 I30 V34 V35 I45	V28-L32 HydrophobicContact CG1-CD1 3.81Å; V28-L32 HydrophobicContact CG1-CG 4.36Å; V28-L32 WeakPolarHBondContact O-CB 3.32Å; V28-L32 VanDerWaalsContact O-CG 3.24Å; V28-L32 WeakPolarHBondContact O-CG 3.34Å; V28-L32 PolarHBondContact O-N 3.42Å; L29-L32 PolarHBondContact O-N 3.49Å; I30-L32 VanDerWaalsContact C-N 3.3Å; I30-L32 PolarHBondContact O-N 3.04Å; L32-V34 VanDerWaalsContact C-N 3.31Å; L32-V34 PolarHBondContact O-N 2.94Å; L32-V35 CarbonylContact O-C 3.18Å; L32-V35 WeakPolarHBondContact O-CA 3.25Å; L32-V35 PolarHBondContact O-N 3.34Å; L32-V35 VanDerWaalsContact O-N 3.07Å; L32-I45 HydrophobicContact CD1-CB 3.96Å; L32-I45 HydrophobicContact CD1-CG2 3.39Å; L32-I45 HydrophobicContact CD2-CD1 4.25Å; L32-I45 HydrophobicContact CD2-CG2 4.46Å; L32-I45 HydrophobicContact CG-CG2 4.49Å
33	G	76.8	Confident	75.9	Confident	45 Å²	45	55.5 Å²	55.5	46%	0.464	35%	0.354	S	S	.	.	H	α-helix	trans	-66.8	-32.5	177.3	0	0	0	0	0	112.8	L29 I30 V35	L29-G33 PolarHBondContact O-N 2.89Å; I30-G33 PolarHBondContact O-N 3.25Å; G33-V35 PolarHBondContact O-N 3Å
34	V	75.9	Confident	75.9	Confident	97 Å²	97	56.6 Å²	56.6	59%	0.588	35%	0.35	S	S	*	.	H	α-helix	trans	-66.2	-31.4	171.3	171.9	0	0	0	0	111.1	I30 L32 D36	I30-V34 VanDerWaalsContact O-CG2 3.28Å; I30-V34 WeakPolarHBondContact O-CG2 3.34Å; I30-V34 PolarHBondContact O-N 3.5Å; L32-V34 VanDerWaalsContact C-N 3.31Å; L32-V34 PolarHBondContact O-N 2.94Å; V34-D36 PolarHBondContact O-N 3.43Å
35	V	68.4	Low	76	Confident	8 Å²	8	55.4 Å²	55.4	5%	0.048	34%	0.343	C	S	.	.			trans	-97.2	75.5	176	-162.7	0	0	0	0	109.8	C31 L32 G33 V37 A119 Y120	C31-V35 WeakPolarHBondContact O-CG2 3.44Å; C31-V35 PolarHBondContact O-N 3.27Å; L32-V35 CarbonylContact O-C 3.18Å; L32-V35 WeakPolarHBondContact O-CA 3.25Å; L32-V35 PolarHBondContact O-N 3.34Å; L32-V35 VanDerWaalsContact O-N 3.07Å; G33-V35 PolarHBondContact O-N 3Å; V35-V37 HydrophobicContact CG1-CB 4.1Å; V35-V37 HydrophobicContact CG1-CG2 3.7Å; V35-V37 PolarHBondContact O-N 3.11Å; V35-A119 HydrophobicContact CG2-CB 3.72Å; V35-Y120 HydrophobicContact CB-CE1 4.45Å; V35-Y120 HydrophobicContact CB-CE2 4.23Å; V35-Y120 HydrophobicContact CG1-CD2 4.28Å; V35-Y120 HydrophobicContact CG1-CE1 4.28Å; V35-Y120 HydrophobicContact CG1-CE2 3.38Å; V35-Y120 WeakPolarHBondContact CG1-OH 3.29Å; V35-Y120 HydrophobicContact CG2-CD2 4.46Å; V35-Y120 HydrophobicContact CG2-CE2 4.28Å
36	D	63.3	Low	76.1	Confident	151 Å²	151	61.7 Å²	61.7	81%	0.807	37%	0.367	S	S	*	.			trans	-63.7	19.1	178.3	-140	-0.8	0	0	0	114	V34	V34-D36 PolarHBondContact O-N 3.43Å
37	V	59.5	Low	76.3	Confident	68 Å²	68	63.6 Å²	63.6	41%	0.412	37%	0.372	S	S	.	.			trans	-95	118.9	-175.1	-161.7	0	0	0	0	108.4	V35 H39	V35-V37 HydrophobicContact CG1-CB 4.1Å; V35-V37 HydrophobicContact CG1-CG2 3.7Å; V35-V37 PolarHBondContact O-N 3.11Å; V37-H39 VanDerWaalsContact CB-CE1 3.46Å; V37-H39 WeakPolarHBondContact CB-CE1 3.1Å; V37-H39 WeakPolarHBondContact CB-ND1 3.46Å; V37-H39 WeakPolarHBondContact CG1-CE1 3.04Å; V37-H39 VanDerWaalsContact CG1-ND1 3.33Å; V37-H39 WeakPolarHBondContact CG1-ND1 3.43Å; V37-H39 PolarHBondContact O-N 2.94Å
38	V	59.6	Low	76.3	Confident	142 Å²	142	60.9 Å²	60.9	86%	0.861	36%	0.358	S	S	*	.			trans	-68.9	59.7	177.5	-150.7	0	0	0	0	110.4
39	H	64.8	Low	76.4	Confident	54 Å²	54	60.8 Å²	60.8	25%	0.25	36%	0.358	C	S	.	.			trans	-77	146	174.2	-72.3	109.9	0	0	0	110.3	V37 G41 T42 Y120	V37-H39 VanDerWaalsContact CB-CE1 3.46Å; V37-H39 WeakPolarHBondContact CB-CE1 3.1Å; V37-H39 WeakPolarHBondContact CB-ND1 3.46Å; V37-H39 WeakPolarHBondContact CG1-CE1 3.04Å; V37-H39 VanDerWaalsContact CG1-ND1 3.33Å; V37-H39 WeakPolarHBondContact CG1-ND1 3.43Å; V37-H39 PolarHBondContact O-N 2.94Å; H39-G41 PolarHBondContact O-N 3.06Å; H39-T42 HydrophobicContact CB-CG2 4.1Å; H39-T42 PolarHBondContact O-N 3.31Å; H39-T42 PolarHBondContact O-OG1 3.12Å; H39-Y120 AromaticContact ND1-CZ 3.88Å; H39-Y120 PolarHBondContact ND1-OH 2.81Å
40	A	70.6	Confident	76.6	Confident	83 Å²	83	61.6 Å²	61.6	69%	0.686	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	126.4	173.2	0	0	0	0	0	110.4	N103	A40-N103 PolarHBondContact O-ND2 3.39Å
41	G	72.5	Confident	76.8	Confident	30 Å²	30	57.9 Å²	57.9	31%	0.309	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	-16.2	178.8	0	0	0	0	0	115.9	H39 G43 F44 I45	H39-G41 PolarHBondContact O-N 3.06Å; G41-G43 VanDerWaalsContact C-N 3.25Å; G41-G43 PolarHBondContact O-N 3.33Å; G41-F44 WeakPolarHBondContact O-CB 3.08Å; G41-F44 PolarHBondContact O-N 2.86Å; G41-F44 VanDerWaalsContact O-N 3.08Å; G41-I45 PolarHBondContact O-N 3.38Å
42	T	77.1	Confident	77	Confident	29 Å²	29	56.9 Å²	56.9	18%	0.178	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-36.1	176.6	56.8	0	0	0	0	112.1	H39 F44 I45 W46	H39-T42 HydrophobicContact CB-CG2 4.1Å; H39-T42 PolarHBondContact O-N 3.31Å; H39-T42 PolarHBondContact O-OG1 3.12Å; T42-F44 VanDerWaalsContact C-N 3.28Å; T42-F44 PolarHBondContact O-N 3.45Å; T42-I45 PolarHBondContact O-N 3.07Å; T42-I45 VanDerWaalsContact O-N 3.17Å; T42-W46 WeakPolarHBondContact O-CB 3.41Å; T42-W46 PolarHBondContact O-N 2.96Å
43	G	82.4	Confident	77.4	Confident	52 Å²	52	59.3 Å²	59.3	54%	0.536	35%	0.353	S	S	.	.	H	α-helix	trans	-61.2	-33.9	175.3	0	0	0	0	0	113.6	G41 F47	G41-G43 VanDerWaalsContact C-N 3.25Å; G41-G43 PolarHBondContact O-N 3.33Å; G43-F47 WeakPolarHBondContact O-CB 3.43Å; G43-F47 PolarHBondContact O-N 3.48Å
44	F	83.8	Confident	77.8	Confident	72 Å²	72	61.6 Å²	61.6	32%	0.316	35%	0.354	S	S	.	.	H	α-helix	trans	-68.7	-45	174.3	-176.3	-98.5	0	0	0	110.8	G41 T42 W46 F47 T48 F92 I95 I99	G41-F44 WeakPolarHBondContact O-CB 3.08Å; G41-F44 PolarHBondContact O-N 2.86Å; G41-F44 VanDerWaalsContact O-N 3.08Å; T42-F44 VanDerWaalsContact C-N 3.28Å; T42-F44 PolarHBondContact O-N 3.45Å; F44-W46 VanDerWaalsContact C-N 3.32Å; F44-W46 PolarHBondContact O-N 3.04Å; F44-F47 PolarHBondContact O-N 2.97Å; F44-T48 HydrophobicContact CD1-CG2 3.93Å; F44-T48 HydrophobicContact CE1-CG2 3.6Å; F44-T48 HydrophobicContact CE2-CG2 4.34Å; F44-T48 HydrophobicContact CG-CG2 4.46Å; F44-T48 HydrophobicContact CZ-CG2 3.86Å; F44-T48 WeakPolarHBondContact O-CG2 3.39Å; F44-T48 PolarHBondContact O-N 2.89Å; F44-T48 PolarHBondContact O-OG1 3.18Å; F44-F92 HydrophobicContact CE1-CD1 4.18Å; F44-F92 HydrophobicContact CE2-CD1 4.37Å; F44-F92 HydrophobicContact CE2-CE1 4.18Å; F44-F92 AromaticContact CZ-CD1 3.56Å; F44-F92 HydrophobicContact CZ-CD1 3.56Å; F44-F92 AromaticContact CZ-CE1 3.74Å; F44-F92 HydrophobicContact CZ-CE1 3.74Å; F44-I95 HydrophobicContact CD1-CG2 4.19Å; F44-I95 HydrophobicContact CE1-CB 4.03Å; F44-I95 HydrophobicContact CE1-CG2 3.5Å; F44-I95 HydrophobicContact CZ-CG2 4.09Å; F44-I99 HydrophobicContact CB-CD1 4.45Å; F44-I99 HydrophobicContact CD1-CD1 3.72Å; F44-I99 HydrophobicContact CE1-CD1 4.37Å; F44-I99 HydrophobicContact CG-CD1 4.37Å
45	I	83.6	Confident	78.2	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.015	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-44	178.9	-50.7	169.4	0	0	0	110	V28 L32 G41 T42 F47 T48 T49 I99 A100	V28-I45 HydrophobicContact CG1-CG2 4.24Å; L32-I45 HydrophobicContact CD1-CB 3.96Å; L32-I45 HydrophobicContact CD1-CG2 3.39Å; L32-I45 HydrophobicContact CD2-CD1 4.25Å; L32-I45 HydrophobicContact CD2-CG2 4.46Å; L32-I45 HydrophobicContact CG-CG2 4.49Å; G41-I45 PolarHBondContact O-N 3.38Å; T42-I45 PolarHBondContact O-N 3.07Å; T42-I45 VanDerWaalsContact O-N 3.17Å; I45-F47 PolarHBondContact O-N 3.28Å; I45-T48 WeakPolarHBondContact CA-OG1 3.15Å; I45-T48 PolarHBondContact O-N 3.18Å; I45-T48 PolarHBondContact O-OG1 3.48Å; I45-T49 PolarHBondContact O-N 3.08Å; I45-T49 PolarHBondContact O-OG1 2.99Å; I45-I99 HydrophobicContact CD1-CB 4.33Å; I45-I99 HydrophobicContact CD1-CG2 3.98Å; I45-I99 HydrophobicContact CG1-CG2 4.42Å; I45-A100 HydrophobicContact CD1-CB 4.49Å
46	W	84.1	Confident	78.6	Confident	137 Å²	137	59.2 Å²	59.2	52%	0.519	34%	0.341	S	S	.	.	H	α-helix	trans	-57.1	-50	174.8	-172.8	-94.4	0	0	0	112	L29 T42 F44 T48 T49 V50	L29-W46 HydrophobicContact CD2-CD2 4.22Å; L29-W46 HydrophobicContact CD2-CE3 3.6Å; L29-W46 HydrophobicContact CD2-CH2 4.09Å; L29-W46 HydrophobicContact CD2-CZ3 3.54Å; T42-W46 WeakPolarHBondContact O-CB 3.41Å; T42-W46 PolarHBondContact O-N 2.96Å; F44-W46 VanDerWaalsContact C-N 3.32Å; F44-W46 PolarHBondContact O-N 3.04Å; W46-T48 PolarHBondContact O-N 3.36Å; W46-T49 PolarHBondContact O-N 3.16Å; W46-V50 WeakPolarHBondContact O-CG2 3.35Å; W46-V50 PolarHBondContact O-N 3.01Å
47	F	88	Confident	79.5	Confident	125 Å²	125	56.6 Å²	56.6	55%	0.548	33%	0.326	S	S	.	.	H	α-helix	trans	-57.2	-50.1	176.4	176.6	-102.1	0	0	0	111.5	G43 F44 I45 T49 V50 S51	G43-F47 WeakPolarHBondContact O-CB 3.43Å; G43-F47 PolarHBondContact O-N 3.48Å; F44-F47 PolarHBondContact O-N 2.97Å; I45-F47 PolarHBondContact O-N 3.28Å; F47-T49 VanDerWaalsContact C-N 3.29Å; F47-T49 PolarHBondContact O-N 2.89Å; F47-V50 PolarHBondContact O-N 3.28Å; F47-S51 VanDerWaalsContact O-CB 3.26Å; F47-S51 WeakPolarHBondContact O-CB 3.5Å; F47-S51 PolarHBondContact O-N 3.27Å; F47-S51 PolarHBondContact O-OG 2.95Å
48	T	85.7	Confident	80.6	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-40.1	179.7	58.1	0	0	0	0	112.3	F44 I45 W46 S52 W89 F92 S96	F44-T48 HydrophobicContact CD1-CG2 3.93Å; F44-T48 HydrophobicContact CE1-CG2 3.6Å; F44-T48 HydrophobicContact CE2-CG2 4.34Å; F44-T48 HydrophobicContact CG-CG2 4.46Å; F44-T48 HydrophobicContact CZ-CG2 3.86Å; F44-T48 WeakPolarHBondContact O-CG2 3.39Å; F44-T48 PolarHBondContact O-N 2.89Å; F44-T48 PolarHBondContact O-OG1 3.18Å; I45-T48 WeakPolarHBondContact CA-OG1 3.15Å; I45-T48 PolarHBondContact O-N 3.18Å; I45-T48 PolarHBondContact O-OG1 3.48Å; W46-T48 PolarHBondContact O-N 3.36Å; T48-S52 VanDerWaalsContact O-CB 3.3Å; T48-S52 WeakPolarHBondContact O-CB 3.29Å; T48-S52 PolarHBondContact O-N 3.36Å; T48-S52 PolarHBondContact O-OG 3.03Å; T48-W89 VanDerWaalsContact O-CZ3 3.27Å; T48-W89 WeakPolarHBondContact O-CZ3 3.42Å; T48-F92 HydrophobicContact CG2-CB 3.91Å; T48-F92 HydrophobicContact CG2-CD1 3.59Å; T48-F92 HydrophobicContact CG2-CE1 4.41Å; T48-F92 HydrophobicContact CG2-CG 4Å; T48-S96 PolarHBondContact OG1-OG 3.5Å; T48-S96 VanDerWaalsContact OG1-OG 3.14Å
49	T	84.4	Confident	81.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-76.3	-35.7	-175.5	-40.5	0	0	0	0	112.2	C25 L29 I45 W46 F47 S52 L53	C25-T49 HydrophobicContact CB-CG2 3.65Å; C25-T49 WeakPolarHBondContact O-CG2 3.11Å; L29-T49 HydrophobicContact CD1-CG2 4.09Å; L29-T49 HydrophobicContact CD2-CG2 3.95Å; L29-T49 HydrophobicContact CG-CG2 3.61Å; I45-T49 PolarHBondContact O-N 3.08Å; I45-T49 PolarHBondContact O-OG1 2.99Å; W46-T49 PolarHBondContact O-N 3.16Å; F47-T49 VanDerWaalsContact C-N 3.29Å; F47-T49 PolarHBondContact O-N 2.89Å; T49-S52 WeakPolarHBondContact CA-OG 3.5Å; T49-S52 PolarHBondContact O-OG 2.96Å; T49-L53 WeakPolarHBondContact O-CB 3.48Å; T49-L53 PolarHBondContact O-N 3.17Å
50	V	87.8	Confident	81.8	Confident	51 Å²	51	53.3 Å²	53.3	31%	0.309	31%	0.31	S	S	.	.	H	α-helix	trans	-70.3	-44.4	173.5	173.7	0	0	0	0	110.5	W46 F47 S52 L53 I54	W46-V50 WeakPolarHBondContact O-CG2 3.35Å; W46-V50 PolarHBondContact O-N 3.01Å; F47-V50 PolarHBondContact O-N 3.28Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.29Å; V50-L53 PolarHBondContact O-N 2.79Å; V50-I54 HydrophobicContact CG1-CD1 4.06Å; V50-I54 WeakPolarHBondContact O-CG1 3.46Å; V50-I54 PolarHBondContact O-N 3.25Å
51	S	89.1	Confident	82.2	Confident	26 Å²	26	52.3 Å²	52.3	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-33.4	178.5	-61.8	0	0	0	0	112.3	F47 I54 S55	F47-S51 VanDerWaalsContact O-CB 3.26Å; F47-S51 WeakPolarHBondContact O-CB 3.5Å; F47-S51 PolarHBondContact O-N 3.27Å; F47-S51 PolarHBondContact O-OG 2.95Å; S51-I54 PolarHBondContact O-N 3.48Å; S51-S55 WeakPolarHBondContact O-CB 3.3Å; S51-S55 PolarHBondContact O-N 3.49Å; S51-S55 PolarHBondContact O-OG 2.74Å
52	S	83.3	Confident	82.2	Confident	1 Å²	1	54 Å²	54	1%	0.007	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-41.6	173.9	65.2	0	0	0	0	111	C25 T48 T49 V50 I54 S55 T56	C25-S52 PolarHBondContact SG-OG 3.34Å; T48-S52 VanDerWaalsContact O-CB 3.3Å; T48-S52 WeakPolarHBondContact O-CB 3.29Å; T48-S52 PolarHBondContact O-N 3.36Å; T48-S52 PolarHBondContact O-OG 3.03Å; T49-S52 WeakPolarHBondContact CA-OG 3.5Å; T49-S52 PolarHBondContact O-OG 2.96Å; V50-S52 VanDerWaalsContact C-N 3.32Å; V50-S52 PolarHBondContact O-N 3.29Å; S52-I54 PolarHBondContact O-N 3.33Å; S52-S55 PolarHBondContact O-N 3.36Å; S52-S55 VanDerWaalsContact O-N 3.14Å; S52-T56 WeakPolarHBondContact O-CG2 3.42Å; S52-T56 PolarHBondContact O-N 3.05Å; S52-T56 PolarHBondContact O-OG1 3.31Å
53	L	84.2	Confident	81.7	Confident	69 Å²	69	57.8 Å²	57.8	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-63.7	-40.5	177.1	-171.3	150.1	0	0	0	112.3	T49 V50 S55 T56 L57	T49-L53 WeakPolarHBondContact O-CB 3.48Å; T49-L53 PolarHBondContact O-N 3.17Å; V50-L53 PolarHBondContact O-N 2.79Å; L53-S55 VanDerWaalsContact C-N 3.3Å; L53-S55 PolarHBondContact O-N 2.86Å; L53-T56 PolarHBondContact O-OG1 2.8Å; L53-L57 WeakPolarHBondContact O-CB 3.34Å; L53-L57 PolarHBondContact O-N 3.14Å
54	I	87	Confident	81.3	Confident	94 Å²	94	59.8 Å²	59.8	48%	0.482	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-41	173.8	-65.4	165.8	0	0	0	110.1	V50 S51 S52 L57 V58	V50-I54 HydrophobicContact CG1-CD1 4.06Å; V50-I54 WeakPolarHBondContact O-CG1 3.46Å; V50-I54 PolarHBondContact O-N 3.25Å; S51-I54 PolarHBondContact O-N 3.48Å; S52-I54 PolarHBondContact O-N 3.33Å; I54-L57 PolarHBondContact O-N 3.01Å; I54-V58 HydrophobicContact CG2-CG2 4.49Å; I54-V58 VanDerWaalsContact O-CG2 3.3Å; I54-V58 WeakPolarHBondContact O-CG2 3.19Å; I54-V58 PolarHBondContact O-N 3.48Å
55	S	82.5	Confident	80.9	Confident	40 Å²	40	60.7 Å²	60.7	28%	0.28	32%	0.324	S	S	.	.	H	α-helix	trans	-68.5	-39.4	-178.6	-59.2	0	0	0	0	112.7	S51 S52 L53 L57 V58 A59 W89	S51-S55 WeakPolarHBondContact O-CB 3.3Å; S51-S55 PolarHBondContact O-N 3.49Å; S51-S55 PolarHBondContact O-OG 2.74Å; S52-S55 PolarHBondContact O-N 3.36Å; S52-S55 VanDerWaalsContact O-N 3.14Å; L53-S55 VanDerWaalsContact C-N 3.3Å; L53-S55 PolarHBondContact O-N 2.86Å; S55-L57 VanDerWaalsContact C-N 3.35Å; S55-V58 PolarHBondContact O-N 3.47Å; S55-A59 WeakPolarHBondContact O-CB 3.38Å; S55-A59 PolarHBondContact O-N 2.96Å; S55-W89 WeakPolarHBondContact OG-CZ2 3.37Å
56	T	78.5	Confident	80	Confident	14 Å²	14	65.1 Å²	65.1	9%	0.086	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-39.5	174	57.1	0	0	0	0	111.4	C18 E22 S52 L53 V58 A59 L60	C18-T56 WeakPolarHBondContact SG-CB 3.33Å; C18-T56 WeakPolarHBondContact SG-CG2 3.32Å; E22-T56 PolarHBondContact OE1-OG1 2.78Å; S52-T56 WeakPolarHBondContact O-CG2 3.42Å; S52-T56 PolarHBondContact O-N 3.05Å; S52-T56 PolarHBondContact O-OG1 3.31Å; L53-T56 PolarHBondContact O-OG1 2.8Å; T56-V58 PolarHBondContact O-N 2.81Å; T56-A59 PolarHBondContact O-N 3.26Å; T56-L60 WeakPolarHBondContact O-CB 3.43Å; T56-L60 PolarHBondContact O-N 3.45Å
57	L	81.5	Confident	78.5	Confident	96 Å²	96	63.4 Å²	63.4	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-62.5	-43	175.3	-170.2	150.4	0	0	0	111.6	L53 I54 S55 L60 C61	L53-L57 WeakPolarHBondContact O-CB 3.34Å; L53-L57 PolarHBondContact O-N 3.14Å; I54-L57 PolarHBondContact O-N 3.01Å; S55-L57 VanDerWaalsContact C-N 3.35Å; L57-L60 PolarHBondContact O-N 3.31Å; L57-C61 PolarHBondContact O-N 2.92Å; L57-C61 PolarHBondContact O-SG 3.38Å; L57-C61 VanDerWaalsContact O-SG 3.39Å
58	V	82.8	Confident	77	Confident	74 Å²	74	61.1 Å²	61.1	45%	0.448	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-44.3	174.8	171.7	0	0	0	0	111	I54 S55 T56 L60 C61 L62	I54-V58 HydrophobicContact CG2-CG2 4.49Å; I54-V58 VanDerWaalsContact O-CG2 3.3Å; I54-V58 WeakPolarHBondContact O-CG2 3.19Å; I54-V58 PolarHBondContact O-N 3.48Å; S55-V58 PolarHBondContact O-N 3.47Å; T56-V58 PolarHBondContact O-N 2.81Å; V58-L60 VanDerWaalsContact C-N 3.32Å; V58-L60 PolarHBondContact O-N 3.33Å; V58-C61 PolarHBondContact O-N 3.23Å; V58-L62 HydrophobicContact CG1-CD1 4.01Å; V58-L62 WeakPolarHBondContact O-CG 3.17Å; V58-L62 PolarHBondContact O-N 3.09Å
59	A	74.7	Confident	75.5	Confident	32 Å²	32	68.3 Å²	68.3	26%	0.264	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-41	176	0	0	0	0	0	111.9	S55 T56 L62 Y63	S55-A59 WeakPolarHBondContact O-CB 3.38Å; S55-A59 PolarHBondContact O-N 2.96Å; T56-A59 PolarHBondContact O-N 3.26Å; A59-L62 PolarHBondContact O-N 3.39Å; A59-Y63 WeakPolarHBondContact O-CB 3.3Å; A59-Y63 PolarHBondContact O-N 2.84Å
60	L	75	Confident	74.1	Confident	89 Å²	89	74.7 Å²	74.7	47%	0.466	41%	0.413	S	S	.	.	H	α-helix	trans	-65.3	-42.5	176.1	-171.6	146.2	0	0	0	111.6	T56 L57 V58 L62 Y63 V64	T56-L60 WeakPolarHBondContact O-CB 3.43Å; T56-L60 PolarHBondContact O-N 3.45Å; L57-L60 PolarHBondContact O-N 3.31Å; V58-L60 VanDerWaalsContact C-N 3.32Å; V58-L60 PolarHBondContact O-N 3.33Å; L60-L62 PolarHBondContact O-N 3.42Å; L60-Y63 WeakPolarHBondContact O-CB 3.22Å; L60-Y63 PolarHBondContact O-N 3.27Å; L60-V64 HydrophobicContact CD2-CG2 4.13Å; L60-V64 WeakPolarHBondContact O-CG2 3.49Å; L60-V64 PolarHBondContact O-N 3.3Å
61	C	78.7	Confident	72.5	Confident	63 Å²	63	73.4 Å²	73.4	43%	0.426	41%	0.41	S	S	.	.	H	α-helix	trans	-59.6	-45.4	173.3	-75.4	0	0	0	0	111.6	L57 V58 Y63 V64 V65	L57-C61 PolarHBondContact O-N 2.92Å; L57-C61 PolarHBondContact O-SG 3.38Å; L57-C61 VanDerWaalsContact O-SG 3.39Å; V58-C61 PolarHBondContact O-N 3.23Å; C61-Y63 VanDerWaalsContact C-N 3.3Å; C61-Y63 PolarHBondContact O-N 2.95Å; C61-V64 PolarHBondContact O-N 2.87Å; C61-V65 VanDerWaalsContact O-CG2 3.25Å; C61-V65 WeakPolarHBondContact O-CG2 3.27Å; C61-V65 PolarHBondContact O-N 3.3Å; C61-V65 VanDerWaalsContact O-N 3.07Å
62	L	71.7	Confident	70.7	Confident	65 Å²	65	78 Å²	78	34%	0.34	44%	0.44	S	S	.	.	H	α-helix	trans	-64.3	-35.9	177.9	-68.2	169.8	0	0	0	112	V58 A59 L60 L67 W78	V58-L62 HydrophobicContact CG1-CD1 4.01Å; V58-L62 WeakPolarHBondContact O-CG 3.17Å; V58-L62 PolarHBondContact O-N 3.09Å; A59-L62 PolarHBondContact O-N 3.39Å; L60-L62 PolarHBondContact O-N 3.42Å; L62-L67 HydrophobicContact CD2-CD1 4.12Å; L62-W78 HydrophobicContact CB-CH2 3.84Å; L62-W78 HydrophobicContact CD1-CH2 3.63Å; L62-W78 HydrophobicContact CD1-CZ3 4.15Å; L62-W78 HydrophobicContact CG-CH2 4.27Å
63	Y	68.2	Low	69	Low	108 Å²	108	85.6 Å²	85.6	42%	0.424	47%	0.473	S	S	.	.	H	α-helix	trans	-63.7	-47.6	173	-176.3	-93.8	0	0	0	112.2	A59 L60 C61 V65 H66	A59-Y63 WeakPolarHBondContact O-CB 3.3Å; A59-Y63 PolarHBondContact O-N 2.84Å; L60-Y63 WeakPolarHBondContact O-CB 3.22Å; L60-Y63 PolarHBondContact O-N 3.27Å; C61-Y63 VanDerWaalsContact C-N 3.3Å; C61-Y63 PolarHBondContact O-N 2.95Å; Y63-V65 VanDerWaalsContact C-N 3.32Å; Y63-V65 PolarHBondContact O-N 2.95Å; Y63-H66 PolarHBondContact O-N 3.49Å; Y63-H66 PolarHBondContact O-ND1 3.39Å; Y63-H66 VanDerWaalsContact O-ND1 3.09Å
64	V	73.2	Confident	67.6	Low	95 Å²	95	88.5 Å²	88.5	58%	0.576	49%	0.494	S	S	*	.	H	α-helix	trans	-61	-41.2	179.3	171.5	0	0	0	0	111.3	L60 C61 H66	L60-V64 HydrophobicContact CD2-CG2 4.13Å; L60-V64 WeakPolarHBondContact O-CG2 3.49Å; L60-V64 PolarHBondContact O-N 3.3Å; C61-V64 PolarHBondContact O-N 2.87Å; V64-H66 PolarHBondContact O-N 2.93Å; V64-H66 PolarHBondContact O-ND1 3.45Å
65	V	74.3	Confident	66	Low	91 Å²	91	92.6 Å²	92.6	55%	0.552	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-5.3	-175.8	-173.4	0	0	0	0	112.5	C61 Y63 L67	C61-V65 VanDerWaalsContact O-CG2 3.25Å; C61-V65 WeakPolarHBondContact O-CG2 3.27Å; C61-V65 PolarHBondContact O-N 3.3Å; C61-V65 VanDerWaalsContact O-N 3.07Å; Y63-V65 VanDerWaalsContact C-N 3.32Å; Y63-V65 PolarHBondContact O-N 2.95Å; V65-L67 HydrophobicContact CB-CG 4.15Å; V65-L67 HydrophobicContact CG1-CD1 4.14Å; V65-L67 HydrophobicContact CG1-CD2 3.78Å; V65-L67 HydrophobicContact CG1-CG 3.63Å; V65-L67 PolarHBondContact O-N 3.27Å
66	H	65.1	Low	64.8	Low	95 Å²	95	94.9 Å²	94.9	44%	0.44	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	33.4	176.3	-72.8	59.3	0	0	0	113.2	Y63 V64 T68 E69	Y63-H66 PolarHBondContact O-N 3.49Å; Y63-H66 PolarHBondContact O-ND1 3.39Å; Y63-H66 VanDerWaalsContact O-ND1 3.09Å; V64-H66 PolarHBondContact O-N 2.93Å; V64-H66 PolarHBondContact O-ND1 3.45Å; H66-T68 PolarHBondContact O-N 3.02Å; H66-E69 PolarHBondContact O-N 2.84Å
67	L	54	Low	64.1	Low	102 Å²	102	97.9 Å²	97.9	53%	0.534	54%	0.542	S	S	.	.	H	α-helix	trans	-62	-12.7	-179.4	-70	173.3	0	0	0	112.6	L62 V65	L62-L67 HydrophobicContact CD2-CD1 4.12Å; V65-L67 HydrophobicContact CB-CG 4.15Å; V65-L67 HydrophobicContact CG1-CD1 4.14Å; V65-L67 HydrophobicContact CG1-CD2 3.78Å; V65-L67 HydrophobicContact CG1-CG 3.63Å; V65-L67 PolarHBondContact O-N 3.27Å
68	T	55	Low	63.3	Low	76 Å²	76	98.1 Å²	98.1	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-70	-24.6	177.9	46.6	0	0	0	0	113.8	F7 H66	F7-T68 HydrophobicContact CZ-CG2 4.38Å; H66-T68 PolarHBondContact O-N 3.02Å
69	E	55.1	Low	62.4	Low	154 Å²	154	97.3 Å²	97.3	72%	0.72	53%	0.527	S	S	*	.	H	α-helix	trans	-96.9	-22.6	-172.2	-61.8	-165.7	172.7	0	0	114.7	H66	H66-E69 PolarHBondContact O-N 2.84Å
70	T	55.5	Low	62.2	Low	133 Å²	133	100 Å²	100	82%	0.816	54%	0.536	S	S	*	.	H	α-helix	trans	-129.7	0.3	-167.4	47.5	0	0	0	0	116.5
71	G	52.4	Low	62.2	Low	24 Å²	24	97.4 Å²	97.4	25%	0.247	53%	0.531	C	S	.	.	S	Bend	trans	-100.8	152.2	-177.8	0	0	0	0	0	115.4	F73	G71-F73 PolarHBondContact O-N 3.03Å
72	P	52.4	Low	62	Low	124 Å²	124	96 Å²	96	81%	0.805	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-64.3	7	170.6	27.3	-34.5	0	0	0	114.7	V74	P72-V74 PolarHBondContact O-N 3.41Å
73	F	48.1	Very low	62.2	Low	160 Å²	160	95.7 Å²	95.7	70%	0.702	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-84.4	17.5	175.4	-63.4	-68.2	0	0	0	114	G71 H75 V76	G71-F73 PolarHBondContact O-N 3.03Å; F73-H75 PolarHBondContact O-N 3.34Å; F73-V76 HydrophobicContact CD1-CG2 4.43Å; F73-V76 PolarHBondContact O-N 2.8Å
74	V	54.2	Low	62.9	Low	130 Å²	130	94.3 Å²	94.3	79%	0.788	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-48.8	-24.9	170.6	172.9	0	0	0	0	112.7	P72	P72-V74 PolarHBondContact O-N 3.41Å
75	H	52.2	Low	63.3	Low	179 Å²	179	94.1 Å²	94.1	83%	0.829	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-88.4	-12.3	-176.8	-145.1	70.5	0	0	0	115.5	F73 P77	F73-H75 PolarHBondContact O-N 3.34Å; H75-P77 VanDerWaalsContact O-CD 3.25Å; H75-P77 WeakPolarHBondContact O-CD 3.33Å
76	V	58	Low	63.6	Low	89 Å²	89	90.5 Å²	90.5	54%	0.539	49%	0.487	S	S	.	.	S	Bend	trans	-76.1	120	173.2	-178.8	0	0	0	0	106.4	F73 W78	F73-V76 HydrophobicContact CD1-CG2 4.43Å; F73-V76 PolarHBondContact O-N 2.8Å; V76-W78 PolarHBondContact O-N 3.45Å
77	P	63.6	Low	64.4	Low	76 Å²	76	87.6 Å²	87.6	49%	0.494	48%	0.478	S	S	.	.			trans	-68.4	80.8	172.5	29.6	-33.1	0	0	0	107.4	H75 F79 L80 G81	H75-P77 VanDerWaalsContact O-CD 3.25Å; H75-P77 WeakPolarHBondContact O-CD 3.33Å; P77-F79 PolarHBondContact O-N 3.23Å; P77-L80 HydrophobicContact CB-CB 4.05Å; P77-L80 HydrophobicContact CG-CB 4.06Å; P77-L80 HydrophobicContact CG-CD2 4.4Å; P77-L80 WeakPolarHBondContact O-CB 3.47Å; P77-L80 PolarHBondContact O-N 3.34Å; P77-G81 PolarHBondContact O-N 2.9Å
78	W	64.6	Low	65.9	Low	101 Å²	101	86.2 Å²	86.2	38%	0.383	47%	0.47	S	S	.	.	H	α-helix	trans	-47.7	-36.9	173.9	178.3	-90	0	0	0	110.4	L62 V76 L80 G81 E82	L62-W78 HydrophobicContact CB-CH2 3.84Å; L62-W78 HydrophobicContact CD1-CH2 3.63Å; L62-W78 HydrophobicContact CD1-CZ3 4.15Å; L62-W78 HydrophobicContact CG-CH2 4.27Å; V76-W78 PolarHBondContact O-N 3.45Å; W78-L80 VanDerWaalsContact C-N 3.34Å; W78-L80 PolarHBondContact O-N 2.9Å; W78-G81 WeakPolarHBondContact O-CA 2.99Å; W78-G81 PolarHBondContact O-N 3.49Å; W78-G81 VanDerWaalsContact O-N 3.11Å; W78-E82 PolarHBondContact NE1-OE2 2.94Å; W78-E82 PolarHBondContact O-N 2.84Å
79	F	64.6	Low	67.2	Low	57 Å²	57	84.1 Å²	84.1	25%	0.25	45%	0.453	C	S	.	.	H	α-helix	trans	-53.2	-42.5	172.3	-163.5	-85.5	0	0	0	114.9	P77 F83 F141 N144 W145	P77-F79 PolarHBondContact O-N 3.23Å; F79-F83 WeakPolarHBondContact O-CB 3.33Å; F79-F83 PolarHBondContact O-N 2.92Å; F79-F83 VanDerWaalsContact O-N 3.11Å; F79-F141 HydrophobicContact CD1-CD1 4.49Å; F79-F141 AromaticContact CD2-CD1 3.87Å; F79-F141 HydrophobicContact CD2-CD1 3.87Å; F79-F141 HydrophobicContact CD2-CE1 4.2Å; F79-F141 HydrophobicContact CE1-CB 4Å; F79-F141 HydrophobicContact CE1-CD1 4.04Å; F79-F141 WeakPolarHBondContact CE1-O 3.3Å; F79-F141 AromaticContact CE2-CD1 3.43Å; F79-F141 HydrophobicContact CE2-CD1 3.43Å; F79-F141 VanDerWaalsContact CE2-CD1 3.43Å; F79-F141 HydrophobicContact CE2-CE1 4.05Å; F79-F141 HydrophobicContact CG-CD1 4.42Å; F79-F141 HydrophobicContact CZ-CB 3.9Å; F79-F141 AromaticContact CZ-CD1 3.54Å; F79-F141 HydrophobicContact CZ-CD1 3.54Å; F79-F141 HydrophobicContact CZ-CG 4.24Å; F79-F141 WeakPolarHBondContact CZ-O 3.22Å; F79-N144 HydrophobicContact CZ-CB 4.19Å; F79-W145 HydrophobicContact CD1-CB 4.49Å; F79-W145 HydrophobicContact CE1-CB 3.65Å; F79-W145 HydrophobicContact CE1-CG 4.35Å; F79-W145 HydrophobicContact CZ-CB 4.08Å
80	L	70.8	Confident	68.6	Low	90 Å²	90	77.6 Å²	77.6	47%	0.471	43%	0.425	S	S	.	.	H	α-helix	trans	-71.9	-36.7	178.7	-174.2	65.8	0	0	0	110.5	P77 W78 F83 I84	P77-L80 HydrophobicContact CB-CB 4.05Å; P77-L80 HydrophobicContact CG-CB 4.06Å; P77-L80 HydrophobicContact CG-CD2 4.4Å; P77-L80 WeakPolarHBondContact O-CB 3.47Å; P77-L80 PolarHBondContact O-N 3.34Å; W78-L80 VanDerWaalsContact C-N 3.34Å; W78-L80 PolarHBondContact O-N 2.9Å; L80-F83 PolarHBondContact O-N 3.49Å; L80-I84 HydrophobicContact CD1-CD1 4.21Å; L80-I84 HydrophobicContact CD1-CG1 4.42Å; L80-I84 HydrophobicContact CD2-CD1 4.4Å; L80-I84 HydrophobicContact CG-CD1 3.81Å; L80-I84 HydrophobicContact CG-CG1 4.42Å; L80-I84 WeakPolarHBondContact O-CB 3.47Å; L80-I84 VanDerWaalsContact O-CG1 3.23Å; L80-I84 WeakPolarHBondContact O-CG1 3.38Å; L80-I84 PolarHBondContact O-N 3.22Å
81	G	75.4	Confident	70.2	Confident	34 Å²	34	77 Å²	77	35%	0.351	42%	0.416	S	S	.	.	H	α-helix	trans	-59.6	-49.8	174.1	0	0	0	0	0	112.1	P77 W78 F83 I84 L85	P77-G81 PolarHBondContact O-N 2.9Å; W78-G81 WeakPolarHBondContact O-CA 2.99Å; W78-G81 PolarHBondContact O-N 3.49Å; W78-G81 VanDerWaalsContact O-N 3.11Å; G81-F83 VanDerWaalsContact C-N 3.34Å; G81-F83 PolarHBondContact O-N 3.2Å; G81-I84 PolarHBondContact O-N 3.39Å; G81-L85 WeakPolarHBondContact O-CB 3.35Å; G81-L85 WeakPolarHBondContact O-CG 3.38Å; G81-L85 PolarHBondContact O-N 3.43Å
82	E	73.8	Confident	71.9	Confident	34 Å²	34	78.8 Å²	78.8	16%	0.159	42%	0.417	C	S	.	.	H	α-helix	trans	-60	-43	177.4	-151.4	83.8	-141.5	0	0	111.8	V14 W78 S86 F141	V14-E82 WeakPolarHBondContact CG1-OE1 3.35Å; V14-E82 HydrophobicContact CG2-CG 4.44Å; W78-E82 PolarHBondContact NE1-OE2 2.94Å; W78-E82 PolarHBondContact O-N 2.84Å; E82-S86 WeakPolarHBondContact O-CB 3.43Å; E82-S86 PolarHBondContact O-N 3.4Å; E82-F141 HydrophobicContact CB-CE1 4.43Å; E82-F141 HydrophobicContact CB-CZ 4.28Å; E82-F141 HydrophobicContact CG-CE1 4.28Å; E82-F141 HydrophobicContact CG-CE2 4Å; E82-F141 HydrophobicContact CG-CZ 3.68Å
83	F	76.1	Confident	73.5	Confident	58 Å²	58	73 Å²	73	25%	0.254	38%	0.379	S	S	.	.	H	α-helix	trans	-63.6	-45.8	178.2	176.5	-102.4	0	0	0	112.4	F79 L80 G81 S87 A138 F141 Y142	F79-F83 WeakPolarHBondContact O-CB 3.33Å; F79-F83 PolarHBondContact O-N 2.92Å; F79-F83 VanDerWaalsContact O-N 3.11Å; L80-F83 PolarHBondContact O-N 3.49Å; G81-F83 VanDerWaalsContact C-N 3.34Å; G81-F83 PolarHBondContact O-N 3.2Å; F83-S87 VanDerWaalsContact O-CB 3.31Å; F83-S87 WeakPolarHBondContact O-CB 3.26Å; F83-S87 PolarHBondContact O-N 3.21Å; F83-S87 PolarHBondContact O-OG 3.36Å; F83-A138 HydrophobicContact CD2-CB 4.04Å; F83-A138 WeakPolarHBondContact CD2-O 3.43Å; F83-A138 HydrophobicContact CE2-CB 3.98Å; F83-A138 WeakPolarHBondContact CE2-O 3.42Å; F83-F141 HydrophobicContact CD2-CB 4.13Å; F83-Y142 HydrophobicContact CZ-CD2 4.45Å
84	I	82.3	Confident	75.4	Confident	79 Å²	79	66.2 Å²	66.2	41%	0.405	36%	0.355	S	S	.	.	H	α-helix	trans	-65.5	-47.3	179.5	-69.2	167.8	0	0	0	109.9	L80 G81 S86 S87 I88	L80-I84 HydrophobicContact CD1-CD1 4.21Å; L80-I84 HydrophobicContact CD1-CG1 4.42Å; L80-I84 HydrophobicContact CD2-CD1 4.4Å; L80-I84 HydrophobicContact CG-CD1 3.81Å; L80-I84 HydrophobicContact CG-CG1 4.42Å; L80-I84 WeakPolarHBondContact O-CB 3.47Å; L80-I84 VanDerWaalsContact O-CG1 3.23Å; L80-I84 WeakPolarHBondContact O-CG1 3.38Å; L80-I84 PolarHBondContact O-N 3.22Å; G81-I84 PolarHBondContact O-N 3.39Å; I84-S86 PolarHBondContact O-N 2.94Å; I84-S87 PolarHBondContact O-N 3.32Å; I84-I88 HydrophobicContact CG2-CD1 3.53Å; I84-I88 HydrophobicContact CG2-CG1 4.23Å; I84-I88 WeakPolarHBondContact O-CB 3.37Å; I84-I88 VanDerWaalsContact O-CG1 3.25Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 2.74Å
85	L	81.7	Confident	77.1	Confident	91 Å²	91	63.7 Å²	63.7	48%	0.476	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-50.8	178.5	-74.5	170.6	0	0	0	111.1	G81 S87 I88 W89	G81-L85 WeakPolarHBondContact O-CB 3.35Å; G81-L85 WeakPolarHBondContact O-CG 3.38Å; G81-L85 PolarHBondContact O-N 3.43Å; L85-S87 VanDerWaalsContact C-N 3.27Å; L85-S87 PolarHBondContact O-N 2.68Å; L85-I88 PolarHBondContact O-N 2.68Å; L85-W89 PolarHBondContact O-N 2.94Å
86	S	79.9	Confident	78.8	Confident	14 Å²	14	55.1 Å²	55.1	10%	0.098	30%	0.297	C	S	.	.	H	α-helix	trans	-61.3	-36.1	179.2	-168.8	0	0	0	0	112.5	E82 I84 S90 F134	E82-S86 WeakPolarHBondContact O-CB 3.43Å; E82-S86 PolarHBondContact O-N 3.4Å; I84-S86 PolarHBondContact O-N 2.94Å; S86-S90 WeakPolarHBondContact O-CB 3.34Å; S86-S90 PolarHBondContact O-N 3.43Å; S86-F134 PolarHBondContact OG-O 3.25Å
87	S	82.4	Confident	80.2	Confident	35 Å²	35	51.2 Å²	51.2	25%	0.245	27%	0.274	C	S	.	.	H	α-helix	trans	-70.1	-44.6	178.2	-60.2	0	0	0	0	111.9	F83 I84 L85 W89 S90 L91	F83-S87 VanDerWaalsContact O-CB 3.31Å; F83-S87 WeakPolarHBondContact O-CB 3.26Å; F83-S87 PolarHBondContact O-N 3.21Å; F83-S87 PolarHBondContact O-OG 3.36Å; I84-S87 PolarHBondContact O-N 3.32Å; L85-S87 VanDerWaalsContact C-N 3.27Å; L85-S87 PolarHBondContact O-N 2.68Å; S87-W89 VanDerWaalsContact C-N 3.33Å; S87-W89 PolarHBondContact O-N 3.37Å; S87-S90 PolarHBondContact O-N 3.38Å; S87-L91 WeakPolarHBondContact O-CG 3.34Å; S87-L91 PolarHBondContact O-N 3.48Å
88	I	86.5	Confident	81.4	Confident	73 Å²	73	52.9 Å²	52.9	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-46.1	176.3	-71.6	172.3	0	0	0	109.9	I84 L85 L91 F92	I84-I88 HydrophobicContact CG2-CD1 3.53Å; I84-I88 HydrophobicContact CG2-CG1 4.23Å; I84-I88 WeakPolarHBondContact O-CB 3.37Å; I84-I88 VanDerWaalsContact O-CG1 3.25Å; I84-I88 WeakPolarHBondContact O-CG1 3.48Å; I84-I88 PolarHBondContact O-N 2.74Å; L85-I88 PolarHBondContact O-N 2.68Å; I88-L91 PolarHBondContact O-N 2.88Å; I88-F92 HydrophobicContact CG2-CD2 3.56Å; I88-F92 HydrophobicContact CG2-CE2 3.29Å; I88-F92 HydrophobicContact CG2-CZ 4.48Å; I88-F92 WeakPolarHBondContact O-CD2 3.3Å; I88-F92 PolarHBondContact O-N 2.78Å
89	W	82.2	Confident	82.5	Confident	31 Å²	31	49.9 Å²	49.9	12%	0.117	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-41.6	177.6	-73.4	118.4	0	0	0	112.7	T48 S55 L85 S87 L91 F92 F93	T48-W89 VanDerWaalsContact O-CZ3 3.27Å; T48-W89 WeakPolarHBondContact O-CZ3 3.42Å; S55-W89 WeakPolarHBondContact OG-CZ2 3.37Å; L85-W89 PolarHBondContact O-N 2.94Å; S87-W89 VanDerWaalsContact C-N 3.33Å; S87-W89 PolarHBondContact O-N 3.37Å; W89-L91 VanDerWaalsContact C-N 3.31Å; W89-L91 PolarHBondContact O-N 3.01Å; W89-F92 HydrophobicContact CE3-CB 4.34Å; W89-F92 HydrophobicContact CE3-CD2 4.24Å; W89-F92 HydrophobicContact CZ3-CD2 4.26Å; W89-F92 PolarHBondContact O-N 2.88Å; W89-F93 VanDerWaalsContact O-CD2 3.22Å; W89-F93 WeakPolarHBondContact O-CD2 3.34Å; W89-F93 PolarHBondContact O-N 3.46Å
90	S	85	Confident	83.4	Confident	18 Å²	18	47.3 Å²	47.3	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-56.8	-44.5	174	-178.5	0	0	0	0	111.6	S86 S87 F93 G94 C131	S86-S90 WeakPolarHBondContact O-CB 3.34Å; S86-S90 PolarHBondContact O-N 3.43Å; S87-S90 PolarHBondContact O-N 3.38Å; S90-F93 PolarHBondContact O-N 3.29Å; S90-G94 PolarHBondContact O-N 3.3Å; S90-C131 PolarHBondContact O-SG 2.97Å; S90-C131 PolarHBondContact OG-O 3.42Å; S90-C131 PolarHBondContact OG-SG 2.97Å
91	L	88.4	Confident	84	Confident	120 Å²	120	45 Å²	45	63%	0.628	25%	0.252	S	S	*	.	H	α-helix	trans	-63.3	-43.9	176.1	-68.5	174.8	0	0	0	112.3	S87 I88 W89 F93 G94 I95	S87-L91 WeakPolarHBondContact O-CG 3.34Å; S87-L91 PolarHBondContact O-N 3.48Å; I88-L91 PolarHBondContact O-N 2.88Å; W89-L91 VanDerWaalsContact C-N 3.31Å; W89-L91 PolarHBondContact O-N 3.01Å; L91-F93 PolarHBondContact O-N 3.39Å; L91-G94 PolarHBondContact O-N 3.18Å; L91-I95 VanDerWaalsContact O-CG1 3.3Å; L91-I95 WeakPolarHBondContact O-CG1 3.22Å; L91-I95 PolarHBondContact O-N 3.49Å
92	F	87.7	Confident	84.4	Confident	62 Å²	62	46.5 Å²	46.5	27%	0.272	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-44.2	177.2	-80.2	-61.3	0	0	0	112.3	F44 T48 I88 W89 G94 I95 S96	F44-F92 HydrophobicContact CE1-CD1 4.18Å; F44-F92 HydrophobicContact CE2-CD1 4.37Å; F44-F92 HydrophobicContact CE2-CE1 4.18Å; F44-F92 AromaticContact CZ-CD1 3.56Å; F44-F92 HydrophobicContact CZ-CD1 3.56Å; F44-F92 AromaticContact CZ-CE1 3.74Å; F44-F92 HydrophobicContact CZ-CE1 3.74Å; T48-F92 HydrophobicContact CG2-CB 3.91Å; T48-F92 HydrophobicContact CG2-CD1 3.59Å; T48-F92 HydrophobicContact CG2-CE1 4.41Å; T48-F92 HydrophobicContact CG2-CG 4Å; I88-F92 HydrophobicContact CG2-CD2 3.56Å; I88-F92 HydrophobicContact CG2-CE2 3.29Å; I88-F92 HydrophobicContact CG2-CZ 4.48Å; I88-F92 WeakPolarHBondContact O-CD2 3.3Å; I88-F92 PolarHBondContact O-N 2.78Å; W89-F92 HydrophobicContact CE3-CB 4.34Å; W89-F92 HydrophobicContact CE3-CD2 4.24Å; W89-F92 HydrophobicContact CZ3-CD2 4.26Å; W89-F92 PolarHBondContact O-N 2.88Å; F92-G94 VanDerWaalsContact C-N 3.34Å; F92-G94 PolarHBondContact O-N 3.26Å; F92-I95 PolarHBondContact O-N 3.39Å; F92-S96 WeakPolarHBondContact O-CB 3.3Å; F92-S96 PolarHBondContact O-N 3.22Å; F92-S96 PolarHBondContact O-OG 2.87Å
93	F	85.9	Confident	84.6	Confident	1 Å²	1	45.4 Å²	45.4	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-36.1	174.7	-81	-68.8	0	0	0	112.6	C25 W89 S90 L91 S96 A97 A130 C131 F134	C25-F93 VanDerWaalsContact SG-CZ 3.57Å; W89-F93 VanDerWaalsContact O-CD2 3.22Å; W89-F93 WeakPolarHBondContact O-CD2 3.34Å; W89-F93 PolarHBondContact O-N 3.46Å; S90-F93 PolarHBondContact O-N 3.29Å; L91-F93 PolarHBondContact O-N 3.39Å; F93-S96 PolarHBondContact O-N 2.87Å; F93-A97 WeakPolarHBondContact O-CB 3.41Å; F93-A97 PolarHBondContact O-N 3.06Å; F93-A130 HydrophobicContact CD1-CB 4Å; F93-A130 HydrophobicContact CD2-CB 4.47Å; F93-A130 HydrophobicContact CE1-CB 4.38Å; F93-A130 HydrophobicContact CG-CB 4.08Å; F93-C131 HydrophobicContact CB-CB 4.03Å; F93-F134 AromaticContact CD2-CD2 3.85Å; F93-F134 HydrophobicContact CD2-CD2 3.85Å; F93-F134 AromaticContact CD2-CE2 3.81Å; F93-F134 HydrophobicContact CD2-CE2 3.81Å; F93-F134 HydrophobicContact CE2-CD2 4.05Å; F93-F134 AromaticContact CE2-CE2 3.51Å; F93-F134 HydrophobicContact CE2-CE2 3.51Å; F93-F134 HydrophobicContact CE2-CZ 4.37Å; F93-F134 HydrophobicContact CZ-CE2 4.39Å
94	G	87.8	Confident	84.4	Confident	18 Å²	18	44.3 Å²	44.3	19%	0.186	25%	0.248	C	C	.	.	H	α-helix	trans	-61.1	-46.8	172.8	0	0	0	0	0	112.4	S90 L91 F92 A97 I98	S90-G94 PolarHBondContact O-N 3.3Å; L91-G94 PolarHBondContact O-N 3.18Å; F92-G94 VanDerWaalsContact C-N 3.34Å; F92-G94 PolarHBondContact O-N 3.26Å; G94-A97 WeakPolarHBondContact O-CB 3.43Å; G94-A97 PolarHBondContact O-N 2.88Å; G94-I98 VanDerWaalsContact O-CG1 3.3Å; G94-I98 WeakPolarHBondContact O-CG1 3.25Å; G94-I98 PolarHBondContact O-N 3.49Å
95	I	89.5	Confident	83.9	Confident	77 Å²	77	44.4 Å²	44.4	40%	0.395	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-45.4	176.5	-64.5	162.9	0	0	0	110.2	F44 L91 F92 A97 I98 I99	F44-I95 HydrophobicContact CD1-CG2 4.19Å; F44-I95 HydrophobicContact CE1-CB 4.03Å; F44-I95 HydrophobicContact CE1-CG2 3.5Å; F44-I95 HydrophobicContact CZ-CG2 4.09Å; L91-I95 VanDerWaalsContact O-CG1 3.3Å; L91-I95 WeakPolarHBondContact O-CG1 3.22Å; L91-I95 PolarHBondContact O-N 3.49Å; F92-I95 PolarHBondContact O-N 3.39Å; I95-A97 VanDerWaalsContact C-N 3.32Å; I95-A97 PolarHBondContact O-N 3.36Å; I95-I98 PolarHBondContact O-N 3.02Å; I95-I99 HydrophobicContact CG2-CD1 3.78Å; I95-I99 HydrophobicContact CG2-CG1 4.38Å; I95-I99 VanDerWaalsContact O-CG1 3.3Å; I95-I99 WeakPolarHBondContact O-CG1 3.49Å; I95-I99 PolarHBondContact O-N 3.3Å
96	S	88	Confident	83.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-39	176.6	-71.9	0	0	0	0	112.7	T48 F92 F93 I99 A100	T48-S96 PolarHBondContact OG1-OG 3.5Å; T48-S96 VanDerWaalsContact OG1-OG 3.14Å; F92-S96 WeakPolarHBondContact O-CB 3.3Å; F92-S96 PolarHBondContact O-N 3.22Å; F92-S96 PolarHBondContact O-OG 2.87Å; F93-S96 PolarHBondContact O-N 2.87Å; S96-I99 PolarHBondContact O-N 2.88Å; S96-A100 WeakPolarHBondContact O-CB 3.45Å; S96-A100 PolarHBondContact O-N 3.45Å
97	A	88.1	Confident	82.1	Confident	7 Å²	7	48.4 Å²	48.4	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-43.3	174	0	0	0	0	0	112	F93 G94 I95 A100 A101 C127 V128	F93-A97 WeakPolarHBondContact O-CB 3.41Å; F93-A97 PolarHBondContact O-N 3.06Å; G94-A97 WeakPolarHBondContact O-CB 3.43Å; G94-A97 PolarHBondContact O-N 2.88Å; I95-A97 VanDerWaalsContact C-N 3.32Å; I95-A97 PolarHBondContact O-N 3.36Å; A97-A100 PolarHBondContact O-N 2.96Å; A97-A101 VanDerWaalsContact O-CB 3.32Å; A97-A101 WeakPolarHBondContact O-CB 3.39Å; A97-A101 PolarHBondContact O-N 3.3Å; A97-C127 HydrophobicContact CB-CB 3.68Å; A97-V128 HydrophobicContact CB-CG2 3.73Å
98	I	88.9	Confident	80.7	Confident	111 Å²	111	51.3 Å²	51.3	57%	0.569	29%	0.285	S	S	*	.	H	α-helix	trans	-63.3	-46.4	177.3	-65.4	162.6	0	0	0	110.2	G94 I95 A100 A101 V102	G94-I98 VanDerWaalsContact O-CG1 3.3Å; G94-I98 WeakPolarHBondContact O-CG1 3.25Å; G94-I98 PolarHBondContact O-N 3.49Å; I95-I98 PolarHBondContact O-N 3.02Å; I98-A100 VanDerWaalsContact C-N 3.34Å; I98-A100 PolarHBondContact O-N 3.03Å; I98-A101 PolarHBondContact O-N 3.18Å; I98-V102 HydrophobicContact CG2-CG2 4.35Å; I98-V102 VanDerWaalsContact O-CG2 3.29Å; I98-V102 WeakPolarHBondContact O-CG2 3.49Å; I98-V102 PolarHBondContact O-N 3.21Å
99	I	87.1	Confident	79	Confident	38 Å²	38	57.5 Å²	57.5	20%	0.195	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-45.3	177.7	-65	165.5	0	0	0	110.4	F44 I45 I95 S96 V102 N103	F44-I99 HydrophobicContact CB-CD1 4.45Å; F44-I99 HydrophobicContact CD1-CD1 3.72Å; F44-I99 HydrophobicContact CE1-CD1 4.37Å; F44-I99 HydrophobicContact CG-CD1 4.37Å; I45-I99 HydrophobicContact CD1-CB 4.33Å; I45-I99 HydrophobicContact CD1-CG2 3.98Å; I45-I99 HydrophobicContact CG1-CG2 4.42Å; I95-I99 HydrophobicContact CG2-CD1 3.78Å; I95-I99 HydrophobicContact CG2-CG1 4.38Å; I95-I99 VanDerWaalsContact O-CG1 3.3Å; I95-I99 WeakPolarHBondContact O-CG1 3.49Å; I95-I99 PolarHBondContact O-N 3.3Å; S96-I99 PolarHBondContact O-N 2.88Å; I99-V102 PolarHBondContact O-N 3.44Å; I99-N103 WeakPolarHBondContact O-CB 3.36Å; I99-N103 PolarHBondContact O-N 3.41Å; I99-N103 PolarHBondContact O-ND2 3.4Å
100	A	83.2	Confident	77.3	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	33%	0.331	C	S	.	.	H	α-helix	trans	-63.4	-41.4	177.3	0	0	0	0	0	112.2	I45 S96 A97 I98 N103 S104	I45-A100 HydrophobicContact CD1-CB 4.49Å; S96-A100 WeakPolarHBondContact O-CB 3.45Å; S96-A100 PolarHBondContact O-N 3.45Å; A97-A100 PolarHBondContact O-N 2.96Å; I98-A100 VanDerWaalsContact C-N 3.34Å; I98-A100 PolarHBondContact O-N 3.03Å; A100-N103 PolarHBondContact O-N 2.88Å; A100-S104 PolarHBondContact O-N 3.38Å
101	A	84.4	Confident	75.5	Confident	43 Å²	43	74.5 Å²	74.5	36%	0.355	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-46	176.6	0	0	0	0	0	111.6	A97 I98 N103 S104 S105	A97-A101 VanDerWaalsContact O-CB 3.32Å; A97-A101 WeakPolarHBondContact O-CB 3.39Å; A97-A101 PolarHBondContact O-N 3.3Å; I98-A101 PolarHBondContact O-N 3.18Å; A101-N103 VanDerWaalsContact C-N 3.31Å; A101-N103 PolarHBondContact O-N 3.23Å; A101-S104 PolarHBondContact O-N 3.44Å; A101-S104 PolarHBondContact O-OG 2.85Å; A101-S105 PolarHBondContact O-N 3.01Å; A101-S105 VanDerWaalsContact O-N 3.13Å
102	V	84.7	Confident	73.5	Confident	65 Å²	65	74.9 Å²	74.9	39%	0.394	37%	0.37	S	S	.	.	H	α-helix	trans	-60.8	-42.4	175.4	173.4	0	0	0	0	110.6	I98 I99 S104 S105 R106	I98-V102 HydrophobicContact CG2-CG2 4.35Å; I98-V102 VanDerWaalsContact O-CG2 3.29Å; I98-V102 WeakPolarHBondContact O-CG2 3.49Å; I98-V102 PolarHBondContact O-N 3.21Å; I99-V102 PolarHBondContact O-N 3.44Å; V102-S104 PolarHBondContact O-N 2.93Å; V102-S105 PolarHBondContact O-N 3.41Å; V102-S105 PolarHBondContact O-OG 2.85Å; V102-R106 PolarHBondContact O-N 2.93Å; V102-R106 VanDerWaalsContact O-N 3.13Å
103	N	76.7	Confident	71.7	Confident	11 Å²	11	76.2 Å²	76.2	6%	0.059	38%	0.383	C	S	.	.	H	α-helix	trans	-66.6	-35.7	177.5	-76.9	-21.1	0	0	0	112.7	A40 I99 A100 A101 S105 R106 S107 Y120	A40-N103 PolarHBondContact O-ND2 3.39Å; I99-N103 WeakPolarHBondContact O-CB 3.36Å; I99-N103 PolarHBondContact O-N 3.41Å; I99-N103 PolarHBondContact O-ND2 3.4Å; A100-N103 PolarHBondContact O-N 2.88Å; A101-N103 VanDerWaalsContact C-N 3.31Å; A101-N103 PolarHBondContact O-N 3.23Å; N103-S105 VanDerWaalsContact C-N 3.31Å; N103-S105 PolarHBondContact O-N 3.08Å; N103-R106 PolarHBondContact O-N 3.31Å; N103-S107 WeakPolarHBondContact O-CB 3.47Å; N103-S107 PolarHBondContact O-N 3.2Å; N103-Y120 HydrophobicContact CB-CE1 4.48Å
104	S	72.1	Confident	69.9	Low	35 Å²	35	84 Å²	84	25%	0.245	42%	0.424	C	S	.	.	H	α-helix	trans	-60.9	-39.4	172.5	75.2	0	0	0	0	112.3	A100 A101 V102 S107	A100-S104 PolarHBondContact O-N 3.38Å; A101-S104 PolarHBondContact O-N 3.44Å; A101-S104 PolarHBondContact O-OG 2.85Å; V102-S104 PolarHBondContact O-N 2.93Å; S104-S107 PolarHBondContact O-N 2.87Å
105	S	71.7	Confident	68.4	Low	80 Å²	80	87.8 Å²	87.8	56%	0.559	44%	0.444	S	S	*	.	H	α-helix	trans	-70	-32.7	177.6	70.8	0	0	0	0	113.6	A101 V102 N103	A101-S105 PolarHBondContact O-N 3.01Å; A101-S105 VanDerWaalsContact O-N 3.13Å; V102-S105 PolarHBondContact O-N 3.41Å; V102-S105 PolarHBondContact O-OG 2.85Å; N103-S105 VanDerWaalsContact C-N 3.31Å; N103-S105 PolarHBondContact O-N 3.08Å
106	R	65.9	Low	66.9	Low	179 Å²	179	85.6 Å²	85.6	68%	0.675	44%	0.435	S	S	*	.	H	α-helix	trans	-75.8	-31.3	175.5	-73.2	-174.5	177.3	-178.4	-0	112.8	V102 N103 S108	V102-R106 PolarHBondContact O-N 2.93Å; V102-R106 VanDerWaalsContact O-N 3.13Å; N103-R106 PolarHBondContact O-N 3.31Å; R106-S108 PolarHBondContact O-N 3.26Å; R106-S108 VanDerWaalsContact O-N 3.15Å
107	S	57.2	Low	65.7	Low	10 Å²	10	87.6 Å²	87.6	7%	0.07	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-65.8	-15.2	-176	-167.6	0	0	0	0	113.6	N103 S104 Y109 Y110 H117	N103-S107 WeakPolarHBondContact O-CB 3.47Å; N103-S107 PolarHBondContact O-N 3.2Å; S104-S107 PolarHBondContact O-N 2.87Å; S107-Y109 PolarHBondContact O-N 3.26Å; S107-Y110 PolarHBondContact O-N 3.43Å; S107-H117 PolarHBondContact O-CE1 3.14Å; S107-H117 PolarHBondContact O-NE2 3.17Å
108	S	54.6	Low	64.7	Low	97 Å²	97	89.5 Å²	89.5	68%	0.678	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-46.3	-19.2	175	-66.1	0	0	0	0	114.8	R106	R106-S108 PolarHBondContact O-N 3.26Å; R106-S108 VanDerWaalsContact O-N 3.15Å
109	Y	50.9	Low	64.1	Low	202 Å²	202	85 Å²	85	79%	0.792	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-83.3	-28.3	179.8	-143.2	-101	0	0	0	115.4	S107	S107-Y109 PolarHBondContact O-N 3.26Å
110	Y	45.8	Very low	63.6	Low	173 Å²	173	83.3 Å²	83.3	68%	0.678	44%	0.435	S	S	*	.	S	Bend	trans	-95.1	112.4	-177	-76.1	-83.2	0	0	0	111.3	S107 N112 H117	S107-Y110 PolarHBondContact O-N 3.43Å; Y110-N112 PolarHBondContact O-N 2.85Å; Y110-H117 PolarHBondContact O-NE2 3.43Å
111	R	47.4	Very low	63.5	Low	233 Å²	233	84.5 Å²	84.5	88%	0.879	45%	0.448	S	S	*	.	S	Bend	trans	-60.7	8.8	-173.8	-83.3	173.6	69.9	-170.9	3.1	117.3	V113	R111-V113 PolarHBondContact O-N 3.29Å
112	N	45.9	Very low	63.4	Low	129 Å²	129	84.3 Å²	84.3	69%	0.69	45%	0.446	S	S	*	.			trans	-85.6	70.8	167.6	-77.1	-37.8	0	0	0	109.3	Y110 H117	Y110-N112 PolarHBondContact O-N 2.85Å; N112-H117 PolarHBondContact O-CD2 2.77Å
113	V	50.4	Low	63.3	Low	90 Å²	90	81.4 Å²	81.4	55%	0.545	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-29.5	-164.1	-179.2	0	0	0	0	113.6	R111	R111-V113 PolarHBondContact O-N 3.29Å
114	L	47.8	Very low	63.7	Low	164 Å²	164	81.9 Å²	81.9	86%	0.859	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-32.2	-166.2	-110.9	72.5	0	0	0	115.2
115	T	56.2	Low	64.4	Low	98 Å²	98	86.1 Å²	86.1	60%	0.601	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-40.6	-174	41.2	0	0	0	0	113.5	A119	T115-A119 WeakPolarHBondContact O-CB 3.39Å; T115-A119 PolarHBondContact O-N 3.09Å
116	S	58.2	Low	65.1	Low	31 Å²	31	85.3 Å²	85.3	22%	0.217	43%	0.434	C	S	.	.	H	α-helix	trans	-78.1	-36	-171.5	-53.6	0	0	0	0	114.2	Y120	S116-Y120 WeakPolarHBondContact O-CD2 3.45Å; S116-Y120 PolarHBondContact O-N 2.82Å
117	H	61.8	Low	66	Low	41 Å²	41	76.9 Å²	76.9	19%	0.19	40%	0.402	C	S	.	.	H	α-helix	trans	-72.4	-45.5	-177.4	-68.3	-110.1	0	0	0	111.9	S107 Y110 N112 A119 Y120 G121	S107-H117 PolarHBondContact O-CE1 3.14Å; S107-H117 PolarHBondContact O-NE2 3.17Å; Y110-H117 PolarHBondContact O-NE2 3.43Å; N112-H117 PolarHBondContact O-CD2 2.77Å; H117-A119 VanDerWaalsContact C-N 3.27Å; H117-A119 PolarHBondContact O-N 2.71Å; H117-Y120 PolarHBondContact O-N 3.18Å; H117-G121 PolarHBondContact O-N 3.07Å; H117-G121 VanDerWaalsContact O-N 3.14Å
118	G	68.8	Low	67.5	Low	48 Å²	48	79.7 Å²	79.7	50%	0.495	42%	0.419	S	S	.	.	H	α-helix	trans	-62.3	-35.2	176.6	0	0	0	0	0	112.3	G121 A122	G118-G121 PolarHBondContact O-N 2.76Å; G118-A122 WeakPolarHBondContact O-CB 3.32Å; G118-A122 PolarHBondContact O-N 3.3Å
119	A	74.7	Confident	69.1	Low	15 Å²	15	78.3 Å²	78.3	12%	0.124	40%	0.404	C	S	.	.	H	α-helix	trans	-64.8	-45.9	178	0	0	0	0	0	112.6	V35 T115 H117 A122 A123	V35-A119 HydrophobicContact CG2-CB 3.72Å; T115-A119 WeakPolarHBondContact O-CB 3.39Å; T115-A119 PolarHBondContact O-N 3.09Å; H117-A119 VanDerWaalsContact C-N 3.27Å; H117-A119 PolarHBondContact O-N 2.71Å; A119-A122 PolarHBondContact O-N 3.36Å; A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 3.01Å
120	Y	77.5	Confident	70.6	Confident	3 Å²	3	68.7 Å²	68.7	1%	0.012	37%	0.366	C	S	.	.	H	α-helix	trans	-65.4	-40.7	175.8	-79.9	-61.6	0	0	0	112.6	V35 H39 N103 S116 H117 A123 S124	V35-Y120 HydrophobicContact CB-CE1 4.45Å; V35-Y120 HydrophobicContact CB-CE2 4.23Å; V35-Y120 HydrophobicContact CG1-CD2 4.28Å; V35-Y120 HydrophobicContact CG1-CE1 4.28Å; V35-Y120 HydrophobicContact CG1-CE2 3.38Å; V35-Y120 WeakPolarHBondContact CG1-OH 3.29Å; V35-Y120 HydrophobicContact CG2-CD2 4.46Å; V35-Y120 HydrophobicContact CG2-CE2 4.28Å; H39-Y120 AromaticContact ND1-CZ 3.88Å; H39-Y120 PolarHBondContact ND1-OH 2.81Å; N103-Y120 HydrophobicContact CB-CE1 4.48Å; S116-Y120 WeakPolarHBondContact O-CD2 3.45Å; S116-Y120 PolarHBondContact O-N 2.82Å; H117-Y120 PolarHBondContact O-N 3.18Å; Y120-A123 PolarHBondContact O-N 3.49Å; Y120-S124 WeakPolarHBondContact O-CB 3.48Å; Y120-S124 PolarHBondContact O-N 3.35Å
121	G	80.5	Confident	72.5	Confident	28 Å²	28	61.9 Å²	61.9	29%	0.289	34%	0.343	S	S	.	.	H	α-helix	trans	-60.8	-50.3	175.3	0	0	0	0	0	111.6	H117 G118 A123 S124 F125	H117-G121 PolarHBondContact O-N 3.07Å; H117-G121 VanDerWaalsContact O-N 3.14Å; G118-G121 PolarHBondContact O-N 2.76Å; G121-A123 PolarHBondContact O-N 3.01Å; G121-S124 PolarHBondContact O-N 3.32Å; G121-S124 PolarHBondContact O-OG 2.98Å; G121-F125 PolarHBondContact O-N 3.26Å
122	A	83.2	Confident	74.3	Confident	38 Å²	38	56 Å²	56	31%	0.314	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-44.4	176.7	0	0	0	0	0	111.8	G118 A119 S124 F125 F126	G118-A122 WeakPolarHBondContact O-CB 3.32Å; G118-A122 PolarHBondContact O-N 3.3Å; A119-A122 PolarHBondContact O-N 3.36Å; A122-S124 VanDerWaalsContact C-N 3.33Å; A122-S124 PolarHBondContact O-N 2.97Å; A122-F125 WeakPolarHBondContact O-CB 3.36Å; A122-F125 PolarHBondContact O-N 2.95Å; A122-F125 VanDerWaalsContact O-N 3.15Å; A122-F126 HydrophobicContact CB-CD2 4.5Å; A122-F126 HydrophobicContact CB-CE2 4.33Å; A122-F126 WeakPolarHBondContact O-CD2 3.35Å; A122-F126 PolarHBondContact O-N 3.48Å
123	A	83	Confident	76.2	Confident	4 Å²	4	52 Å²	52	3%	0.033	31%	0.314	C	S	.	.	H	α-helix	trans	-58.2	-44.8	176.2	0	0	0	0	0	111.5	C31 A119 Y120 G121 F125 F126 C127	C31-A123 HydrophobicContact CB-CB 3.85Å; A119-A123 WeakPolarHBondContact O-CB 3.48Å; A119-A123 PolarHBondContact O-N 3.01Å; Y120-A123 PolarHBondContact O-N 3.49Å; G121-A123 PolarHBondContact O-N 3.01Å; A123-F125 VanDerWaalsContact C-N 3.32Å; A123-F125 PolarHBondContact O-N 2.69Å; A123-F126 PolarHBondContact O-N 3.33Å; A123-C127 WeakPolarHBondContact O-CB 3.43Å; A123-C127 PolarHBondContact O-N 3.28Å; A123-C127 PolarHBondContact O-SG 3.13Å
124	S	84.3	Confident	77.6	Confident	22 Å²	22	48.9 Å²	48.9	15%	0.154	29%	0.293	C	S	.	.	H	α-helix	trans	-61.7	-40.5	177	75.2	0	0	0	0	111.9	Y120 G121 A122 C127 V128	Y120-S124 WeakPolarHBondContact O-CB 3.48Å; Y120-S124 PolarHBondContact O-N 3.35Å; G121-S124 PolarHBondContact O-N 3.32Å; G121-S124 PolarHBondContact O-OG 2.98Å; A122-S124 VanDerWaalsContact C-N 3.33Å; A122-S124 PolarHBondContact O-N 2.97Å; S124-C127 PolarHBondContact O-N 3.47Å; S124-V128 WeakPolarHBondContact O-CG2 3.35Å; S124-V128 PolarHBondContact O-N 2.87Å
125	F	86.8	Confident	79.3	Confident	124 Å²	124	42.3 Å²	42.3	54%	0.544	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-47.1	176.5	-178.8	-100.9	0	0	0	112	G121 A122 A123 C127 V128 L129	G121-F125 PolarHBondContact O-N 3.26Å; A122-F125 WeakPolarHBondContact O-CB 3.36Å; A122-F125 PolarHBondContact O-N 2.95Å; A122-F125 VanDerWaalsContact O-N 3.15Å; A123-F125 VanDerWaalsContact C-N 3.32Å; A123-F125 PolarHBondContact O-N 2.69Å; F125-C127 PolarHBondContact O-N 3.22Å; F125-V128 PolarHBondContact O-N 3.44Å; F125-L129 HydrophobicContact CD1-CD1 3.9Å; F125-L129 HydrophobicContact CD1-CG 4.43Å; F125-L129 HydrophobicContact CE1-CD1 3.39Å; F125-L129 HydrophobicContact CE1-CG 4.11Å; F125-L129 HydrophobicContact CZ-CD1 3.9Å; F125-L129 HydrophobicContact CZ-CD2 4.48Å; F125-L129 HydrophobicContact CZ-CG 4.28Å; F125-L129 WeakPolarHBondContact O-CG 3.46Å; F125-L129 PolarHBondContact O-N 3.45Å
126	F	87	Confident	80.5	Confident	62 Å²	62	39.6 Å²	39.6	27%	0.272	25%	0.252	S	S	.	.	H	α-helix	trans	-65.8	-36.1	177.1	-71.7	-64.4	0	0	0	112.6	L24 I27 V28 A122 A123 L129 A130	L24-F126 HydrophobicContact CD2-CD1 3.9Å; I27-F126 HydrophobicContact CG2-CD2 3.76Å; I27-F126 HydrophobicContact CG2-CE2 3.98Å; I27-F126 HydrophobicContact CG2-CG 4.09Å; I27-F126 HydrophobicContact CG2-CZ 4.44Å; V28-F126 HydrophobicContact CG2-CB 4.19Å; A122-F126 HydrophobicContact CB-CD2 4.5Å; A122-F126 HydrophobicContact CB-CE2 4.33Å; A122-F126 WeakPolarHBondContact O-CD2 3.35Å; A122-F126 PolarHBondContact O-N 3.48Å; A123-F126 PolarHBondContact O-N 3.33Å; F126-L129 HydrophobicContact CD1-CD1 4.36Å; F126-L129 PolarHBondContact O-N 2.85Å; F126-A130 WeakPolarHBondContact O-CB 3.24Å; F126-A130 PolarHBondContact O-N 3.38Å
127	C	85.1	Confident	81.6	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-39.2	173.2	-72.4	0	0	0	0	112.2	A97 A123 S124 F125 A130 C131	A97-C127 HydrophobicContact CB-CB 3.68Å; A123-C127 WeakPolarHBondContact O-CB 3.43Å; A123-C127 PolarHBondContact O-N 3.28Å; A123-C127 PolarHBondContact O-SG 3.13Å; S124-C127 PolarHBondContact O-N 3.47Å; F125-C127 PolarHBondContact O-N 3.22Å; C127-A130 PolarHBondContact O-N 3.05Å; C127-C131 WeakPolarHBondContact O-CB 3.48Å; C127-C131 PolarHBondContact O-N 3.15Å
128	V	87.7	Confident	82.4	Confident	70 Å²	70	37.1 Å²	37.1	42%	0.424	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-43.9	174.1	172.7	0	0	0	0	110.7	A97 S124 F125 A130 C131 L132	A97-V128 HydrophobicContact CB-CG2 3.73Å; S124-V128 WeakPolarHBondContact O-CG2 3.35Å; S124-V128 PolarHBondContact O-N 2.87Å; F125-V128 PolarHBondContact O-N 3.44Å; V128-A130 VanDerWaalsContact C-N 3.32Å; V128-A130 PolarHBondContact O-N 2.86Å; V128-C131 WeakPolarHBondContact O-CB 3.38Å; V128-C131 PolarHBondContact O-N 3.27Å; V128-L132 HydrophobicContact CG1-CD1 4.12Å; V128-L132 HydrophobicContact CG1-CG 4.39Å; V128-L132 WeakPolarHBondContact O-CG 3.17Å; V128-L132 PolarHBondContact O-N 3.33Å
129	L	87.4	Confident	83	Confident	68 Å²	68	41.8 Å²	41.8	36%	0.356	24%	0.243	S	C	.	.	H	α-helix	trans	-61	-41.4	175.6	-71.8	-179.7	0	0	0	112	F125 F126 L132 A133	F125-L129 HydrophobicContact CD1-CD1 3.9Å; F125-L129 HydrophobicContact CD1-CG 4.43Å; F125-L129 HydrophobicContact CE1-CD1 3.39Å; F125-L129 HydrophobicContact CE1-CG 4.11Å; F125-L129 HydrophobicContact CZ-CD1 3.9Å; F125-L129 HydrophobicContact CZ-CD2 4.48Å; F125-L129 HydrophobicContact CZ-CG 4.28Å; F125-L129 WeakPolarHBondContact O-CG 3.46Å; F125-L129 PolarHBondContact O-N 3.45Å; F126-L129 HydrophobicContact CD1-CD1 4.36Å; F126-L129 PolarHBondContact O-N 2.85Å; L129-L132 PolarHBondContact O-N 3.24Å; L129-A133 WeakPolarHBondContact O-CB 3.24Å; L129-A133 PolarHBondContact O-N 2.91Å
130	A	83.2	Confident	83.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-46.1	174.3	0	0	0	0	0	111.2	L24 F93 F126 C127 V128 L132 A133 F134	L24-A130 HydrophobicContact CB-CB 4.34Å; L24-A130 HydrophobicContact CD1-CB 3.89Å; F93-A130 HydrophobicContact CD1-CB 4Å; F93-A130 HydrophobicContact CD2-CB 4.47Å; F93-A130 HydrophobicContact CE1-CB 4.38Å; F93-A130 HydrophobicContact CG-CB 4.08Å; F126-A130 WeakPolarHBondContact O-CB 3.24Å; F126-A130 PolarHBondContact O-N 3.38Å; C127-A130 PolarHBondContact O-N 3.05Å; V128-A130 VanDerWaalsContact C-N 3.32Å; V128-A130 PolarHBondContact O-N 2.86Å; A130-L132 VanDerWaalsContact C-N 3.32Å; A130-L132 PolarHBondContact O-N 3.48Å; A130-A133 PolarHBondContact O-N 3.36Å; A130-F134 WeakPolarHBondContact O-CD2 3.48Å; A130-F134 PolarHBondContact O-N 2.87Å
131	C	85.7	Confident	83	Confident	29 Å²	29	47 Å²	47	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-57	-45.2	176.3	178.2	0	0	0	0	111.9	S90 F93 C127 V128 G135	S90-C131 PolarHBondContact O-SG 2.97Å; S90-C131 PolarHBondContact OG-O 3.42Å; S90-C131 PolarHBondContact OG-SG 2.97Å; F93-C131 HydrophobicContact CB-CB 4.03Å; C127-C131 WeakPolarHBondContact O-CB 3.48Å; C127-C131 PolarHBondContact O-N 3.15Å; V128-C131 WeakPolarHBondContact O-CB 3.38Å; V128-C131 PolarHBondContact O-N 3.27Å; C131-G135 PolarHBondContact O-N 3.37Å
132	L	86.1	Confident	82.7	Confident	111 Å²	111	50.5 Å²	50.5	58%	0.581	27%	0.266	S	S	*	.	H	α-helix	trans	-67.4	-39.5	176.7	-71.1	175.8	0	0	0	112.3	V128 L129 A130 G135 A136	V128-L132 HydrophobicContact CG1-CD1 4.12Å; V128-L132 HydrophobicContact CG1-CG 4.39Å; V128-L132 WeakPolarHBondContact O-CG 3.17Å; V128-L132 PolarHBondContact O-N 3.33Å; L129-L132 PolarHBondContact O-N 3.24Å; A130-L132 VanDerWaalsContact C-N 3.32Å; A130-L132 PolarHBondContact O-N 3.48Å; L132-G135 PolarHBondContact O-N 3.4Å; L132-A136 WeakPolarHBondContact O-CB 3.4Å; L132-A136 PolarHBondContact O-N 2.92Å
133	A	83.9	Confident	82.5	Confident	45 Å²	45	54.5 Å²	54.5	37%	0.372	27%	0.273	S	S	.	.	H	α-helix	trans	-62.8	-50.6	177.3	0	0	0	0	0	111.1	L129 A130 A136 C137	L129-A133 WeakPolarHBondContact O-CB 3.24Å; L129-A133 PolarHBondContact O-N 2.91Å; A130-A133 PolarHBondContact O-N 3.36Å; A133-A136 PolarHBondContact O-N 2.89Å; A133-C137 PolarHBondContact O-N 3.34Å; A133-C137 PolarHBondContact O-SG 3.45Å
134	F	80.9	Confident	82	Confident	24 Å²	24	56.4 Å²	56.4	11%	0.105	28%	0.283	C	S	.	.	H	α-helix	trans	-65.8	-38	176.1	-75	-65	0	0	0	112.8	A21 S86 F93 A130 C137 A138	A21-F134 HydrophobicContact CB-CE1 3.9Å; A21-F134 HydrophobicContact CB-CE2 3.65Å; A21-F134 HydrophobicContact CB-CZ 3.18Å; S86-F134 PolarHBondContact OG-O 3.25Å; F93-F134 AromaticContact CD2-CD2 3.85Å; F93-F134 HydrophobicContact CD2-CD2 3.85Å; F93-F134 AromaticContact CD2-CE2 3.81Å; F93-F134 HydrophobicContact CD2-CE2 3.81Å; F93-F134 HydrophobicContact CE2-CD2 4.05Å; F93-F134 AromaticContact CE2-CE2 3.51Å; F93-F134 HydrophobicContact CE2-CE2 3.51Å; F93-F134 HydrophobicContact CE2-CZ 4.37Å; F93-F134 HydrophobicContact CZ-CE2 4.39Å; A130-F134 WeakPolarHBondContact O-CD2 3.48Å; A130-F134 PolarHBondContact O-N 2.87Å; F134-C137 PolarHBondContact O-N 2.94Å; F134-A138 PolarHBondContact O-N 3.27Å
135	G	82.7	Confident	81.2	Confident	25 Å²	25	61.9 Å²	61.9	26%	0.258	30%	0.3	S	S	.	.	H	α-helix	trans	-64.4	-40.4	175.2	0	0	0	0	0	112.2	C131 L132 A138 Y139	C131-G135 PolarHBondContact O-N 3.37Å; L132-G135 PolarHBondContact O-N 3.4Å; G135-A138 PolarHBondContact O-N 3.18Å; G135-Y139 WeakPolarHBondContact O-CB 3.43Å; G135-Y139 PolarHBondContact O-N 3.29Å
136	A	81.8	Confident	80.5	Confident	41 Å²	41	62.7 Å²	62.7	34%	0.339	30%	0.3	S	S	.	.	H	α-helix	trans	-64.5	-43.7	175.6	0	0	0	0	0	111.2	L132 A133 A138 Y139 Y140	L132-A136 WeakPolarHBondContact O-CB 3.4Å; L132-A136 PolarHBondContact O-N 2.92Å; A133-A136 PolarHBondContact O-N 2.89Å; A136-A138 PolarHBondContact O-N 3.04Å; A136-Y139 WeakPolarHBondContact O-CB 3.44Å; A136-Y139 PolarHBondContact O-N 3.48Å; A136-Y140 HydrophobicContact CB-CE2 4.49Å; A136-Y140 WeakPolarHBondContact O-CD2 3.24Å; A136-Y140 PolarHBondContact O-N 3.35Å
137	C	80.6	Confident	79.5	Confident	13 Å²	13	65.2 Å²	65.2	9%	0.088	31%	0.31	C	S	.	.	H	α-helix	trans	-54.4	-53.5	172.7	-65.6	0	0	0	0	110.8	F13 A133 F134 Y139 Y140 F141	F13-C137 HydrophobicContact CE1-CB 4.46Å; F13-C137 VanDerWaalsContact CE1-SG 3.53Å; A133-C137 PolarHBondContact O-N 3.34Å; A133-C137 PolarHBondContact O-SG 3.45Å; F134-C137 PolarHBondContact O-N 2.94Å; C137-Y139 VanDerWaalsContact C-N 3.26Å; C137-Y139 PolarHBondContact O-N 2.9Å; C137-Y140 PolarHBondContact O-N 2.92Å; C137-Y140 VanDerWaalsContact O-N 3.16Å; C137-F141 WeakPolarHBondContact O-CD2 3.28Å; C137-F141 PolarHBondContact O-N 3.4Å; C137-F141 VanDerWaalsContact O-N 3.08Å
138	A	79.3	Confident	78.3	Confident	7 Å²	7	68.1 Å²	68.1	6%	0.058	33%	0.331	C	S	.	.	H	α-helix	trans	-57.9	-37.8	178	0	0	0	0	0	112.5	F83 F134 G135 A136 F141 Y142	F83-A138 HydrophobicContact CD2-CB 4.04Å; F83-A138 WeakPolarHBondContact CD2-O 3.43Å; F83-A138 HydrophobicContact CE2-CB 3.98Å; F83-A138 WeakPolarHBondContact CE2-O 3.42Å; F134-A138 PolarHBondContact O-N 3.27Å; G135-A138 PolarHBondContact O-N 3.18Å; A136-A138 PolarHBondContact O-N 3.04Å; A138-F141 WeakPolarHBondContact O-CB 3.06Å; A138-F141 PolarHBondContact O-N 2.88Å; A138-Y142 PolarHBondContact O-N 3.38Å
139	Y	80.7	Confident	76.8	Confident	146 Å²	146	67.7 Å²	67.7	57%	0.573	33%	0.329	S	S	*	.	H	α-helix	trans	-65.1	-42.8	176.8	-177	-100.4	0	0	0	112.7	G135 A136 C137 F141 Y142 R143	G135-Y139 WeakPolarHBondContact O-CB 3.43Å; G135-Y139 PolarHBondContact O-N 3.29Å; A136-Y139 WeakPolarHBondContact O-CB 3.44Å; A136-Y139 PolarHBondContact O-N 3.48Å; C137-Y139 VanDerWaalsContact C-N 3.26Å; C137-Y139 PolarHBondContact O-N 2.9Å; Y139-F141 VanDerWaalsContact C-N 3.32Å; Y139-F141 PolarHBondContact O-N 3.45Å; Y139-Y142 PolarHBondContact O-N 3.28Å; Y139-R143 WeakPolarHBondContact O-CB 3.11Å; Y139-R143 PolarHBondContact O-N 2.73Å
140	Y	79.4	Confident	75.3	Confident	117 Å²	117	68.4 Å²	68.4	46%	0.459	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.2	-73.5	-67	0	0	0	111.8	F13 A136 C137 R143 N144	F13-Y140 HydrophobicContact CE1-CD2 4.3Å; A136-Y140 HydrophobicContact CB-CE2 4.49Å; A136-Y140 WeakPolarHBondContact O-CD2 3.24Å; A136-Y140 PolarHBondContact O-N 3.35Å; C137-Y140 PolarHBondContact O-N 2.92Å; C137-Y140 VanDerWaalsContact O-N 3.16Å; Y140-R143 PolarHBondContact O-N 3.26Å; Y140-N144 WeakPolarHBondContact O-CB 3.21Å; Y140-N144 PolarHBondContact O-N 2.86Å; Y140-N144 PolarHBondContact O-ND2 3.19Å
141	F	73.1	Confident	73.9	Confident	12 Å²	12	72.9 Å²	72.9	5%	0.053	36%	0.363	C	S	.	.	H	α-helix	trans	-59.4	-52.4	170.6	-78.4	-71.8	0	0	0	111.5	I10 V14 F79 E82 F83 C137 A138 Y139 R143 N144 W145	I10-F141 HydrophobicContact CG2-CD1 3.93Å; I10-F141 HydrophobicContact CG2-CE1 3.09Å; I10-F141 HydrophobicContact CG2-CE2 4.12Å; I10-F141 HydrophobicContact CG2-CZ 3.17Å; V14-F141 HydrophobicContact CG2-CE2 3.47Å; V14-F141 VanDerWaalsContact CG2-CE2 3.47Å; V14-F141 HydrophobicContact CG2-CZ 3.4Å; V14-F141 VanDerWaalsContact CG2-CZ 3.4Å; F79-F141 HydrophobicContact CD1-CD1 4.49Å; F79-F141 AromaticContact CD2-CD1 3.87Å; F79-F141 HydrophobicContact CD2-CD1 3.87Å; F79-F141 HydrophobicContact CD2-CE1 4.2Å; F79-F141 HydrophobicContact CE1-CB 4Å; F79-F141 HydrophobicContact CE1-CD1 4.04Å; F79-F141 WeakPolarHBondContact CE1-O 3.3Å; F79-F141 AromaticContact CE2-CD1 3.43Å; F79-F141 HydrophobicContact CE2-CD1 3.43Å; F79-F141 VanDerWaalsContact CE2-CD1 3.43Å; F79-F141 HydrophobicContact CE2-CE1 4.05Å; F79-F141 HydrophobicContact CG-CD1 4.42Å; F79-F141 HydrophobicContact CZ-CB 3.9Å; F79-F141 AromaticContact CZ-CD1 3.54Å; F79-F141 HydrophobicContact CZ-CD1 3.54Å; F79-F141 HydrophobicContact CZ-CG 4.24Å; F79-F141 WeakPolarHBondContact CZ-O 3.22Å; E82-F141 HydrophobicContact CB-CE1 4.43Å; E82-F141 HydrophobicContact CB-CZ 4.28Å; E82-F141 HydrophobicContact CG-CE1 4.28Å; E82-F141 HydrophobicContact CG-CE2 4Å; E82-F141 HydrophobicContact CG-CZ 3.68Å; F83-F141 HydrophobicContact CD2-CB 4.13Å; C137-F141 WeakPolarHBondContact O-CD2 3.28Å; C137-F141 PolarHBondContact O-N 3.4Å; C137-F141 VanDerWaalsContact O-N 3.08Å; A138-F141 WeakPolarHBondContact O-CB 3.06Å; A138-F141 PolarHBondContact O-N 2.88Å; Y139-F141 VanDerWaalsContact C-N 3.32Å; Y139-F141 PolarHBondContact O-N 3.45Å; F141-R143 VanDerWaalsContact C-N 3.26Å; F141-R143 PolarHBondContact O-N 2.84Å; F141-N144 PolarHBondContact O-N 2.89Å; F141-N144 VanDerWaalsContact O-N 3.15Å; F141-W145 PolarHBondContact O-N 3.13Å
142	Y	75.6	Confident	72.3	Confident	101 Å²	101	76.3 Å²	76.3	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-57	-43.2	178.8	-177.4	-98.7	0	0	0	112.1	F83 A138 Y139 W145 R146	F83-Y142 HydrophobicContact CZ-CD2 4.45Å; A138-Y142 PolarHBondContact O-N 3.38Å; Y139-Y142 PolarHBondContact O-N 3.28Å; Y142-W145 HydrophobicContact CD2-CE3 4.37Å; Y142-W145 HydrophobicContact CE2-CE3 4.25Å; Y142-W145 HydrophobicContact CE2-CZ3 4.27Å; Y142-W145 PolarHBondContact O-N 3.42Å; Y142-R146 HydrophobicContact CD1-CG 4.23Å; Y142-R146 HydrophobicContact CE1-CG 3.8Å; Y142-R146 HydrophobicContact CE2-CG 4.47Å; Y142-R146 WeakPolarHBondContact O-CG 3.46Å; Y142-R146 PolarHBondContact O-N 3.41Å; Y142-R146 VanDerWaalsContact O-N 3.07Å
143	R	77.7	Confident	70.7	Confident	121 Å²	121	72.9 Å²	72.9	46%	0.457	37%	0.371	S	S	.	.	H	α-helix	trans	-59.2	-50.3	176.4	-174.1	177.6	173.2	177.3	1.3	111.1	Y139 Y140 F141 W145 R146 F147	Y139-R143 WeakPolarHBondContact O-CB 3.11Å; Y139-R143 PolarHBondContact O-N 2.73Å; Y140-R143 PolarHBondContact O-N 3.26Å; F141-R143 VanDerWaalsContact C-N 3.26Å; F141-R143 PolarHBondContact O-N 2.84Å; R143-W145 VanDerWaalsContact C-N 3.32Å; R143-W145 PolarHBondContact O-N 3.43Å; R143-R146 PolarHBondContact O-N 2.66Å; R143-R146 VanDerWaalsContact O-N 3.16Å; R143-F147 HydrophobicContact CG-CD2 3.75Å; R143-F147 HydrophobicContact CG-CE2 3.45Å; R143-F147 VanDerWaalsContact CG-CE2 3.45Å; R143-F147 WeakPolarHBondContact O-CD2 3.35Å; R143-F147 PolarHBondContact O-N 2.98Å
144	N	72.3	Confident	68.8	Low	45 Å²	45	77.6 Å²	77.6	24%	0.241	39%	0.386	C	S	.	.	H	α-helix	trans	-62.5	-38.2	-179.9	-71.1	-20.4	0	0	0	112.2	I10 F79 Y140 F141 R146 F147 S148	I10-N144 WeakPolarHBondContact CD1-ND2 3.1Å; F79-N144 HydrophobicContact CZ-CB 4.19Å; Y140-N144 WeakPolarHBondContact O-CB 3.21Å; Y140-N144 PolarHBondContact O-N 2.86Å; Y140-N144 PolarHBondContact O-ND2 3.19Å; F141-N144 PolarHBondContact O-N 2.89Å; F141-N144 VanDerWaalsContact O-N 3.15Å; N144-R146 VanDerWaalsContact C-N 3.35Å; N144-R146 PolarHBondContact O-N 2.71Å; N144-F147 PolarHBondContact O-N 3.15Å; N144-S148 PolarHBondContact O-N 3.14Å; N144-S148 PolarHBondContact O-OG 3.29Å; N144-S148 VanDerWaalsContact O-OG 3.13Å
145	W	68.5	Low	67.2	Low	136 Å²	136	85.2 Å²	85.2	52%	0.515	41%	0.413	S	S	.	.	H	α-helix	trans	-63.3	-39.8	174.6	-176.5	60.5	0	0	0	112.8	F79 F141 Y142 R143 S148 T149	F79-W145 HydrophobicContact CD1-CB 4.49Å; F79-W145 HydrophobicContact CE1-CB 3.65Å; F79-W145 HydrophobicContact CE1-CG 4.35Å; F79-W145 HydrophobicContact CZ-CB 4.08Å; F141-W145 PolarHBondContact O-N 3.13Å; Y142-W145 HydrophobicContact CD2-CE3 4.37Å; Y142-W145 HydrophobicContact CE2-CE3 4.25Å; Y142-W145 HydrophobicContact CE2-CZ3 4.27Å; Y142-W145 PolarHBondContact O-N 3.42Å; R143-W145 VanDerWaalsContact C-N 3.32Å; R143-W145 PolarHBondContact O-N 3.43Å; W145-S148 PolarHBondContact O-N 3.22Å; W145-T149 WeakPolarHBondContact O-CG2 3.43Å; W145-T149 PolarHBondContact O-N 3.45Å; W145-T149 PolarHBondContact O-OG1 3.45Å
146	R	70.9	Confident	65.5	Low	142 Å²	142	94.1 Å²	94.1	54%	0.536	44%	0.439	S	S	.	.	H	α-helix	trans	-67	-34.5	175.8	-66.5	-72.8	-79.8	-172.4	-6	112.5	Y142 R143 N144 T149 T150	Y142-R146 HydrophobicContact CD1-CG 4.23Å; Y142-R146 HydrophobicContact CE1-CG 3.8Å; Y142-R146 HydrophobicContact CE2-CG 4.47Å; Y142-R146 WeakPolarHBondContact O-CG 3.46Å; Y142-R146 PolarHBondContact O-N 3.41Å; Y142-R146 VanDerWaalsContact O-N 3.07Å; R143-R146 PolarHBondContact O-N 2.66Å; R143-R146 VanDerWaalsContact O-N 3.16Å; N144-R146 VanDerWaalsContact C-N 3.35Å; N144-R146 PolarHBondContact O-N 2.71Å; R146-T149 WeakPolarHBondContact CA-OG1 3.45Å; R146-T149 PolarHBondContact O-OG1 3.49Å; R146-T149 VanDerWaalsContact O-OG1 3.06Å; R146-T150 PolarHBondContact O-N 3.41Å; R146-T150 PolarHBondContact O-OG1 3.27Å
147	F	66.7	Low	63.8	Low	114 Å²	114	97.1 Å²	97.1	50%	0.5	45%	0.453	S	S	.	.	H	α-helix	trans	-74.7	-36.9	174.2	-76.3	-71	0	0	0	113.1	R143 N144 T150 V151	R143-F147 HydrophobicContact CG-CD2 3.75Å; R143-F147 HydrophobicContact CG-CE2 3.45Å; R143-F147 VanDerWaalsContact CG-CE2 3.45Å; R143-F147 WeakPolarHBondContact O-CD2 3.35Å; R143-F147 PolarHBondContact O-N 2.98Å; N144-F147 PolarHBondContact O-N 3.15Å; F147-T150 PolarHBondContact O-OG1 3.48Å; F147-V151 WeakPolarHBondContact O-CG2 3.33Å; F147-V151 PolarHBondContact O-N 2.84Å
148	S	60.3	Low	62.4	Low	64 Å²	64	101.5 Å²	101.5	45%	0.448	48%	0.48	S	S	.	.	H	α-helix	trans	-67.3	-39.6	176.6	-63	0	0	0	0	112	N144 W145 T150 V151 D152	N144-S148 PolarHBondContact O-N 3.14Å; N144-S148 PolarHBondContact O-OG 3.29Å; N144-S148 VanDerWaalsContact O-OG 3.13Å; W145-S148 PolarHBondContact O-N 3.22Å; S148-T150 PolarHBondContact O-N 3.37Å; S148-V151 PolarHBondContact O-N 2.95Å; S148-D152 PolarHBondContact O-N 3.2Å
149	T	56.9	Low	60.9	Low	61 Å²	61	106.2 Å²	106.2	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-32.8	178.7	47.6	0	0	0	0	113.5	W145 R146 G153	W145-T149 WeakPolarHBondContact O-CG2 3.43Å; W145-T149 PolarHBondContact O-N 3.45Å; W145-T149 PolarHBondContact O-OG1 3.45Å; R146-T149 WeakPolarHBondContact CA-OG1 3.45Å; R146-T149 PolarHBondContact O-OG1 3.49Å; R146-T149 VanDerWaalsContact O-OG1 3.06Å; T149-G153 PolarHBondContact O-N 3.27Å
150	T	56	Low	59.6	Low	83 Å²	83	106.1 Å²	106.1	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-71.1	-39	174.5	44.6	0	0	0	0	112.4	R146 F147 S148 G153 Q154	R146-T150 PolarHBondContact O-N 3.41Å; R146-T150 PolarHBondContact O-OG1 3.27Å; F147-T150 PolarHBondContact O-OG1 3.48Å; S148-T150 PolarHBondContact O-N 3.37Å; T150-G153 PolarHBondContact O-N 2.83Å; T150-Q154 WeakPolarHBondContact O-CB 3.48Å; T150-Q154 PolarHBondContact O-N 2.85Å
151	V	52.2	Low	58.2	Low	93 Å²	93	106 Å²	106	56%	0.564	53%	0.527	S	S	*	.	H	α-helix	trans	-67.6	-41.8	177.1	177.5	0	0	0	0	111.4	F147 S148 Q154 R155	F147-V151 WeakPolarHBondContact O-CG2 3.33Å; F147-V151 PolarHBondContact O-N 2.84Å; S148-V151 PolarHBondContact O-N 2.95Å; V151-Q154 PolarHBondContact O-N 2.74Å; V151-R155 WeakPolarHBondContact O-CB 3.28Å; V151-R155 PolarHBondContact O-N 3.07Å
152	D	53.6	Low	57.5	Low	101 Å²	101	110.7 Å²	110.7	54%	0.54	56%	0.557	S	S	.	*	H	α-helix	trans	-68.8	-36.5	175.8	-75.7	-32	0	0	0	112.3	S148 Q154 R155 R156	S148-D152 PolarHBondContact O-N 3.2Å; D152-Q154 VanDerWaalsContact C-N 3.29Å; D152-Q154 PolarHBondContact O-N 3.34Å; D152-R155 PolarHBondContact O-N 3.48Å; D152-R156 VanDerWaalsContact O-CB 3.29Å; D152-R156 WeakPolarHBondContact O-CB 3.38Å; D152-R156 PolarHBondContact O-N 3.41Å
153	G	50.6	Low	56.4	Low	40 Å²	40	111.4 Å²	111.4	41%	0.412	57%	0.572	S	S	.	*	H	α-helix	trans	-59.6	-40.1	171.6	0	0	0	0	0	112.5	T149 T150 T157	T149-G153 PolarHBondContact O-N 3.27Å; T150-G153 PolarHBondContact O-N 2.83Å; G153-T157 PolarHBondContact O-N 2.97Å; G153-T157 PolarHBondContact O-OG1 3.37Å
154	Q	45.1	Very low	55.6	Low	144 Å²	144	111.1 Å²	111.1	67%	0.673	58%	0.584	S	S	*	*	H	α-helix	trans	-74.3	-39.5	177.4	-144.9	170.8	-64.3	0	0	111.8	T150 V151 D152 R156 T157 V158	T150-Q154 WeakPolarHBondContact O-CB 3.48Å; T150-Q154 PolarHBondContact O-N 2.85Å; V151-Q154 PolarHBondContact O-N 2.74Å; D152-Q154 VanDerWaalsContact C-N 3.29Å; D152-Q154 PolarHBondContact O-N 3.34Å; Q154-R156 PolarHBondContact O-N 3.45Å; Q154-T157 PolarHBondContact O-N 3.29Å; Q154-V158 WeakPolarHBondContact O-CG2 3.48Å; Q154-V158 PolarHBondContact O-N 3.37Å
155	R	47.3	Very low	55	Low	183 Å²	183	114.8 Å²	114.8	69%	0.691	61%	0.608	S	S	*	*	H	α-helix	trans	-67.6	-35	177.5	-151.1	176.9	-168.9	-168.7	1.6	112.2	V151 D152 T157 V158 T159	V151-R155 WeakPolarHBondContact O-CB 3.28Å; V151-R155 PolarHBondContact O-N 3.07Å; D152-R155 PolarHBondContact O-N 3.48Å; R155-T157 VanDerWaalsContact C-N 3.3Å; R155-T157 PolarHBondContact O-N 2.8Å; R155-V158 PolarHBondContact O-N 3.01Å; R155-T159 PolarHBondContact O-N 2.8Å; R155-T159 PolarHBondContact O-OG1 3.34Å; R155-T159 VanDerWaalsContact O-OG1 3.11Å
156	R	46.7	Very low	54.5	Low	213 Å²	213	114.2 Å²	114.2	80%	0.804	62%	0.62	S	S	*	*	H	α-helix	trans	-70.5	-26.5	174.1	-145.5	176.4	-162.6	174.8	4.4	112.6	D152 Q154	D152-R156 VanDerWaalsContact O-CB 3.29Å; D152-R156 WeakPolarHBondContact O-CB 3.38Å; D152-R156 PolarHBondContact O-N 3.41Å; Q154-R156 PolarHBondContact O-N 3.45Å
157	T	47	Very low	54.1	Low	103 Å²	103	113.5 Å²	113.5	63%	0.632	63%	0.631	S	S	*	*	H	α-helix	trans	-78.6	-34.1	175.1	-51.9	0	0	0	0	112.1	G153 Q154 R155	G153-T157 PolarHBondContact O-N 2.97Å; G153-T157 PolarHBondContact O-OG1 3.37Å; Q154-T157 PolarHBondContact O-N 3.29Å; R155-T157 VanDerWaalsContact C-N 3.3Å; R155-T157 PolarHBondContact O-N 2.8Å
158	V	49.6	Very low	53.8	Low	106 Å²	106	113.3 Å²	113.3	64%	0.642	64%	0.642	S	S	*	*	H	α-helix	trans	-74.5	-28.6	-179.5	178.4	0	0	0	0	113	Q154 R155 I160	Q154-V158 WeakPolarHBondContact O-CG2 3.48Å; Q154-V158 PolarHBondContact O-N 3.37Å; R155-V158 PolarHBondContact O-N 3.01Å; V158-I160 PolarHBondContact O-N 2.85Å; V158-I160 VanDerWaalsContact O-N 3.14Å
159	T	48.5	Very low	53.6	Low	105 Å²	105	116 Å²	116	64%	0.644	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-7.7	-178.4	-53	0	0	0	0	114.4	R155	R155-T159 PolarHBondContact O-N 2.8Å; R155-T159 PolarHBondContact O-OG1 3.34Å; R155-T159 VanDerWaalsContact O-OG1 3.11Å
160	I	53.9	Low	53.9	Low	144 Å²	144	125 Å²	125	74%	0.738	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	-15.9	-179.1	-59.7	-179.5	0	0	0	113.2	V158 T162	V158-I160 PolarHBondContact O-N 2.85Å; V158-I160 VanDerWaalsContact O-N 3.14Å; I160-T162 PolarHBondContact O-N 3.4Å
161	T	49.5	Very low	54.6	Low	114 Å²	114	135.1 Å²	135.1	70%	0.699	72%	0.716	S	S	*	*			trans	-99.8	65.4	-179.9	-38.7	0	0	0	0	112.3
162	T	58.3	Low	54.7	Low	112 Å²	112	137.2 Å²	137.2	69%	0.687	72%	0.723	S	S	*	*			trans	-100.2	82.2	154.8	-49.4	0	0	0	0	107.7	I160 T164	I160-T162 PolarHBondContact O-N 3.4Å; T162-T164 PolarHBondContact O-N 3.37Å
163	T	53.2	Low	54.8	Low	116 Å²	116	139.1 Å²	139.1	71%	0.712	73%	0.733	S	S	*	*			trans	-75.9	96.2	163.2	-0.7	0	0	0	0	107.2	T165	T163-T165 PolarHBondContact O-N 3.49Å
164	T	60.6	Low	55	Low	115 Å²	115	144.6 Å²	144.6	71%	0.706	75%	0.751	S	S	*	*			trans	-73.2	91.7	170.5	-23.9	0	0	0	0	108.1	T162 T166	T162-T164 PolarHBondContact O-N 3.37Å; T164-T166 PolarHBondContact O-N 3.07Å
165	T	58.8	Low	55.6	Low	122 Å²	122	144.6 Å²	144.6	75%	0.748	76%	0.755	S	S	*	*			trans	-78.8	98.2	168.8	-33.4	0	0	0	0	107.8	T163 T167	T163-T165 PolarHBondContact O-N 3.49Å; T165-T167 PolarHBondContact O-N 3.05Å
166	T	59.3	Low	56.1	Low	124 Å²	124	142.3 Å²	142.3	76%	0.761	76%	0.759	S	S	*	*			trans	-72.9	105	172.9	49.8	0	0	0	0	109.5	T164	T164-T166 PolarHBondContact O-N 3.07Å
167	T	62.2	Low	56.7	Low	126 Å²	126	137.5 Å²	137.5	77%	0.773	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-82.5	121	163.9	37.8	0	0	0	0	109.5	T165	T165-T167 PolarHBondContact O-N 3.05Å
168	P	60.7	Low	57.4	Low	111 Å²	111	140 Å²	140	72%	0.721	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-70.5	147.3	179.2	27.5	-32.6	0	0	0	111.7	R170	P168-R170 PolarHBondContact O-N 2.91Å
169	P	55.2	Low	58	Low	120 Å²	120	142.6 Å²	142.6	78%	0.779	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.4	127.5	-177.7	27.2	-32.3	0	0	0	110.9
170	R	63.2	Low	58.8	Low	251 Å²	251	145.8 Å²	145.8	95%	0.947	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-84.8	119.4	163.3	-81.9	-164	-174.3	-173.5	3.2	108.7	P168	P168-R170 PolarHBondContact O-N 2.91Å
171	Y	70.9	Confident	59.3	Low	294 Å²	294	145.9 Å²	145.9	100%	1.153	79%	0.79	S	S	*	*			trans	-65.5	0	160.5	-85.7	-93	0	0	0	111

Retrieved 171 of 171 residues in 387.1 ms (Link to these results)

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