A0A077Z9V2_TRITR Loading...

PQ-loop domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z9V2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 245 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	43.9	Very low	55.7	Low	237 Å²	237	147.1 Å²	147.1	100%	1.167	74%	0.738	S	S	*	*				0	97.8	0	-75.3	-174.7	-75.6	0	0	106.3	E3	M1-E3 PolarHBondContact O-N 3.46Å
2	E	54.8	Low	56	Low	186 Å²	186	155.6 Å²	155.6	87%	0.869	76%	0.755	S	S	*	*			trans	-78.5	110.2	171.1	-75.8	177.4	159.5	0	0	107.4	N4	E2-N4 PolarHBondContact O-N 2.96Å
3	E	55.7	Low	57.1	Low	144 Å²	144	151.2 Å²	151.2	67%	0.673	74%	0.737	S	S	*	*			trans	-71.5	104.8	172.8	-71.4	-176.7	158.9	0	0	108.6	M1 F5	M1-E3 PolarHBondContact O-N 3.46Å; E3-F5 HydrophobicContact CB-CD2 4.28Å; E3-F5 HydrophobicContact CB-CE1 4.33Å; E3-F5 HydrophobicContact CB-CE2 3.67Å; E3-F5 HydrophobicContact CB-CZ 3.71Å; E3-F5 WeakPolarHBondContact O-CD2 3.4Å; E3-F5 WeakPolarHBondContact O-CE2 3.33Å; E3-F5 PolarHBondContact O-N 3.03Å; E3-F5 WeakPolarHBondContact OE2-CZ 3.28Å
4	N	56.9	Low	58.5	Low	152 Å²	152	149.5 Å²	149.5	81%	0.813	73%	0.733	S	S	*	*			trans	-70.9	92.2	169.6	-80.5	-36.3	0	0	0	109.4	E2 I6	E2-N4 PolarHBondContact O-N 2.96Å; N4-I6 PolarHBondContact O-N 2.89Å
5	F	65.3	Low	59.9	Low	164 Å²	164	146.6 Å²	146.6	72%	0.719	72%	0.72	S	S	*	*			trans	-74	115.8	171.2	-58.7	-82.4	0	0	0	110.4	E3 L7	E3-F5 HydrophobicContact CB-CD2 4.28Å; E3-F5 HydrophobicContact CB-CE1 4.33Å; E3-F5 HydrophobicContact CB-CE2 3.67Å; E3-F5 HydrophobicContact CB-CZ 3.71Å; E3-F5 WeakPolarHBondContact O-CD2 3.4Å; E3-F5 WeakPolarHBondContact O-CE2 3.33Å; E3-F5 PolarHBondContact O-N 3.03Å; E3-F5 WeakPolarHBondContact OE2-CZ 3.28Å; F5-L7 PolarHBondContact O-N 2.96Å
6	I	62.8	Low	60.7	Low	144 Å²	144	143.9 Å²	143.9	74%	0.738	71%	0.709	S	S	*	*			trans	-82.4	107.9	167.9	-58.8	175.7	0	0	0	107.7	N4 I8	N4-I6 PolarHBondContact O-N 2.89Å; I6-I8 VanDerWaalsContact C-N 3.33Å; I6-I8 HydrophobicContact CG2-CG1 3.73Å; I6-I8 PolarHBondContact O-N 3.43Å
7	L	52.3	Low	61.1	Low	153 Å²	153	139.6 Å²	139.6	80%	0.801	69%	0.69	S	S	*	*			trans	-70.4	90.1	167.6	-79.7	166.7	0	0	0	109.6	F5 S9	F5-L7 PolarHBondContact O-N 2.96Å; L7-S9 PolarHBondContact O-N 3.22Å
8	I	53.4	Low	62	Low	127 Å²	127	137.7 Å²	137.7	65%	0.651	68%	0.682	S	S	*	*			trans	-79	104.1	167.9	-50.7	178.9	0	0	0	107.2	I6 V10	I6-I8 VanDerWaalsContact C-N 3.33Å; I6-I8 HydrophobicContact CG2-CG1 3.73Å; I6-I8 PolarHBondContact O-N 3.43Å; I8-V10 HydrophobicContact CB-CG2 4.15Å; I8-V10 HydrophobicContact CG2-CG2 3.46Å; I8-V10 VanDerWaalsContact CG2-CG2 3.46Å; I8-V10 PolarHBondContact O-N 2.89Å
9	S	56	Low	62.8	Low	74 Å²	74	134.6 Å²	134.6	52%	0.517	67%	0.668	S	S	.	*			trans	-70.7	80.8	166.1	-49.1	0	0	0	0	108.9	L7 Y11	L7-S9 PolarHBondContact O-N 3.22Å; S9-Y11 PolarHBondContact O-N 3.39Å
10	V	55.1	Low	63.2	Low	114 Å²	114	130.1 Å²	130.1	69%	0.691	65%	0.65	S	S	*	*			trans	-73.6	121.5	171.3	-175	0	0	0	0	107.6	I8 R12	I8-V10 HydrophobicContact CB-CG2 4.15Å; I8-V10 HydrophobicContact CG2-CG2 3.46Å; I8-V10 VanDerWaalsContact CG2-CG2 3.46Å; I8-V10 PolarHBondContact O-N 2.89Å; V10-R12 PolarHBondContact O-N 3.39Å
11	Y	56.4	Low	63.5	Low	123 Å²	123	125.8 Å²	125.8	48%	0.482	63%	0.632	S	S	.	*			trans	-60.3	123	171.8	-68.8	-83.7	0	0	0	108.2	S9 L13 N17	S9-Y11 PolarHBondContact O-N 3.39Å; Y11-L13 PolarHBondContact O-N 3.33Å; Y11-N17 HydrophobicContact CD1-CB 4.41Å
12	R	59.3	Low	65.2	Low	249 Å²	249	118.8 Å²	118.8	94%	0.94	60%	0.598	S	S	*	*	S	Bend	trans	-61.3	-26.3	-179.5	-82.3	-164.9	-156.2	-155.9	5.9	113.2	V10	V10-R12 PolarHBondContact O-N 3.39Å
13	L	70.6	Confident	66.1	Low	98 Å²	98	115.2 Å²	115.2	51%	0.513	58%	0.584	S	S	.	*			trans	-145.9	105.8	-175.3	-73.5	174.1	0	0	0	109	Y11 I15 L16	Y11-L13 PolarHBondContact O-N 3.33Å; L13-I15 HydrophobicContact CB-CG2 4.14Å; L13-I15 PolarHBondContact O-N 3.01Å; L13-L16 HydrophobicContact CB-CB 4.37Å; L13-L16 HydrophobicContact CB-CD1 4.01Å; L13-L16 HydrophobicContact CB-CG 3.95Å; L13-L16 HydrophobicContact CD1-CD1 3.88Å; L13-L16 HydrophobicContact CD1-CG 4.22Å; L13-L16 PolarHBondContact O-N 3.41Å
14	D	76.4	Confident	66.7	Low	128 Å²	128	109 Å²	109	68%	0.684	56%	0.56	S	S	*	*	H	α-helix	trans	-57.6	-30.2	176.6	-68.6	-37.1	0	0	0	112.2	L16 N17 L18	D14-L16 VanDerWaalsContact C-N 3.28Å; D14-L16 PolarHBondContact O-N 2.91Å; D14-N17 WeakPolarHBondContact O-CB 3.31Å; D14-N17 PolarHBondContact O-N 3.35Å; D14-N17 VanDerWaalsContact O-N 3.13Å; D14-L18 PolarHBondContact O-N 3.45Å
15	I	80.3	Confident	67.5	Low	106 Å²	106	108.6 Å²	108.6	54%	0.544	55%	0.546	S	S	.	.	H	α-helix	trans	-61.6	-34.6	176.6	-163.1	162	0	0	0	112.5	L13 L18 I19	L13-I15 HydrophobicContact CB-CG2 4.14Å; L13-I15 PolarHBondContact O-N 3.01Å; I15-L18 PolarHBondContact O-N 3.45Å; I15-I19 HydrophobicContact CG1-CD1 4.13Å; I15-I19 WeakPolarHBondContact O-CB 3.41Å; I15-I19 WeakPolarHBondContact O-CD1 3.33Å; I15-I19 WeakPolarHBondContact O-CG1 3.36Å; I15-I19 PolarHBondContact O-N 2.98Å
16	L	72.7	Confident	68.1	Low	104 Å²	104	105 Å²	105	55%	0.545	54%	0.538	S	S	.	.	H	α-helix	trans	-70.8	-35.4	176.7	-68.9	179.7	0	0	0	111.4	L13 D14 S20	L13-L16 HydrophobicContact CB-CB 4.37Å; L13-L16 HydrophobicContact CB-CD1 4.01Å; L13-L16 HydrophobicContact CB-CG 3.95Å; L13-L16 HydrophobicContact CD1-CD1 3.88Å; L13-L16 HydrophobicContact CD1-CG 4.22Å; L13-L16 PolarHBondContact O-N 3.41Å; D14-L16 VanDerWaalsContact C-N 3.28Å; D14-L16 PolarHBondContact O-N 2.91Å; L16-S20 VanDerWaalsContact O-CB 3.3Å; L16-S20 WeakPolarHBondContact O-CB 3.3Å; L16-S20 PolarHBondContact O-N 3.1Å
17	N	66.7	Low	68.4	Low	71 Å²	71	103.1 Å²	103.1	38%	0.38	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-42	175.1	-171.1	37.1	0	0	0	111	Y11 D14 S20 S21	Y11-N17 HydrophobicContact CD1-CB 4.41Å; D14-N17 WeakPolarHBondContact O-CB 3.31Å; D14-N17 PolarHBondContact O-N 3.35Å; D14-N17 VanDerWaalsContact O-N 3.13Å; N17-S20 PolarHBondContact O-N 3.24Å; N17-S21 WeakPolarHBondContact O-CB 3.49Å; N17-S21 PolarHBondContact O-N 3.45Å
18	L	76.9	Confident	69.3	Low	105 Å²	105	97.7 Å²	97.7	55%	0.55	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-49.6	173.3	-179.8	62.7	0	0	0	111.5	D14 I15 S20 S21 I22	D14-L18 PolarHBondContact O-N 3.45Å; I15-L18 PolarHBondContact O-N 3.45Å; L18-S20 VanDerWaalsContact C-N 3.34Å; L18-S20 PolarHBondContact O-N 3.01Å; L18-S21 PolarHBondContact O-N 3.11Å; L18-I22 HydrophobicContact CD1-CD1 4.06Å; L18-I22 HydrophobicContact CD1-CG1 4.36Å; L18-I22 HydrophobicContact CG-CD1 3.91Å; L18-I22 VanDerWaalsContact O-CG1 3.32Å; L18-I22 WeakPolarHBondContact O-CG1 3.48Å; L18-I22 PolarHBondContact O-N 3.37Å
19	I	78.3	Confident	70.3	Confident	79 Å²	79	93.7 Å²	93.7	41%	0.405	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-46.8	177.1	-70.1	164.5	0	0	0	110.5	I15 S21 I22 L23	I15-I19 HydrophobicContact CG1-CD1 4.13Å; I15-I19 WeakPolarHBondContact O-CB 3.41Å; I15-I19 WeakPolarHBondContact O-CD1 3.33Å; I15-I19 WeakPolarHBondContact O-CG1 3.36Å; I15-I19 PolarHBondContact O-N 2.98Å; I19-S21 VanDerWaalsContact C-N 3.31Å; I19-S21 PolarHBondContact O-N 2.88Å; I19-I22 PolarHBondContact O-N 3.11Å; I19-L23 HydrophobicContact CG2-CD1 3.86Å; I19-L23 HydrophobicContact CG2-CG 4.27Å; I19-L23 WeakPolarHBondContact O-CB 3.16Å; I19-L23 WeakPolarHBondContact O-CG 3.2Å; I19-L23 PolarHBondContact O-N 2.86Å
20	S	69.7	Low	71.3	Confident	44 Å²	44	92.8 Å²	92.8	31%	0.308	48%	0.475	S	S	.	.	H	α-helix	trans	-60.9	-39.4	178.3	-172.6	0	0	0	0	112.2	L16 N17 L18 G24 C93	L16-S20 VanDerWaalsContact O-CB 3.3Å; L16-S20 WeakPolarHBondContact O-CB 3.3Å; L16-S20 PolarHBondContact O-N 3.1Å; N17-S20 PolarHBondContact O-N 3.24Å; L18-S20 VanDerWaalsContact C-N 3.34Å; L18-S20 PolarHBondContact O-N 3.01Å; S20-G24 PolarHBondContact O-N 3.39Å; S20-C93 PolarHBondContact OG-SG 3.32Å
21	S	70.6	Confident	72.1	Confident	39 Å²	39	92 Å²	92	27%	0.273	46%	0.459	S	S	.	.	H	α-helix	trans	-66.2	-46.9	176.5	-171.8	0	0	0	0	111.3	N17 L18 I19 L23 G24 W25	N17-S21 WeakPolarHBondContact O-CB 3.49Å; N17-S21 PolarHBondContact O-N 3.45Å; L18-S21 PolarHBondContact O-N 3.11Å; I19-S21 VanDerWaalsContact C-N 3.31Å; I19-S21 PolarHBondContact O-N 2.88Å; S21-L23 PolarHBondContact O-N 3.42Å; S21-G24 PolarHBondContact O-N 3.24Å; S21-G24 VanDerWaalsContact O-N 3.15Å; S21-W25 PolarHBondContact O-N 2.95Å
22	I	78.2	Confident	72.9	Confident	90 Å²	90	87 Å²	87	46%	0.462	44%	0.442	S	S	.	.	H	α-helix	trans	-58.7	-49	177	-67.9	167.7	0	0	0	110.6	L18 I19 G24 W25 V26	L18-I22 HydrophobicContact CD1-CD1 4.06Å; L18-I22 HydrophobicContact CD1-CG1 4.36Å; L18-I22 HydrophobicContact CG-CD1 3.91Å; L18-I22 VanDerWaalsContact O-CG1 3.32Å; L18-I22 WeakPolarHBondContact O-CG1 3.48Å; L18-I22 PolarHBondContact O-N 3.37Å; I19-I22 PolarHBondContact O-N 3.11Å; I22-G24 VanDerWaalsContact C-N 3.27Å; I22-G24 PolarHBondContact O-N 2.89Å; I22-W25 PolarHBondContact O-N 2.95Å; I22-V26 HydrophobicContact CG2-CG2 4.28Å; I22-V26 WeakPolarHBondContact O-CG2 3.24Å; I22-V26 PolarHBondContact O-N 3.5Å
23	L	74.9	Confident	73.7	Confident	111 Å²	111	80.5 Å²	80.5	58%	0.581	43%	0.425	S	S	*	.	H	α-helix	trans	-60.1	-38.2	177.5	-71	175.7	0	0	0	111.8	I19 S21 V26 Y27	I19-L23 HydrophobicContact CG2-CD1 3.86Å; I19-L23 HydrophobicContact CG2-CG 4.27Å; I19-L23 WeakPolarHBondContact O-CB 3.16Å; I19-L23 WeakPolarHBondContact O-CG 3.2Å; I19-L23 PolarHBondContact O-N 2.86Å; S21-L23 PolarHBondContact O-N 3.42Å; L23-V26 PolarHBondContact O-N 2.93Å; L23-Y27 WeakPolarHBondContact O-CB 3.35Å; L23-Y27 PolarHBondContact O-N 3.32Å
24	G	67.7	Low	74	Confident	15 Å²	15	79 Å²	79	16%	0.155	42%	0.423	C	S	.	.	H	α-helix	trans	-61.3	-44.8	174.3	0	0	0	0	0	113	S20 S21 I22 F28	S20-G24 PolarHBondContact O-N 3.39Å; S21-G24 PolarHBondContact O-N 3.24Å; S21-G24 VanDerWaalsContact O-N 3.15Å; I22-G24 VanDerWaalsContact C-N 3.27Å; I22-G24 PolarHBondContact O-N 2.89Å; G24-F28 WeakPolarHBondContact O-CB 3.33Å; G24-F28 PolarHBondContact O-N 3.05Å
25	W	73.5	Confident	74	Confident	142 Å²	142	74.7 Å²	74.7	54%	0.538	40%	0.398	S	S	.	.	H	α-helix	trans	-69.1	-39.9	177	-75.8	111.3	0	0	0	113	S21 I22 F28 A29 P99	S21-W25 PolarHBondContact O-N 2.95Å; I22-W25 PolarHBondContact O-N 2.95Å; W25-F28 AromaticContact CE3-CD1 3.79Å; W25-F28 HydrophobicContact CE3-CD1 3.79Å; W25-F28 HydrophobicContact CE3-CE1 4.42Å; W25-F28 AromaticContact CZ3-CD1 3.93Å; W25-F28 HydrophobicContact CZ3-CD1 3.93Å; W25-F28 HydrophobicContact CZ3-CE1 4.17Å; W25-F28 WeakPolarHBondContact O-CB 3.36Å; W25-F28 PolarHBondContact O-N 3.33Å; W25-A29 WeakPolarHBondContact O-CB 3.46Å; W25-A29 PolarHBondContact O-N 2.97Å; W25-P99 HydrophobicContact CH2-CG 4.19Å; W25-P99 HydrophobicContact CZ3-CG 4.09Å
26	V	77.7	Confident	73.9	Confident	89 Å²	89	75.9 Å²	75.9	54%	0.539	40%	0.395	S	S	.	.	H	α-helix	trans	-63.3	-45.5	174.7	171.5	0	0	0	0	110.5	I22 L23 F28 A29 A30	I22-V26 HydrophobicContact CG2-CG2 4.28Å; I22-V26 WeakPolarHBondContact O-CG2 3.24Å; I22-V26 PolarHBondContact O-N 3.5Å; L23-V26 PolarHBondContact O-N 2.93Å; V26-F28 PolarHBondContact O-N 2.94Å; V26-A29 PolarHBondContact O-N 3.14Å; V26-A30 VanDerWaalsContact O-CB 3.31Å; V26-A30 WeakPolarHBondContact O-CB 3.28Å; V26-A30 PolarHBondContact O-N 2.9Å
27	Y	70.3	Confident	74.4	Confident	105 Å²	105	74.9 Å²	74.9	41%	0.412	40%	0.395	S	S	.	.	H	α-helix	trans	-57	-48.1	173.6	169.4	-91.2	0	0	0	111.2	L23 A29 A30 W31	L23-Y27 WeakPolarHBondContact O-CB 3.35Å; L23-Y27 PolarHBondContact O-N 3.32Å; Y27-A29 PolarHBondContact O-N 3.47Å; Y27-A30 PolarHBondContact O-N 3.41Å; Y27-W31 AromaticContact CD2-CD1 3.62Å; Y27-W31 AromaticContact CD2-NE1 3.64Å; Y27-W31 AromaticContact CE1-CD1 3.71Å; Y27-W31 HydrophobicContact CE1-CG 4.47Å; Y27-W31 AromaticContact CE1-NE1 3.96Å; Y27-W31 AromaticContact CE2-CD1 3.33Å; Y27-W31 AromaticContact CE2-NE1 2.94Å; Y27-W31 AromaticContact CG-CD1 3.96Å; Y27-W31 AromaticContact CZ-CD1 3.34Å; Y27-W31 AromaticContact CZ-CE2 3.93Å; Y27-W31 AromaticContact CZ-NE1 3.11Å; Y27-W31 VanDerWaalsContact O-CD1 3.28Å; Y27-W31 PolarHBondContact O-N 3.1Å; Y27-W31 PolarHBondContact OH-NE1 2.94Å
28	F	70.9	Confident	75.1	Confident	39 Å²	39	74.7 Å²	74.7	17%	0.171	39%	0.392	C	S	.	.	H	α-helix	trans	-57.9	-47.6	176.5	164.8	-115.3	0	0	0	112.6	G24 W25 V26 W31 T32 P99 H103	G24-F28 WeakPolarHBondContact O-CB 3.33Å; G24-F28 PolarHBondContact O-N 3.05Å; W25-F28 AromaticContact CE3-CD1 3.79Å; W25-F28 HydrophobicContact CE3-CD1 3.79Å; W25-F28 HydrophobicContact CE3-CE1 4.42Å; W25-F28 AromaticContact CZ3-CD1 3.93Å; W25-F28 HydrophobicContact CZ3-CD1 3.93Å; W25-F28 HydrophobicContact CZ3-CE1 4.17Å; W25-F28 WeakPolarHBondContact O-CB 3.36Å; W25-F28 PolarHBondContact O-N 3.33Å; V26-F28 PolarHBondContact O-N 2.94Å; F28-W31 PolarHBondContact O-N 2.86Å; F28-T32 WeakPolarHBondContact CE2-OG1 3.4Å; F28-T32 WeakPolarHBondContact O-CB 3.46Å; F28-T32 PolarHBondContact O-N 3.33Å; F28-T32 PolarHBondContact O-OG1 2.8Å; F28-P99 HydrophobicContact CD1-CB 4.19Å; F28-P99 HydrophobicContact CD2-CB 3.73Å; F28-P99 HydrophobicContact CE1-CB 3.9Å; F28-P99 HydrophobicContact CE2-CB 3.43Å; F28-P99 VanDerWaalsContact CE2-CB 3.43Å; F28-P99 WeakPolarHBondContact CE2-O 3.32Å; F28-P99 HydrophobicContact CG-CB 4.09Å; F28-P99 HydrophobicContact CZ-CB 3.5Å; F28-H103 HydrophobicContact CE2-CB 4.03Å; F28-H103 HydrophobicContact CZ-CB 4.42Å
29	A	74.1	Confident	75.3	Confident	42 Å²	42	70 Å²	70	35%	0.347	37%	0.368	S	S	.	.	H	α-helix	trans	-63.9	-44.4	179.4	0	0	0	0	0	111.4	W25 V26 Y27 W31 T32 I33	W25-A29 WeakPolarHBondContact O-CB 3.46Å; W25-A29 PolarHBondContact O-N 2.97Å; V26-A29 PolarHBondContact O-N 3.14Å; Y27-A29 PolarHBondContact O-N 3.47Å; A29-W31 PolarHBondContact O-N 2.8Å; A29-T32 PolarHBondContact O-N 3.3Å; A29-I33 WeakPolarHBondContact O-CB 3.38Å; A29-I33 VanDerWaalsContact O-CG1 3.26Å; A29-I33 WeakPolarHBondContact O-CG1 3.19Å; A29-I33 PolarHBondContact O-N 3.14Å
30	A	76.4	Confident	75.6	Confident	55 Å²	55	68.7 Å²	68.7	46%	0.455	36%	0.363	S	S	.	.	H	α-helix	trans	-60.7	-45.6	177.8	0	0	0	0	0	111.9	V26 Y27 I33 S34	V26-A30 VanDerWaalsContact O-CB 3.31Å; V26-A30 WeakPolarHBondContact O-CB 3.28Å; V26-A30 PolarHBondContact O-N 2.9Å; Y27-A30 PolarHBondContact O-N 3.41Å; A30-I33 PolarHBondContact O-N 3.17Å; A30-S34 WeakPolarHBondContact O-CB 3.33Å; A30-S34 PolarHBondContact O-N 3.01Å
31	W	73.5	Confident	76.1	Confident	97 Å²	97	70.1 Å²	70.1	37%	0.367	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-47.2	174.9	-90.9	88.3	0	0	0	111.7	Y27 F28 A29 I33 S34 F35 F63 S100	Y27-W31 AromaticContact CD2-CD1 3.62Å; Y27-W31 AromaticContact CD2-NE1 3.64Å; Y27-W31 AromaticContact CE1-CD1 3.71Å; Y27-W31 HydrophobicContact CE1-CG 4.47Å; Y27-W31 AromaticContact CE1-NE1 3.96Å; Y27-W31 AromaticContact CE2-CD1 3.33Å; Y27-W31 AromaticContact CE2-NE1 2.94Å; Y27-W31 AromaticContact CG-CD1 3.96Å; Y27-W31 AromaticContact CZ-CD1 3.34Å; Y27-W31 AromaticContact CZ-CE2 3.93Å; Y27-W31 AromaticContact CZ-NE1 3.11Å; Y27-W31 VanDerWaalsContact O-CD1 3.28Å; Y27-W31 PolarHBondContact O-N 3.1Å; Y27-W31 PolarHBondContact OH-NE1 2.94Å; F28-W31 PolarHBondContact O-N 2.86Å; A29-W31 PolarHBondContact O-N 2.8Å; W31-I33 PolarHBondContact O-N 3.31Å; W31-S34 WeakPolarHBondContact O-CB 3.05Å; W31-S34 PolarHBondContact O-N 2.87Å; W31-S34 PolarHBondContact O-OG 3.22Å; W31-F35 HydrophobicContact CE3-CE2 4.15Å; W31-F35 HydrophobicContact CE3-CZ 4.16Å; W31-F35 HydrophobicContact CZ3-CZ 4.39Å; W31-F35 WeakPolarHBondContact O-CD2 3.3Å; W31-F35 VanDerWaalsContact O-CE2 3.27Å; W31-F35 WeakPolarHBondContact O-CE2 3.41Å; W31-F63 HydrophobicContact CE3-CZ 4.4Å; W31-F63 HydrophobicContact CZ3-CE1 4.28Å; W31-F63 AromaticContact CZ3-CZ 3.78Å; W31-F63 HydrophobicContact CZ3-CZ 3.78Å; W31-S100 WeakPolarHBondContact CB-OG 3.22Å
32	T	71.7	Confident	76.7	Confident	19 Å²	19	68.4 Å²	68.4	12%	0.117	36%	0.355	C	S	.	.	H	α-helix	trans	-57.5	-51.2	177.8	-67.3	0	0	0	0	111.6	F28 A29 S34 F35 H103	F28-T32 WeakPolarHBondContact CE2-OG1 3.4Å; F28-T32 WeakPolarHBondContact O-CB 3.46Å; F28-T32 PolarHBondContact O-N 3.33Å; F28-T32 PolarHBondContact O-OG1 2.8Å; A29-T32 PolarHBondContact O-N 3.3Å; T32-S34 PolarHBondContact O-N 2.85Å; T32-F35 PolarHBondContact O-N 2.64Å; T32-H103 WeakPolarHBondContact CG2-CD2 3.22Å; T32-H103 WeakPolarHBondContact CG2-NE2 3.27Å; T32-H103 PolarHBondContact OG1-CD2 3.35Å
33	I	76.7	Confident	76.9	Confident	112 Å²	112	67.3 Å²	67.3	57%	0.574	35%	0.349	S	S	*	.	H	α-helix	trans	-62.3	-32.8	-178.8	-68	166.5	0	0	0	111.4	A29 A30 W31 F35 W36 P37	A29-I33 WeakPolarHBondContact O-CB 3.38Å; A29-I33 VanDerWaalsContact O-CG1 3.26Å; A29-I33 WeakPolarHBondContact O-CG1 3.19Å; A29-I33 PolarHBondContact O-N 3.14Å; A30-I33 PolarHBondContact O-N 3.17Å; W31-I33 PolarHBondContact O-N 3.31Å; I33-F35 PolarHBondContact O-N 3.48Å; I33-F35 VanDerWaalsContact O-N 3.13Å; I33-W36 PolarHBondContact O-N 3.12Å; I33-W36 VanDerWaalsContact O-N 3.15Å; I33-P37 WeakPolarHBondContact O-CD 3.48Å
34	S	77.8	Confident	77.5	Confident	67 Å²	67	71.8 Å²	71.8	47%	0.469	36%	0.358	S	S	.	.	H	α-helix	trans	-61.6	-22.4	-177.1	78.6	0	0	0	0	114.6	A30 W31 T32 P37	A30-S34 WeakPolarHBondContact O-CB 3.33Å; A30-S34 PolarHBondContact O-N 3.01Å; W31-S34 WeakPolarHBondContact O-CB 3.05Å; W31-S34 PolarHBondContact O-N 2.87Å; W31-S34 PolarHBondContact O-OG 3.22Å; T32-S34 PolarHBondContact O-N 2.85Å; S34-P37 WeakPolarHBondContact O-CD 3.49Å
35	F	74.9	Confident	78.4	Confident	37 Å²	37	77.2 Å²	77.2	16%	0.162	37%	0.374	C	S	.	.	H	α-helix	trans	-82	-25.4	178.5	-66	-76.4	0	0	0	113.8	W31 T32 I33 F63 S104 N108	W31-F35 HydrophobicContact CE3-CE2 4.15Å; W31-F35 HydrophobicContact CE3-CZ 4.16Å; W31-F35 HydrophobicContact CZ3-CZ 4.39Å; W31-F35 WeakPolarHBondContact O-CD2 3.3Å; W31-F35 VanDerWaalsContact O-CE2 3.27Å; W31-F35 WeakPolarHBondContact O-CE2 3.41Å; T32-F35 PolarHBondContact O-N 2.64Å; I33-F35 PolarHBondContact O-N 3.48Å; I33-F35 VanDerWaalsContact O-N 3.13Å; F35-F63 HydrophobicContact CE1-CE2 4.25Å; F35-F63 HydrophobicContact CE1-CZ 4.43Å; F35-F63 HydrophobicContact CZ-CE1 4.42Å; F35-F63 HydrophobicContact CZ-CE2 4.04Å; F35-F63 AromaticContact CZ-CZ 3.79Å; F35-F63 HydrophobicContact CZ-CZ 3.79Å; F35-S104 WeakPolarHBondContact CE2-OG 3.43Å; F35-N108 HydrophobicContact CB-CB 3.74Å; F35-N108 WeakPolarHBondContact CB-OD1 3.14Å; F35-N108 HydrophobicContact CD1-CB 4.36Å; F35-N108 HydrophobicContact CD2-CB 4.42Å; F35-N108 HydrophobicContact CG-CB 3.93Å
36	W	78	Confident	79	Confident	131 Å²	131	76.3 Å²	76.3	50%	0.496	37%	0.374	S	S	.	.	H	α-helix	trans	-66.3	-40.1	-174.4	-69.5	80.1	0	0	0	114.7	I33 Q38 I39 V40	I33-W36 PolarHBondContact O-N 3.12Å; I33-W36 VanDerWaalsContact O-N 3.15Å; W36-Q38 VanDerWaalsContact C-N 3.26Å; W36-Q38 PolarHBondContact O-N 3.15Å; W36-I39 PolarHBondContact O-N 3.13Å; W36-I39 VanDerWaalsContact O-N 3.1Å; W36-V40 WeakPolarHBondContact O-CG2 3.47Å; W36-V40 PolarHBondContact O-N 3.22Å
37	P	83.2	Confident	79.2	Confident	84 Å²	84	73.1 Å²	73.1	55%	0.545	36%	0.355	S	S	.	.	H	α-helix	trans	-53.4	-42.4	179.2	-29.7	35.2	0	0	0	113.2	I33 S34 L41	I33-P37 WeakPolarHBondContact O-CD 3.48Å; S34-P37 WeakPolarHBondContact O-CD 3.49Å; P37-L41 WeakPolarHBondContact O-CB 3.49Å; P37-L41 PolarHBondContact O-N 3.4Å
38	Q	81.9	Confident	79.8	Confident	67 Å²	67	68.1 Å²	68.1	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-66.8	-42.4	178.9	-173.8	61.5	47.2	0	0	111.5	W36 L41 N42 L51	W36-Q38 VanDerWaalsContact C-N 3.26Å; W36-Q38 PolarHBondContact O-N 3.15Å; Q38-L41 PolarHBondContact O-N 3.44Å; Q38-N42 PolarHBondContact NE2-OD1 2.89Å; Q38-N42 WeakPolarHBondContact O-CB 3.3Å; Q38-N42 PolarHBondContact O-N 3.36Å; Q38-N42 PolarHBondContact O-ND2 3.29Å; Q38-N42 PolarHBondContact O-OD1 3.23Å; Q38-L51 HydrophobicContact CG-CD1 4.26Å
39	I	80.9	Confident	80.2	Confident	6 Å²	6	69.6 Å²	69.6	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-62.1	-50.5	177.7	-68	170.6	0	0	0	110.7	W36 L41 N42 I43 N108 F111	W36-I39 PolarHBondContact O-N 3.13Å; W36-I39 VanDerWaalsContact O-N 3.1Å; I39-L41 VanDerWaalsContact C-N 3.29Å; I39-L41 PolarHBondContact O-N 3.03Å; I39-N42 WeakPolarHBondContact O-CB 3.28Å; I39-N42 PolarHBondContact O-N 3.47Å; I39-I43 HydrophobicContact CG2-CD1 3.95Å; I39-I43 WeakPolarHBondContact O-CG1 3.48Å; I39-I43 PolarHBondContact O-N 3.46Å; I39-N108 HydrophobicContact CD1-CB 4.35Å; I39-N108 WeakPolarHBondContact CD1-OD1 3.46Å; I39-F111 HydrophobicContact CB-CD1 4.46Å; I39-F111 HydrophobicContact CD1-CD1 4Å; I39-F111 HydrophobicContact CG1-CD1 4.15Å; I39-F111 HydrophobicContact CG2-CD1 3.49Å; I39-F111 VanDerWaalsContact CG2-CD1 3.49Å; I39-F111 HydrophobicContact CG2-CE1 3.31Å
40	V	84.2	Confident	80.6	Confident	52 Å²	52	70.3 Å²	70.3	32%	0.315	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-42.3	178.1	172.6	0	0	0	0	110.4	W36 I43 R44	W36-V40 WeakPolarHBondContact O-CG2 3.47Å; W36-V40 PolarHBondContact O-N 3.22Å; V40-I43 PolarHBondContact O-N 3.31Å; V40-R44 HydrophobicContact CG1-CG 4.3Å; V40-R44 WeakPolarHBondContact O-CB 3.45Å; V40-R44 VanDerWaalsContact O-CG 3.28Å; V40-R44 WeakPolarHBondContact O-CG 3.22Å; V40-R44 PolarHBondContact O-N 2.92Å
41	L	80	Confident	80.9	Confident	74 Å²	74	68.3 Å²	68.3	39%	0.387	34%	0.341	S	S	.	.	H	α-helix	trans	-64.6	-43.5	177.5	-170.4	67.9	0	0	0	111.9	P37 Q38 I39 I43 R44 R45	P37-L41 WeakPolarHBondContact O-CB 3.49Å; P37-L41 PolarHBondContact O-N 3.4Å; Q38-L41 PolarHBondContact O-N 3.44Å; I39-L41 VanDerWaalsContact C-N 3.29Å; I39-L41 PolarHBondContact O-N 3.03Å; L41-I43 VanDerWaalsContact C-N 3.32Å; L41-I43 PolarHBondContact O-N 3.25Å; L41-R44 PolarHBondContact O-N 3.38Å; L41-R45 HydrophobicContact CD1-CG 4.13Å; L41-R45 HydrophobicContact CG-CG 4.33Å; L41-R45 WeakPolarHBondContact O-CB 3.25Å; L41-R45 WeakPolarHBondContact O-CG 3.41Å; L41-R45 PolarHBondContact O-N 3.38Å
42	N	83.8	Confident	81.5	Confident	2 Å²	2	68 Å²	68	1%	0.011	35%	0.347	C	S	.	.	H	α-helix	trans	-59.6	-43.6	175.8	-70.1	-12.4	0	0	0	111	Q38 I39 K46 V48 F119	Q38-N42 PolarHBondContact NE2-OD1 2.89Å; Q38-N42 WeakPolarHBondContact O-CB 3.3Å; Q38-N42 PolarHBondContact O-N 3.36Å; Q38-N42 PolarHBondContact O-ND2 3.29Å; Q38-N42 PolarHBondContact O-OD1 3.23Å; I39-N42 WeakPolarHBondContact O-CB 3.28Å; I39-N42 PolarHBondContact O-N 3.47Å; N42-K46 WeakPolarHBondContact O-CA 3.27Å; N42-K46 PolarHBondContact O-N 2.91Å; N42-V48 HydrophobicContact CB-CG1 4.35Å; N42-F119 HydrophobicContact CB-CD2 4.19Å; N42-F119 HydrophobicContact CB-CE2 4.12Å; N42-F119 WeakPolarHBondContact O-CD2 3.44Å; N42-F119 VanDerWaalsContact O-CE2 3.24Å; N42-F119 WeakPolarHBondContact O-CE2 3.49Å
43	I	83.4	Confident	82.3	Confident	68 Å²	68	68.3 Å²	68.3	35%	0.349	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-48.6	176.6	-67.5	166.7	0	0	0	111.2	I39 V40 L41 K46 F111 H115	I39-I43 HydrophobicContact CG2-CD1 3.95Å; I39-I43 WeakPolarHBondContact O-CG1 3.48Å; I39-I43 PolarHBondContact O-N 3.46Å; V40-I43 PolarHBondContact O-N 3.31Å; L41-I43 VanDerWaalsContact C-N 3.32Å; L41-I43 PolarHBondContact O-N 3.25Å; I43-K46 VanDerWaalsContact O-CD 3.31Å; I43-K46 WeakPolarHBondContact O-CD 3.15Å; I43-K46 WeakPolarHBondContact O-CE 3.49Å; I43-K46 PolarHBondContact O-N 3.39Å; I43-F111 HydrophobicContact CD1-CE1 4.34Å; I43-H115 WeakPolarHBondContact CG1-CE1 3.26Å
44	R	87.4	Confident	82.9	Confident	204 Å²	204	64.2 Å²	64.2	77%	0.77	33%	0.326	S	S	*	.	H	α-helix	trans	-64.7	-40.5	-177.8	-75.1	-179.2	-178.3	-171.4	2.1	112.2	V40 L41	V40-R44 HydrophobicContact CG1-CG 4.3Å; V40-R44 WeakPolarHBondContact O-CB 3.45Å; V40-R44 VanDerWaalsContact O-CG 3.28Å; V40-R44 WeakPolarHBondContact O-CG 3.22Å; V40-R44 PolarHBondContact O-N 2.92Å; L41-R44 PolarHBondContact O-N 3.38Å
45	R	86.2	Confident	83.3	Confident	130 Å²	130	66.9 Å²	66.9	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-83.6	-18.9	-178.4	-67.2	179.1	66.8	-172.9	-0.4	113.4	L41 S47	L41-R45 HydrophobicContact CD1-CG 4.13Å; L41-R45 HydrophobicContact CG-CG 4.33Å; L41-R45 WeakPolarHBondContact O-CB 3.25Å; L41-R45 WeakPolarHBondContact O-CG 3.41Å; L41-R45 PolarHBondContact O-N 3.38Å; R45-S47 PolarHBondContact O-N 3.46Å
46	K	85	Confident	83.8	Confident	123 Å²	123	66.1 Å²	66.1	54%	0.535	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	29.6	-169.1	-58.9	-67	-176.6	176.4	0	112.5	N42 I43 F119 K120	N42-K46 WeakPolarHBondContact O-CA 3.27Å; N42-K46 PolarHBondContact O-N 2.91Å; I43-K46 VanDerWaalsContact O-CD 3.31Å; I43-K46 WeakPolarHBondContact O-CD 3.15Å; I43-K46 WeakPolarHBondContact O-CE 3.49Å; I43-K46 PolarHBondContact O-N 3.39Å; K46-F119 HydrophobicContact CB-CD1 4.35Å; K46-F119 HydrophobicContact CD-CD1 4.1Å; K46-F119 HydrophobicContact CD-CE1 3.49Å; K46-F119 VanDerWaalsContact CD-CE1 3.49Å; K46-F119 HydrophobicContact CD-CZ 3.99Å; K46-K120 PolarHBondContact O-N 2.97Å
47	S	82.1	Confident	84.2	Confident	21 Å²	21	60.8 Å²	60.8	15%	0.147	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-152.7	139.9	-175.8	178.5	0	0	0	0	109.4	R45 V49 K120	R45-S47 PolarHBondContact O-N 3.46Å; S47-V49 VanDerWaalsContact OG-CG2 3.28Å; S47-V49 WeakPolarHBondContact OG-CG2 3.18Å; S47-V49 PolarHBondContact OG-N 2.74Å; S47-K120 WeakPolarHBondContact CA-O 3.19Å; S47-K120 PolarHBondContact OG-O 2.91Å; S47-K120 VanDerWaalsContact OG-O 3.11Å
48	V	83.8	Confident	84.2	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	30%	0.302	C	S	.	.			trans	-107.6	14.3	178.2	-63.5	0	0	0	0	112.2	N42 G50 L51 F53 F119 K120 R121 Q124	N42-V48 HydrophobicContact CB-CG1 4.35Å; V48-G50 PolarHBondContact O-N 3.33Å; V48-L51 WeakPolarHBondContact O-CB 3.41Å; V48-L51 PolarHBondContact O-N 3.3Å; V48-F53 HydrophobicContact CG2-CE1 4.01Å; V48-F53 HydrophobicContact CG2-CZ 4.01Å; V48-F119 HydrophobicContact CG1-CB 4.11Å; V48-F119 HydrophobicContact CG1-CD2 4.22Å; V48-K120 PolarHBondContact N-O 3.48Å; V48-R121 HydrophobicContact CG2-CB 4.15Å; V48-R121 HydrophobicContact CG2-CG 3.87Å; V48-Q124 PolarHBondContact O-OE1 3.43Å
49	V	79.4	Confident	84.3	Confident	70 Å²	70	59.5 Å²	59.5	42%	0.424	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-0.3	-174.2	173.8	0	0	0	0	114.4	S47 Q124	S47-V49 VanDerWaalsContact OG-CG2 3.28Å; S47-V49 WeakPolarHBondContact OG-CG2 3.18Å; S47-V49 PolarHBondContact OG-N 2.74Å; V49-Q124 PolarHBondContact O-NE2 3.31Å
50	G	81.6	Confident	84.4	Confident	57 Å²	57	60 Å²	60	59%	0.588	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-9.9	170	0	0	0	0	0	115.1	V48	V48-G50 PolarHBondContact O-N 3.33Å
51	L	82.9	Confident	84.4	Confident	12 Å²	12	58.1 Å²	58.1	6%	0.063	29%	0.293	C	S	.	.	S	Bend	trans	-88.6	120.4	-176.1	-178.2	61.2	0	0	0	109.6	Q38 V48 F53 L56 T112	Q38-L51 HydrophobicContact CG-CD1 4.26Å; V48-L51 WeakPolarHBondContact O-CB 3.41Å; V48-L51 PolarHBondContact O-N 3.3Å; L51-F53 WeakPolarHBondContact O-CD1 3.29Å; L51-F53 PolarHBondContact O-N 3.11Å; L51-L56 HydrophobicContact CD2-CD2 4.14Å; L51-T112 HydrophobicContact CD2-CG2 3.79Å
52	N	86.9	Confident	84.3	Confident	91 Å²	91	56.4 Å²	56.4	49%	0.487	29%	0.294	S	S	.	.			trans	-72.4	116.4	174.5	-174	-9.4	0	0	0	109.9	D54 F55 L56	N52-D54 VanDerWaalsContact C-N 3.25Å; N52-D54 PolarHBondContact O-N 2.85Å; N52-D54 WeakPolarHBondContact OD1-CB 3.31Å; N52-D54 PolarHBondContact OD1-N 3.39Å; N52-F55 HydrophobicContact CB-CB 4.06Å; N52-F55 WeakPolarHBondContact O-CB 3.47Å; N52-F55 PolarHBondContact O-N 2.81Å; N52-L56 PolarHBondContact O-N 3.16Å; N52-L56 VanDerWaalsContact O-N 3.07Å
53	F	87.5	Confident	84	Confident	25 Å²	25	57.5 Å²	57.5	11%	0.11	30%	0.299	C	S	.	.	H	α-helix	trans	-66.1	-28.3	-179.8	-72	2.3	0	0	0	112.8	V48 L51 L56 A57 R121 Q124 I126	V48-F53 HydrophobicContact CG2-CE1 4.01Å; V48-F53 HydrophobicContact CG2-CZ 4.01Å; L51-F53 WeakPolarHBondContact O-CD1 3.29Å; L51-F53 PolarHBondContact O-N 3.11Å; F53-L56 PolarHBondContact O-N 3.26Å; F53-A57 WeakPolarHBondContact O-CB 3.47Å; F53-A57 PolarHBondContact O-N 2.78Å; F53-R121 HydrophobicContact CE2-CB 4.27Å; F53-R121 HydrophobicContact CE2-CG 4.46Å; F53-R121 HydrophobicContact CZ-CB 3.88Å; F53-R121 HydrophobicContact CZ-CG 3.94Å; F53-Q124 HydrophobicContact CD2-CB 4.22Å; F53-Q124 HydrophobicContact CE2-CB 4.04Å; F53-Q124 HydrophobicContact CZ-CB 4.3Å; F53-I126 HydrophobicContact CB-CG1 4.01Å
54	D	89.5	Confident	83.9	Confident	26 Å²	26	55.8 Å²	55.8	14%	0.139	29%	0.29	C	S	.	.	H	α-helix	trans	-64.9	-46.4	174.4	-69.4	-9.2	0	0	0	111.1	N52 L56 A57 L58 I126 S127 C130	N52-D54 VanDerWaalsContact C-N 3.25Å; N52-D54 PolarHBondContact O-N 2.85Å; N52-D54 WeakPolarHBondContact OD1-CB 3.31Å; N52-D54 PolarHBondContact OD1-N 3.39Å; D54-L56 VanDerWaalsContact C-N 3.33Å; D54-L56 PolarHBondContact O-N 3.37Å; D54-A57 PolarHBondContact O-N 3.24Å; D54-L58 WeakPolarHBondContact O-CB 3.04Å; D54-L58 WeakPolarHBondContact O-CG 3.29Å; D54-L58 PolarHBondContact O-N 2.93Å; D54-I126 VanDerWaalsContact OD1-CA 3.23Å; D54-I126 WeakPolarHBondContact OD1-CA 3.33Å; D54-I126 WeakPolarHBondContact OD1-CG2 3.43Å; D54-S127 PolarHBondContact OD1-N 3.26Å; D54-S127 WeakPolarHBondContact OD2-CB 3.39Å; D54-C130 HydrophobicContact CB-CB 4.18Å; D54-C130 VanDerWaalsContact CB-SG 3.56Å; D54-C130 PolarHBondContact OD2-SG 3.33Å; D54-C130 VanDerWaalsContact OD2-SG 3.34Å
55	F	86.6	Confident	83.5	Confident	123 Å²	123	49.5 Å²	49.5	54%	0.539	27%	0.268	S	S	.	.	H	α-helix	trans	-59.1	-47	175.4	171.1	-93.5	0	0	0	110.5	N52 N59	N52-F55 HydrophobicContact CB-CB 4.06Å; N52-F55 WeakPolarHBondContact O-CB 3.47Å; N52-F55 PolarHBondContact O-N 2.81Å; F55-N59 WeakPolarHBondContact CD2-ND2 3.28Å; F55-N59 WeakPolarHBondContact CE2-ND2 3.39Å; F55-N59 VanDerWaalsContact CZ-ND2 3.3Å; F55-N59 WeakPolarHBondContact CZ-ND2 3.45Å; F55-N59 VanDerWaalsContact O-CB 3.28Å; F55-N59 WeakPolarHBondContact O-CB 3.33Å; F55-N59 PolarHBondContact O-N 3.07Å; F55-N59 PolarHBondContact O-ND2 3.47Å
56	L	86.3	Confident	82.7	Confident	21 Å²	21	47.9 Å²	47.9	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-48	178.7	-178.9	63.6	0	0	0	111.4	L51 N52 F53 D54 N59 S60 T112 I113	L51-L56 HydrophobicContact CD2-CD2 4.14Å; N52-L56 PolarHBondContact O-N 3.16Å; N52-L56 VanDerWaalsContact O-N 3.07Å; F53-L56 PolarHBondContact O-N 3.26Å; D54-L56 VanDerWaalsContact C-N 3.33Å; D54-L56 PolarHBondContact O-N 3.37Å; L56-N59 PolarHBondContact O-N 3.28Å; L56-S60 VanDerWaalsContact O-CB 3.26Å; L56-S60 WeakPolarHBondContact O-CB 3.43Å; L56-S60 PolarHBondContact O-N 3.32Å; L56-S60 PolarHBondContact O-OG 2.95Å; L56-T112 HydrophobicContact CD1-CG2 3.83Å; L56-T112 HydrophobicContact CD2-CG2 4.25Å; L56-I113 HydrophobicContact CD2-CG1 4.14Å; L56-I113 HydrophobicContact CG-CG1 4.43Å
57	A	84.9	Confident	82.1	Confident	19 Å²	19	42.2 Å²	42.2	16%	0.157	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-43.6	-176.9	0	0	0	0	0	112.5	F53 D54 S60 T61 I126 L134	F53-A57 WeakPolarHBondContact O-CB 3.47Å; F53-A57 PolarHBondContact O-N 2.78Å; D54-A57 PolarHBondContact O-N 3.24Å; A57-S60 PolarHBondContact O-N 2.98Å; A57-T61 WeakPolarHBondContact O-CB 3.39Å; A57-T61 PolarHBondContact O-N 3.46Å; A57-T61 PolarHBondContact O-OG1 3.28Å; A57-I126 HydrophobicContact CB-CD1 4.17Å; A57-L134 HydrophobicContact CB-CD1 3.84Å
58	L	85	Confident	81.6	Confident	72 Å²	72	45.2 Å²	45.2	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-67.6	-44.1	177.4	-71.3	170.6	0	0	0	111.9	D54 T61 G62 L134	D54-L58 WeakPolarHBondContact O-CB 3.04Å; D54-L58 WeakPolarHBondContact O-CG 3.29Å; D54-L58 PolarHBondContact O-N 2.93Å; L58-T61 PolarHBondContact O-N 3.37Å; L58-G62 PolarHBondContact O-N 3.49Å; L58-L134 HydrophobicContact CD2-CD2 4.07Å; L58-L134 HydrophobicContact CD2-CG 4.26Å
59	N	82.7	Confident	80.9	Confident	52 Å²	52	51.5 Å²	51.5	28%	0.278	28%	0.28	S	S	.	.	H	α-helix	trans	-62.4	-44.9	175.5	-85.3	-91.7	0	0	0	111.1	F55 L56 T61 G62 F63	F55-N59 WeakPolarHBondContact CD2-ND2 3.28Å; F55-N59 WeakPolarHBondContact CE2-ND2 3.39Å; F55-N59 VanDerWaalsContact CZ-ND2 3.3Å; F55-N59 WeakPolarHBondContact CZ-ND2 3.45Å; F55-N59 VanDerWaalsContact O-CB 3.28Å; F55-N59 WeakPolarHBondContact O-CB 3.33Å; F55-N59 PolarHBondContact O-N 3.07Å; F55-N59 PolarHBondContact O-ND2 3.47Å; L56-N59 PolarHBondContact O-N 3.28Å; N59-T61 VanDerWaalsContact C-N 3.27Å; N59-T61 PolarHBondContact O-N 3.5Å; N59-G62 PolarHBondContact O-N 2.89Å; N59-G62 VanDerWaalsContact O-N 3.16Å; N59-F63 HydrophobicContact CB-CD2 4.2Å; N59-F63 HydrophobicContact CB-CE2 4.21Å; N59-F63 WeakPolarHBondContact O-CD2 3.21Å; N59-F63 PolarHBondContact O-N 3.44Å
60	S	82.6	Confident	80.3	Confident	16 Å²	16	48.8 Å²	48.8	11%	0.112	26%	0.264	C	S	.	.	H	α-helix	trans	-55.2	-46.5	177.8	-57.6	0	0	0	0	111.5	L56 A57 L64 I109	L56-S60 VanDerWaalsContact O-CB 3.26Å; L56-S60 WeakPolarHBondContact O-CB 3.43Å; L56-S60 PolarHBondContact O-N 3.32Å; L56-S60 PolarHBondContact O-OG 2.95Å; A57-S60 PolarHBondContact O-N 2.98Å; S60-L64 WeakPolarHBondContact O-CB 3.34Å; S60-L64 PolarHBondContact O-N 2.63Å; S60-I109 WeakPolarHBondContact OG-CG2 3.27Å
61	T	84.2	Confident	79.6	Confident	13 Å²	13	47.7 Å²	47.7	8%	0.08	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-42	178.6	-56.5	0	0	0	0	111.6	A57 L58 N59 L64 F65 L134 L137 W138	A57-T61 WeakPolarHBondContact O-CB 3.39Å; A57-T61 PolarHBondContact O-N 3.46Å; A57-T61 PolarHBondContact O-OG1 3.28Å; L58-T61 PolarHBondContact O-N 3.37Å; N59-T61 VanDerWaalsContact C-N 3.27Å; N59-T61 PolarHBondContact O-N 3.5Å; T61-L64 WeakPolarHBondContact O-CB 3.27Å; T61-L64 PolarHBondContact O-N 3.45Å; T61-F65 HydrophobicContact CG2-CD2 3.7Å; T61-F65 HydrophobicContact CG2-CE2 3.38Å; T61-F65 HydrophobicContact CG2-CZ 4.49Å; T61-F65 WeakPolarHBondContact O-CD2 3.31Å; T61-F65 PolarHBondContact O-N 2.86Å; T61-L134 HydrophobicContact CG2-CD2 3.99Å; T61-L134 VanDerWaalsContact OG1-CD2 3.26Å; T61-L134 WeakPolarHBondContact OG1-CD2 3.24Å; T61-L137 HydrophobicContact CG2-CD2 3.62Å; T61-W138 HydrophobicContact CG2-CZ2 4.43Å
62	G	79.6	Confident	78.7	Confident	39 Å²	39	49.1 Å²	49.1	40%	0.402	26%	0.26	S	S	.	.	H	α-helix	trans	-63.1	-46.7	177.1	0	0	0	0	0	113.1	L58 N59 L64 F65 Y66	L58-G62 PolarHBondContact O-N 3.49Å; N59-G62 PolarHBondContact O-N 2.89Å; N59-G62 VanDerWaalsContact O-N 3.16Å; G62-L64 VanDerWaalsContact C-N 3.32Å; G62-L64 PolarHBondContact O-N 2.81Å; G62-F65 PolarHBondContact O-N 2.88Å; G62-Y66 VanDerWaalsContact O-CB 3.28Å; G62-Y66 WeakPolarHBondContact O-CB 3.44Å; G62-Y66 PolarHBondContact O-N 3.49Å
63	F	77.3	Confident	77.4	Confident	25 Å²	25	45.8 Å²	45.8	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-65.4	-34.6	176.8	-79.2	-66.8	0	0	0	112.5	W31 F35 N59 S67 Y105 I109	W31-F63 HydrophobicContact CE3-CZ 4.4Å; W31-F63 HydrophobicContact CZ3-CE1 4.28Å; W31-F63 AromaticContact CZ3-CZ 3.78Å; W31-F63 HydrophobicContact CZ3-CZ 3.78Å; F35-F63 HydrophobicContact CE1-CE2 4.25Å; F35-F63 HydrophobicContact CE1-CZ 4.43Å; F35-F63 HydrophobicContact CZ-CE1 4.42Å; F35-F63 HydrophobicContact CZ-CE2 4.04Å; F35-F63 AromaticContact CZ-CZ 3.79Å; F35-F63 HydrophobicContact CZ-CZ 3.79Å; N59-F63 HydrophobicContact CB-CD2 4.2Å; N59-F63 HydrophobicContact CB-CE2 4.21Å; N59-F63 WeakPolarHBondContact O-CD2 3.21Å; N59-F63 PolarHBondContact O-N 3.44Å; F63-S67 VanDerWaalsContact O-CB 3.29Å; F63-S67 WeakPolarHBondContact O-CB 3.14Å; F63-S67 PolarHBondContact O-N 3.18Å; F63-S67 PolarHBondContact O-OG 2.71Å; F63-Y105 HydrophobicContact CB-CD2 4.48Å; F63-I109 HydrophobicContact CB-CD1 3.64Å; F63-I109 HydrophobicContact CD2-CD1 3.44Å; F63-I109 VanDerWaalsContact CD2-CD1 3.44Å; F63-I109 HydrophobicContact CE2-CD1 4.37Å; F63-I109 HydrophobicContact CG-CD1 3.77Å
64	L	79.8	Confident	76.1	Confident	32 Å²	32	49 Å²	49	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-57.3	171.7	173.3	52.1	0	0	0	110.9	S60 T61 G62 Y66 S67 V68 Y105 W138	S60-L64 WeakPolarHBondContact O-CB 3.34Å; S60-L64 PolarHBondContact O-N 2.63Å; T61-L64 WeakPolarHBondContact O-CB 3.27Å; T61-L64 PolarHBondContact O-N 3.45Å; G62-L64 VanDerWaalsContact C-N 3.32Å; G62-L64 PolarHBondContact O-N 2.81Å; L64-Y66 VanDerWaalsContact C-N 3.28Å; L64-Y66 PolarHBondContact O-N 3.47Å; L64-S67 WeakPolarHBondContact O-CB 3.3Å; L64-S67 PolarHBondContact O-N 2.93Å; L64-S67 VanDerWaalsContact O-N 3.09Å; L64-V68 HydrophobicContact CD1-CG2 3.89Å; L64-V68 WeakPolarHBondContact O-CG2 3.08Å; L64-V68 PolarHBondContact O-N 3.12Å; L64-Y105 HydrophobicContact CB-CD2 3.88Å; L64-Y105 HydrophobicContact CB-CE2 3.45Å; L64-Y105 VanDerWaalsContact CB-CE2 3.45Å; L64-Y105 HydrophobicContact CD1-CD1 4.47Å; L64-Y105 HydrophobicContact CD1-CE1 3.74Å; L64-Y105 HydrophobicContact CD1-CE2 3.94Å; L64-Y105 VanDerWaalsContact CD1-CZ 3.45Å; L64-Y105 WeakPolarHBondContact CD1-OH 3.44Å; L64-Y105 HydrophobicContact CD2-CE2 4.38Å; L64-Y105 HydrophobicContact CG-CE2 4.08Å; L64-W138 HydrophobicContact CD2-CH2 3.46Å; L64-W138 VanDerWaalsContact CD2-CH2 3.46Å; L64-W138 HydrophobicContact CD2-CZ2 3.7Å
65	F	79.3	Confident	74.7	Confident	71 Å²	71	55 Å²	55	31%	0.311	28%	0.278	S	S	.	.	H	α-helix	trans	-60.3	-39.3	-179.3	-76.2	-55.8	0	0	0	112.1	T61 G62 V68 Y69 L137 A141	T61-F65 HydrophobicContact CG2-CD2 3.7Å; T61-F65 HydrophobicContact CG2-CE2 3.38Å; T61-F65 HydrophobicContact CG2-CZ 4.49Å; T61-F65 WeakPolarHBondContact O-CD2 3.31Å; T61-F65 PolarHBondContact O-N 2.86Å; G62-F65 PolarHBondContact O-N 2.88Å; F65-V68 PolarHBondContact O-N 3.49Å; F65-Y69 VanDerWaalsContact O-CB 3.28Å; F65-Y69 WeakPolarHBondContact O-CB 3.45Å; F65-Y69 PolarHBondContact O-N 3.34Å; F65-L137 HydrophobicContact CD2-CD2 4.13Å; F65-L137 HydrophobicContact CE2-CD1 4.19Å; F65-L137 HydrophobicContact CE2-CD2 3.53Å; F65-L137 HydrophobicContact CE2-CG 3.68Å; F65-L137 HydrophobicContact CZ-CD2 4.49Å; F65-L137 HydrophobicContact CZ-CG 4.2Å; F65-A141 HydrophobicContact CZ-CB 4.46Å
66	Y	70.6	Confident	73.6	Confident	96 Å²	96	53 Å²	53	38%	0.376	27%	0.272	S	S	.	.	H	α-helix	trans	-63.9	-41.5	175.7	-173.1	-119.6	0	0	0	111.8	G62 L64 Y69 N70 S101	G62-Y66 VanDerWaalsContact O-CB 3.28Å; G62-Y66 WeakPolarHBondContact O-CB 3.44Å; G62-Y66 PolarHBondContact O-N 3.49Å; L64-Y66 VanDerWaalsContact C-N 3.28Å; L64-Y66 PolarHBondContact O-N 3.47Å; Y66-Y69 PolarHBondContact O-N 2.92Å; Y66-N70 WeakPolarHBondContact CD1-ND2 3.14Å; Y66-N70 WeakPolarHBondContact CD2-ND2 3.37Å; Y66-N70 VanDerWaalsContact CE1-ND2 3.27Å; Y66-N70 WeakPolarHBondContact CE1-ND2 3.26Å; Y66-N70 VanDerWaalsContact CE2-ND2 3.26Å; Y66-N70 WeakPolarHBondContact CE2-ND2 3.25Å; Y66-N70 PolarHBondContact O-N 3.1Å; Y66-N70 PolarHBondContact O-ND2 2.99Å; Y66-S101 WeakPolarHBondContact CD1-OG 2.99Å; Y66-S101 WeakPolarHBondContact CE1-OG 3.4Å
67	S	71	Confident	72.2	Confident	5 Å²	5	56.6 Å²	56.6	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-63.5	-46	176.2	-59.6	0	0	0	0	111.3	F63 L64 Y69 N70 C71 S101	F63-S67 VanDerWaalsContact O-CB 3.29Å; F63-S67 WeakPolarHBondContact O-CB 3.14Å; F63-S67 PolarHBondContact O-N 3.18Å; F63-S67 PolarHBondContact O-OG 2.71Å; L64-S67 WeakPolarHBondContact O-CB 3.3Å; L64-S67 PolarHBondContact O-N 2.93Å; L64-S67 VanDerWaalsContact O-N 3.09Å; S67-Y69 PolarHBondContact O-N 3.42Å; S67-N70 PolarHBondContact O-N 3.03Å; S67-C71 PolarHBondContact O-N 3.36Å; S67-C71 PolarHBondContact O-SG 2.87Å; S67-S101 WeakPolarHBondContact OG-CB 3.5Å; S67-S101 PolarHBondContact OG-O 3.2Å
68	V	73	Confident	71	Confident	83 Å²	83	61.8 Å²	61.8	50%	0.503	32%	0.321	S	S	.	.	H	α-helix	trans	-60.2	-45	175.7	173.8	0	0	0	0	111.3	L64 F65 N70 C71 A72	L64-V68 HydrophobicContact CD1-CG2 3.89Å; L64-V68 WeakPolarHBondContact O-CG2 3.08Å; L64-V68 PolarHBondContact O-N 3.12Å; F65-V68 PolarHBondContact O-N 3.49Å; V68-N70 PolarHBondContact O-N 3.31Å; V68-C71 WeakPolarHBondContact O-CB 3.27Å; V68-C71 PolarHBondContact O-N 3.15Å; V68-A72 PolarHBondContact O-N 2.92Å
69	Y	68.9	Low	69.8	Low	133 Å²	133	60.5 Å²	60.5	52%	0.522	32%	0.316	S	S	.	.	H	α-helix	trans	-59.6	-46	177	175	-101.7	0	0	0	112.1	F65 Y66 S67 C71 A72 L73	F65-Y69 VanDerWaalsContact O-CB 3.28Å; F65-Y69 WeakPolarHBondContact O-CB 3.45Å; F65-Y69 PolarHBondContact O-N 3.34Å; Y66-Y69 PolarHBondContact O-N 2.92Å; S67-Y69 PolarHBondContact O-N 3.42Å; Y69-C71 PolarHBondContact O-N 3.39Å; Y69-A72 PolarHBondContact O-N 3.5Å; Y69-L73 HydrophobicContact CD1-CD1 4.08Å; Y69-L73 HydrophobicContact CE1-CD1 3.42Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.42Å; Y69-L73 HydrophobicContact CE1-CG 4.27Å; Y69-L73 HydrophobicContact CE2-CD1 4.25Å; Y69-L73 HydrophobicContact CE2-CG 4.38Å; Y69-L73 WeakPolarHBondContact O-CG 3.01Å; Y69-L73 PolarHBondContact O-N 3.5Å
70	N	65.6	Low	68.5	Low	13 Å²	13	60.8 Å²	60.8	7%	0.07	32%	0.321	C	S	.	.	H	α-helix	trans	-66.2	-36.1	177	-75.3	-69.6	0	0	0	112.3	Y66 S67 V68 F74 L94	Y66-N70 WeakPolarHBondContact CD1-ND2 3.14Å; Y66-N70 WeakPolarHBondContact CD2-ND2 3.37Å; Y66-N70 VanDerWaalsContact CE1-ND2 3.27Å; Y66-N70 WeakPolarHBondContact CE1-ND2 3.26Å; Y66-N70 VanDerWaalsContact CE2-ND2 3.26Å; Y66-N70 WeakPolarHBondContact CE2-ND2 3.25Å; Y66-N70 PolarHBondContact O-N 3.1Å; Y66-N70 PolarHBondContact O-ND2 2.99Å; S67-N70 PolarHBondContact O-N 3.03Å; V68-N70 PolarHBondContact O-N 3.31Å; N70-F74 PolarHBondContact O-N 3.36Å; N70-L94 WeakPolarHBondContact OD1-CD2 2.96Å
71	C	67	Low	67.4	Low	35 Å²	35	63.4 Å²	63.4	24%	0.236	34%	0.337	C	S	.	.	H	α-helix	trans	-59.2	-51.1	170.8	-69.1	0	0	0	0	111	S67 V68 Y69 L73 F74 Y75 Y102	S67-C71 PolarHBondContact O-N 3.36Å; S67-C71 PolarHBondContact O-SG 2.87Å; V68-C71 WeakPolarHBondContact O-CB 3.27Å; V68-C71 PolarHBondContact O-N 3.15Å; Y69-C71 PolarHBondContact O-N 3.39Å; C71-L73 VanDerWaalsContact C-N 3.33Å; C71-L73 PolarHBondContact O-N 2.61Å; C71-F74 PolarHBondContact O-N 2.89Å; C71-Y75 HydrophobicContact CB-CD2 4.21Å; C71-Y75 HydrophobicContact CB-CE2 4.36Å; C71-Y75 WeakPolarHBondContact O-CD2 3.21Å; C71-Y75 PolarHBondContact O-N 3.4Å; C71-Y102 WeakPolarHBondContact SG-CE1 2.96Å; C71-Y102 PolarHBondContact SG-OH 2.87Å
72	A	64	Low	66.2	Low	41 Å²	41	68.2 Å²	68.2	34%	0.339	36%	0.359	S	S	.	.	H	α-helix	trans	-60.1	-43	-176.5	0	0	0	0	0	111.6	V68 Y69 F74 I76	V68-A72 PolarHBondContact O-N 2.92Å; Y69-A72 PolarHBondContact O-N 3.5Å; A72-F74 PolarHBondContact O-N 3.47Å; A72-I76 HydrophobicContact CB-CD1 4.23Å; A72-I76 WeakPolarHBondContact O-CB 3.12Å; A72-I76 WeakPolarHBondContact O-CD1 3.3Å; A72-I76 WeakPolarHBondContact O-CG1 3.28Å; A72-I76 PolarHBondContact O-N 2.93Å; A72-I76 VanDerWaalsContact O-N 3.12Å
73	L	60.7	Low	65.2	Low	22 Å²	22	69 Å²	69	12%	0.115	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-31.7	175.4	-71.1	-177.7	0	0	0	113.2	Y69 C71 V79 C80 L94	Y69-L73 HydrophobicContact CD1-CD1 4.08Å; Y69-L73 HydrophobicContact CE1-CD1 3.42Å; Y69-L73 VanDerWaalsContact CE1-CD1 3.42Å; Y69-L73 HydrophobicContact CE1-CG 4.27Å; Y69-L73 HydrophobicContact CE2-CD1 4.25Å; Y69-L73 HydrophobicContact CE2-CG 4.38Å; Y69-L73 WeakPolarHBondContact O-CG 3.01Å; Y69-L73 PolarHBondContact O-N 3.5Å; C71-L73 VanDerWaalsContact C-N 3.33Å; C71-L73 PolarHBondContact O-N 2.61Å; L73-V79 HydrophobicContact CD2-CG1 3.48Å; L73-V79 VanDerWaalsContact CD2-CG1 3.48Å; L73-C80 PolarHBondContact O-SG 3.18Å; L73-L94 HydrophobicContact CB-CD2 4.41Å; L73-L94 HydrophobicContact CD1-CD2 3.32Å
74	F	60.4	Low	64.1	Low	91 Å²	91	75 Å²	75	40%	0.399	37%	0.373	S	S	.	.	H	α-helix	trans	-80.7	-44.6	-179.7	-178.2	-116.6	0	0	0	113.3	N70 C71 A72 R98	N70-F74 PolarHBondContact O-N 3.36Å; C71-F74 PolarHBondContact O-N 2.89Å; A72-F74 PolarHBondContact O-N 3.47Å; F74-R98 VanDerWaalsContact CE2-CZ 3.44Å
75	Y	60	Low	63.1	Low	154 Å²	154	79.2 Å²	79.2	60%	0.604	40%	0.396	S	S	*	.	H	α-helix	trans	-83.5	-15.5	-174	-70.4	-69.8	0	0	0	113.7	C71 P77	C71-Y75 HydrophobicContact CB-CD2 4.21Å; C71-Y75 HydrophobicContact CB-CE2 4.36Å; C71-Y75 WeakPolarHBondContact O-CD2 3.21Å; C71-Y75 PolarHBondContact O-N 3.4Å; Y75-P77 WeakPolarHBondContact O-CD 3.13Å
76	I	63.1	Low	62.2	Low	80 Å²	80	79.2 Å²	79.2	41%	0.41	41%	0.405	S	S	.	.			trans	-92.4	99.3	176.3	-57.3	168.9	0	0	0	108.9	A72 L78 V79 C80	A72-I76 HydrophobicContact CB-CD1 4.23Å; A72-I76 WeakPolarHBondContact O-CB 3.12Å; A72-I76 WeakPolarHBondContact O-CD1 3.3Å; A72-I76 WeakPolarHBondContact O-CG1 3.28Å; A72-I76 PolarHBondContact O-N 2.93Å; A72-I76 VanDerWaalsContact O-N 3.12Å; I76-L78 HydrophobicContact CG2-CB 4.24Å; I76-L78 PolarHBondContact O-N 3.34Å; I76-V79 HydrophobicContact CB-CB 4.49Å; I76-V79 HydrophobicContact CB-CG2 4.12Å; I76-V79 HydrophobicContact CG2-CB 4.38Å; I76-V79 HydrophobicContact CG2-CG2 3.71Å; I76-V79 PolarHBondContact O-N 2.97Å; I76-V79 VanDerWaalsContact O-N 3.13Å; I76-C80 PolarHBondContact O-N 2.75Å
77	P	55.8	Low	61.4	Low	96 Å²	96	77.4 Å²	77.4	62%	0.623	42%	0.416	S	S	*	.	H	α-helix	trans	-61.5	-32.3	-174.8	23.4	-33.7	0	0	0	112.5	Y75 V79 C80 T81	Y75-P77 WeakPolarHBondContact O-CD 3.13Å; P77-V79 VanDerWaalsContact C-N 3.28Å; P77-V79 PolarHBondContact O-N 2.96Å; P77-C80 WeakPolarHBondContact O-CB 3.42Å; P77-C80 PolarHBondContact O-N 3.21Å; P77-T81 PolarHBondContact O-N 3.26Å; P77-T81 PolarHBondContact O-OG1 3.49Å; P77-T81 VanDerWaalsContact O-OG1 3.13Å
78	L	59.7	Low	60.5	Low	128 Å²	128	78.4 Å²	78.4	67%	0.67	42%	0.423	S	S	*	.	H	α-helix	trans	-59.3	-38.3	178.2	-174.7	66.1	0	0	0	112.4	I76 T81 E82	I76-L78 HydrophobicContact CG2-CB 4.24Å; I76-L78 PolarHBondContact O-N 3.34Å; L78-T81 WeakPolarHBondContact CA-OG1 3.47Å; L78-T81 PolarHBondContact O-OG1 3.17Å; L78-E82 WeakPolarHBondContact O-CB 3.26Å; L78-E82 PolarHBondContact O-N 2.99Å; L78-E82 VanDerWaalsContact O-N 3.1Å
79	V	60.7	Low	59.4	Low	46 Å²	46	79.5 Å²	79.5	28%	0.279	43%	0.434	S	S	.	.	H	α-helix	trans	-75.1	-37.7	179.8	-178.1	0	0	0	0	110.6	L73 I76 P77 T81 Q83	L73-V79 HydrophobicContact CD2-CG1 3.48Å; L73-V79 VanDerWaalsContact CD2-CG1 3.48Å; I76-V79 HydrophobicContact CB-CB 4.49Å; I76-V79 HydrophobicContact CB-CG2 4.12Å; I76-V79 HydrophobicContact CG2-CB 4.38Å; I76-V79 HydrophobicContact CG2-CG2 3.71Å; I76-V79 PolarHBondContact O-N 2.97Å; I76-V79 VanDerWaalsContact O-N 3.13Å; P77-V79 VanDerWaalsContact C-N 3.28Å; P77-V79 PolarHBondContact O-N 2.96Å; V79-T81 VanDerWaalsContact C-N 3.35Å; V79-T81 PolarHBondContact O-N 2.9Å; V79-Q83 HydrophobicContact CG1-CG 4.41Å; V79-Q83 WeakPolarHBondContact O-CB 3.38Å; V79-Q83 WeakPolarHBondContact O-CG 3.39Å; V79-Q83 PolarHBondContact O-N 3.32Å; V79-Q83 VanDerWaalsContact O-N 3.08Å
80	C	56.3	Low	58.3	Low	57 Å²	57	77.4 Å²	77.4	39%	0.385	44%	0.444	S	S	.	.	H	α-helix	trans	-61.2	-41.8	173.9	-77.1	0	0	0	0	112.3	L73 I76 P77 R84	L73-C80 PolarHBondContact O-SG 3.18Å; I76-C80 PolarHBondContact O-N 2.75Å; P77-C80 WeakPolarHBondContact O-CB 3.42Å; P77-C80 PolarHBondContact O-N 3.21Å; C80-R84 VanDerWaalsContact O-CB 3.25Å; C80-R84 WeakPolarHBondContact O-CB 3.34Å; C80-R84 PolarHBondContact O-N 3.49Å; C80-R84 VanDerWaalsContact O-N 3.11Å
81	T	57.8	Low	57.5	Low	71 Å²	71	82.9 Å²	82.9	44%	0.436	46%	0.464	S	S	.	.	H	α-helix	trans	-71.6	-41.6	-179.9	47.8	0	0	0	0	112.3	P77 L78 V79 R84 N85	P77-T81 PolarHBondContact O-N 3.26Å; P77-T81 PolarHBondContact O-OG1 3.49Å; P77-T81 VanDerWaalsContact O-OG1 3.13Å; L78-T81 WeakPolarHBondContact CA-OG1 3.47Å; L78-T81 PolarHBondContact O-OG1 3.17Å; V79-T81 VanDerWaalsContact C-N 3.35Å; V79-T81 PolarHBondContact O-N 2.9Å; T81-R84 WeakPolarHBondContact O-CB 3.47Å; T81-R84 PolarHBondContact O-N 2.88Å; T81-R84 VanDerWaalsContact O-N 3.16Å; T81-N85 PolarHBondContact O-N 3.48Å
82	E	60.2	Low	56.5	Low	115 Å²	115	85 Å²	85	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-64.7	-46.5	179.5	-168.5	59.5	-154.1	0	0	111.2	L78 R84 N85 S86	L78-E82 WeakPolarHBondContact O-CB 3.26Å; L78-E82 PolarHBondContact O-N 2.99Å; L78-E82 VanDerWaalsContact O-N 3.1Å; E82-R84 PolarHBondContact O-N 2.94Å; E82-N85 PolarHBondContact O-N 2.96Å; E82-N85 VanDerWaalsContact O-N 3.08Å; E82-S86 PolarHBondContact O-N 3.35Å; E82-S86 PolarHBondContact O-OG 2.88Å
83	Q	57.3	Low	55.6	Low	54 Å²	54	85.3 Å²	85.3	25%	0.252	47%	0.467	S	S	.	.	H	α-helix	trans	-64.9	-27.1	175.7	-70.5	-170.6	-12.4	0	0	113	V79	V79-Q83 HydrophobicContact CG1-CG 4.41Å; V79-Q83 WeakPolarHBondContact O-CB 3.38Å; V79-Q83 WeakPolarHBondContact O-CG 3.39Å; V79-Q83 PolarHBondContact O-N 3.32Å; V79-Q83 VanDerWaalsContact O-N 3.08Å
84	R	54.6	Low	55.2	Low	151 Å²	151	86.7 Å²	86.7	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-69.7	-36.4	174.3	171.2	162.1	-172	171.2	2	111.9	C80 T81 E82 R92	C80-R84 VanDerWaalsContact O-CB 3.25Å; C80-R84 WeakPolarHBondContact O-CB 3.34Å; C80-R84 PolarHBondContact O-N 3.49Å; C80-R84 VanDerWaalsContact O-N 3.11Å; T81-R84 WeakPolarHBondContact O-CB 3.47Å; T81-R84 PolarHBondContact O-N 2.88Å; T81-R84 VanDerWaalsContact O-N 3.16Å; E82-R84 PolarHBondContact O-N 2.94Å; R84-R92 VanDerWaalsContact CA-NH2 3.28Å; R84-R92 PolarHBondContact O-NH2 2.92Å
85	N	59.2	Low	54.5	Low	121 Å²	121	85.2 Å²	85.2	65%	0.647	47%	0.474	S	S	*	.	H	α-helix	trans	-80.8	-30.3	-178.9	-68.4	-13.8	0	0	0	112.8	T81 E82 G87	T81-N85 PolarHBondContact O-N 3.48Å; E82-N85 PolarHBondContact O-N 2.96Å; E82-N85 VanDerWaalsContact O-N 3.08Å; N85-G87 PolarHBondContact O-N 2.91Å
86	S	59.6	Low	53.8	Low	71 Å²	71	79.7 Å²	79.7	50%	0.497	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	13.3	-179.7	-45.3	0	0	0	0	115.6	E82 S88	E82-S86 PolarHBondContact O-N 3.35Å; E82-S86 PolarHBondContact O-OG 2.88Å; S86-S88 PolarHBondContact O-N 3.32Å
87	G	54.1	Low	53.4	Low	59 Å²	59	77.5 Å²	77.5	61%	0.608	45%	0.449	S	S	*	.			trans	63.2	0.7	172.9	0	0	0	0	0	116.5	N85 S89	N85-G87 PolarHBondContact O-N 2.91Å; G87-S89 PolarHBondContact O-N 3.44Å
88	S	52.5	Low	53.5	Low	26 Å²	26	76.8 Å²	76.8	18%	0.182	43%	0.434	C	S	.	.			trans	-81.5	86.9	-178	61	0	0	0	0	111.3	S86 A90 R91	S86-S88 PolarHBondContact O-N 3.32Å; S88-A90 PolarHBondContact O-N 3.25Å; S88-R91 PolarHBondContact O-N 3.28Å; S88-R91 PolarHBondContact OG-NE 2.91Å; S88-R91 VanDerWaalsContact OG-NE 3.15Å; S88-R91 PolarHBondContact OG-NH2 3.37Å
89	S	49.3	Very low	53.5	Low	105 Å²	105	72.5 Å²	72.5	73%	0.734	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-51.3	-23.8	174.9	-48.5	0	0	0	0	113.7	G87 R91	G87-S89 PolarHBondContact O-N 3.44Å; S89-R91 PolarHBondContact O-N 3.32Å
90	A	47.2	Very low	53.4	Low	89 Å²	89	70.6 Å²	70.6	74%	0.736	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-70.3	-21.3	-177.2	0	0	0	0	0	115.2	S88	S88-A90 PolarHBondContact O-N 3.25Å
91	R	48.4	Very low	53.5	Low	129 Å²	129	68 Å²	68	49%	0.487	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-97.4	-12	-175.2	-81.1	179.2	-80.2	-127.3	1.7	114.8	S88 S89 C93 L94	S88-R91 PolarHBondContact O-N 3.28Å; S88-R91 PolarHBondContact OG-NE 2.91Å; S88-R91 VanDerWaalsContact OG-NE 3.15Å; S88-R91 PolarHBondContact OG-NH2 3.37Å; S89-R91 PolarHBondContact O-N 3.32Å; R91-C93 PolarHBondContact O-N 3.32Å; R91-L94 WeakPolarHBondContact O-CD1 3.33Å; R91-L94 PolarHBondContact O-N 3.37Å
92	R	45.1	Very low	53.9	Low	78 Å²	78	68 Å²	68	29%	0.294	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.4	177.4	-142.6	161.3	-66	-155	5.4	112.7	R84 L94	R84-R92 VanDerWaalsContact CA-NH2 3.28Å; R84-R92 PolarHBondContact O-NH2 2.92Å; R92-L94 PolarHBondContact O-N 3.31Å
93	C	46	Very low	54.2	Low	49 Å²	49	65 Å²	65	33%	0.331	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-6.1	173.2	-89.5	0	0	0	0	115.3	S20 R91 C95 C96 S97	S20-C93 PolarHBondContact OG-SG 3.32Å; R91-C93 PolarHBondContact O-N 3.32Å; C93-C95 PolarHBondContact O-N 3.46Å; C93-C95 VanDerWaalsContact O-N 3.14Å; C93-C96 PolarHBondContact O-N 3.39Å; C93-S97 PolarHBondContact O-N 2.9Å
94	L	51.7	Low	54.4	Low	50 Å²	50	62.4 Å²	62.4	26%	0.262	35%	0.352	S	S	.	.	H	α-helix	trans	-58.9	-26.2	172.7	-96.1	88.6	0	0	0	112.5	N70 L73 R91 R92 C96 S97 R98	N70-L94 WeakPolarHBondContact OD1-CD2 2.96Å; L73-L94 HydrophobicContact CB-CD2 4.41Å; L73-L94 HydrophobicContact CD1-CD2 3.32Å; R91-L94 WeakPolarHBondContact O-CD1 3.33Å; R91-L94 PolarHBondContact O-N 3.37Å; R92-L94 PolarHBondContact O-N 3.31Å; L94-C96 PolarHBondContact O-N 3.04Å; L94-S97 PolarHBondContact O-N 2.82Å; L94-R98 PolarHBondContact O-N 3.16Å
95	C	45.2	Very low	54.9	Low	61 Å²	61	58.6 Å²	58.6	41%	0.412	34%	0.338	S	S	.	.	H	α-helix	trans	-61.6	-31	174.3	-62.2	0	0	0	0	113.1	C93 R98	C93-C95 PolarHBondContact O-N 3.46Å; C93-C95 VanDerWaalsContact O-N 3.14Å; C95-R98 VanDerWaalsContact CB-NH1 3.28Å; C95-R98 WeakPolarHBondContact O-CB 3.43Å; C95-R98 WeakPolarHBondContact O-CG 3.23Å; C95-R98 VanDerWaalsContact SG-CZ 3.6Å; C95-R98 PolarHBondContact SG-NH2 2.71Å
96	C	46.7	Very low	55.3	Low	37 Å²	37	58 Å²	58	25%	0.25	33%	0.334	C	S	.	.	H	α-helix	trans	-87.6	-26.4	179.3	-60.3	0	0	0	0	112.2	C93 L94 R98 P99	C93-C96 PolarHBondContact O-N 3.39Å; L94-C96 PolarHBondContact O-N 3.04Å; C96-R98 PolarHBondContact O-N 3.46Å; C96-P99 WeakPolarHBondContact O-CD 3.32Å
97	S	53.3	Low	55.7	Low	34 Å²	34	57.8 Å²	57.8	24%	0.238	33%	0.331	C	S	.	.	H	α-helix	trans	-73	-11.2	173.1	-56.9	0	0	0	0	113.6	C93 L94 S100	C93-S97 PolarHBondContact O-N 2.9Å; L94-S97 PolarHBondContact O-N 2.82Å; S97-S100 PolarHBondContact O-N 2.87Å
98	R	58.9	Low	56.6	Low	82 Å²	82	55.2 Å²	55.2	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-47.8	-51.9	-173.5	-85.7	-175.4	-170.5	116.6	14	114.9	F74 L94 C95 C96 S100 Y102	F74-R98 VanDerWaalsContact CE2-CZ 3.44Å; L94-R98 PolarHBondContact O-N 3.16Å; C95-R98 VanDerWaalsContact CB-NH1 3.28Å; C95-R98 WeakPolarHBondContact O-CB 3.43Å; C95-R98 WeakPolarHBondContact O-CG 3.23Å; C95-R98 VanDerWaalsContact SG-CZ 3.6Å; C95-R98 PolarHBondContact SG-NH2 2.71Å; C96-R98 PolarHBondContact O-N 3.46Å; R98-S100 VanDerWaalsContact C-N 3.31Å; R98-S100 PolarHBondContact O-N 3.33Å; R98-Y102 WeakPolarHBondContact O-CD2 3.35Å
99	P	60.1	Low	57.7	Low	37 Å²	37	54.3 Å²	54.3	24%	0.24	30%	0.297	C	S	.	.	H	α-helix	trans	-74.5	-24	-165.7	-16.6	32.7	0	0	0	113	W25 F28 C96 H103	W25-P99 HydrophobicContact CH2-CG 4.19Å; W25-P99 HydrophobicContact CZ3-CG 4.09Å; F28-P99 HydrophobicContact CD1-CB 4.19Å; F28-P99 HydrophobicContact CD2-CB 3.73Å; F28-P99 HydrophobicContact CE1-CB 3.9Å; F28-P99 HydrophobicContact CE2-CB 3.43Å; F28-P99 VanDerWaalsContact CE2-CB 3.43Å; F28-P99 WeakPolarHBondContact CE2-O 3.32Å; F28-P99 HydrophobicContact CG-CB 4.09Å; F28-P99 HydrophobicContact CZ-CB 3.5Å; C96-P99 WeakPolarHBondContact O-CD 3.32Å; P99-H103 VanDerWaalsContact O-CB 3.24Å; P99-H103 WeakPolarHBondContact O-CB 3.09Å; P99-H103 PolarHBondContact O-N 2.82Å
100	S	58.2	Low	59.1	Low	7 Å²	7	52.1 Å²	52.1	5%	0.049	28%	0.28	C	S	.	.	H	α-helix	trans	-66.3	-48.3	-171.9	-162.1	0	0	0	0	112.9	W31 S97 R98 H103 S104	W31-S100 WeakPolarHBondContact CB-OG 3.22Å; S97-S100 PolarHBondContact O-N 2.87Å; R98-S100 VanDerWaalsContact C-N 3.31Å; R98-S100 PolarHBondContact O-N 3.33Å; S100-H103 PolarHBondContact O-N 2.88Å; S100-S104 VanDerWaalsContact O-CB 3.26Å; S100-S104 WeakPolarHBondContact O-CB 3.45Å; S100-S104 PolarHBondContact O-N 2.81Å; S100-S104 PolarHBondContact O-OG 2.91Å
101	S	59.2	Low	60.7	Low	3 Å²	3	52.3 Å²	52.3	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-45.3	-178.6	-45.3	0	0	0	0	110.9	Y66 S67 S104 Y105	Y66-S101 WeakPolarHBondContact CD1-OG 2.99Å; Y66-S101 WeakPolarHBondContact CE1-OG 3.4Å; S67-S101 WeakPolarHBondContact OG-CB 3.5Å; S67-S101 PolarHBondContact OG-O 3.2Å; S101-S104 PolarHBondContact O-N 3.31Å; S101-Y105 VanDerWaalsContact O-CB 3.27Å; S101-Y105 WeakPolarHBondContact O-CB 3.44Å; S101-Y105 PolarHBondContact O-N 2.98Å
102	Y	65.1	Low	62.2	Low	69 Å²	69	46.7 Å²	46.7	27%	0.271	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-47.6	176.9	-65.8	-64.1	0	0	0	111.8	C71 R98 S104 Y105 L106	C71-Y102 WeakPolarHBondContact SG-CE1 2.96Å; C71-Y102 PolarHBondContact SG-OH 2.87Å; R98-Y102 WeakPolarHBondContact O-CD2 3.35Å; Y102-S104 PolarHBondContact O-N 2.91Å; Y102-Y105 PolarHBondContact O-N 3.06Å; Y102-L106 HydrophobicContact CD1-CD1 4.33Å; Y102-L106 WeakPolarHBondContact O-CB 3.33Å; Y102-L106 VanDerWaalsContact O-CG 3.3Å; Y102-L106 WeakPolarHBondContact O-CG 3.48Å; Y102-L106 PolarHBondContact O-N 3.02Å
103	H	67.4	Low	64	Low	53 Å²	53	46.4 Å²	46.4	25%	0.245	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-38.4	-178.3	-173.2	75.4	0	0	0	112.4	F28 T32 P99 S100 C107 N108	F28-H103 HydrophobicContact CE2-CB 4.03Å; F28-H103 HydrophobicContact CZ-CB 4.42Å; T32-H103 WeakPolarHBondContact CG2-CD2 3.22Å; T32-H103 WeakPolarHBondContact CG2-NE2 3.27Å; T32-H103 PolarHBondContact OG1-CD2 3.35Å; P99-H103 VanDerWaalsContact O-CB 3.24Å; P99-H103 WeakPolarHBondContact O-CB 3.09Å; P99-H103 PolarHBondContact O-N 2.82Å; S100-H103 PolarHBondContact O-N 2.88Å; H103-C107 WeakPolarHBondContact O-CB 3.5Å; H103-C107 PolarHBondContact O-N 2.99Å; H103-N108 PolarHBondContact CD2-ND2 3.06Å; H103-N108 PolarHBondContact NE2-ND2 3.5Å; H103-N108 VanDerWaalsContact NE2-ND2 3.12Å; H103-N108 PolarHBondContact O-N 3.09Å; H103-N108 PolarHBondContact O-ND2 3.37Å
104	S	60.6	Low	65.8	Low	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	I	π-helix	trans	-67.1	-47.6	177.6	-54.6	0	0	0	0	111.3	F35 S100 S101 Y102 N108 I109	F35-S104 WeakPolarHBondContact CE2-OG 3.43Å; S100-S104 VanDerWaalsContact O-CB 3.26Å; S100-S104 WeakPolarHBondContact O-CB 3.45Å; S100-S104 PolarHBondContact O-N 2.81Å; S100-S104 PolarHBondContact O-OG 2.91Å; S101-S104 PolarHBondContact O-N 3.31Å; Y102-S104 PolarHBondContact O-N 2.91Å; S104-N108 PolarHBondContact O-N 2.87Å; S104-I109 WeakPolarHBondContact O-CG1 3.48Å; S104-I109 PolarHBondContact O-N 3.44Å; S104-I109 VanDerWaalsContact O-N 3.12Å
105	Y	66.2	Low	67.2	Low	71 Å²	71	46.3 Å²	46.3	28%	0.278	24%	0.241	S	C	.	.	I	π-helix	trans	-76.4	-40.6	-176.9	-178.9	-106.4	0	0	0	113.8	F63 L64 S101 Y102 P110	F63-Y105 HydrophobicContact CB-CD2 4.48Å; L64-Y105 HydrophobicContact CB-CD2 3.88Å; L64-Y105 HydrophobicContact CB-CE2 3.45Å; L64-Y105 VanDerWaalsContact CB-CE2 3.45Å; L64-Y105 HydrophobicContact CD1-CD1 4.47Å; L64-Y105 HydrophobicContact CD1-CE1 3.74Å; L64-Y105 HydrophobicContact CD1-CE2 3.94Å; L64-Y105 VanDerWaalsContact CD1-CZ 3.45Å; L64-Y105 WeakPolarHBondContact CD1-OH 3.44Å; L64-Y105 HydrophobicContact CD2-CE2 4.38Å; L64-Y105 HydrophobicContact CG-CE2 4.08Å; S101-Y105 VanDerWaalsContact O-CB 3.27Å; S101-Y105 WeakPolarHBondContact O-CB 3.44Å; S101-Y105 PolarHBondContact O-N 2.98Å; Y102-Y105 PolarHBondContact O-N 3.06Å; Y105-P110 WeakPolarHBondContact O-CD 3.49Å; Y105-P110 VanDerWaalsContact O-CG 3.29Å; Y105-P110 WeakPolarHBondContact O-CG 3.33Å
106	L	66	Low	69	Low	108 Å²	108	43.9 Å²	43.9	57%	0.565	23%	0.225	S	C	*	.	I	π-helix	trans	-82.3	-33.5	-175.3	-64.3	172.6	0	0	0	112.8	Y102	Y102-L106 HydrophobicContact CD1-CD1 4.33Å; Y102-L106 WeakPolarHBondContact O-CB 3.33Å; Y102-L106 VanDerWaalsContact O-CG 3.3Å; Y102-L106 WeakPolarHBondContact O-CG 3.48Å; Y102-L106 PolarHBondContact O-N 3.02Å
107	C	68.9	Low	70.6	Confident	66 Å²	66	45.7 Å²	45.7	45%	0.446	24%	0.235	S	C	.	.	I	π-helix	trans	-107.5	-58.9	-173.7	-57.7	0	0	0	0	112.3	H103 F111	H103-C107 WeakPolarHBondContact O-CB 3.5Å; H103-C107 PolarHBondContact O-N 2.99Å; C107-F111 WeakPolarHBondContact O-CB 3.42Å; C107-F111 PolarHBondContact O-N 2.89Å
108	N	71.6	Confident	72	Confident	5 Å²	5	50 Å²	50	3%	0.027	25%	0.251	C	S	.	.	I	π-helix	trans	-75.2	-40.6	-165.7	-72.6	-75.8	0	0	0	113.9	F35 I39 H103 S104 T112	F35-N108 HydrophobicContact CB-CB 3.74Å; F35-N108 WeakPolarHBondContact CB-OD1 3.14Å; F35-N108 HydrophobicContact CD1-CB 4.36Å; F35-N108 HydrophobicContact CD2-CB 4.42Å; F35-N108 HydrophobicContact CG-CB 3.93Å; I39-N108 HydrophobicContact CD1-CB 4.35Å; I39-N108 WeakPolarHBondContact CD1-OD1 3.46Å; H103-N108 PolarHBondContact CD2-ND2 3.06Å; H103-N108 PolarHBondContact NE2-ND2 3.5Å; H103-N108 VanDerWaalsContact NE2-ND2 3.12Å; H103-N108 PolarHBondContact O-N 3.09Å; H103-N108 PolarHBondContact O-ND2 3.37Å; S104-N108 PolarHBondContact O-N 2.87Å; N108-T112 WeakPolarHBondContact O-CB 3.29Å; N108-T112 PolarHBondContact O-N 3.37Å; N108-T112 PolarHBondContact O-OG1 3.09Å
109	I	77.7	Confident	73.3	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.041	24%	0.242	C	C	.	.	H	α-helix	trans	-71.1	-49.9	-177	-69.6	171.1	0	0	0	111.9	S60 F63 S104 F111 T112 I113	S60-I109 WeakPolarHBondContact OG-CG2 3.27Å; F63-I109 HydrophobicContact CB-CD1 3.64Å; F63-I109 HydrophobicContact CD2-CD1 3.44Å; F63-I109 VanDerWaalsContact CD2-CD1 3.44Å; F63-I109 HydrophobicContact CE2-CD1 4.37Å; F63-I109 HydrophobicContact CG-CD1 3.77Å; S104-I109 WeakPolarHBondContact O-CG1 3.48Å; S104-I109 PolarHBondContact O-N 3.44Å; S104-I109 VanDerWaalsContact O-N 3.12Å; I109-F111 VanDerWaalsContact C-N 3.25Å; I109-F111 PolarHBondContact O-N 3.46Å; I109-T112 PolarHBondContact O-N 2.93Å; I109-T112 VanDerWaalsContact O-N 3.1Å; I109-I113 HydrophobicContact CG2-CD1 3.74Å; I109-I113 HydrophobicContact CG2-CG1 4.38Å; I109-I113 WeakPolarHBondContact O-CG1 3.36Å; I109-I113 PolarHBondContact O-N 2.93Å
110	P	77.8	Confident	74.1	Confident	59 Å²	59	53.6 Å²	53.6	38%	0.383	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-38.9	175.6	-26.3	36.6	0	0	0	111.8	Y105 I113 H114	Y105-P110 WeakPolarHBondContact O-CD 3.49Å; Y105-P110 VanDerWaalsContact O-CG 3.29Å; Y105-P110 WeakPolarHBondContact O-CG 3.33Å; P110-I113 PolarHBondContact O-N 3.2Å; P110-H114 VanDerWaalsContact O-CB 3.3Å; P110-H114 WeakPolarHBondContact O-CB 3.37Å; P110-H114 PolarHBondContact O-N 3.39Å
111	F	79.8	Confident	75.2	Confident	92 Å²	92	58.3 Å²	58.3	40%	0.404	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-44	175.1	-160.8	-101.3	0	0	0	111.7	I39 I43 C107 I109 I113 H114 H115	I39-F111 HydrophobicContact CB-CD1 4.46Å; I39-F111 HydrophobicContact CD1-CD1 4Å; I39-F111 HydrophobicContact CG1-CD1 4.15Å; I39-F111 HydrophobicContact CG2-CD1 3.49Å; I39-F111 VanDerWaalsContact CG2-CD1 3.49Å; I39-F111 HydrophobicContact CG2-CE1 3.31Å; I43-F111 HydrophobicContact CD1-CE1 4.34Å; C107-F111 WeakPolarHBondContact O-CB 3.42Å; C107-F111 PolarHBondContact O-N 2.89Å; I109-F111 VanDerWaalsContact C-N 3.25Å; I109-F111 PolarHBondContact O-N 3.46Å; F111-I113 PolarHBondContact O-N 3.25Å; F111-H114 WeakPolarHBondContact O-CB 3.21Å; F111-H114 PolarHBondContact O-N 2.9Å; F111-H115 AromaticContact CD1-CD2 3.88Å; F111-H115 AromaticContact CD1-NE2 3.58Å; F111-H115 AromaticContact CE1-CD2 3.83Å; F111-H115 AromaticContact CE1-CE1 3.3Å; F111-H115 WeakPolarHBondContact CE1-CE1 3.26Å; F111-H115 AromaticContact CE1-NE2 3.05Å; F111-H115 WeakPolarHBondContact CE1-NE2 3.47Å; F111-H115 AromaticContact CE2-NE2 3.77Å; F111-H115 AromaticContact CZ-CE1 3.69Å; F111-H115 AromaticContact CZ-NE2 3.16Å; F111-H115 WeakPolarHBondContact CZ-NE2 3.29Å; F111-H115 PolarHBondContact O-CD2 2.96Å; F111-H115 PolarHBondContact O-N 3.44Å
112	T	80.3	Confident	76.1	Confident	11 Å²	11	61.2 Å²	61.2	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-64.8	-41.6	176.1	-57.1	0	0	0	0	111.8	L51 L56 N108 I109 H115 C116	L51-T112 HydrophobicContact CD2-CG2 3.79Å; L56-T112 HydrophobicContact CD1-CG2 3.83Å; L56-T112 HydrophobicContact CD2-CG2 4.25Å; N108-T112 WeakPolarHBondContact O-CB 3.29Å; N108-T112 PolarHBondContact O-N 3.37Å; N108-T112 PolarHBondContact O-OG1 3.09Å; I109-T112 PolarHBondContact O-N 2.93Å; I109-T112 VanDerWaalsContact O-N 3.1Å; T112-H115 PolarHBondContact O-N 3.15Å; T112-C116 PolarHBondContact O-N 3.28Å; T112-C116 PolarHBondContact O-SG 3.37Å
113	I	83.5	Confident	77	Confident	73 Å²	73	63.6 Å²	63.6	37%	0.374	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-43.6	175.3	-67.9	168.2	0	0	0	110.5	L56 I109 P110 F111 H115 C116 T117	L56-I113 HydrophobicContact CD2-CG1 4.14Å; L56-I113 HydrophobicContact CG-CG1 4.43Å; I109-I113 HydrophobicContact CG2-CD1 3.74Å; I109-I113 HydrophobicContact CG2-CG1 4.38Å; I109-I113 WeakPolarHBondContact O-CG1 3.36Å; I109-I113 PolarHBondContact O-N 2.93Å; P110-I113 PolarHBondContact O-N 3.2Å; F111-I113 PolarHBondContact O-N 3.25Å; I113-H115 VanDerWaalsContact C-N 3.3Å; I113-H115 PolarHBondContact O-N 3Å; I113-C116 CarbonylContact O-C 3.54Å; I113-C116 WeakPolarHBondContact O-CA 3.43Å; I113-C116 VanDerWaalsContact O-CB 3.28Å; I113-C116 WeakPolarHBondContact O-CB 3.29Å; I113-C116 PolarHBondContact O-N 3.3Å; I113-C116 VanDerWaalsContact O-N 3.14Å; I113-T117 WeakPolarHBondContact O-CG2 3.36Å; I113-T117 PolarHBondContact O-N 3.29Å
114	H	83.9	Confident	77.7	Confident	85 Å²	85	63.8 Å²	63.8	39%	0.394	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-40.4	174.4	-178	86	0	0	0	111.7	P110 F111 C116 T117 Q118	P110-H114 VanDerWaalsContact O-CB 3.3Å; P110-H114 WeakPolarHBondContact O-CB 3.37Å; P110-H114 PolarHBondContact O-N 3.39Å; F111-H114 WeakPolarHBondContact O-CB 3.21Å; F111-H114 PolarHBondContact O-N 2.9Å; H114-C116 VanDerWaalsContact C-N 3.33Å; H114-C116 PolarHBondContact O-N 2.89Å; H114-T117 WeakPolarHBondContact O-CA 3.14Å; H114-T117 PolarHBondContact O-N 3.43Å; H114-T117 PolarHBondContact O-OG1 2.92Å; H114-Q118 PolarHBondContact CE1-NE2 2.94Å; H114-Q118 VanDerWaalsContact NE2-CD 3.28Å; H114-Q118 PolarHBondContact NE2-NE2 3.5Å; H114-Q118 PolarHBondContact O-N 3.2Å; H114-Q118 VanDerWaalsContact O-N 3.14Å
115	H	81	Confident	78.9	Confident	12 Å²	12	74.4 Å²	74.4	6%	0.056	38%	0.38	C	S	.	.	H	α-helix	trans	-68.4	-35.5	176.3	-76	-133.2	0	0	0	111.6	I43 F111 T112 I113 T117 Q118 F119	I43-H115 WeakPolarHBondContact CG1-CE1 3.26Å; F111-H115 AromaticContact CD1-CD2 3.88Å; F111-H115 AromaticContact CD1-NE2 3.58Å; F111-H115 AromaticContact CE1-CD2 3.83Å; F111-H115 AromaticContact CE1-CE1 3.3Å; F111-H115 WeakPolarHBondContact CE1-CE1 3.26Å; F111-H115 AromaticContact CE1-NE2 3.05Å; F111-H115 WeakPolarHBondContact CE1-NE2 3.47Å; F111-H115 AromaticContact CE2-NE2 3.77Å; F111-H115 AromaticContact CZ-CE1 3.69Å; F111-H115 AromaticContact CZ-NE2 3.16Å; F111-H115 WeakPolarHBondContact CZ-NE2 3.29Å; F111-H115 PolarHBondContact O-CD2 2.96Å; F111-H115 PolarHBondContact O-N 3.44Å; T112-H115 PolarHBondContact O-N 3.15Å; I113-H115 VanDerWaalsContact C-N 3.3Å; I113-H115 PolarHBondContact O-N 3Å; H115-T117 PolarHBondContact O-N 3.47Å; H115-Q118 PolarHBondContact O-N 3.32Å; H115-F119 HydrophobicContact CB-CD2 3.85Å; H115-F119 HydrophobicContact CB-CE2 3.8Å; H115-F119 AromaticContact CE1-CE2 4Å; H115-F119 AromaticContact CG-CE2 3.71Å; H115-F119 AromaticContact ND1-CE2 3.2Å; H115-F119 WeakPolarHBondContact ND1-CE2 3.45Å; H115-F119 AromaticContact ND1-CZ 3.81Å; H115-F119 VanDerWaalsContact O-CB 3.32Å; H115-F119 WeakPolarHBondContact O-CB 3.25Å; H115-F119 WeakPolarHBondContact O-CD2 3.48Å; H115-F119 WeakPolarHBondContact O-CG 3.45Å; H115-F119 PolarHBondContact O-N 3.25Å
116	C	81.9	Confident	79.8	Confident	10 Å²	10	75 Å²	75	7%	0.068	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-35.5	168.2	-66.7	0	0	0	0	110.8	T112 I113 H114 R121	T112-C116 PolarHBondContact O-N 3.28Å; T112-C116 PolarHBondContact O-SG 3.37Å; I113-C116 CarbonylContact O-C 3.54Å; I113-C116 WeakPolarHBondContact O-CA 3.43Å; I113-C116 VanDerWaalsContact O-CB 3.28Å; I113-C116 WeakPolarHBondContact O-CB 3.29Å; I113-C116 PolarHBondContact O-N 3.3Å; I113-C116 VanDerWaalsContact O-N 3.14Å; H114-C116 VanDerWaalsContact C-N 3.33Å; H114-C116 PolarHBondContact O-N 2.89Å; C116-R121 VanDerWaalsContact O-CD 3.25Å; C116-R121 WeakPolarHBondContact O-CD 3.22Å; C116-R121 WeakPolarHBondContact O-CG 3.48Å; C116-R121 PolarHBondContact O-NE 2.96Å
117	T	82	Confident	81	Confident	75 Å²	75	72.1 Å²	72.1	46%	0.46	38%	0.376	S	S	.	.	H	α-helix	trans	-69.4	-39.6	-179.8	68.2	0	0	0	0	113.6	I113 H114 H115 R121	I113-T117 WeakPolarHBondContact O-CG2 3.36Å; I113-T117 PolarHBondContact O-N 3.29Å; H114-T117 WeakPolarHBondContact O-CA 3.14Å; H114-T117 PolarHBondContact O-N 3.43Å; H114-T117 PolarHBondContact O-OG1 2.92Å; H115-T117 PolarHBondContact O-N 3.47Å; T117-R121 PolarHBondContact O-NH2 3.35Å
118	Q	82.3	Confident	82	Confident	123 Å²	123	79.3 Å²	79.3	58%	0.575	39%	0.394	S	S	*	.	H	α-helix	trans	-87	-35.9	-174.3	-65.2	-168.2	-19.4	0	0	115	H114 H115	H114-Q118 PolarHBondContact CE1-NE2 2.94Å; H114-Q118 VanDerWaalsContact NE2-CD 3.28Å; H114-Q118 PolarHBondContact NE2-NE2 3.5Å; H114-Q118 PolarHBondContact O-N 3.2Å; H114-Q118 VanDerWaalsContact O-N 3.14Å; H115-Q118 PolarHBondContact O-N 3.32Å
119	F	85	Confident	83.1	Confident	26 Å²	26	84.7 Å²	84.7	11%	0.114	42%	0.421	C	S	.	.	S	Bend	trans	-89.1	161.8	-171.9	-63.5	-33.2	0	0	0	113.7	N42 K46 V48 H115 R121	N42-F119 HydrophobicContact CB-CD2 4.19Å; N42-F119 HydrophobicContact CB-CE2 4.12Å; N42-F119 WeakPolarHBondContact O-CD2 3.44Å; N42-F119 VanDerWaalsContact O-CE2 3.24Å; N42-F119 WeakPolarHBondContact O-CE2 3.49Å; K46-F119 HydrophobicContact CB-CD1 4.35Å; K46-F119 HydrophobicContact CD-CD1 4.1Å; K46-F119 HydrophobicContact CD-CE1 3.49Å; K46-F119 VanDerWaalsContact CD-CE1 3.49Å; K46-F119 HydrophobicContact CD-CZ 3.99Å; V48-F119 HydrophobicContact CG1-CB 4.11Å; V48-F119 HydrophobicContact CG1-CD2 4.22Å; H115-F119 HydrophobicContact CB-CD2 3.85Å; H115-F119 HydrophobicContact CB-CE2 3.8Å; H115-F119 AromaticContact CE1-CE2 4Å; H115-F119 AromaticContact CG-CE2 3.71Å; H115-F119 AromaticContact ND1-CE2 3.2Å; H115-F119 WeakPolarHBondContact ND1-CE2 3.45Å; H115-F119 AromaticContact ND1-CZ 3.81Å; H115-F119 VanDerWaalsContact O-CB 3.32Å; H115-F119 WeakPolarHBondContact O-CB 3.25Å; H115-F119 WeakPolarHBondContact O-CD2 3.48Å; H115-F119 WeakPolarHBondContact O-CG 3.45Å; H115-F119 PolarHBondContact O-N 3.25Å; F119-R121 WeakPolarHBondContact O-CG 3.32Å; F119-R121 PolarHBondContact O-N 3.31Å; F119-R121 VanDerWaalsContact O-N 3.11Å
120	K	77.7	Confident	83.7	Confident	169 Å²	169	85 Å²	85	74%	0.735	42%	0.424	S	S	*	.	B	Isolated β-bridge	trans	-61	115.9	178.8	-67	-176.5	179.8	-179.7	0	110.3	K46 S47 V48	K46-K120 PolarHBondContact O-N 2.97Å; S47-K120 WeakPolarHBondContact CA-O 3.19Å; S47-K120 PolarHBondContact OG-O 2.91Å; S47-K120 VanDerWaalsContact OG-O 3.11Å; V48-K120 PolarHBondContact N-O 3.48Å
121	R	80.8	Confident	84.3	Confident	107 Å²	107	84.4 Å²	84.4	40%	0.404	42%	0.424	S	S	.	.			trans	-92.9	-15.2	-178.5	-50	-176.2	-150.7	180	7.8	114.2	V48 F53 C116 T117 F119 Q124	V48-R121 HydrophobicContact CG2-CB 4.15Å; V48-R121 HydrophobicContact CG2-CG 3.87Å; F53-R121 HydrophobicContact CE2-CB 4.27Å; F53-R121 HydrophobicContact CE2-CG 4.46Å; F53-R121 HydrophobicContact CZ-CB 3.88Å; F53-R121 HydrophobicContact CZ-CG 3.94Å; C116-R121 VanDerWaalsContact O-CD 3.25Å; C116-R121 WeakPolarHBondContact O-CD 3.22Å; C116-R121 WeakPolarHBondContact O-CG 3.48Å; C116-R121 PolarHBondContact O-NE 2.96Å; T117-R121 PolarHBondContact O-NH2 3.35Å; F119-R121 WeakPolarHBondContact O-CG 3.32Å; F119-R121 PolarHBondContact O-N 3.31Å; F119-R121 VanDerWaalsContact O-N 3.11Å; R121-Q124 WeakPolarHBondContact O-CB 3.26Å; R121-Q124 WeakPolarHBondContact O-CG 3.27Å; R121-Q124 PolarHBondContact O-OE1 2.93Å
122	G	79	Confident	85	Confident	64 Å²	64	85.2 Å²	85.2	66%	0.66	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	-143.9	-170.4	0	0	0	0	0	111.7	Q124	G122-Q124 VanDerWaalsContact C-N 3.33Å
123	S	83.8	Confident	85.5	Confident	118 Å²	118	89.3 Å²	89.3	83%	0.825	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	11	178.2	54.5	0	0	0	0	114.1	R125	S123-R125 PolarHBondContact O-N 2.75Å
124	Q	82.9	Confident	85.9	Confident	58 Å²	58	87 Å²	87	27%	0.271	44%	0.441	S	S	.	.			trans	-68.5	131.1	-176.1	-64.4	179.6	-39	0	0	111.6	V48 V49 F53 R121 G122	V48-Q124 PolarHBondContact O-OE1 3.43Å; V49-Q124 PolarHBondContact O-NE2 3.31Å; F53-Q124 HydrophobicContact CD2-CB 4.22Å; F53-Q124 HydrophobicContact CE2-CB 4.04Å; F53-Q124 HydrophobicContact CZ-CB 4.3Å; R121-Q124 WeakPolarHBondContact O-CB 3.26Å; R121-Q124 WeakPolarHBondContact O-CG 3.27Å; R121-Q124 PolarHBondContact O-OE1 2.93Å; G122-Q124 VanDerWaalsContact C-N 3.33Å
125	R	84	Confident	86.3	Confident	223 Å²	223	86.1 Å²	86.1	84%	0.842	45%	0.448	S	S	*	.			trans	-137.5	158.4	174.7	-63.6	-174.6	-179	-173.9	0.4	108.9	S123 S127	S123-R125 PolarHBondContact O-N 2.75Å; R125-S127 PolarHBondContact O-N 3.47Å
126	I	85.8	Confident	86.8	Confident	83 Å²	83	90 Å²	90	43%	0.426	47%	0.473	S	S	.	.			trans	-65.8	132.1	171.2	-63	173	0	0	0	108.5	F53 D54 A57 C130 A131	F53-I126 HydrophobicContact CB-CG1 4.01Å; D54-I126 VanDerWaalsContact OD1-CA 3.23Å; D54-I126 WeakPolarHBondContact OD1-CA 3.33Å; D54-I126 WeakPolarHBondContact OD1-CG2 3.43Å; A57-I126 HydrophobicContact CB-CD1 4.17Å; I126-C130 HydrophobicContact CG2-CB 4.01Å; I126-A131 HydrophobicContact CG2-CB 4.34Å
127	S	91	Very high	87.2	Confident	47 Å²	47	93.3 Å²	93.3	33%	0.329	49%	0.489	S	S	.	.			trans	-62.2	145.8	176.1	178.4	0	0	0	0	110.9	D54 R125 I129 C130 A131	D54-S127 PolarHBondContact OD1-N 3.26Å; D54-S127 WeakPolarHBondContact OD2-CB 3.39Å; R125-S127 PolarHBondContact O-N 3.47Å; S127-I129 PolarHBondContact O-N 3.21Å; S127-I129 PolarHBondContact OG-N 2.85Å; S127-C130 PolarHBondContact O-N 3.47Å; S127-A131 PolarHBondContact O-N 3.4Å
128	R	91	Very high	87.5	Confident	217 Å²	217	94.8 Å²	94.8	82%	0.819	49%	0.487	S	S	*	.	H	α-helix	trans	-58.2	-36.5	177.4	-66.2	-176	179.4	-178.9	-0.3	112.1	A131 I132	R128-A131 PolarHBondContact O-N 3.09Å; R128-I132 WeakPolarHBondContact O-CD1 3.44Å; R128-I132 VanDerWaalsContact O-CG1 3.22Å; R128-I132 WeakPolarHBondContact O-CG1 3.45Å; R128-I132 PolarHBondContact O-N 2.86Å
129	I	92.9	Very high	87.9	Confident	118 Å²	118	90.3 Å²	90.3	61%	0.605	47%	0.473	S	S	*	.	H	α-helix	trans	-63	-49.5	178.3	-61.5	170.9	0	0	0	109.8	S127 A131 I132 L133	S127-I129 PolarHBondContact O-N 3.21Å; S127-I129 PolarHBondContact OG-N 2.85Å; I129-A131 VanDerWaalsContact C-N 3.33Å; I129-A131 PolarHBondContact O-N 3.32Å; I129-I132 PolarHBondContact O-N 3.37Å; I129-L133 HydrophobicContact CG2-CD1 4.13Å; I129-L133 WeakPolarHBondContact O-CG 3.39Å; I129-L133 PolarHBondContact O-N 2.91Å
130	C	91	Very high	88.1	Confident	14 Å²	14	93.7 Å²	93.7	10%	0.095	50%	0.496	C	S	.	.	H	α-helix	trans	-62.2	-40.8	177.4	-67.9	0	0	0	0	111.7	D54 I126 S127 L133 L134	D54-C130 HydrophobicContact CB-CB 4.18Å; D54-C130 VanDerWaalsContact CB-SG 3.56Å; D54-C130 PolarHBondContact OD2-SG 3.33Å; D54-C130 VanDerWaalsContact OD2-SG 3.34Å; I126-C130 HydrophobicContact CG2-CB 4.01Å; S127-C130 PolarHBondContact O-N 3.47Å; C130-L133 PolarHBondContact O-N 3.41Å; C130-L134 WeakPolarHBondContact O-CB 3.29Å; C130-L134 VanDerWaalsContact O-CG 3.29Å; C130-L134 WeakPolarHBondContact O-CG 3.36Å; C130-L134 PolarHBondContact O-N 2.92Å
131	A	90.8	Very high	88.4	Confident	47 Å²	47	87 Å²	87	39%	0.388	47%	0.472	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175.3	0	0	0	0	0	112.5	I126 S127 R128 I129 A135	I126-A131 HydrophobicContact CG2-CB 4.34Å; S127-A131 PolarHBondContact O-N 3.4Å; R128-A131 PolarHBondContact O-N 3.09Å; I129-A131 VanDerWaalsContact C-N 3.33Å; I129-A131 PolarHBondContact O-N 3.32Å; A131-A135 VanDerWaalsContact O-CB 3.29Å; A131-A135 WeakPolarHBondContact O-CB 3.28Å; A131-A135 PolarHBondContact O-N 3.01Å
132	I	93.7	Very high	88.7	Confident	109 Å²	109	86.9 Å²	86.9	56%	0.559	48%	0.479	S	S	*	.	H	α-helix	trans	-63.8	-45.9	175.6	-68.9	163.3	0	0	0	110.5	R128 I129 L134 A135 V136	R128-I132 WeakPolarHBondContact O-CD1 3.44Å; R128-I132 VanDerWaalsContact O-CG1 3.22Å; R128-I132 WeakPolarHBondContact O-CG1 3.45Å; R128-I132 PolarHBondContact O-N 2.86Å; I129-I132 PolarHBondContact O-N 3.37Å; I132-L134 PolarHBondContact O-N 2.77Å; I132-A135 PolarHBondContact O-N 3.44Å; I132-V136 HydrophobicContact CG2-CG2 4.41Å; I132-V136 WeakPolarHBondContact O-CG2 3.28Å; I132-V136 PolarHBondContact O-N 3.34Å
133	L	92.4	Very high	89.2	Confident	98 Å²	98	88 Å²	88	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-60.4	-45.1	178.5	-72.2	172.8	0	0	0	112	I129 C130 V136 L137	I129-L133 HydrophobicContact CG2-CD1 4.13Å; I129-L133 WeakPolarHBondContact O-CG 3.39Å; I129-L133 PolarHBondContact O-N 2.91Å; C130-L133 PolarHBondContact O-N 3.41Å; L133-V136 PolarHBondContact O-N 2.86Å; L133-L137 WeakPolarHBondContact O-CB 3.42Å; L133-L137 PolarHBondContact O-N 3.32Å
134	L	90.7	Very high	89.2	Confident	25 Å²	25	85.1 Å²	85.1	13%	0.131	46%	0.456	C	S	.	.	H	α-helix	trans	-63	-43.4	174.9	-71.7	170.1	0	0	0	111.2	A57 L58 T61 C130 I132 V136 L137 W138	A57-L134 HydrophobicContact CB-CD1 3.84Å; L58-L134 HydrophobicContact CD2-CD2 4.07Å; L58-L134 HydrophobicContact CD2-CG 4.26Å; T61-L134 HydrophobicContact CG2-CD2 3.99Å; T61-L134 VanDerWaalsContact OG1-CD2 3.26Å; T61-L134 WeakPolarHBondContact OG1-CD2 3.24Å; C130-L134 WeakPolarHBondContact O-CB 3.29Å; C130-L134 VanDerWaalsContact O-CG 3.29Å; C130-L134 WeakPolarHBondContact O-CG 3.36Å; C130-L134 PolarHBondContact O-N 2.92Å; I132-L134 PolarHBondContact O-N 2.77Å; L134-V136 PolarHBondContact O-N 3.07Å; L134-L137 PolarHBondContact O-N 3.48Å; L134-W138 WeakPolarHBondContact O-CB 3.17Å; L134-W138 VanDerWaalsContact O-CD1 3.23Å; L134-W138 PolarHBondContact O-N 3.44Å
135	A	91.5	Very high	89.1	Confident	66 Å²	66	85.7 Å²	85.7	55%	0.545	46%	0.461	S	S	.	.	H	α-helix	trans	-61.6	-41.7	177.9	0	0	0	0	0	112.3	A131 I132 G139	A131-A135 VanDerWaalsContact O-CB 3.29Å; A131-A135 WeakPolarHBondContact O-CB 3.28Å; A131-A135 PolarHBondContact O-N 3.01Å; I132-A135 PolarHBondContact O-N 3.44Å; A135-G139 WeakPolarHBondContact O-CA 3.43Å; A135-G139 PolarHBondContact O-N 3Å
136	V	92.5	Very high	89.3	Confident	93 Å²	93	79.1 Å²	79.1	56%	0.564	44%	0.441	S	S	*	.	H	α-helix	trans	-64.9	-48.1	175.5	171.9	0	0	0	0	110.7	I132 L133 L134 G139 V140	I132-V136 HydrophobicContact CG2-CG2 4.41Å; I132-V136 WeakPolarHBondContact O-CG2 3.28Å; I132-V136 PolarHBondContact O-N 3.34Å; L133-V136 PolarHBondContact O-N 2.86Å; L134-V136 PolarHBondContact O-N 3.07Å; V136-G139 PolarHBondContact O-N 3.13Å; V136-V140 WeakPolarHBondContact O-CG2 3.49Å; V136-V140 PolarHBondContact O-N 3.44Å
137	L	89.2	Confident	89.3	Confident	79 Å²	79	78.9 Å²	78.9	41%	0.414	44%	0.444	S	S	.	.	H	α-helix	trans	-61.2	-49.1	-178.2	-178.3	64.9	0	0	0	112.2	T61 F65 L133 L134 G139 V140 A141	T61-L137 HydrophobicContact CG2-CD2 3.62Å; F65-L137 HydrophobicContact CD2-CD2 4.13Å; F65-L137 HydrophobicContact CE2-CD1 4.19Å; F65-L137 HydrophobicContact CE2-CD2 3.53Å; F65-L137 HydrophobicContact CE2-CG 3.68Å; F65-L137 HydrophobicContact CZ-CD2 4.49Å; F65-L137 HydrophobicContact CZ-CG 4.2Å; L133-L137 WeakPolarHBondContact O-CB 3.42Å; L133-L137 PolarHBondContact O-N 3.32Å; L134-L137 PolarHBondContact O-N 3.48Å; L137-G139 VanDerWaalsContact C-N 3.34Å; L137-V140 PolarHBondContact O-N 3.44Å; L137-A141 PolarHBondContact O-N 2.9Å; L137-A141 VanDerWaalsContact O-N 3.13Å
138	W	89.9	Confident	88.8	Confident	107 Å²	107	79 Å²	79	41%	0.405	45%	0.447	S	S	.	.	H	α-helix	trans	-69.9	-31.6	176.6	-77.8	99.4	0	0	0	112.4	T61 L64 L134 A141 L142	T61-W138 HydrophobicContact CG2-CZ2 4.43Å; L64-W138 HydrophobicContact CD2-CH2 3.46Å; L64-W138 VanDerWaalsContact CD2-CH2 3.46Å; L64-W138 HydrophobicContact CD2-CZ2 3.7Å; L134-W138 WeakPolarHBondContact O-CB 3.17Å; L134-W138 VanDerWaalsContact O-CD1 3.23Å; L134-W138 PolarHBondContact O-N 3.44Å; W138-A141 PolarHBondContact O-N 2.83Å; W138-L142 WeakPolarHBondContact O-CB 3.27Å; W138-L142 PolarHBondContact O-N 2.96Å
139	G	90.1	Very high	88.3	Confident	29 Å²	29	69.7 Å²	69.7	30%	0.299	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-45	172.6	0	0	0	0	0	112.4	A135 V136 L137 L142 V143	A135-G139 WeakPolarHBondContact O-CA 3.43Å; A135-G139 PolarHBondContact O-N 3Å; V136-G139 PolarHBondContact O-N 3.13Å; L137-G139 VanDerWaalsContact C-N 3.34Å; G139-L142 PolarHBondContact O-N 3.42Å; G139-V143 VanDerWaalsContact O-CG2 3.32Å; G139-V143 WeakPolarHBondContact O-CG2 3.37Å; G139-V143 PolarHBondContact O-N 3.46Å
140	V	89.2	Confident	88.1	Confident	96 Å²	96	68.7 Å²	68.7	58%	0.582	41%	0.412	S	S	*	.	H	α-helix	trans	-61.7	-44.5	174.6	171.4	0	0	0	0	111	V136 L137 L142 V143 A144	V136-V140 WeakPolarHBondContact O-CG2 3.49Å; V136-V140 PolarHBondContact O-N 3.44Å; L137-V140 PolarHBondContact O-N 3.44Å; V140-L142 VanDerWaalsContact C-N 3.34Å; V140-L142 PolarHBondContact O-N 3.35Å; V140-V143 PolarHBondContact O-N 3.29Å; V140-A144 PolarHBondContact O-N 3.25Å
141	A	84.4	Confident	87.9	Confident	29 Å²	29	71.2 Å²	71.2	24%	0.24	43%	0.43	C	S	.	.	H	α-helix	trans	-59.6	-44.8	175.7	0	0	0	0	0	111.6	F65 L137 W138 A144 L145	F65-A141 HydrophobicContact CZ-CB 4.46Å; L137-A141 PolarHBondContact O-N 2.9Å; L137-A141 VanDerWaalsContact O-N 3.13Å; W138-A141 PolarHBondContact O-N 2.83Å; A141-A144 PolarHBondContact O-N 2.83Å; A141-L145 WeakPolarHBondContact O-CG 3.42Å; A141-L145 PolarHBondContact O-N 2.9Å
142	L	86.3	Confident	87.5	Confident	104 Å²	104	71.9 Å²	71.9	55%	0.545	43%	0.426	S	S	.	.	H	α-helix	trans	-63.2	-43.9	177.2	-179.7	63.6	0	0	0	112.4	W138 G139 V140 A144 L145 I146	W138-L142 WeakPolarHBondContact O-CB 3.27Å; W138-L142 PolarHBondContact O-N 2.96Å; G139-L142 PolarHBondContact O-N 3.42Å; V140-L142 VanDerWaalsContact C-N 3.34Å; V140-L142 PolarHBondContact O-N 3.35Å; L142-A144 VanDerWaalsContact C-N 3.32Å; L142-A144 PolarHBondContact O-N 3.4Å; L142-L145 WeakPolarHBondContact O-CB 3.3Å; L142-L145 PolarHBondContact O-N 3.32Å; L142-I146 HydrophobicContact CD1-CD1 4.44Å; L142-I146 HydrophobicContact CG-CD1 4.08Å; L142-I146 WeakPolarHBondContact O-CG1 3.44Å; L142-I146 PolarHBondContact O-N 2.95Å
143	V	89.2	Confident	87.1	Confident	88 Å²	88	69.3 Å²	69.3	53%	0.533	42%	0.416	S	S	.	.	H	α-helix	trans	-60.6	-43.8	176.2	170.4	0	0	0	0	110.6	G139 V140 L145 I146 V147	G139-V143 VanDerWaalsContact O-CG2 3.32Å; G139-V143 WeakPolarHBondContact O-CG2 3.37Å; G139-V143 PolarHBondContact O-N 3.46Å; V140-V143 PolarHBondContact O-N 3.29Å; V143-L145 VanDerWaalsContact C-N 3.3Å; V143-L145 PolarHBondContact O-N 3.45Å; V143-I146 PolarHBondContact O-N 3.13Å; V143-V147 HydrophobicContact CG1-CG2 4.36Å; V143-V147 WeakPolarHBondContact O-CG2 3.28Å; V143-V147 PolarHBondContact O-N 2.89Å
144	A	84	Confident	87	Confident	58 Å²	58	69.8 Å²	69.8	48%	0.479	42%	0.419	S	S	.	.	H	α-helix	trans	-60	-40.4	175.8	0	0	0	0	0	112.1	V140 A141 L142 V147 A148	V140-A144 PolarHBondContact O-N 3.25Å; A141-A144 PolarHBondContact O-N 2.83Å; L142-A144 VanDerWaalsContact C-N 3.32Å; L142-A144 PolarHBondContact O-N 3.4Å; A144-V147 PolarHBondContact O-N 3.34Å; A144-A148 PolarHBondContact O-N 2.91Å
145	L	82.4	Confident	86.7	Confident	69 Å²	69	71.4 Å²	71.4	36%	0.361	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-43.1	174.5	-68.8	179.7	0	0	0	112.4	A141 L142 V143 A148 A149 T205 L209	A141-L145 WeakPolarHBondContact O-CG 3.42Å; A141-L145 PolarHBondContact O-N 2.9Å; L142-L145 WeakPolarHBondContact O-CB 3.3Å; L142-L145 PolarHBondContact O-N 3.32Å; V143-L145 VanDerWaalsContact C-N 3.3Å; V143-L145 PolarHBondContact O-N 3.45Å; L145-A148 PolarHBondContact O-N 2.88Å; L145-A149 PolarHBondContact O-N 2.88Å; L145-T205 HydrophobicContact CD1-CG2 4.43Å; L145-L209 HydrophobicContact CD2-CD1 4.27Å; L145-L209 HydrophobicContact CD2-CD2 3.89Å
146	I	86.4	Confident	86.4	Confident	85 Å²	85	69.3 Å²	69.3	44%	0.436	41%	0.406	S	S	.	.	H	α-helix	trans	-62.9	-46	176.9	-67.9	165.7	0	0	0	110.4	L142 V143 A148 A149 L150	L142-I146 HydrophobicContact CD1-CD1 4.44Å; L142-I146 HydrophobicContact CG-CD1 4.08Å; L142-I146 WeakPolarHBondContact O-CG1 3.44Å; L142-I146 PolarHBondContact O-N 2.95Å; V143-I146 PolarHBondContact O-N 3.13Å; I146-A148 VanDerWaalsContact C-N 3.31Å; I146-A148 PolarHBondContact O-N 3.18Å; I146-A149 PolarHBondContact O-N 2.91Å; I146-L150 HydrophobicContact CG2-CD1 3.85Å; I146-L150 HydrophobicContact CG2-CG 4.2Å; I146-L150 WeakPolarHBondContact O-CB 3.34Å; I146-L150 VanDerWaalsContact O-CG 3.31Å; I146-L150 WeakPolarHBondContact O-CG 3.41Å; I146-L150 PolarHBondContact O-N 3.14Å
147	V	86.7	Confident	86.2	Confident	79 Å²	79	67.7 Å²	67.7	48%	0.479	40%	0.396	S	S	.	.	H	α-helix	trans	-58.6	-45.5	177.6	171.4	0	0	0	0	110.3	V143 A144 A149 L150 S151	V143-V147 HydrophobicContact CG1-CG2 4.36Å; V143-V147 WeakPolarHBondContact O-CG2 3.28Å; V143-V147 PolarHBondContact O-N 2.89Å; A144-V147 PolarHBondContact O-N 3.34Å; V147-A149 PolarHBondContact O-N 3.31Å; V147-L150 PolarHBondContact O-N 3.03Å; V147-S151 PolarHBondContact O-N 3.23Å; V147-S151 PolarHBondContact O-OG 3.44Å
148	A	80.8	Confident	86.1	Confident	49 Å²	49	67.3 Å²	67.3	41%	0.405	39%	0.394	S	S	.	.	H	α-helix	trans	-59.5	-45.2	176	0	0	0	0	0	112.4	A144 L145 I146 L150 S151 I152	A144-A148 PolarHBondContact O-N 2.91Å; L145-A148 PolarHBondContact O-N 2.88Å; I146-A148 VanDerWaalsContact C-N 3.31Å; I146-A148 PolarHBondContact O-N 3.18Å; A148-L150 PolarHBondContact O-N 3.38Å; A148-S151 PolarHBondContact O-N 3.26Å; A148-I152 WeakPolarHBondContact O-CG1 3.36Å; A148-I152 PolarHBondContact O-N 2.93Å; A148-I152 VanDerWaalsContact O-N 3.08Å
149	A	80.7	Confident	85.8	Confident	21 Å²	21	62.5 Å²	62.5	17%	0.174	38%	0.376	C	S	.	.	H	α-helix	trans	-62.3	-42.3	176.9	0	0	0	0	0	112.5	L145 I146 V147 I152 T153	L145-A149 PolarHBondContact O-N 2.88Å; I146-A149 PolarHBondContact O-N 2.91Å; V147-A149 PolarHBondContact O-N 3.31Å; A149-I152 PolarHBondContact O-N 3.31Å; A149-T153 WeakPolarHBondContact O-CB 3.13Å; A149-T153 PolarHBondContact O-N 2.77Å; A149-T153 PolarHBondContact O-OG1 3.03Å
150	L	88.8	Confident	85.6	Confident	97 Å²	97	67.7 Å²	67.7	51%	0.508	39%	0.388	S	S	.	.	H	α-helix	trans	-64.4	-42.3	175.8	-71.5	174.6	0	0	0	110.9	I146 V147 A148 I152 T153 L154	I146-L150 HydrophobicContact CG2-CD1 3.85Å; I146-L150 HydrophobicContact CG2-CG 4.2Å; I146-L150 WeakPolarHBondContact O-CB 3.34Å; I146-L150 VanDerWaalsContact O-CG 3.31Å; I146-L150 WeakPolarHBondContact O-CG 3.41Å; I146-L150 PolarHBondContact O-N 3.14Å; V147-L150 PolarHBondContact O-N 3.03Å; A148-L150 PolarHBondContact O-N 3.38Å; L150-I152 VanDerWaalsContact C-N 3.33Å; L150-I152 PolarHBondContact O-N 3.03Å; L150-T153 PolarHBondContact O-N 2.84Å; L150-L154 WeakPolarHBondContact O-CB 3.36Å; L150-L154 WeakPolarHBondContact O-CG 3.38Å; L150-L154 PolarHBondContact O-N 3.28Å
151	S	85.7	Confident	85.4	Confident	68 Å²	68	72.4 Å²	72.4	48%	0.476	40%	0.395	S	S	.	.	H	α-helix	trans	-58.4	-43.8	175.9	-64.2	0	0	0	0	112	V147 A148 L154 Q155	V147-S151 PolarHBondContact O-N 3.23Å; V147-S151 PolarHBondContact O-OG 3.44Å; A148-S151 PolarHBondContact O-N 3.26Å; S151-L154 PolarHBondContact O-N 3.26Å; S151-Q155 PolarHBondContact O-N 3.12Å; S151-Q155 VanDerWaalsContact O-N 3.12Å
152	I	83.4	Confident	85.3	Confident	60 Å²	60	79.5 Å²	79.5	31%	0.308	42%	0.416	S	S	.	.	H	α-helix	trans	-65	-44.6	176.3	-61.7	163.8	0	0	0	110.6	A148 A149 L150 L154 Q155 V156 F216 F220	A148-I152 WeakPolarHBondContact O-CG1 3.36Å; A148-I152 PolarHBondContact O-N 2.93Å; A148-I152 VanDerWaalsContact O-N 3.08Å; A149-I152 PolarHBondContact O-N 3.31Å; L150-I152 VanDerWaalsContact C-N 3.33Å; L150-I152 PolarHBondContact O-N 3.03Å; I152-L154 VanDerWaalsContact C-N 3.33Å; I152-L154 PolarHBondContact O-N 3.26Å; I152-Q155 WeakPolarHBondContact O-CB 3.38Å; I152-Q155 PolarHBondContact O-N 3.39Å; I152-Q155 VanDerWaalsContact O-N 3.12Å; I152-V156 PolarHBondContact O-N 3.06Å; I152-F216 HydrophobicContact CG2-CB 3.71Å; I152-F216 HydrophobicContact CG2-CD1 3.58Å; I152-F216 HydrophobicContact CG2-CD2 3.79Å; I152-F216 HydrophobicContact CG2-CE1 4.08Å; I152-F216 HydrophobicContact CG2-CE2 4.28Å; I152-F216 HydrophobicContact CG2-CG 3.41Å; I152-F216 VanDerWaalsContact CG2-CG 3.41Å; I152-F216 HydrophobicContact CG2-CZ 4.41Å; I152-F220 HydrophobicContact CG2-CE2 3.98Å; I152-F220 HydrophobicContact CG2-CZ 4.2Å
153	T	85.1	Confident	85.1	Confident	55 Å²	55	79.4 Å²	79.4	34%	0.337	41%	0.411	S	S	.	.	H	α-helix	trans	-61.6	-41.7	178	-55.5	0	0	0	0	111.8	A149 L150 Q155 V156 V157 F216	A149-T153 WeakPolarHBondContact O-CB 3.13Å; A149-T153 PolarHBondContact O-N 2.77Å; A149-T153 PolarHBondContact O-OG1 3.03Å; L150-T153 PolarHBondContact O-N 2.84Å; T153-Q155 VanDerWaalsContact C-N 3.28Å; T153-Q155 PolarHBondContact O-N 3.23Å; T153-V156 WeakPolarHBondContact O-CB 3.46Å; T153-V156 PolarHBondContact O-N 3.48Å; T153-V157 WeakPolarHBondContact O-CG2 3.46Å; T153-V157 PolarHBondContact O-N 3.37Å; T153-F216 WeakPolarHBondContact OG1-CZ 2.93Å
154	L	89.2	Confident	84.4	Confident	109 Å²	109	76.2 Å²	76.2	57%	0.571	39%	0.392	S	S	*	.	H	α-helix	trans	-60.4	-40.3	175.6	-72.5	172.7	0	0	0	110.8	L150 S151 I152 V157 L158	L150-L154 WeakPolarHBondContact O-CB 3.36Å; L150-L154 WeakPolarHBondContact O-CG 3.38Å; L150-L154 PolarHBondContact O-N 3.28Å; S151-L154 PolarHBondContact O-N 3.26Å; I152-L154 VanDerWaalsContact C-N 3.33Å; I152-L154 PolarHBondContact O-N 3.26Å; L154-V157 PolarHBondContact O-N 3.18Å; L154-L158 WeakPolarHBondContact O-CB 3.2Å; L154-L158 VanDerWaalsContact O-CG 3.27Å; L154-L158 WeakPolarHBondContact O-CG 3.46Å; L154-L158 PolarHBondContact O-N 3.39Å
155	Q	84.9	Confident	84.1	Confident	58 Å²	58	73.7 Å²	73.7	27%	0.271	37%	0.371	S	S	.	.	H	α-helix	trans	-63.1	-42.6	175	-170.4	62	56.5	0	0	112.1	S151 I152 T153 V157 L158 N159 F168 F220	S151-Q155 PolarHBondContact O-N 3.12Å; S151-Q155 VanDerWaalsContact O-N 3.12Å; I152-Q155 WeakPolarHBondContact O-CB 3.38Å; I152-Q155 PolarHBondContact O-N 3.39Å; I152-Q155 VanDerWaalsContact O-N 3.12Å; T153-Q155 VanDerWaalsContact C-N 3.28Å; T153-Q155 PolarHBondContact O-N 3.23Å; Q155-V157 VanDerWaalsContact C-N 3.33Å; Q155-V157 PolarHBondContact O-N 2.98Å; Q155-L158 PolarHBondContact O-N 3.43Å; Q155-N159 PolarHBondContact NE2-OD1 2.89Å; Q155-N159 VanDerWaalsContact O-CG 3.24Å; Q155-N159 PolarHBondContact O-N 2.85Å; Q155-N159 PolarHBondContact O-OD1 3.43Å; Q155-F168 HydrophobicContact CG-CD2 4.39Å; Q155-F168 HydrophobicContact CG-CE2 3.87Å; Q155-F168 HydrophobicContact CG-CZ 4.13Å; Q155-F220 HydrophobicContact CB-CE1 4.39Å; Q155-F220 HydrophobicContact CB-CZ 4.14Å; Q155-F220 HydrophobicContact CG-CE1 3.98Å; Q155-F220 HydrophobicContact CG-CZ 4.04Å
156	V	86.3	Confident	83.4	Confident	23 Å²	23	75.1 Å²	75.1	14%	0.139	38%	0.376	C	S	.	.	H	α-helix	trans	-59.1	-44.7	174.4	172.1	0	0	0	0	111.2	I152 T153 N159 Y160 F216 I219 F220 Q223	I152-V156 PolarHBondContact O-N 3.06Å; T153-V156 WeakPolarHBondContact O-CB 3.46Å; T153-V156 PolarHBondContact O-N 3.48Å; V156-N159 PolarHBondContact O-N 3.48Å; V156-Y160 WeakPolarHBondContact O-CB 3.3Å; V156-Y160 PolarHBondContact O-N 2.84Å; V156-F216 HydrophobicContact CG2-CD1 3.92Å; V156-F216 HydrophobicContact CG2-CE1 4.31Å; V156-I219 HydrophobicContact CG1-CG2 3.64Å; V156-I219 HydrophobicContact CG2-CG2 4.04Å; V156-F220 HydrophobicContact CG2-CD1 4.37Å; V156-F220 HydrophobicContact CG2-CE1 3.65Å; V156-F220 HydrophobicContact CG2-CE2 4.26Å; V156-F220 HydrophobicContact CG2-CZ 3.58Å; V156-Q223 PolarHBondContact O-NE2 3.27Å
157	V	87.6	Confident	82.7	Confident	59 Å²	59	75.5 Å²	75.5	36%	0.358	40%	0.4	S	S	.	.	H	α-helix	trans	-66.3	-40.1	178.1	173.3	0	0	0	0	111.3	T153 L154 Q155 Y160 R161	T153-V157 WeakPolarHBondContact O-CG2 3.46Å; T153-V157 PolarHBondContact O-N 3.37Å; L154-V157 PolarHBondContact O-N 3.18Å; Q155-V157 VanDerWaalsContact C-N 3.33Å; Q155-V157 PolarHBondContact O-N 2.98Å; V157-Y160 WeakPolarHBondContact O-CB 3.44Å; V157-Y160 PolarHBondContact O-N 3.15Å; V157-R161 HydrophobicContact CG1-CG 4.34Å; V157-R161 WeakPolarHBondContact O-CG 3.44Å; V157-R161 PolarHBondContact O-N 2.91Å
158	L	87	Confident	82.1	Confident	71 Å²	71	74.5 Å²	74.5	37%	0.372	39%	0.39	S	S	.	.	H	α-helix	trans	-62.9	-46.1	176.6	-75.5	172.7	0	0	0	111.5	L154 Q155 Y160 R161 R162	L154-L158 WeakPolarHBondContact O-CB 3.2Å; L154-L158 VanDerWaalsContact O-CG 3.27Å; L154-L158 WeakPolarHBondContact O-CG 3.46Å; L154-L158 PolarHBondContact O-N 3.39Å; Q155-L158 PolarHBondContact O-N 3.43Å; L158-Y160 VanDerWaalsContact C-N 3.27Å; L158-Y160 PolarHBondContact O-N 3.06Å; L158-R161 PolarHBondContact O-N 3.49Å; L158-R162 WeakPolarHBondContact O-CB 3.21Å; L158-R162 WeakPolarHBondContact O-CG 3.08Å; L158-R162 PolarHBondContact O-N 3.22Å
159	N	83.8	Confident	81.9	Confident	5 Å²	5	75.2 Å²	75.2	3%	0.027	39%	0.392	C	S	.	.	H	α-helix	trans	-59.4	-40.7	173.9	-68	-3.2	0	0	0	110.9	Q155 V156 K163 T165 F220 Q223	Q155-N159 PolarHBondContact NE2-OD1 2.89Å; Q155-N159 VanDerWaalsContact O-CG 3.24Å; Q155-N159 PolarHBondContact O-N 2.85Å; Q155-N159 PolarHBondContact O-OD1 3.43Å; V156-N159 PolarHBondContact O-N 3.48Å; N159-K163 PolarHBondContact O-N 3.17Å; N159-T165 HydrophobicContact CB-CG2 4.45Å; N159-F220 WeakPolarHBondContact ND2-CE1 3.22Å; N159-Q223 PolarHBondContact ND2-OE1 3.3Å
160	Y	85.5	Confident	81.9	Confident	139 Å²	139	75.6 Å²	75.6	55%	0.545	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-40.6	176	177	-96.3	0	0	0	113.3	V156 V157 L158 K163 Y228	V156-Y160 WeakPolarHBondContact O-CB 3.3Å; V156-Y160 PolarHBondContact O-N 2.84Å; V157-Y160 WeakPolarHBondContact O-CB 3.44Å; V157-Y160 PolarHBondContact O-N 3.15Å; L158-Y160 VanDerWaalsContact C-N 3.27Å; L158-Y160 PolarHBondContact O-N 3.06Å; Y160-K163 VanDerWaalsContact O-CD 3.27Å; Y160-K163 WeakPolarHBondContact O-CD 3.4Å; Y160-K163 WeakPolarHBondContact O-CE 3.17Å; Y160-K163 PolarHBondContact O-NZ 2.91Å; Y160-Y228 WeakPolarHBondContact CA-OH 3.35Å; Y160-Y228 WeakPolarHBondContact CD2-OH 3.08Å
161	R	86	Confident	81.2	Confident	195 Å²	195	74.2 Å²	74.2	74%	0.736	39%	0.393	S	S	*	.	H	α-helix	trans	-71	-40.4	178.8	-75.6	-176.7	178.5	-163.5	0.2	112.4	V157 L158 K163	V157-R161 HydrophobicContact CG1-CG 4.34Å; V157-R161 WeakPolarHBondContact O-CG 3.44Å; V157-R161 PolarHBondContact O-N 2.91Å; L158-R161 PolarHBondContact O-N 3.49Å; R161-K163 VanDerWaalsContact C-N 3.31Å
162	R	81.4	Confident	80.5	Confident	178 Å²	178	73.7 Å²	73.7	67%	0.672	39%	0.39	S	S	*	.	H	α-helix	trans	-77.8	-17.3	179.7	-69.8	179.4	178.6	177.8	-0.4	113.3	L158 S164	L158-R162 WeakPolarHBondContact O-CB 3.21Å; L158-R162 WeakPolarHBondContact O-CG 3.08Å; L158-R162 PolarHBondContact O-N 3.22Å; R162-S164 PolarHBondContact O-N 3.44Å; R162-S164 VanDerWaalsContact O-N 3.08Å
163	K	82.1	Confident	80.5	Confident	102 Å²	102	71.5 Å²	71.5	44%	0.443	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	27.5	-172.5	-55.6	-66.1	177.3	-168.6	0	112.7	N159 Y160 R161 Y228	N159-K163 PolarHBondContact O-N 3.17Å; Y160-K163 VanDerWaalsContact O-CD 3.27Å; Y160-K163 WeakPolarHBondContact O-CD 3.4Å; Y160-K163 WeakPolarHBondContact O-CE 3.17Å; Y160-K163 PolarHBondContact O-NZ 2.91Å; R161-K163 VanDerWaalsContact C-N 3.31Å; K163-Y228 VanDerWaalsContact C-CD1 3.45Å; K163-Y228 HydrophobicContact CB-CD1 4.08Å; K163-Y228 HydrophobicContact CB-CE1 3.89Å; K163-Y228 HydrophobicContact CD-CD1 4.42Å; K163-Y228 HydrophobicContact CD-CE1 3.44Å; K163-Y228 VanDerWaalsContact CD-CE1 3.44Å; K163-Y228 HydrophobicContact CG-CE1 4.3Å; K163-Y228 PolarHBondContact NZ-OH 3.38Å; K163-Y228 VanDerWaalsContact O-CD1 3.22Å; K163-Y228 WeakPolarHBondContact O-CD1 3.21Å
164	S	74.6	Confident	80.1	Confident	21 Å²	21	74.5 Å²	74.5	15%	0.147	39%	0.387	C	S	.	.			trans	-150.3	143.6	-176.7	176.6	0	0	0	0	109	R162 E166	R162-S164 PolarHBondContact O-N 3.44Å; R162-S164 VanDerWaalsContact O-N 3.08Å; S164-E166 PolarHBondContact OG-N 3.14Å; S164-E166 VanDerWaalsContact OG-N 3.15Å
165	T	77.6	Confident	79.5	Confident	5 Å²	5	75.1 Å²	75.1	3%	0.031	39%	0.39	C	S	.	.			trans	-113.3	18.7	172	69.5	0	0	0	0	111.2	N159 F168 Q223 R224 Y228	N159-T165 HydrophobicContact CB-CG2 4.45Å; T165-F168 PolarHBondContact O-N 3.14Å; T165-Q223 HydrophobicContact CG2-CB 4.18Å; T165-R224 VanDerWaalsContact OG1-CD 3.25Å; T165-R224 WeakPolarHBondContact OG1-CD 3.27Å; T165-R224 PolarHBondContact OG1-NH1 3.17Å; T165-R224 VanDerWaalsContact OG1-NH1 3.07Å; T165-Y228 HydrophobicContact CG2-CD2 4Å
166	E	68.1	Low	79.2	Confident	99 Å²	99	76.6 Å²	76.6	46%	0.463	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	137.4	177.2	-72.2	-153	144.9	0	0	111.6	S164 F168 Y231	S164-E166 PolarHBondContact OG-N 3.14Å; S164-E166 VanDerWaalsContact OG-N 3.15Å; E166-F168 VanDerWaalsContact C-N 3.31Å; E166-Y231 HydrophobicContact CG-CD1 3.9Å; E166-Y231 HydrophobicContact CG-CG 4.46Å; E166-Y231 WeakPolarHBondContact OE1-CD1 3.33Å; E166-Y231 WeakPolarHBondContact OE2-CD1 3.48Å; E166-Y231 WeakPolarHBondContact OE2-CE1 3.38Å
167	G	71.4	Confident	79.1	Confident	92 Å²	92	77.7 Å²	77.7	95%	0.948	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-6	-174.1	0	0	0	0	0	115.2
168	F	73.4	Confident	78.8	Confident	59 Å²	59	77.6 Å²	77.6	26%	0.259	40%	0.402	S	S	.	.			trans	-97	123.4	176.4	-169.4	-115.8	0	0	0	111.3	Q155 T165 E166 I170 I173 F220	Q155-F168 HydrophobicContact CG-CD2 4.39Å; Q155-F168 HydrophobicContact CG-CE2 3.87Å; Q155-F168 HydrophobicContact CG-CZ 4.13Å; T165-F168 PolarHBondContact O-N 3.14Å; E166-F168 VanDerWaalsContact C-N 3.31Å; F168-I170 PolarHBondContact O-N 3.14Å; F168-I173 HydrophobicContact CD1-CG1 4.49Å; F168-I173 HydrophobicContact CE1-CD1 3.83Å; F168-I173 HydrophobicContact CE1-CG1 3.57Å; F168-I173 HydrophobicContact CZ-CD1 3.75Å; F168-I173 HydrophobicContact CZ-CG1 4.02Å; F168-F220 AromaticContact CE1-CD1 3.75Å; F168-F220 HydrophobicContact CE1-CD1 3.75Å; F168-F220 HydrophobicContact CE1-CD2 4.38Å; F168-F220 AromaticContact CE1-CE1 3.94Å; F168-F220 HydrophobicContact CE1-CE1 3.94Å; F168-F220 HydrophobicContact CE1-CG 4Å; F168-F220 HydrophobicContact CE1-CZ 4.33Å; F168-F220 HydrophobicContact CZ-CD1 4.33Å; F168-F220 HydrophobicContact CZ-CE1 4.08Å; F168-F220 HydrophobicContact CZ-CE2 4.36Å; F168-F220 HydrophobicContact CZ-CZ 4.1Å
169	S	77.3	Confident	78.3	Confident	63 Å²	63	76.1 Å²	76.1	44%	0.441	41%	0.405	S	S	.	.			trans	-72.8	107.3	-177.6	175.7	0	0	0	0	111.9	S172	S169-S172 WeakPolarHBondContact CB-OG 3.29Å; S169-S172 PolarHBondContact O-N 3.21Å; S169-S172 PolarHBondContact OG-N 3.21Å; S169-S172 PolarHBondContact OG-OG 2.92Å
170	I	81	Confident	78.1	Confident	29 Å²	29	76.3 Å²	76.3	15%	0.149	41%	0.407	C	S	.	.	H	α-helix	trans	-79.2	-27.7	179.6	-54.6	-174.1	0	0	0	111.6	F168 S172 I173 F174 F221 R224 Y225	F168-I170 PolarHBondContact O-N 3.14Å; I170-S172 PolarHBondContact O-N 2.97Å; I170-I173 PolarHBondContact O-N 2.92Å; I170-F174 PolarHBondContact O-N 3.35Å; I170-F221 HydrophobicContact CG2-CD1 4.47Å; I170-F221 HydrophobicContact CG2-CE1 4.36Å; I170-R224 HydrophobicContact CD1-CB 3.54Å; I170-R224 HydrophobicContact CD1-CG 3.14Å; I170-R224 VanDerWaalsContact CD1-NE 3.29Å; I170-Y225 HydrophobicContact CG2-CE2 4.2Å
171	A	73.8	Confident	78.1	Confident	68 Å²	68	73.9 Å²	73.9	56%	0.562	40%	0.402	S	S	*	.	H	α-helix	trans	-59.3	-37.2	172.6	0	0	0	0	0	111.2	F174 L175	A171-F174 PolarHBondContact O-N 3.46Å; A171-L175 WeakPolarHBondContact O-CG 3.28Å; A171-L175 PolarHBondContact O-N 3.18Å
172	S	71.1	Confident	77.8	Confident	58 Å²	58	68.5 Å²	68.5	41%	0.406	39%	0.394	S	S	.	.	H	α-helix	trans	-64	-46.8	175.1	-57.4	0	0	0	0	111.4	S169 I170 F174 L175 D176	S169-S172 WeakPolarHBondContact CB-OG 3.29Å; S169-S172 PolarHBondContact O-N 3.21Å; S169-S172 PolarHBondContact OG-N 3.21Å; S169-S172 PolarHBondContact OG-OG 2.92Å; I170-S172 PolarHBondContact O-N 2.97Å; S172-F174 VanDerWaalsContact C-N 3.26Å; S172-F174 PolarHBondContact O-N 3.4Å; S172-L175 PolarHBondContact O-N 3.02Å; S172-D176 PolarHBondContact O-N 3.32Å
173	I	82.6	Confident	77.6	Confident	13 Å²	13	61.4 Å²	61.4	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-37.4	174.9	-60.7	-49.2	0	0	0	112	F168 I170 D176 F177 D217 F220 F221	F168-I173 HydrophobicContact CD1-CG1 4.49Å; F168-I173 HydrophobicContact CE1-CD1 3.83Å; F168-I173 HydrophobicContact CE1-CG1 3.57Å; F168-I173 HydrophobicContact CZ-CD1 3.75Å; F168-I173 HydrophobicContact CZ-CG1 4.02Å; I170-I173 PolarHBondContact O-N 2.92Å; I173-D176 PolarHBondContact O-N 2.97Å; I173-F177 VanDerWaalsContact O-CB 3.29Å; I173-F177 WeakPolarHBondContact O-CB 3.4Å; I173-F177 PolarHBondContact O-N 2.89Å; I173-D217 HydrophobicContact CG2-CB 3.85Å; I173-F220 HydrophobicContact CD1-CD2 3.87Å; I173-F220 HydrophobicContact CD1-CE2 4.25Å; I173-F220 HydrophobicContact CD1-CG 4.49Å; I173-F220 HydrophobicContact CG1-CB 4.33Å; I173-F220 HydrophobicContact CG1-CD2 4.25Å; I173-F220 HydrophobicContact CG1-CG 4.42Å; I173-F220 HydrophobicContact CG2-CB 3.96Å; I173-F220 HydrophobicContact CG2-CD2 4.41Å; I173-F221 HydrophobicContact CG2-CD1 4.43Å; I173-F221 HydrophobicContact CG2-CE1 4.01Å; I173-F221 HydrophobicContact CG2-CZ 4.14Å
174	F	78.3	Confident	77.6	Confident	118 Å²	118	57.2 Å²	57.2	52%	0.518	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-39.9	177.2	-171.2	-90	0	0	0	113	I170 A171 S172 T178 F221	I170-F174 PolarHBondContact O-N 3.35Å; A171-F174 PolarHBondContact O-N 3.46Å; S172-F174 VanDerWaalsContact C-N 3.26Å; S172-F174 PolarHBondContact O-N 3.4Å; F174-T178 WeakPolarHBondContact O-CB 3.35Å; F174-T178 PolarHBondContact O-N 3.19Å; F174-T178 PolarHBondContact O-OG1 3.08Å; F174-F221 HydrophobicContact CB-CE1 4.3Å; F174-F221 HydrophobicContact CB-CZ 4.22Å; F174-F221 HydrophobicContact CD2-CE1 4.17Å; F174-F221 AromaticContact CD2-CZ 3.84Å; F174-F221 HydrophobicContact CD2-CZ 3.84Å; F174-F221 HydrophobicContact CG-CZ 4.48Å
175	L	75.6	Confident	78	Confident	122 Å²	122	59.5 Å²	59.5	64%	0.639	37%	0.369	S	S	*	.	H	α-helix	trans	-66.4	-41.6	173.7	-70.8	173.2	0	0	0	111.5	A171 S172 T178 G179	A171-L175 WeakPolarHBondContact O-CG 3.28Å; A171-L175 PolarHBondContact O-N 3.18Å; S172-L175 PolarHBondContact O-N 3.02Å; L175-T178 PolarHBondContact O-N 3.46Å; L175-G179 PolarHBondContact O-N 3.21Å
176	D	78.7	Confident	78.1	Confident	90 Å²	90	63.4 Å²	63.4	48%	0.481	39%	0.387	S	S	.	.	H	α-helix	trans	-63.1	-45.9	176.7	-74.7	-11.6	0	0	0	111.1	S172 I173 T178 G179 G180	S172-D176 PolarHBondContact O-N 3.32Å; I173-D176 PolarHBondContact O-N 2.97Å; D176-T178 PolarHBondContact O-N 3.4Å; D176-G179 PolarHBondContact O-N 3.34Å; D176-G180 PolarHBondContact O-N 3.38Å
177	F	83.6	Confident	78.5	Confident	45 Å²	45	59.4 Å²	59.4	20%	0.197	37%	0.368	C	S	.	.	H	α-helix	trans	-58.7	-47.2	175	-179.6	-105.5	0	0	0	112	I173 G179 G180 M181 I214 D217 V218 F221	I173-F177 VanDerWaalsContact O-CB 3.29Å; I173-F177 WeakPolarHBondContact O-CB 3.4Å; I173-F177 PolarHBondContact O-N 2.89Å; F177-G179 VanDerWaalsContact C-N 3.35Å; F177-G179 PolarHBondContact O-N 3.21Å; F177-G180 PolarHBondContact O-N 2.89Å; F177-M181 HydrophobicContact CD1-CG 4.43Å; F177-M181 HydrophobicContact CD1-SD 3.84Å; F177-M181 HydrophobicContact CE1-CG 4.14Å; F177-M181 HydrophobicContact CE1-SD 3.17Å; F177-M181 WeakPolarHBondContact CE1-SD 3.47Å; F177-M181 HydrophobicContact CE2-CG 4.41Å; F177-M181 HydrophobicContact CE2-SD 4.27Å; F177-M181 HydrophobicContact CZ-CG 4.12Å; F177-M181 HydrophobicContact CZ-SD 3.43Å; F177-M181 WeakPolarHBondContact CZ-SD 3.28Å; F177-M181 WeakPolarHBondContact O-CB 3.39Å; F177-M181 WeakPolarHBondContact O-CG 3.37Å; F177-M181 PolarHBondContact O-N 2.89Å; F177-I214 HydrophobicContact CD2-CG2 4.25Å; F177-I214 HydrophobicContact CE2-CG2 3.86Å; F177-D217 VanDerWaalsContact CA-OD2 3.28Å; F177-D217 WeakPolarHBondContact CA-OD2 3.27Å; F177-D217 HydrophobicContact CB-CB 3.87Å; F177-D217 HydrophobicContact CD2-CB 3.87Å; F177-D217 HydrophobicContact CG-CB 4.32Å; F177-D217 PolarHBondContact N-OD2 3.35Å; F177-V218 HydrophobicContact CE2-CG2 3.87Å; F177-F221 HydrophobicContact CB-CE2 3.93Å; F177-F221 HydrophobicContact CB-CZ 4.08Å; F177-F221 AromaticContact CD1-CE2 3.94Å; F177-F221 HydrophobicContact CD1-CE2 3.94Å; F177-F221 HydrophobicContact CD1-CZ 4.42Å; F177-F221 AromaticContact CD2-CE2 4Å; F177-F221 HydrophobicContact CD2-CE2 4Å; F177-F221 HydrophobicContact CE1-CE2 4.42Å; F177-F221 HydrophobicContact CE2-CE2 4.47Å; F177-F221 AromaticContact CG-CE2 3.7Å; F177-F221 HydrophobicContact CG-CE2 3.7Å; F177-F221 HydrophobicContact CG-CZ 4.26Å
178	T	82	Confident	79	Confident	57 Å²	57	59.6 Å²	59.6	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-62.7	-42.9	178	-56.8	0	0	0	0	110.9	F174 L175 D176 M181 C182	F174-T178 WeakPolarHBondContact O-CB 3.35Å; F174-T178 PolarHBondContact O-N 3.19Å; F174-T178 PolarHBondContact O-OG1 3.08Å; L175-T178 PolarHBondContact O-N 3.46Å; D176-T178 PolarHBondContact O-N 3.4Å; T178-M181 PolarHBondContact O-N 3.26Å; T178-C182 WeakPolarHBondContact O-CB 3.32Å; T178-C182 PolarHBondContact O-N 3.01Å; T178-C182 PolarHBondContact O-SG 3.17Å
179	G	77	Confident	79.3	Confident	41 Å²	41	62.3 Å²	62.3	42%	0.423	36%	0.359	S	S	.	.	H	α-helix	trans	-63	-43.5	175.6	0	0	0	0	0	112.6	L175 D176 F177 C182 S183	L175-G179 PolarHBondContact O-N 3.21Å; D176-G179 PolarHBondContact O-N 3.34Å; F177-G179 VanDerWaalsContact C-N 3.35Å; F177-G179 PolarHBondContact O-N 3.21Å; G179-C182 PolarHBondContact O-N 3.13Å; G179-S183 VanDerWaalsContact O-CB 3.29Å; G179-S183 WeakPolarHBondContact O-CB 3.35Å; G179-S183 PolarHBondContact O-N 3.32Å
180	G	80	Confident	78.9	Confident	8 Å²	8	62.1 Å²	62.1	8%	0.082	35%	0.352	C	S	.	.	H	α-helix	trans	-59.7	-48.6	174.3	0	0	0	0	0	111.8	D176 F177 S183 M184	D176-G180 PolarHBondContact O-N 3.38Å; F177-G180 PolarHBondContact O-N 2.89Å; G180-S183 PolarHBondContact O-N 2.9Å; G180-M184 WeakPolarHBondContact O-CG 3.44Å; G180-M184 PolarHBondContact O-N 3.2Å
181	M	83.5	Confident	78.5	Confident	89 Å²	89	60.8 Å²	60.8	44%	0.438	35%	0.346	S	S	.	.	H	α-helix	trans	-60.5	-49.6	176.4	-74.8	-173	74.2	0	0	112.1	F177 T178 S183 M184 C185 I214	F177-M181 HydrophobicContact CD1-CG 4.43Å; F177-M181 HydrophobicContact CD1-SD 3.84Å; F177-M181 HydrophobicContact CE1-CG 4.14Å; F177-M181 HydrophobicContact CE1-SD 3.17Å; F177-M181 WeakPolarHBondContact CE1-SD 3.47Å; F177-M181 HydrophobicContact CE2-CG 4.41Å; F177-M181 HydrophobicContact CE2-SD 4.27Å; F177-M181 HydrophobicContact CZ-CG 4.12Å; F177-M181 HydrophobicContact CZ-SD 3.43Å; F177-M181 WeakPolarHBondContact CZ-SD 3.28Å; F177-M181 WeakPolarHBondContact O-CB 3.39Å; F177-M181 WeakPolarHBondContact O-CG 3.37Å; F177-M181 PolarHBondContact O-N 2.89Å; T178-M181 PolarHBondContact O-N 3.26Å; M181-S183 VanDerWaalsContact C-N 3.29Å; M181-S183 PolarHBondContact O-N 3.33Å; M181-M184 PolarHBondContact O-N 3.35Å; M181-C185 WeakPolarHBondContact O-CB 3.33Å; M181-C185 PolarHBondContact O-N 3.27Å; M181-C185 PolarHBondContact O-SG 2.97Å; M181-C185 VanDerWaalsContact O-SG 3.32Å; M181-I214 HydrophobicContact CG-CD1 4.44Å
182	C	80.5	Confident	78.8	Confident	82 Å²	82	66 Å²	66	55%	0.554	35%	0.352	S	S	*	.	H	α-helix	trans	-58.3	-41.9	177.1	-74.8	0	0	0	0	111.9	T178 G179 C185 Q186	T178-C182 WeakPolarHBondContact O-CB 3.32Å; T178-C182 PolarHBondContact O-N 3.01Å; T178-C182 PolarHBondContact O-SG 3.17Å; G179-C182 PolarHBondContact O-N 3.13Å; C182-C185 PolarHBondContact O-N 3.03Å; C182-Q186 WeakPolarHBondContact O-CB 3.36Å; C182-Q186 PolarHBondContact O-N 2.8Å
183	S	77.7	Confident	79	Confident	28 Å²	28	69.4 Å²	69.4	20%	0.196	37%	0.366	C	S	.	.	H	α-helix	trans	-63.9	-43.3	176.5	-177.4	0	0	0	0	112	G179 G180 M181 Q186 M187 K206	G179-S183 VanDerWaalsContact O-CB 3.29Å; G179-S183 WeakPolarHBondContact O-CB 3.35Å; G179-S183 PolarHBondContact O-N 3.32Å; G180-S183 PolarHBondContact O-N 2.9Å; M181-S183 VanDerWaalsContact C-N 3.29Å; M181-S183 PolarHBondContact O-N 3.33Å; S183-Q186 WeakPolarHBondContact O-CB 3.32Å; S183-Q186 PolarHBondContact O-N 3.49Å; S183-M187 WeakPolarHBondContact O-CG 3.44Å; S183-M187 PolarHBondContact O-N 2.85Å; S183-M187 VanDerWaalsContact O-N 3.1Å; S183-K206 WeakPolarHBondContact OG-CE 3.46Å
184	M	81.3	Confident	78.2	Confident	15 Å²	15	73.6 Å²	73.6	7%	0.074	39%	0.386	C	S	.	.	H	α-helix	trans	-63.7	-48.7	175.4	-70.3	-58.1	89.8	0	0	111	G180 M181 Q186 M187 F188 F207 I214	G180-M184 WeakPolarHBondContact O-CG 3.44Å; G180-M184 PolarHBondContact O-N 3.2Å; M181-M184 PolarHBondContact O-N 3.35Å; M184-Q186 VanDerWaalsContact C-N 3.27Å; M184-Q186 PolarHBondContact O-N 3.33Å; M184-M187 PolarHBondContact O-N 3.3Å; M184-F188 WeakPolarHBondContact O-CD2 3.42Å; M184-F188 PolarHBondContact O-N 2.89Å; M184-F207 HydrophobicContact CE-CD2 4.35Å; M184-F207 HydrophobicContact SD-CD2 3.74Å; M184-F207 HydrophobicContact SD-CE2 3.95Å; M184-I214 HydrophobicContact CG-CD1 3.66Å
185	C	83.8	Confident	77.9	Confident	69 Å²	69	74.4 Å²	74.4	47%	0.466	40%	0.396	S	S	.	.	H	α-helix	trans	-56	-42.4	175.9	-70.2	0	0	0	0	111.8	M181 C182 M187 F188 I189	M181-C185 WeakPolarHBondContact O-CB 3.33Å; M181-C185 PolarHBondContact O-N 3.27Å; M181-C185 PolarHBondContact O-SG 2.97Å; M181-C185 VanDerWaalsContact O-SG 3.32Å; C182-C185 PolarHBondContact O-N 3.03Å; C185-M187 VanDerWaalsContact C-N 3.34Å; C185-M187 PolarHBondContact O-N 3.34Å; C185-F188 PolarHBondContact O-N 2.95Å; C185-I189 VanDerWaalsContact O-CG1 3.25Å; C185-I189 WeakPolarHBondContact O-CG1 3.47Å; C185-I189 PolarHBondContact O-N 3.42Å
186	Q	80.2	Confident	77.6	Confident	87 Å²	87	73.4 Å²	73.4	41%	0.407	39%	0.388	S	S	.	.	H	α-helix	trans	-57.2	-46.2	174.6	-174.3	-164.1	-18.3	0	0	111.5	C182 S183 M184 I189 I190	C182-Q186 WeakPolarHBondContact O-CB 3.36Å; C182-Q186 PolarHBondContact O-N 2.8Å; S183-Q186 WeakPolarHBondContact O-CB 3.32Å; S183-Q186 PolarHBondContact O-N 3.49Å; M184-Q186 VanDerWaalsContact C-N 3.27Å; M184-Q186 PolarHBondContact O-N 3.33Å; Q186-I189 PolarHBondContact O-N 2.96Å; Q186-I190 HydrophobicContact CG-CD1 3.95Å; Q186-I190 VanDerWaalsContact O-CG1 3.27Å; Q186-I190 WeakPolarHBondContact O-CG1 3.37Å; Q186-I190 PolarHBondContact O-N 3.21Å
187	M	76	Confident	77.4	Confident	15 Å²	15	75.4 Å²	75.4	7%	0.074	39%	0.389	C	S	.	.	H	α-helix	trans	-65.4	-39.2	179.9	-67.2	-61.6	-68	0	0	112.3	S183 M184 C185 I190 A191 L200 D203 K206	S183-M187 WeakPolarHBondContact O-CG 3.44Å; S183-M187 PolarHBondContact O-N 2.85Å; S183-M187 VanDerWaalsContact O-N 3.1Å; M184-M187 PolarHBondContact O-N 3.3Å; C185-M187 VanDerWaalsContact C-N 3.34Å; C185-M187 PolarHBondContact O-N 3.34Å; M187-I190 PolarHBondContact O-N 3.39Å; M187-A191 WeakPolarHBondContact O-CB 3.11Å; M187-A191 PolarHBondContact O-N 3.08Å; M187-L200 HydrophobicContact CB-CD1 3.88Å; M187-D203 HydrophobicContact CE-CB 3.97Å; M187-K206 HydrophobicContact SD-CD 3.99Å
188	F	81.7	Confident	76.6	Confident	95 Å²	95	77.2 Å²	77.2	42%	0.417	41%	0.407	S	S	.	.	H	α-helix	trans	-64.8	-42.5	174.2	-81.6	-77	0	0	0	112.3	M184 C185 I190 A191 Y192 W197 L200	M184-F188 WeakPolarHBondContact O-CD2 3.42Å; M184-F188 PolarHBondContact O-N 2.89Å; C185-F188 PolarHBondContact O-N 2.95Å; F188-I190 VanDerWaalsContact C-N 3.32Å; F188-I190 PolarHBondContact O-N 3.05Å; F188-A191 PolarHBondContact O-N 3.12Å; F188-Y192 VanDerWaalsContact O-CB 3.31Å; F188-Y192 WeakPolarHBondContact O-CB 3.25Å; F188-Y192 PolarHBondContact O-N 3.41Å; F188-W197 HydrophobicContact CD1-CZ3 4.08Å; F188-W197 HydrophobicContact CE1-CZ3 4.34Å; F188-L200 HydrophobicContact CE1-CD2 4.09Å; F188-L200 HydrophobicContact CZ-CD2 4.25Å
189	I	80.6	Confident	75.5	Confident	116 Å²	116	77 Å²	77	60%	0.595	40%	0.402	S	S	*	.	H	α-helix	trans	-61.3	-43	176	-69	164.9	0	0	0	110.4	C185 Q186 N193	C185-I189 VanDerWaalsContact O-CG1 3.25Å; C185-I189 WeakPolarHBondContact O-CG1 3.47Å; C185-I189 PolarHBondContact O-N 3.42Å; Q186-I189 PolarHBondContact O-N 2.96Å; I189-N193 WeakPolarHBondContact O-CB 3.48Å; I189-N193 PolarHBondContact O-N 3.48Å
190	I	67.6	Low	74.9	Confident	60 Å²	60	75.6 Å²	75.6	31%	0.308	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-49.2	177.3	-68.6	166	0	0	0	110.8	Q186 M187 F188 Y192 N193 M194	Q186-I190 HydrophobicContact CG-CD1 3.95Å; Q186-I190 VanDerWaalsContact O-CG1 3.27Å; Q186-I190 WeakPolarHBondContact O-CG1 3.37Å; Q186-I190 PolarHBondContact O-N 3.21Å; M187-I190 PolarHBondContact O-N 3.39Å; F188-I190 VanDerWaalsContact C-N 3.32Å; F188-I190 PolarHBondContact O-N 3.05Å; I190-Y192 VanDerWaalsContact C-N 3.3Å; I190-Y192 PolarHBondContact O-N 3.29Å; I190-N193 PolarHBondContact O-N 3.42Å; I190-M194 HydrophobicContact CG2-CG 4.25Å; I190-M194 WeakPolarHBondContact O-CB 3.33Å; I190-M194 VanDerWaalsContact O-CG 3.29Å; I190-M194 WeakPolarHBondContact O-CG 3.43Å; I190-M194 PolarHBondContact O-N 3.01Å
191	A	73.1	Confident	74.2	Confident	1 Å²	1	81.6 Å²	81.6	1%	0.008	41%	0.409	C	S	.	.	H	α-helix	trans	-60.1	-40.5	179.9	0	0	0	0	0	112.1	M187 F188 D195 E196 W197 L200	M187-A191 WeakPolarHBondContact O-CB 3.11Å; M187-A191 PolarHBondContact O-N 3.08Å; F188-A191 PolarHBondContact O-N 3.12Å; A191-D195 PolarHBondContact O-N 3.29Å; A191-E196 PolarHBondContact O-N 3.45Å; A191-W197 HydrophobicContact CB-CE3 4.17Å; A191-W197 HydrophobicContact CB-CZ3 4.49Å; A191-L200 HydrophobicContact CB-CB 4.49Å
192	Y	79.8	Confident	73	Confident	176 Å²	176	80.5 Å²	80.5	69%	0.69	42%	0.421	S	S	*	.	H	α-helix	trans	-67.4	-46.3	175.5	-178.6	-100.3	0	0	0	112.1	F188 I190 M194 D195 W197	F188-Y192 VanDerWaalsContact O-CB 3.31Å; F188-Y192 WeakPolarHBondContact O-CB 3.25Å; F188-Y192 PolarHBondContact O-N 3.41Å; I190-Y192 VanDerWaalsContact C-N 3.3Å; I190-Y192 PolarHBondContact O-N 3.29Å; Y192-M194 VanDerWaalsContact C-N 3.3Å; Y192-M194 PolarHBondContact O-N 2.86Å; Y192-D195 PolarHBondContact O-N 2.83Å; Y192-W197 HydrophobicContact CD2-CZ2 4.49Å
193	N	74.7	Confident	72.2	Confident	131 Å²	131	79.5 Å²	79.5	70%	0.701	41%	0.41	S	S	*	.	H	α-helix	trans	-69.2	-27.6	-177.1	-168.9	54.4	0	0	0	113.2	I189 I190	I189-N193 WeakPolarHBondContact O-CB 3.48Å; I189-N193 PolarHBondContact O-N 3.48Å; I190-N193 PolarHBondContact O-N 3.42Å
194	M	67.3	Low	71.6	Confident	101 Å²	101	85 Å²	85	50%	0.498	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-5.6	178.8	-63.4	-64.2	-67.9	0	0	113.4	I190 Y192 E196	I190-M194 HydrophobicContact CG2-CG 4.25Å; I190-M194 WeakPolarHBondContact O-CB 3.33Å; I190-M194 VanDerWaalsContact O-CG 3.29Å; I190-M194 WeakPolarHBondContact O-CG 3.43Å; I190-M194 PolarHBondContact O-N 3.01Å; Y192-M194 VanDerWaalsContact C-N 3.3Å; Y192-M194 PolarHBondContact O-N 2.86Å; M194-E196 HydrophobicContact CB-CB 4.32Å; M194-E196 PolarHBondContact O-N 3.04Å
195	D	70.5	Confident	70.8	Confident	135 Å²	135	87.3 Å²	87.3	72%	0.722	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	26.1	-170.6	-153.7	25.5	0	0	0	113.8	A191 Y192	A191-D195 PolarHBondContact O-N 3.29Å; Y192-D195 PolarHBondContact O-N 2.83Å
196	E	69.4	Low	69.9	Low	101 Å²	101	87.1 Å²	87.1	47%	0.472	44%	0.437	S	S	.	.			trans	-124.6	79.8	-176.1	-76.6	-172.9	-173.9	0	0	109.6	A191 M194 S198 Q199	A191-E196 PolarHBondContact O-N 3.45Å; M194-E196 HydrophobicContact CB-CB 4.32Å; M194-E196 PolarHBondContact O-N 3.04Å; E196-S198 PolarHBondContact O-N 2.91Å; E196-S198 VanDerWaalsContact O-N 3.11Å; E196-Q199 HydrophobicContact CB-CG 3.85Å; E196-Q199 VanDerWaalsContact O-CB 3.28Å; E196-Q199 WeakPolarHBondContact O-CB 3.39Å; E196-Q199 WeakPolarHBondContact O-CG 3.36Å; E196-Q199 PolarHBondContact O-N 2.95Å; E196-Q199 PolarHBondContact OE2-NE2 3.24Å
197	W	75.8	Confident	69.6	Low	132 Å²	132	84.5 Å²	84.5	50%	0.5	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-20.1	176.7	-66.3	91.5	0	0	0	113.8	F188 A191 Y192 Q199 L200	F188-W197 HydrophobicContact CD1-CZ3 4.08Å; F188-W197 HydrophobicContact CE1-CZ3 4.34Å; A191-W197 HydrophobicContact CB-CE3 4.17Å; A191-W197 HydrophobicContact CB-CZ3 4.49Å; Y192-W197 HydrophobicContact CD2-CZ2 4.49Å; W197-Q199 PolarHBondContact O-N 2.8Å; W197-L200 WeakPolarHBondContact O-CB 3.48Å; W197-L200 PolarHBondContact O-N 3.27Å; W197-L200 VanDerWaalsContact O-N 3.16Å
198	S	65.5	Low	69.5	Low	83 Å²	83	84.8 Å²	84.8	58%	0.58	43%	0.431	S	S	*	.	H	α-helix	trans	-58.9	-27.6	170.5	56.2	0	0	0	0	112.2	E196 L200 F201 G202	E196-S198 PolarHBondContact O-N 2.91Å; E196-S198 VanDerWaalsContact O-N 3.11Å; S198-L200 VanDerWaalsContact C-N 3.28Å; S198-L200 PolarHBondContact O-N 3.05Å; S198-F201 CarbonylContact O-C 3.56Å; S198-F201 PolarHBondContact O-N 3.19Å; S198-G202 PolarHBondContact O-N 3.41Å
199	Q	60.4	Low	69	Low	52 Å²	52	83.9 Å²	83.9	24%	0.243	43%	0.43	C	S	.	.	H	α-helix	trans	-66.6	-28.4	177.7	-63.9	-176.2	16.8	0	0	112.8	E196 W197 F201 G202 D203	E196-Q199 HydrophobicContact CB-CG 3.85Å; E196-Q199 VanDerWaalsContact O-CB 3.28Å; E196-Q199 WeakPolarHBondContact O-CB 3.39Å; E196-Q199 WeakPolarHBondContact O-CG 3.36Å; E196-Q199 PolarHBondContact O-N 2.95Å; E196-Q199 PolarHBondContact OE2-NE2 3.24Å; W197-Q199 PolarHBondContact O-N 2.8Å; Q199-F201 VanDerWaalsContact C-N 3.26Å; Q199-F201 PolarHBondContact O-N 2.85Å; Q199-G202 PolarHBondContact O-N 2.88Å; Q199-G202 VanDerWaalsContact O-N 3.15Å; Q199-D203 PolarHBondContact O-N 3.47Å
200	L	64	Low	68.9	Low	12 Å²	12	78.7 Å²	78.7	6%	0.063	41%	0.406	C	S	.	.	H	α-helix	trans	-60	-41	175.3	-170.8	70.2	0	0	0	110.9	M187 F188 A191 W197 S198 F207	M187-L200 HydrophobicContact CB-CD1 3.88Å; F188-L200 HydrophobicContact CE1-CD2 4.09Å; F188-L200 HydrophobicContact CZ-CD2 4.25Å; A191-L200 HydrophobicContact CB-CB 4.49Å; W197-L200 WeakPolarHBondContact O-CB 3.48Å; W197-L200 PolarHBondContact O-N 3.27Å; W197-L200 VanDerWaalsContact O-N 3.16Å; S198-L200 VanDerWaalsContact C-N 3.28Å; S198-L200 PolarHBondContact O-N 3.05Å; L200-F207 HydrophobicContact CD1-CD2 3.71Å; L200-F207 HydrophobicContact CD1-CE2 3.96Å; L200-F207 HydrophobicContact CD2-CE2 4.14Å; L200-F207 HydrophobicContact CG-CD2 3.93Å; L200-F207 HydrophobicContact CG-CE2 4.04Å
201	F	66	Low	69.7	Low	133 Å²	133	79.4 Å²	79.4	58%	0.583	41%	0.41	S	S	*	.	H	α-helix	trans	-90.4	-13.9	175	-63.6	-74.3	0	0	0	113.2	S198 Q199 D203 F204	S198-F201 CarbonylContact O-C 3.56Å; S198-F201 PolarHBondContact O-N 3.19Å; Q199-F201 VanDerWaalsContact C-N 3.26Å; Q199-F201 PolarHBondContact O-N 2.85Å; F201-D203 VanDerWaalsContact C-N 3.31Å; F201-F204 WeakPolarHBondContact O-CB 3.45Å; F201-F204 PolarHBondContact O-N 2.98Å
202	G	56.6	Low	70.1	Confident	67 Å²	67	82.3 Å²	82.3	69%	0.691	42%	0.423	S	S	*	.	H	α-helix	trans	-65.8	-33.7	176.7	0	0	0	0	0	112.6	S198 Q199	S198-G202 PolarHBondContact O-N 3.41Å; Q199-G202 PolarHBondContact O-N 2.88Å; Q199-G202 VanDerWaalsContact O-N 3.15Å
203	D	65.3	Low	70.2	Confident	61 Å²	61	75.6 Å²	75.6	33%	0.326	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	59.2	166.3	-162.9	-10.7	0	0	0	110.3	M187 Q199 F201 T205 K206 F207	M187-D203 HydrophobicContact CE-CB 3.97Å; Q199-D203 PolarHBondContact O-N 3.47Å; F201-D203 VanDerWaalsContact C-N 3.31Å; D203-T205 PolarHBondContact O-N 3.02Å; D203-T205 VanDerWaalsContact O-N 3.09Å; D203-K206 HydrophobicContact CB-CB 4.28Å; D203-K206 PolarHBondContact O-N 3.1Å; D203-K206 VanDerWaalsContact O-N 3.09Å; D203-K206 WeakPolarHBondContact OD1-CB 3.4Å; D203-K206 PolarHBondContact OD1-N 3.08Å; D203-K206 VanDerWaalsContact OD2-CB 3.27Å; D203-K206 WeakPolarHBondContact OD2-CB 3.31Å; D203-F207 PolarHBondContact O-N 3.13Å
204	F	64.5	Low	70.8	Confident	143 Å²	143	70.9 Å²	70.9	63%	0.627	38%	0.376	S	S	*	.	H	α-helix	trans	-51.2	-33.9	179.1	-175.4	-98.9	0	0	0	112.2	F201 G208	F201-F204 WeakPolarHBondContact O-CB 3.45Å; F201-F204 PolarHBondContact O-N 2.98Å; F204-G208 WeakPolarHBondContact O-CA 3.4Å; F204-G208 PolarHBondContact O-N 3.11Å
205	T	63.9	Low	71.8	Confident	63 Å²	63	70.3 Å²	70.3	39%	0.387	38%	0.375	S	S	.	.	H	α-helix	trans	-66.7	-52	178.2	-51.4	0	0	0	0	111	L145 D203 G208 L209	L145-T205 HydrophobicContact CD1-CG2 4.43Å; D203-T205 PolarHBondContact O-N 3.02Å; D203-T205 VanDerWaalsContact O-N 3.09Å; T205-G208 PolarHBondContact O-N 3.25Å; T205-L209 HydrophobicContact CG2-CD1 3.81Å; T205-L209 HydrophobicContact CG2-CG 4.36Å; T205-L209 VanDerWaalsContact O-CB 3.25Å; T205-L209 WeakPolarHBondContact O-CB 3.4Å; T205-L209 WeakPolarHBondContact O-CG 3.21Å; T205-L209 PolarHBondContact O-N 2.83Å
206	K	66.1	Low	72.6	Confident	65 Å²	65	65.4 Å²	65.4	28%	0.283	35%	0.347	S	S	.	.	H	α-helix	trans	-66.8	-41.9	-179.5	-171.6	178.6	177.1	-169.6	0	112.1	S183 M187 D203 G210	S183-K206 WeakPolarHBondContact OG-CE 3.46Å; M187-K206 HydrophobicContact SD-CD 3.99Å; D203-K206 HydrophobicContact CB-CB 4.28Å; D203-K206 PolarHBondContact O-N 3.1Å; D203-K206 VanDerWaalsContact O-N 3.09Å; D203-K206 WeakPolarHBondContact OD1-CB 3.4Å; D203-K206 PolarHBondContact OD1-N 3.08Å; D203-K206 VanDerWaalsContact OD2-CB 3.27Å; D203-K206 WeakPolarHBondContact OD2-CB 3.31Å; K206-G210 PolarHBondContact O-N 2.94Å
207	F	73.3	Confident	73.4	Confident	32 Å²	32	60.9 Å²	60.9	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-51.6	175.6	-179.6	-95.6	0	0	0	111.2	M184 L200 D203 L209 G210 L211	M184-F207 HydrophobicContact CE-CD2 4.35Å; M184-F207 HydrophobicContact SD-CD2 3.74Å; M184-F207 HydrophobicContact SD-CE2 3.95Å; L200-F207 HydrophobicContact CD1-CD2 3.71Å; L200-F207 HydrophobicContact CD1-CE2 3.96Å; L200-F207 HydrophobicContact CD2-CE2 4.14Å; L200-F207 HydrophobicContact CG-CD2 3.93Å; L200-F207 HydrophobicContact CG-CE2 4.04Å; D203-F207 PolarHBondContact O-N 3.13Å; F207-L209 PolarHBondContact O-N 3.16Å; F207-G210 PolarHBondContact O-N 3.49Å; F207-L211 HydrophobicContact CE1-CD2 4Å; F207-L211 HydrophobicContact CZ-CD2 4.33Å; F207-L211 WeakPolarHBondContact O-CB 3.34Å; F207-L211 PolarHBondContact O-N 2.96Å
208	G	74.5	Confident	74.1	Confident	22 Å²	22	57.7 Å²	57.7	23%	0.227	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-43.2	179.8	0	0	0	0	0	112.8	F204 T205 Q212	F204-G208 WeakPolarHBondContact O-CA 3.4Å; F204-G208 PolarHBondContact O-N 3.11Å; T205-G208 PolarHBondContact O-N 3.25Å; G208-Q212 WeakPolarHBondContact O-CB 3.25Å; G208-Q212 PolarHBondContact O-N 2.99Å
209	L	70.5	Confident	75.3	Confident	75 Å²	75	56.5 Å²	56.5	39%	0.393	31%	0.307	S	S	.	.	H	α-helix	trans	-66.8	-43.3	176.8	-71.3	174.6	0	0	0	112.5	L145 T205 F207 Q212 S213	L145-L209 HydrophobicContact CD2-CD1 4.27Å; L145-L209 HydrophobicContact CD2-CD2 3.89Å; T205-L209 HydrophobicContact CG2-CD1 3.81Å; T205-L209 HydrophobicContact CG2-CG 4.36Å; T205-L209 VanDerWaalsContact O-CB 3.25Å; T205-L209 WeakPolarHBondContact O-CB 3.4Å; T205-L209 WeakPolarHBondContact O-CG 3.21Å; T205-L209 PolarHBondContact O-N 2.83Å; F207-L209 PolarHBondContact O-N 3.16Å; L209-Q212 PolarHBondContact O-N 3Å; L209-S213 WeakPolarHBondContact O-CB 3.46Å; L209-S213 PolarHBondContact O-N 3.02Å
210	G	78.4	Confident	76.6	Confident	8 Å²	8	54.7 Å²	54.7	8%	0.082	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-45.1	177.1	0	0	0	0	0	111.8	K206 F207 S213 I214	K206-G210 PolarHBondContact O-N 2.94Å; F207-G210 PolarHBondContact O-N 3.49Å; G210-S213 PolarHBondContact O-N 3.15Å; G210-I214 WeakPolarHBondContact O-CD1 3.49Å; G210-I214 VanDerWaalsContact O-CG1 3.28Å; G210-I214 WeakPolarHBondContact O-CG1 3.44Å; G210-I214 PolarHBondContact O-N 2.87Å
211	L	83.5	Confident	77.8	Confident	74 Å²	74	56 Å²	56	39%	0.387	30%	0.304	S	S	.	.	H	α-helix	trans	-64.9	-44.7	176.5	-176.6	62.2	0	0	0	111.9	F207 S213 I214 I215	F207-L211 HydrophobicContact CE1-CD2 4Å; F207-L211 HydrophobicContact CZ-CD2 4.33Å; F207-L211 WeakPolarHBondContact O-CB 3.34Å; F207-L211 PolarHBondContact O-N 2.96Å; L211-S213 PolarHBondContact O-N 3.38Å; L211-I214 PolarHBondContact O-N 2.88Å; L211-I215 HydrophobicContact CD1-CD1 4.4Å; L211-I215 HydrophobicContact CG-CD1 4.06Å; L211-I215 VanDerWaalsContact O-CG1 3.3Å; L211-I215 WeakPolarHBondContact O-CG1 3.42Å; L211-I215 PolarHBondContact O-N 3.08Å
212	Q	81.6	Confident	78.9	Confident	62 Å²	62	53.4 Å²	53.4	29%	0.29	30%	0.299	S	S	.	.	H	α-helix	trans	-59.4	-45.4	176.6	179.9	-176.9	-32.3	0	0	111.3	G208 L209 I215 F216	G208-Q212 WeakPolarHBondContact O-CB 3.25Å; G208-Q212 PolarHBondContact O-N 2.99Å; L209-Q212 PolarHBondContact O-N 3Å; Q212-I215 PolarHBondContact O-N 2.97Å; Q212-F216 HydrophobicContact CG-CD2 3.8Å; Q212-F216 HydrophobicContact CG-CE2 3.71Å; Q212-F216 VanDerWaalsContact O-CD2 3.28Å; Q212-F216 WeakPolarHBondContact O-CD2 3.25Å; Q212-F216 PolarHBondContact O-N 3.35Å; Q212-F216 VanDerWaalsContact O-N 3.14Å
213	S	82.9	Confident	80.3	Confident	35 Å²	35	50.6 Å²	50.6	25%	0.245	27%	0.268	C	S	.	.	H	α-helix	trans	-56.7	-53.6	175.9	-167.6	0	0	0	0	110.6	L209 G210 L211 I215 F216 D217	L209-S213 WeakPolarHBondContact O-CB 3.46Å; L209-S213 PolarHBondContact O-N 3.02Å; G210-S213 PolarHBondContact O-N 3.15Å; L211-S213 PolarHBondContact O-N 3.38Å; S213-I215 VanDerWaalsContact C-N 3.27Å; S213-I215 PolarHBondContact O-N 3.47Å; S213-F216 PolarHBondContact O-N 3.19Å; S213-D217 WeakPolarHBondContact O-CB 3.49Å; S213-D217 PolarHBondContact O-N 3.44Å; S213-D217 VanDerWaalsContact O-OD2 3.04Å; S213-D217 PolarHBondContact OG-OD2 3.48Å
214	I	87	Confident	81.1	Confident	32 Å²	32	51.3 Å²	51.3	16%	0.164	27%	0.266	C	S	.	.	H	α-helix	trans	-56.2	-41.6	-179.2	-69.3	163	0	0	0	111.7	F177 M181 M184 G210 L211 D217 V218	F177-I214 HydrophobicContact CD2-CG2 4.25Å; F177-I214 HydrophobicContact CE2-CG2 3.86Å; M181-I214 HydrophobicContact CG-CD1 4.44Å; M184-I214 HydrophobicContact CG-CD1 3.66Å; G210-I214 WeakPolarHBondContact O-CD1 3.49Å; G210-I214 VanDerWaalsContact O-CG1 3.28Å; G210-I214 WeakPolarHBondContact O-CG1 3.44Å; G210-I214 PolarHBondContact O-N 2.87Å; L211-I214 PolarHBondContact O-N 2.88Å; I214-D217 PolarHBondContact O-N 2.83Å; I214-V218 VanDerWaalsContact O-CG2 3.27Å; I214-V218 WeakPolarHBondContact O-CG2 3.26Å; I214-V218 PolarHBondContact O-N 3Å
215	I	88	Confident	82.2	Confident	90 Å²	90	52.3 Å²	52.3	46%	0.462	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-48.9	177.5	-69.9	165.9	0	0	0	110.9	L211 Q212 S213 V218 I219	L211-I215 HydrophobicContact CD1-CD1 4.4Å; L211-I215 HydrophobicContact CG-CD1 4.06Å; L211-I215 VanDerWaalsContact O-CG1 3.3Å; L211-I215 WeakPolarHBondContact O-CG1 3.42Å; L211-I215 PolarHBondContact O-N 3.08Å; Q212-I215 PolarHBondContact O-N 2.97Å; S213-I215 VanDerWaalsContact C-N 3.27Å; S213-I215 PolarHBondContact O-N 3.47Å; I215-V218 PolarHBondContact O-N 2.97Å; I215-I219 HydrophobicContact CG2-CD1 4.22Å; I215-I219 WeakPolarHBondContact O-CG1 3.43Å; I215-I219 PolarHBondContact O-N 3.48Å; I215-I219 VanDerWaalsContact O-N 3.14Å
216	F	86.4	Confident	83.2	Confident	32 Å²	32	52.2 Å²	52.2	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-68	-36.7	179.6	-78.6	-66.3	0	0	0	112.6	I152 T153 V156 Q212 S213 V218 I219 F220	I152-F216 HydrophobicContact CG2-CB 3.71Å; I152-F216 HydrophobicContact CG2-CD1 3.58Å; I152-F216 HydrophobicContact CG2-CD2 3.79Å; I152-F216 HydrophobicContact CG2-CE1 4.08Å; I152-F216 HydrophobicContact CG2-CE2 4.28Å; I152-F216 HydrophobicContact CG2-CG 3.41Å; I152-F216 VanDerWaalsContact CG2-CG 3.41Å; I152-F216 HydrophobicContact CG2-CZ 4.41Å; T153-F216 WeakPolarHBondContact OG1-CZ 2.93Å; V156-F216 HydrophobicContact CG2-CD1 3.92Å; V156-F216 HydrophobicContact CG2-CE1 4.31Å; Q212-F216 HydrophobicContact CG-CD2 3.8Å; Q212-F216 HydrophobicContact CG-CE2 3.71Å; Q212-F216 VanDerWaalsContact O-CD2 3.28Å; Q212-F216 WeakPolarHBondContact O-CD2 3.25Å; Q212-F216 PolarHBondContact O-N 3.35Å; Q212-F216 VanDerWaalsContact O-N 3.14Å; S213-F216 PolarHBondContact O-N 3.19Å; F216-V218 PolarHBondContact O-N 3.4Å; F216-I219 HydrophobicContact CD1-CD1 4.2Å; F216-I219 WeakPolarHBondContact O-CB 3.18Å; F216-I219 PolarHBondContact O-N 2.84Å; F216-I219 VanDerWaalsContact O-N 3.14Å; F216-F220 HydrophobicContact CB-CE2 4.36Å; F216-F220 WeakPolarHBondContact O-CD2 3.49Å; F216-F220 PolarHBondContact O-N 3.28Å
217	D	88.1	Confident	84	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.027	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-42.9	177.3	-62.7	-28.4	0	0	0	111.4	I173 F177 S213 I214 I219 F220 F221	I173-D217 HydrophobicContact CG2-CB 3.85Å; F177-D217 VanDerWaalsContact CA-OD2 3.28Å; F177-D217 WeakPolarHBondContact CA-OD2 3.27Å; F177-D217 HydrophobicContact CB-CB 3.87Å; F177-D217 HydrophobicContact CD2-CB 3.87Å; F177-D217 HydrophobicContact CG-CB 4.32Å; F177-D217 PolarHBondContact N-OD2 3.35Å; S213-D217 WeakPolarHBondContact O-CB 3.49Å; S213-D217 PolarHBondContact O-N 3.44Å; S213-D217 VanDerWaalsContact O-OD2 3.04Å; S213-D217 PolarHBondContact OG-OD2 3.48Å; I214-D217 PolarHBondContact O-N 2.83Å; D217-I219 VanDerWaalsContact C-N 3.31Å; D217-I219 PolarHBondContact O-N 2.93Å; D217-F220 PolarHBondContact O-N 3.43Å; D217-F221 VanDerWaalsContact O-CD2 3.27Å; D217-F221 WeakPolarHBondContact O-CD2 3.47Å; D217-F221 WeakPolarHBondContact O-CG 3.47Å; D217-F221 PolarHBondContact O-N 3.12Å
218	V	90.1	Very high	84.4	Confident	65 Å²	65	53.7 Å²	53.7	39%	0.394	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-42.3	172.6	172.3	0	0	0	0	111	F177 I214 I215 F216 F220 F221 V222	F177-V218 HydrophobicContact CE2-CG2 3.87Å; I214-V218 VanDerWaalsContact O-CG2 3.27Å; I214-V218 WeakPolarHBondContact O-CG2 3.26Å; I214-V218 PolarHBondContact O-N 3Å; I215-V218 PolarHBondContact O-N 2.97Å; F216-V218 PolarHBondContact O-N 3.4Å; V218-F220 VanDerWaalsContact C-N 3.33Å; V218-F220 PolarHBondContact O-N 3.23Å; V218-F221 PolarHBondContact O-N 3.29Å; V218-V222 HydrophobicContact CG1-CG2 4.43Å; V218-V222 WeakPolarHBondContact O-CG2 3.38Å; V218-V222 PolarHBondContact O-N 3.01Å
219	I	89.7	Confident	84.1	Confident	59 Å²	59	54.9 Å²	54.9	30%	0.303	30%	0.301	S	S	.	.	H	α-helix	trans	-60.1	-44.3	175.6	-67.4	166.2	0	0	0	110.6	V156 I215 F216 D217 V222 Q223	V156-I219 HydrophobicContact CG1-CG2 3.64Å; V156-I219 HydrophobicContact CG2-CG2 4.04Å; I215-I219 HydrophobicContact CG2-CD1 4.22Å; I215-I219 WeakPolarHBondContact O-CG1 3.43Å; I215-I219 PolarHBondContact O-N 3.48Å; I215-I219 VanDerWaalsContact O-N 3.14Å; F216-I219 HydrophobicContact CD1-CD1 4.2Å; F216-I219 WeakPolarHBondContact O-CB 3.18Å; F216-I219 PolarHBondContact O-N 2.84Å; F216-I219 VanDerWaalsContact O-N 3.14Å; D217-I219 VanDerWaalsContact C-N 3.31Å; D217-I219 PolarHBondContact O-N 2.93Å; I219-V222 PolarHBondContact O-N 2.95Å; I219-Q223 HydrophobicContact CG2-CG 4.41Å; I219-Q223 WeakPolarHBondContact O-CB 3.27Å; I219-Q223 WeakPolarHBondContact O-CG 3.15Å; I219-Q223 PolarHBondContact O-N 3.41Å
220	F	87.5	Confident	83.6	Confident	14 Å²	14	60.2 Å²	60.2	6%	0.061	32%	0.324	C	S	.	.	H	α-helix	trans	-65.1	-38.4	177.5	-72.3	-56	0	0	0	112.6	I152 Q155 V156 N159 F168 I173 F216 D217 V218 Q223 R224	I152-F220 HydrophobicContact CG2-CE2 3.98Å; I152-F220 HydrophobicContact CG2-CZ 4.2Å; Q155-F220 HydrophobicContact CB-CE1 4.39Å; Q155-F220 HydrophobicContact CB-CZ 4.14Å; Q155-F220 HydrophobicContact CG-CE1 3.98Å; Q155-F220 HydrophobicContact CG-CZ 4.04Å; V156-F220 HydrophobicContact CG2-CD1 4.37Å; V156-F220 HydrophobicContact CG2-CE1 3.65Å; V156-F220 HydrophobicContact CG2-CE2 4.26Å; V156-F220 HydrophobicContact CG2-CZ 3.58Å; N159-F220 WeakPolarHBondContact ND2-CE1 3.22Å; F168-F220 AromaticContact CE1-CD1 3.75Å; F168-F220 HydrophobicContact CE1-CD1 3.75Å; F168-F220 HydrophobicContact CE1-CD2 4.38Å; F168-F220 AromaticContact CE1-CE1 3.94Å; F168-F220 HydrophobicContact CE1-CE1 3.94Å; F168-F220 HydrophobicContact CE1-CG 4Å; F168-F220 HydrophobicContact CE1-CZ 4.33Å; F168-F220 HydrophobicContact CZ-CD1 4.33Å; F168-F220 HydrophobicContact CZ-CE1 4.08Å; F168-F220 HydrophobicContact CZ-CE2 4.36Å; F168-F220 HydrophobicContact CZ-CZ 4.1Å; I173-F220 HydrophobicContact CD1-CD2 3.87Å; I173-F220 HydrophobicContact CD1-CE2 4.25Å; I173-F220 HydrophobicContact CD1-CG 4.49Å; I173-F220 HydrophobicContact CG1-CB 4.33Å; I173-F220 HydrophobicContact CG1-CD2 4.25Å; I173-F220 HydrophobicContact CG1-CG 4.42Å; I173-F220 HydrophobicContact CG2-CB 3.96Å; I173-F220 HydrophobicContact CG2-CD2 4.41Å; F216-F220 HydrophobicContact CB-CE2 4.36Å; F216-F220 WeakPolarHBondContact O-CD2 3.49Å; F216-F220 PolarHBondContact O-N 3.28Å; D217-F220 PolarHBondContact O-N 3.43Å; V218-F220 VanDerWaalsContact C-N 3.33Å; V218-F220 PolarHBondContact O-N 3.23Å; F220-Q223 PolarHBondContact O-N 2.92Å; F220-R224 PolarHBondContact O-N 2.84Å
221	F	89.2	Confident	82.4	Confident	39 Å²	39	64.1 Å²	64.1	17%	0.171	34%	0.337	C	S	.	.	H	α-helix	trans	-62.8	-43.5	172.7	-67.4	-41.2	0	0	0	112.2	I170 I173 F174 F177 D217 V218 Q223 R224 Y225	I170-F221 HydrophobicContact CG2-CD1 4.47Å; I170-F221 HydrophobicContact CG2-CE1 4.36Å; I173-F221 HydrophobicContact CG2-CD1 4.43Å; I173-F221 HydrophobicContact CG2-CE1 4.01Å; I173-F221 HydrophobicContact CG2-CZ 4.14Å; F174-F221 HydrophobicContact CB-CE1 4.3Å; F174-F221 HydrophobicContact CB-CZ 4.22Å; F174-F221 HydrophobicContact CD2-CE1 4.17Å; F174-F221 AromaticContact CD2-CZ 3.84Å; F174-F221 HydrophobicContact CD2-CZ 3.84Å; F174-F221 HydrophobicContact CG-CZ 4.48Å; F177-F221 HydrophobicContact CB-CE2 3.93Å; F177-F221 HydrophobicContact CB-CZ 4.08Å; F177-F221 AromaticContact CD1-CE2 3.94Å; F177-F221 HydrophobicContact CD1-CE2 3.94Å; F177-F221 HydrophobicContact CD1-CZ 4.42Å; F177-F221 AromaticContact CD2-CE2 4Å; F177-F221 HydrophobicContact CD2-CE2 4Å; F177-F221 HydrophobicContact CE1-CE2 4.42Å; F177-F221 HydrophobicContact CE2-CE2 4.47Å; F177-F221 AromaticContact CG-CE2 3.7Å; F177-F221 HydrophobicContact CG-CE2 3.7Å; F177-F221 HydrophobicContact CG-CZ 4.26Å; D217-F221 VanDerWaalsContact O-CD2 3.27Å; D217-F221 WeakPolarHBondContact O-CD2 3.47Å; D217-F221 WeakPolarHBondContact O-CG 3.47Å; D217-F221 PolarHBondContact O-N 3.12Å; V218-F221 PolarHBondContact O-N 3.29Å; F221-Q223 VanDerWaalsContact C-N 3.33Å; F221-Q223 PolarHBondContact O-N 3.07Å; F221-R224 PolarHBondContact O-N 3.26Å; F221-Y225 HydrophobicContact CB-CD2 4.26Å; F221-Y225 HydrophobicContact CD1-CD2 4.21Å; F221-Y225 AromaticContact CD1-CE2 3.84Å; F221-Y225 HydrophobicContact CD1-CE2 3.84Å; F221-Y225 HydrophobicContact CE1-CE2 4.48Å; F221-Y225 WeakPolarHBondContact O-CB 3.42Å; F221-Y225 PolarHBondContact O-N 3.15Å
222	V	89.2	Confident	80.9	Confident	78 Å²	78	65.3 Å²	65.3	47%	0.473	34%	0.343	S	S	.	.	I	π-helix	trans	-62.2	-43.2	175.3	171.6	0	0	0	0	110.5	V218 I219 G226 L227	V218-V222 HydrophobicContact CG1-CG2 4.43Å; V218-V222 WeakPolarHBondContact O-CG2 3.38Å; V218-V222 PolarHBondContact O-N 3.01Å; I219-V222 PolarHBondContact O-N 2.95Å; V222-G226 CarbonylContact O-C 3.55Å; V222-G226 VanDerWaalsContact O-CA 3.25Å; V222-G226 WeakPolarHBondContact O-CA 3.43Å; V222-G226 PolarHBondContact O-N 3.08Å; V222-L227 HydrophobicContact CG1-CD1 4.33Å; V222-L227 HydrophobicContact CG1-CG 4.38Å; V222-L227 PolarHBondContact O-N 2.89Å
223	Q	86.6	Confident	79.6	Confident	9 Å²	9	65.6 Å²	65.6	4%	0.042	35%	0.351	C	S	.	.	I	π-helix	trans	-60.6	-45.9	176	-75.8	-173.1	-24.8	0	0	111.8	V156 N159 T165 I219 F220 F221 Y228	V156-Q223 PolarHBondContact O-NE2 3.27Å; N159-Q223 PolarHBondContact ND2-OE1 3.3Å; T165-Q223 HydrophobicContact CG2-CB 4.18Å; I219-Q223 HydrophobicContact CG2-CG 4.41Å; I219-Q223 WeakPolarHBondContact O-CB 3.27Å; I219-Q223 WeakPolarHBondContact O-CG 3.15Å; I219-Q223 PolarHBondContact O-N 3.41Å; F220-Q223 PolarHBondContact O-N 2.92Å; F221-Q223 VanDerWaalsContact C-N 3.33Å; F221-Q223 PolarHBondContact O-N 3.07Å; Q223-Y228 HydrophobicContact CB-CD2 3.94Å; Q223-Y228 HydrophobicContact CB-CE2 4.03Å; Q223-Y228 HydrophobicContact CG-CD2 4.4Å; Q223-Y228 HydrophobicContact CG-CE2 3.97Å; Q223-Y228 WeakPolarHBondContact O-CA 3.26Å; Q223-Y228 VanDerWaalsContact O-CB 3.26Å; Q223-Y228 WeakPolarHBondContact O-CB 3.18Å; Q223-Y228 WeakPolarHBondContact O-CD2 3.43Å; Q223-Y228 PolarHBondContact O-N 3.21Å
224	R	83	Confident	77.9	Confident	76 Å²	76	70.9 Å²	70.9	29%	0.287	37%	0.373	S	S	.	.	I	π-helix	trans	-71.1	-61.2	178.5	176.5	65.6	158.1	-174.2	1.2	112.6	T165 I170 F220 F221 Y228 G229	T165-R224 VanDerWaalsContact OG1-CD 3.25Å; T165-R224 WeakPolarHBondContact OG1-CD 3.27Å; T165-R224 PolarHBondContact OG1-NH1 3.17Å; T165-R224 VanDerWaalsContact OG1-NH1 3.07Å; I170-R224 HydrophobicContact CD1-CB 3.54Å; I170-R224 HydrophobicContact CD1-CG 3.14Å; I170-R224 VanDerWaalsContact CD1-NE 3.29Å; F220-R224 PolarHBondContact O-N 2.84Å; F221-R224 PolarHBondContact O-N 3.26Å; R224-Y228 CarbonylContact O-C 3.44Å; R224-G229 WeakPolarHBondContact O-CA 3.47Å; R224-G229 PolarHBondContact O-N 3.02Å
225	Y	86	Confident	76.1	Confident	164 Å²	164	75.8 Å²	75.8	64%	0.643	40%	0.395	S	S	*	.	I	π-helix	trans	-87.3	-24.9	-163.3	-63.3	-64.9	0	0	0	111.9	I170 F221	I170-Y225 HydrophobicContact CG2-CE2 4.2Å; F221-Y225 HydrophobicContact CB-CD2 4.26Å; F221-Y225 HydrophobicContact CD1-CD2 4.21Å; F221-Y225 AromaticContact CD1-CE2 3.84Å; F221-Y225 HydrophobicContact CD1-CE2 3.84Å; F221-Y225 HydrophobicContact CE1-CE2 4.48Å; F221-Y225 WeakPolarHBondContact O-CB 3.42Å; F221-Y225 PolarHBondContact O-N 3.15Å
226	G	84.9	Confident	74.3	Confident	60 Å²	60	77.2 Å²	77.2	62%	0.619	40%	0.4	S	S	*	.	I	π-helix	trans	-94.8	-52.3	178.3	0	0	0	0	0	113.8	V222	V222-G226 CarbonylContact O-C 3.55Å; V222-G226 VanDerWaalsContact O-CA 3.25Å; V222-G226 WeakPolarHBondContact O-CA 3.43Å; V222-G226 PolarHBondContact O-N 3.08Å
227	L	84.5	Confident	72.5	Confident	109 Å²	109	79.2 Å²	79.2	57%	0.571	42%	0.418	S	S	*	.	I	π-helix	trans	-97.8	-40.4	-167.1	-63.3	175.4	0	0	0	114.6	V222	V222-L227 HydrophobicContact CG1-CD1 4.33Å; V222-L227 HydrophobicContact CG1-CG 4.38Å; V222-L227 PolarHBondContact O-N 2.89Å
228	Y	81.6	Confident	70.9	Confident	19 Å²	19	82.9 Å²	82.9	8%	0.075	44%	0.441	C	S	.	.	S	Bend	trans	-123.4	23	-168.6	-47.8	-47.4	0	0	0	112.7	Y160 K163 T165 Q223 R224 Q230	Y160-Y228 WeakPolarHBondContact CA-OH 3.35Å; Y160-Y228 WeakPolarHBondContact CD2-OH 3.08Å; K163-Y228 VanDerWaalsContact C-CD1 3.45Å; K163-Y228 HydrophobicContact CB-CD1 4.08Å; K163-Y228 HydrophobicContact CB-CE1 3.89Å; K163-Y228 HydrophobicContact CD-CD1 4.42Å; K163-Y228 HydrophobicContact CD-CE1 3.44Å; K163-Y228 VanDerWaalsContact CD-CE1 3.44Å; K163-Y228 HydrophobicContact CG-CE1 4.3Å; K163-Y228 PolarHBondContact NZ-OH 3.38Å; K163-Y228 VanDerWaalsContact O-CD1 3.22Å; K163-Y228 WeakPolarHBondContact O-CD1 3.21Å; T165-Y228 HydrophobicContact CG2-CD2 4Å; Q223-Y228 HydrophobicContact CB-CD2 3.94Å; Q223-Y228 HydrophobicContact CB-CE2 4.03Å; Q223-Y228 HydrophobicContact CG-CD2 4.4Å; Q223-Y228 HydrophobicContact CG-CE2 3.97Å; Q223-Y228 WeakPolarHBondContact O-CA 3.26Å; Q223-Y228 VanDerWaalsContact O-CB 3.26Å; Q223-Y228 WeakPolarHBondContact O-CB 3.18Å; Q223-Y228 WeakPolarHBondContact O-CD2 3.43Å; Q223-Y228 PolarHBondContact O-N 3.21Å; R224-Y228 CarbonylContact O-C 3.44Å; Y228-Q230 PolarHBondContact O-N 2.95Å; Y228-Q230 VanDerWaalsContact O-N 3.17Å
229	G	67.8	Low	69.2	Low	47 Å²	47	83.2 Å²	83.2	49%	0.485	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-6.4	-174.1	0	0	0	0	0	114.9	R224	R224-G229 WeakPolarHBondContact O-CA 3.47Å; R224-G229 PolarHBondContact O-N 3.02Å
230	Q	59	Low	67.6	Low	188 Å²	188	84.1 Å²	84.1	88%	0.879	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.6	45.2	-172.9	-64.5	-170.6	-22.7	0	0	113.2	Y228 N232	Y228-Q230 PolarHBondContact O-N 2.95Å; Y228-Q230 VanDerWaalsContact O-N 3.17Å; Q230-N232 PolarHBondContact O-N 3.39Å
231	Y	54.2	Low	66.1	Low	90 Å²	90	86.3 Å²	86.3	35%	0.353	47%	0.471	S	S	.	.			trans	-78.4	109.9	165.8	-171.1	-99.2	0	0	0	109.5	E166 P233 E236	E166-Y231 HydrophobicContact CG-CD1 3.9Å; E166-Y231 HydrophobicContact CG-CG 4.46Å; E166-Y231 WeakPolarHBondContact OE1-CD1 3.33Å; E166-Y231 WeakPolarHBondContact OE2-CD1 3.48Å; E166-Y231 WeakPolarHBondContact OE2-CE1 3.38Å; Y231-P233 HydrophobicContact CD1-CB 4.37Å; Y231-P233 HydrophobicContact CD1-CG 4.34Å; Y231-P233 HydrophobicContact CE1-CB 3.8Å; Y231-P233 HydrophobicContact CE1-CG 4.24Å; Y231-P233 VanDerWaalsContact O-CD 3.26Å; Y231-P233 WeakPolarHBondContact O-CD 3.17Å; Y231-E236 PolarHBondContact OH-OE2 3.28Å
232	N	52.7	Low	64.7	Low	99 Å²	99	88.6 Å²	88.6	53%	0.529	49%	0.488	S	S	.	.			trans	-98.4	99.2	170.8	-93.2	-17.6	0	0	0	108.6	Q230 M234 Q235	Q230-N232 PolarHBondContact O-N 3.39Å; N232-M234 PolarHBondContact O-N 3.18Å; N232-Q235 PolarHBondContact O-N 3.43Å
233	P	52.7	Low	63.2	Low	68 Å²	68	91.5 Å²	91.5	44%	0.442	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.8	178	12.9	-19.8	0	0	0	114.1	Y231	Y231-P233 HydrophobicContact CD1-CB 4.37Å; Y231-P233 HydrophobicContact CD1-CG 4.34Å; Y231-P233 HydrophobicContact CE1-CB 3.8Å; Y231-P233 HydrophobicContact CE1-CG 4.24Å; Y231-P233 VanDerWaalsContact O-CD 3.26Å; Y231-P233 WeakPolarHBondContact O-CD 3.17Å
234	M	47.8	Very low	61.8	Low	146 Å²	146	95.2 Å²	95.2	72%	0.719	53%	0.527	S	S	*	.	H	α-helix	trans	-85.2	-10.1	-176.2	-68.6	-172.6	-76.7	0	0	115	N232 V238	N232-M234 PolarHBondContact O-N 3.18Å; M234-V238 WeakPolarHBondContact O-CG2 3.4Å
235	Q	49.2	Very low	60	Low	135 Å²	135	104.1 Å²	104.1	63%	0.631	56%	0.563	S	S	*	*	H	α-helix	trans	-92.4	-25.4	-179.4	-115.6	157.6	-40.6	0	0	113.7	N232 T239	N232-Q235 PolarHBondContact O-N 3.43Å; Q235-T239 PolarHBondContact O-N 2.66Å; Q235-T239 PolarHBondContact O-OG1 3.31Å
236	E	50.5	Low	58.7	Low	119 Å²	119	101.2 Å²	101.2	56%	0.556	56%	0.559	S	S	*	*	H	α-helix	trans	-81.9	-37.8	-178	-144.5	165.1	-163.1	0	0	111.8	Y231 V238 T239 S240	Y231-E236 PolarHBondContact OH-OE2 3.28Å; E236-V238 PolarHBondContact O-N 3.09Å; E236-T239 PolarHBondContact O-N 3.47Å; E236-S240 PolarHBondContact O-N 2.95Å; E236-S240 PolarHBondContact O-OG 3.07Å; E236-S240 VanDerWaalsContact O-OG 3.07Å
237	S	48.5	Very low	57.3	Low	75 Å²	75	103.3 Å²	103.3	52%	0.524	56%	0.556	S	S	.	*	H	α-helix	trans	-65.2	-38.8	176.2	62.5	0	0	0	0	112.8	S241	S237-S241 VanDerWaalsContact O-CB 3.32Å; S237-S241 WeakPolarHBondContact O-CB 3.46Å; S237-S241 PolarHBondContact O-N 3.47Å; S237-S241 PolarHBondContact O-OG 2.92Å; S237-S241 VanDerWaalsContact O-OG 3.06Å
238	V	54.1	Low	55.8	Low	82 Å²	82	103 Å²	103	50%	0.497	56%	0.555	S	S	.	*	H	α-helix	trans	-66.3	-45.7	175.8	178.7	0	0	0	0	109.9	M234 E236 S240 S241 T242	M234-V238 WeakPolarHBondContact O-CG2 3.4Å; E236-V238 PolarHBondContact O-N 3.09Å; V238-S240 PolarHBondContact O-N 3.33Å; V238-S241 WeakPolarHBondContact CA-OG 3.35Å; V238-S241 PolarHBondContact O-N 2.9Å; V238-S241 PolarHBondContact O-OG 2.79Å; V238-T242 HydrophobicContact CG1-CG2 4.35Å; V238-T242 WeakPolarHBondContact O-CG2 3.45Å; V238-T242 PolarHBondContact O-N 3.21Å; V238-T242 PolarHBondContact O-OG1 3.48Å
239	T	55.2	Low	54.3	Low	72 Å²	72	107.9 Å²	107.9	44%	0.442	58%	0.583	S	S	.	*	H	α-helix	trans	-67	-38.8	-177.8	-45.7	0	0	0	0	112.6	Q235 E236 T242 L243	Q235-T239 PolarHBondContact O-N 2.66Å; Q235-T239 PolarHBondContact O-OG1 3.31Å; E236-T239 PolarHBondContact O-N 3.47Å; T239-T242 WeakPolarHBondContact CA-OG1 3.44Å; T239-T242 PolarHBondContact O-N 3.12Å; T239-T242 PolarHBondContact O-OG1 2.95Å; T239-T242 VanDerWaalsContact O-OG1 3.09Å; T239-L243 HydrophobicContact CG2-CD1 4.01Å; T239-L243 WeakPolarHBondContact O-CB 3.32Å; T239-L243 WeakPolarHBondContact O-CG 3.43Å; T239-L243 PolarHBondContact O-N 3.07Å; T239-L243 VanDerWaalsContact O-N 3.12Å
240	S	55.4	Low	53.5	Low	78 Å²	78	111.8 Å²	111.8	55%	0.545	59%	0.59	S	S	.	*	H	α-helix	trans	-68.3	-34.1	173.8	-57.2	0	0	0	0	112.9	E236 V238 S244	E236-S240 PolarHBondContact O-N 2.95Å; E236-S240 PolarHBondContact O-OG 3.07Å; E236-S240 VanDerWaalsContact O-OG 3.07Å; V238-S240 PolarHBondContact O-N 3.33Å; S240-S244 PolarHBondContact O-OG 3.23Å
241	S	57	Low	53.1	Low	59 Å²	59	106.7 Å²	106.7	41%	0.413	57%	0.57	S	S	.	*	H	α-helix	trans	-76.3	-26.9	176.2	69	0	0	0	0	113.8	S237 V238 S244 Y245	S237-S241 VanDerWaalsContact O-CB 3.32Å; S237-S241 WeakPolarHBondContact O-CB 3.46Å; S237-S241 PolarHBondContact O-N 3.47Å; S237-S241 PolarHBondContact O-OG 2.92Å; S237-S241 VanDerWaalsContact O-OG 3.06Å; V238-S241 WeakPolarHBondContact CA-OG 3.35Å; V238-S241 PolarHBondContact O-N 2.9Å; V238-S241 PolarHBondContact O-OG 2.79Å; S241-S244 PolarHBondContact O-OG 3.06Å; S241-Y245 WeakPolarHBondContact O-CD2 3.38Å
242	T	58.8	Low	53	Low	87 Å²	87	107.9 Å²	107.9	53%	0.534	59%	0.586	S	S	.	*	H	α-helix	trans	-85.5	-18.9	176.2	48.7	0	0	0	0	113.8	V238 T239	V238-T242 HydrophobicContact CG1-CG2 4.35Å; V238-T242 WeakPolarHBondContact O-CG2 3.45Å; V238-T242 PolarHBondContact O-N 3.21Å; V238-T242 PolarHBondContact O-OG1 3.48Å; T239-T242 WeakPolarHBondContact CA-OG1 3.44Å; T239-T242 PolarHBondContact O-N 3.12Å; T239-T242 PolarHBondContact O-OG1 2.95Å; T239-T242 VanDerWaalsContact O-OG1 3.09Å
243	L	58.2	Low	53	Low	140 Å²	140	108.5 Å²	108.5	73%	0.733	59%	0.59	S	S	*	*	S	Bend	trans	-89.9	-2.4	174.1	-75	167.5	0	0	0	113.1	T239	T239-L243 HydrophobicContact CG2-CD1 4.01Å; T239-L243 WeakPolarHBondContact O-CB 3.32Å; T239-L243 WeakPolarHBondContact O-CG 3.43Å; T239-L243 PolarHBondContact O-N 3.07Å; T239-L243 VanDerWaalsContact O-N 3.12Å
244	S	56.8	Low	53.1	Low	86 Å²	86	111.9 Å²	111.9	60%	0.601	60%	0.603	S	S	*	*			trans	-100.3	14.3	177.6	55.4	0	0	0	0	114.3	S240 S241	S240-S244 PolarHBondContact O-OG 3.23Å; S241-S244 PolarHBondContact O-OG 3.06Å
245	Y	45.3	Very low	53.5	Low	264 Å²	264	108.8 Å²	108.8	100%	1.035	59%	0.592	S	S	*	*			trans	-125.3	0	171.2	-76.2	-79.6	0	0	0	109.9	S241	S241-Y245 WeakPolarHBondContact O-CD2 3.38Å

Retrieved 245 of 245 residues in 1677.9 ms (Link to these results)

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