A0A087WR49_MOUSE Loading...

ABPBG11

AlphaFold DB , UniProt , Accession A0A087WR49, Species MOUSE (Mus musculus, Mouse), Gene Scgb2b11, Length 112 aa.

						>A0A087WR49_MOUSE|A0A087WR49|Scgb2b11
MKGTLLLLGLLVTGELSFQTSEACVSFFEGYASVLSGSRVWLYQELQAFDATAEEKVALEKIQGCYSEERIRNILLEPKIMEAMVASPECRSYHSLNNFRSILEFISNLLGE
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.3	Very low	55	Low	221 Å²	221	90.9 Å²	90.9	100%	1.089	49%	0.492	S	S	*	.				0	60.8	0	-65.8	168	55.1	0	0	109.8
2	K	49.8	Very low	55.1	Low	162 Å²	162	85.2 Å²	85.2	70%	0.704	46%	0.462	S	S	*	.			trans	-126	5.8	-163.2	-71.9	-171.5	171.2	-169	0	115.8
3	G	55.4	Low	55.2	Low	25 Å²	25	84.9 Å²	84.9	26%	0.258	47%	0.466	S	S	.	.	S	Bend	trans	-121.1	27.4	174.5	0	0	0	0	0	112.6
4	T	59.1	Low	54.9	Low	81 Å²	81	83.8 Å²	83.8	50%	0.497	48%	0.483	S	S	.	.	S	Bend	trans	-109.2	-19.1	-175.6	-44.8	0	0	0	0	110.7	L8	T4-L8 HydrophobicContact CG2-CD1 3.94Å; T4-L8 VanDerWaalsContact O-CB 3.27Å; T4-L8 WeakPolarHBondContact O-CB 3.24Å; T4-L8 PolarHBondContact O-N 3.5Å
5	L	56.1	Low	54.4	Low	102 Å²	102	88.4 Å²	88.4	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-74.8	-34.1	-175.8	-101.3	138.5	0	0	0	113.3	L8 G9	L5-L8 CarbonylContact O-C 3.58Å; L5-L8 WeakPolarHBondContact O-CB 3.41Å; L5-L8 PolarHBondContact O-N 2.8Å; L5-G9 PolarHBondContact O-N 3.13Å
6	L	57	Low	53.8	Low	19 Å²	19	88.4 Å²	88.4	10%	0.099	50%	0.496	C	S	.	.	H	α-helix	trans	-74.1	-43.9	175.8	-114.1	168.4	0	0	0	112	L8 G9 L10 L46 F49 A51 E55 L59	L6-L8 VanDerWaalsContact C-N 3.27Å; L6-L8 PolarHBondContact O-N 3.47Å; L6-G9 PolarHBondContact O-N 2.76Å; L6-G9 VanDerWaalsContact O-N 3.16Å; L6-L10 WeakPolarHBondContact O-CG 3.27Å; L6-L10 PolarHBondContact O-N 3.3Å; L6-L46 HydrophobicContact CD1-CD2 3.75Å; L6-L46 HydrophobicContact CD2-CD2 3.86Å; L6-L46 HydrophobicContact CG-CD2 4.33Å; L6-F49 HydrophobicContact CG-CB 4.31Å; L6-A51 HydrophobicContact CD1-CB 3.19Å; L6-A51 HydrophobicContact CG-CB 4.45Å; L6-E55 WeakPolarHBondContact CB-OE1 3.01Å; L6-E55 HydrophobicContact CD1-CB 3.86Å; L6-E55 HydrophobicContact CD1-CG 4.4Å; L6-L59 HydrophobicContact CD1-CD1 4.47Å; L6-L59 HydrophobicContact CD2-CD1 4.15Å
7	L	57.3	Low	53.5	Low	99 Å²	99	90.2 Å²	90.2	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-59.5	-39.5	167.9	-81.8	166.9	0	0	0	111.1	L10 L11	L7-L10 PolarHBondContact O-N 3.35Å; L7-L11 HydrophobicContact CB-CD1 4.43Å; L7-L11 WeakPolarHBondContact O-CB 3.22Å; L7-L11 WeakPolarHBondContact O-CD1 3.4Å; L7-L11 PolarHBondContact O-N 3.2Å
8	L	58.2	Low	53.1	Low	82 Å²	82	93.1 Å²	93.1	43%	0.429	52%	0.522	S	S	.	.	H	α-helix	trans	-61.6	-50	170.7	-117.8	83.5	0	0	0	110.3	T4 L5 L6 L10 L11 V12	T4-L8 HydrophobicContact CG2-CD1 3.94Å; T4-L8 VanDerWaalsContact O-CB 3.27Å; T4-L8 WeakPolarHBondContact O-CB 3.24Å; T4-L8 PolarHBondContact O-N 3.5Å; L5-L8 CarbonylContact O-C 3.58Å; L5-L8 WeakPolarHBondContact O-CB 3.41Å; L5-L8 PolarHBondContact O-N 2.8Å; L6-L8 VanDerWaalsContact C-N 3.27Å; L6-L8 PolarHBondContact O-N 3.47Å; L8-L10 PolarHBondContact O-N 3.23Å; L8-L10 VanDerWaalsContact O-N 3.15Å; L8-L11 PolarHBondContact O-N 2.91Å; L8-L11 VanDerWaalsContact O-N 3.13Å; L8-V12 HydrophobicContact CB-CG2 4.08Å; L8-V12 HydrophobicContact CD2-CG2 4.15Å; L8-V12 HydrophobicContact CG-CG2 3.87Å; L8-V12 WeakPolarHBondContact O-CA 3.42Å; L8-V12 WeakPolarHBondContact O-CB 3.49Å; L8-V12 WeakPolarHBondContact O-CG2 3.43Å; L8-V12 PolarHBondContact O-N 2.69Å
9	G	58.3	Low	53	Low	38 Å²	38	97.9 Å²	97.9	39%	0.392	54%	0.54	S	S	.	.	H	α-helix	trans	-55	-37.1	179.2	0	0	0	0	0	113	L5 L6	L5-G9 PolarHBondContact O-N 3.13Å; L6-G9 PolarHBondContact O-N 2.76Å; L6-G9 VanDerWaalsContact O-N 3.16Å
10	L	57.6	Low	52.9	Low	89 Å²	89	96.1 Å²	96.1	47%	0.466	53%	0.532	S	S	.	.	H	α-helix	trans	-79.5	-36.1	176.4	-71	166.7	0	0	0	114	L6 L7 L8 T13 F27	L6-L10 WeakPolarHBondContact O-CG 3.27Å; L6-L10 PolarHBondContact O-N 3.3Å; L7-L10 PolarHBondContact O-N 3.35Å; L8-L10 PolarHBondContact O-N 3.23Å; L8-L10 VanDerWaalsContact O-N 3.15Å; L10-T13 PolarHBondContact O-OG1 3.15Å; L10-F27 HydrophobicContact CD2-CD2 4.44Å; L10-F27 HydrophobicContact CD2-CE2 4.16Å
11	L	54.2	Low	53.1	Low	82 Å²	82	94.4 Å²	94.4	43%	0.429	53%	0.527	S	S	.	.	H	α-helix	trans	-80.6	-28.5	177.4	-88.8	143	0	0	0	112.8	L7 L8 T13 G14 E15	L7-L11 HydrophobicContact CB-CD1 4.43Å; L7-L11 WeakPolarHBondContact O-CB 3.22Å; L7-L11 WeakPolarHBondContact O-CD1 3.4Å; L7-L11 PolarHBondContact O-N 3.2Å; L8-L11 PolarHBondContact O-N 2.91Å; L8-L11 VanDerWaalsContact O-N 3.13Å; L11-T13 PolarHBondContact O-N 3.4Å; L11-G14 PolarHBondContact O-N 2.8Å; L11-G14 VanDerWaalsContact O-N 3.11Å; L11-E15 PolarHBondContact O-N 3.46Å; L11-E15 VanDerWaalsContact O-N 3.11Å
12	V	56.3	Low	53.7	Low	22 Å²	22	90.9 Å²	90.9	13%	0.133	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-18.3	-176	169.5	0	0	0	0	111.4	L8 L16 F18	L8-V12 HydrophobicContact CB-CG2 4.08Å; L8-V12 HydrophobicContact CD2-CG2 4.15Å; L8-V12 HydrophobicContact CG-CG2 3.87Å; L8-V12 WeakPolarHBondContact O-CA 3.42Å; L8-V12 WeakPolarHBondContact O-CB 3.49Å; L8-V12 WeakPolarHBondContact O-CG2 3.43Å; L8-V12 PolarHBondContact O-N 2.69Å; V12-L16 HydrophobicContact CG1-CB 4.36Å; V12-L16 HydrophobicContact CG2-CB 4.35Å; V12-L16 HydrophobicContact CG2-CD1 3.74Å; V12-F18 HydrophobicContact CG1-CB 3.98Å
13	T	56.3	Low	54.3	Low	82 Å²	82	84.9 Å²	84.9	50%	0.503	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-18.2	172.4	56.1	0	0	0	0	113.4	L10 L11 F27	L10-T13 PolarHBondContact O-OG1 3.15Å; L11-T13 PolarHBondContact O-N 3.4Å; T13-F27 HydrophobicContact CG2-CB 4.32Å; T13-F27 HydrophobicContact CG2-CD2 4.13Å; T13-F27 HydrophobicContact CG2-CG 4.17Å
14	G	51	Low	54.9	Low	69 Å²	69	84.4 Å²	84.4	71%	0.711	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-37.1	-177	0	0	0	0	0	115.7	L11	L11-G14 PolarHBondContact O-N 2.8Å; L11-G14 VanDerWaalsContact O-N 3.11Å
15	E	46.9	Very low	55.5	Low	153 Å²	153	82.8 Å²	82.8	72%	0.715	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-19.1	-167.5	-70.2	-179.6	165.1	0	0	114.9	L11	L11-E15 PolarHBondContact O-N 3.46Å; L11-E15 VanDerWaalsContact O-N 3.11Å
16	L	45.7	Very low	56.5	Low	88 Å²	88	79 Å²	79	46%	0.461	45%	0.453	S	S	.	.			trans	-119.5	105	-176.7	-66	168	0	0	0	107.6	V12 F18	V12-L16 HydrophobicContact CG1-CB 4.36Å; V12-L16 HydrophobicContact CG2-CB 4.35Å; V12-L16 HydrophobicContact CG2-CD1 3.74Å; L16-F18 HydrophobicContact CB-CD2 4.49Å; L16-F18 PolarHBondContact O-N 3.4Å
17	S	48.6	Very low	57.5	Low	119 Å²	119	80.9 Å²	80.9	83%	0.832	46%	0.461	S	S	*	.			trans	-63.4	50.7	178.5	-37.7	0	0	0	0	113.1	Q19	S17-Q19 PolarHBondContact O-N 2.79Å; S17-Q19 VanDerWaalsContact O-N 3.12Å
18	F	46.5	Very low	58.6	Low	143 Å²	143	76.8 Å²	76.8	63%	0.627	44%	0.439	S	S	*	.			trans	-74	106.1	177.7	-111.2	-86.5	0	0	0	108.1	V12 L16 T20	V12-F18 HydrophobicContact CG1-CB 3.98Å; L16-F18 HydrophobicContact CB-CD2 4.49Å; L16-F18 PolarHBondContact O-N 3.4Å; F18-T20 HydrophobicContact CD1-CG2 3.9Å; F18-T20 HydrophobicContact CE1-CG2 4.43Å; F18-T20 PolarHBondContact O-N 2.94Å
19	Q	50.2	Low	59.7	Low	184 Å²	184	76 Å²	76	86%	0.86	43%	0.433	S	S	*	.			trans	-65.8	10.7	176.2	-77.4	177.7	-28.9	0	0	114.1	S17 S21	S17-Q19 PolarHBondContact O-N 2.79Å; S17-Q19 VanDerWaalsContact O-N 3.12Å; Q19-S21 PolarHBondContact O-N 3.4Å
20	T	52.1	Low	61	Low	62 Å²	62	75 Å²	75	38%	0.38	42%	0.422	S	S	.	.			trans	-78.4	115.1	-176.6	51.9	0	0	0	0	109.6	F18 E22 A23	F18-T20 HydrophobicContact CD1-CG2 3.9Å; F18-T20 HydrophobicContact CE1-CG2 4.43Å; F18-T20 PolarHBondContact O-N 2.94Å; T20-E22 PolarHBondContact O-N 3.16Å; T20-E22 VanDerWaalsContact O-N 3.08Å; T20-A23 PolarHBondContact O-N 3.48Å
21	S	55.7	Low	62.3	Low	61 Å²	61	72.5 Å²	72.5	43%	0.427	41%	0.407	S	S	.	.	H	α-helix	trans	-48.3	-32.8	172.1	53.6	0	0	0	0	112.9	Q19 V25 N98	Q19-S21 PolarHBondContact O-N 3.4Å; S21-V25 WeakPolarHBondContact O-CG2 3.48Å; S21-V25 PolarHBondContact O-N 2.94Å; S21-N98 VanDerWaalsContact CA-ND2 3.34Å; S21-N98 WeakPolarHBondContact CA-ND2 2.99Å; S21-N98 VanDerWaalsContact CB-CG 3.48Å; S21-N98 WeakPolarHBondContact CB-ND2 3.35Å; S21-N98 WeakPolarHBondContact CB-OD1 2.87Å
22	E	56.4	Low	63.8	Low	146 Å²	146	68.8 Å²	68.8	68%	0.682	39%	0.388	S	S	*	.	H	α-helix	trans	-63.2	-49.6	-178.6	-170.3	175	-167.1	0	0	113.2	T20 C24 V25 S26	T20-E22 PolarHBondContact O-N 3.16Å; T20-E22 VanDerWaalsContact O-N 3.08Å; E22-C24 PolarHBondContact O-N 3.03Å; E22-V25 PolarHBondContact O-N 2.76Å; E22-S26 WeakPolarHBondContact O-CB 3.34Å; E22-S26 PolarHBondContact O-N 3.06Å; E22-S26 PolarHBondContact O-OG 3.5Å
23	A	61.4	Low	65.3	Low	37 Å²	37	67.8 Å²	67.8	31%	0.306	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-33.5	-178.4	0	0	0	0	0	112	T20 F27	T20-A23 PolarHBondContact O-N 3.48Å; A23-F27 PolarHBondContact O-N 3.04Å
24	C	69	Low	66.9	Low	14 Å²	14	64.3 Å²	64.3	10%	0.095	36%	0.361	C	S	.	.	H	α-helix	trans	-68.5	-49.5	178.8	-159.8	0	0	0	0	111.3	E22 S26 F27 F28 H94 I102	E22-C24 PolarHBondContact O-N 3.03Å; C24-S26 PolarHBondContact O-N 3.3Å; C24-F27 WeakPolarHBondContact O-CB 3.29Å; C24-F27 PolarHBondContact O-N 2.56Å; C24-F28 WeakPolarHBondContact O-CD2 3.48Å; C24-F28 PolarHBondContact O-N 3.39Å; C24-H94 PolarHBondContact SG-CE1 3.03Å; C24-I102 HydrophobicContact CB-CD1 4.4Å; C24-I102 WeakPolarHBondContact SG-CD1 3.34Å
25	V	71	Confident	68.6	Low	47 Å²	47	61.9 Å²	61.9	29%	0.285	33%	0.331	S	S	.	.	H	α-helix	trans	-60.1	-46.7	176.8	173.6	0	0	0	0	110.8	S21 E22 F27 F28 E29	S21-V25 WeakPolarHBondContact O-CG2 3.48Å; S21-V25 PolarHBondContact O-N 2.94Å; E22-V25 PolarHBondContact O-N 2.76Å; V25-F27 VanDerWaalsContact C-N 3.28Å; V25-F27 PolarHBondContact O-N 3.13Å; V25-F28 PolarHBondContact O-N 3.18Å; V25-E29 HydrophobicContact CG1-CG 4.27Å; V25-E29 WeakPolarHBondContact O-CG 3.22Å; V25-E29 PolarHBondContact O-N 3.35Å
26	S	76.2	Confident	70.4	Confident	24 Å²	24	56 Å²	56	17%	0.168	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-36	177.1	-70.2	0	0	0	0	114	E22 C24 G30 F49	E22-S26 WeakPolarHBondContact O-CB 3.34Å; E22-S26 PolarHBondContact O-N 3.06Å; E22-S26 PolarHBondContact O-OG 3.5Å; C24-S26 PolarHBondContact O-N 3.3Å; S26-G30 PolarHBondContact O-N 3.2Å; S26-F49 VanDerWaalsContact CB-CZ 3.49Å
27	F	79.2	Confident	72.3	Confident	58 Å²	58	53.7 Å²	53.7	25%	0.254	31%	0.305	S	S	.	.	H	α-helix	trans	-62.1	-46.4	173.4	170.7	-92.4	0	0	0	111.3	L10 T13 A23 C24 V25 G30 Y31 M81	L10-F27 HydrophobicContact CD2-CD2 4.44Å; L10-F27 HydrophobicContact CD2-CE2 4.16Å; T13-F27 HydrophobicContact CG2-CB 4.32Å; T13-F27 HydrophobicContact CG2-CD2 4.13Å; T13-F27 HydrophobicContact CG2-CG 4.17Å; A23-F27 PolarHBondContact O-N 3.04Å; C24-F27 WeakPolarHBondContact O-CB 3.29Å; C24-F27 PolarHBondContact O-N 2.56Å; V25-F27 VanDerWaalsContact C-N 3.28Å; V25-F27 PolarHBondContact O-N 3.13Å; F27-G30 PolarHBondContact O-N 3.22Å; F27-Y31 WeakPolarHBondContact O-CB 3.42Å; F27-Y31 PolarHBondContact O-N 3.47Å; F27-M81 HydrophobicContact CE1-CE 4.21Å
28	F	80	Confident	74.3	Confident	13 Å²	13	50.3 Å²	50.3	6%	0.057	28%	0.281	C	S	.	.	H	α-helix	trans	-68.1	-36.3	179.3	-68.3	-71.6	0	0	0	112.4	C24 V25 Y31 A32 M81 V85 I102 F105 I106	C24-F28 WeakPolarHBondContact O-CD2 3.48Å; C24-F28 PolarHBondContact O-N 3.39Å; V25-F28 PolarHBondContact O-N 3.18Å; F28-Y31 PolarHBondContact O-N 3.27Å; F28-A32 VanDerWaalsContact O-CB 3.23Å; F28-A32 WeakPolarHBondContact O-CB 3.45Å; F28-A32 PolarHBondContact O-N 3.11Å; F28-M81 HydrophobicContact CD1-CG 4.04Å; F28-M81 HydrophobicContact CD1-SD 4.3Å; F28-M81 HydrophobicContact CE1-CG 3.69Å; F28-M81 HydrophobicContact CE1-SD 3.6Å; F28-M81 VanDerWaalsContact CE1-SD 3.6Å; F28-V85 HydrophobicContact CE1-CG2 3.57Å; F28-V85 HydrophobicContact CZ-CG2 3.41Å; F28-V85 VanDerWaalsContact CZ-CG2 3.41Å; F28-I102 HydrophobicContact CD1-CG2 4.19Å; F28-I102 HydrophobicContact CD2-CB 4.25Å; F28-I102 HydrophobicContact CD2-CD1 4.34Å; F28-I102 HydrophobicContact CD2-CG1 3.78Å; F28-I102 HydrophobicContact CD2-CG2 3.56Å; F28-I102 HydrophobicContact CE1-CG2 3.91Å; F28-I102 HydrophobicContact CE2-CB 4.1Å; F28-I102 HydrophobicContact CE2-CD1 3.72Å; F28-I102 HydrophobicContact CE2-CG1 3.63Å; F28-I102 HydrophobicContact CE2-CG2 3.28Å; F28-I102 HydrophobicContact CG-CG2 4.04Å; F28-I102 HydrophobicContact CZ-CG2 3.49Å; F28-I102 VanDerWaalsContact CZ-CG2 3.49Å; F28-F105 HydrophobicContact CB-CD1 3.85Å; F28-F105 HydrophobicContact CB-CE1 3.76Å; F28-F105 WeakPolarHBondContact O-CE1 3.38Å; F28-I106 HydrophobicContact CD1-CD1 4.23Å; F28-I106 HydrophobicContact CE1-CD1 4.17Å
29	E	81.6	Confident	76.5	Confident	65 Å²	65	49.8 Å²	49.8	30%	0.304	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-47.4	172.6	-70.7	172	155.1	0	0	111.2	V25 Y31 A32 S33 F105	V25-E29 HydrophobicContact CG1-CG 4.27Å; V25-E29 WeakPolarHBondContact O-CG 3.22Å; V25-E29 PolarHBondContact O-N 3.35Å; E29-Y31 PolarHBondContact O-N 3.1Å; E29-A32 PolarHBondContact O-N 3.04Å; E29-S33 WeakPolarHBondContact O-CB 3.33Å; E29-S33 PolarHBondContact O-N 3.16Å; E29-F105 HydrophobicContact CG-CE2 4.04Å; E29-F105 HydrophobicContact CG-CZ 3.95Å
30	G	85.3	Confident	78.5	Confident	17 Å²	17	46.4 Å²	46.4	18%	0.175	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-47.1	174	0	0	0	0	0	112.2	S26 F27 S33 V34	S26-G30 PolarHBondContact O-N 3.2Å; F27-G30 PolarHBondContact O-N 3.22Å; G30-S33 PolarHBondContact O-N 3.02Å; G30-S33 PolarHBondContact O-OG 3.19Å; G30-V34 WeakPolarHBondContact O-CG2 3.31Å; G30-V34 PolarHBondContact O-N 3.3Å; G30-V34 VanDerWaalsContact O-N 3.08Å
31	Y	85.8	Confident	80.4	Confident	37 Å²	37	47.7 Å²	47.7	15%	0.145	26%	0.264	C	S	.	.	H	α-helix	trans	-60.6	-45.6	176	176.9	-106.6	0	0	0	112.4	F27 F28 E29 S33 V34 L35 E77 M81	F27-Y31 WeakPolarHBondContact O-CB 3.42Å; F27-Y31 PolarHBondContact O-N 3.47Å; F28-Y31 PolarHBondContact O-N 3.27Å; E29-Y31 PolarHBondContact O-N 3.1Å; Y31-S33 VanDerWaalsContact C-N 3.3Å; Y31-S33 PolarHBondContact O-N 3.4Å; Y31-V34 WeakPolarHBondContact O-CB 3.37Å; Y31-V34 PolarHBondContact O-N 2.88Å; Y31-V34 VanDerWaalsContact O-N 3.16Å; Y31-L35 HydrophobicContact CD1-CD1 3.98Å; Y31-L35 HydrophobicContact CD1-CG 4.41Å; Y31-L35 HydrophobicContact CE1-CD1 3.32Å; Y31-L35 HydrophobicContact CE1-CG 4.02Å; Y31-L35 HydrophobicContact CE2-CD1 4.37Å; Y31-L35 HydrophobicContact CE2-CD2 4.45Å; Y31-L35 HydrophobicContact CE2-CG 4.29Å; Y31-L35 PolarHBondContact O-N 3.44Å; Y31-E77 PolarHBondContact OH-O 3.11Å; Y31-M81 HydrophobicContact CD1-CE 3.79Å; Y31-M81 HydrophobicContact CD1-CG 4.39Å; Y31-M81 HydrophobicContact CD2-CE 3.94Å; Y31-M81 HydrophobicContact CE1-CB 3.96Å; Y31-M81 HydrophobicContact CE1-CE 3.51Å; Y31-M81 HydrophobicContact CE1-CG 4Å; Y31-M81 HydrophobicContact CE2-CE 3.7Å; Y31-M81 HydrophobicContact CG-CE 3.97Å; Y31-M81 VanDerWaalsContact CZ-CE 3.45Å
32	A	85	Confident	82.1	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.033	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-40.2	176.8	0	0	0	0	0	111.7	F28 E29 V34 L35 S36 F105 L109	F28-A32 VanDerWaalsContact O-CB 3.23Å; F28-A32 WeakPolarHBondContact O-CB 3.45Å; F28-A32 PolarHBondContact O-N 3.11Å; E29-A32 PolarHBondContact O-N 3.04Å; A32-V34 VanDerWaalsContact C-N 3.3Å; A32-V34 PolarHBondContact O-N 2.91Å; A32-L35 PolarHBondContact O-N 3.2Å; A32-S36 WeakPolarHBondContact O-CB 3.47Å; A32-S36 PolarHBondContact O-N 3.12Å; A32-F105 HydrophobicContact CB-CE1 3.96Å; A32-F105 HydrophobicContact CB-CZ 3.81Å; A32-L109 HydrophobicContact CB-CD1 3.54Å; A32-L109 HydrophobicContact CB-CD2 4.09Å; A32-L109 HydrophobicContact CB-CG 4.48Å
33	S	88	Confident	83.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-38	176.2	83.4	0	0	0	0	111.7	E29 G30 Y31 S36 L42 Q63	E29-S33 WeakPolarHBondContact O-CB 3.33Å; E29-S33 PolarHBondContact O-N 3.16Å; G30-S33 PolarHBondContact O-N 3.02Å; G30-S33 PolarHBondContact O-OG 3.19Å; Y31-S33 VanDerWaalsContact C-N 3.3Å; Y31-S33 PolarHBondContact O-N 3.4Å; S33-S36 PolarHBondContact O-N 3.3Å; S33-S36 PolarHBondContact O-OG 3.19Å; S33-L42 VanDerWaalsContact OG-CD1 3.26Å; S33-L42 WeakPolarHBondContact OG-CD1 3.42Å; S33-Q63 PolarHBondContact O-NE2 3.44Å
34	V	89	Confident	85.2	Confident	9 Å²	9	44.7 Å²	44.7	6%	0.055	24%	0.235	C	C	.	.	H	α-helix	trans	-63.2	-50.5	172.8	171.3	0	0	0	0	110.3	G30 Y31 A32 S36 G37 L42 L59 I62 Q63 Y66	G30-V34 WeakPolarHBondContact O-CG2 3.31Å; G30-V34 PolarHBondContact O-N 3.3Å; G30-V34 VanDerWaalsContact O-N 3.08Å; Y31-V34 WeakPolarHBondContact O-CB 3.37Å; Y31-V34 PolarHBondContact O-N 2.88Å; Y31-V34 VanDerWaalsContact O-N 3.16Å; A32-V34 VanDerWaalsContact C-N 3.3Å; A32-V34 PolarHBondContact O-N 2.91Å; V34-S36 VanDerWaalsContact C-N 3.25Å; V34-S36 PolarHBondContact O-N 3.42Å; V34-G37 PolarHBondContact O-N 3.39Å; V34-L42 HydrophobicContact CG2-CD1 3.78Å; V34-L59 HydrophobicContact CG2-CB 4.48Å; V34-L59 HydrophobicContact CG2-CD2 4.08Å; V34-I62 HydrophobicContact CG1-CB 4.25Å; V34-I62 HydrophobicContact CG1-CG2 3.73Å; V34-Q63 HydrophobicContact CG1-CB 4.25Å; V34-Q63 VanDerWaalsContact O-CG 3.26Å; V34-Q63 WeakPolarHBondContact O-CG 3.33Å; V34-Q63 PolarHBondContact O-NE2 3Å; V34-Y66 HydrophobicContact CG1-CD2 3.73Å; V34-Y66 HydrophobicContact CG1-CE2 3.88Å
35	L	87	Confident	86	Confident	19 Å²	19	45.6 Å²	45.6	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-28.8	179.4	-70.2	-173.1	0	0	0	113.8	Y31 A32 G37 Y66 E77 P78	Y31-L35 HydrophobicContact CD1-CD1 3.98Å; Y31-L35 HydrophobicContact CD1-CG 4.41Å; Y31-L35 HydrophobicContact CE1-CD1 3.32Å; Y31-L35 HydrophobicContact CE1-CG 4.02Å; Y31-L35 HydrophobicContact CE2-CD1 4.37Å; Y31-L35 HydrophobicContact CE2-CD2 4.45Å; Y31-L35 HydrophobicContact CE2-CG 4.29Å; Y31-L35 PolarHBondContact O-N 3.44Å; A32-L35 PolarHBondContact O-N 3.2Å; L35-G37 PolarHBondContact O-N 3.03Å; L35-G37 VanDerWaalsContact O-N 3.11Å; L35-Y66 HydrophobicContact CD2-CD1 3.71Å; L35-Y66 HydrophobicContact CD2-CD2 3.79Å; L35-Y66 HydrophobicContact CD2-CE1 3.68Å; L35-Y66 HydrophobicContact CD2-CE2 3.73Å; L35-Y66 HydrophobicContact CD2-CG 3.74Å; L35-E77 HydrophobicContact CD1-CB 3.95Å; L35-E77 HydrophobicContact CD2-CB 3.81Å; L35-E77 HydrophobicContact CD2-CG 4.19Å; L35-P78 HydrophobicContact CD1-CG 3.91Å
36	S	85	Confident	86.9	Confident	29 Å²	29	43.6 Å²	43.6	20%	0.203	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-24.2	-176	77	0	0	0	0	113.8	A32 S33 V34 S38 W41	A32-S36 WeakPolarHBondContact O-CB 3.47Å; A32-S36 PolarHBondContact O-N 3.12Å; S33-S36 PolarHBondContact O-N 3.3Å; S33-S36 PolarHBondContact O-OG 3.19Å; V34-S36 VanDerWaalsContact C-N 3.25Å; V34-S36 PolarHBondContact O-N 3.42Å; S36-S38 PolarHBondContact O-N 3.29Å; S36-S38 WeakPolarHBondContact OG-CB 3.22Å; S36-S38 PolarHBondContact OG-N 2.64Å; S36-W41 VanDerWaalsContact CB-CE3 3.46Å
37	G	86.4	Confident	87.4	Confident	40 Å²	40	48.8 Å²	48.8	41%	0.412	25%	0.247	S	C	.	.			trans	70.9	0.8	-169.5	0	0	0	0	0	113.9	V34 L35 Q63	V34-G37 PolarHBondContact O-N 3.39Å; L35-G37 PolarHBondContact O-N 3.03Å; L35-G37 VanDerWaalsContact O-N 3.11Å; G37-Q63 VanDerWaalsContact C-CD 3.49Å
38	S	89.7	Confident	87.5	Confident	47 Å²	47	49.7 Å²	49.7	33%	0.329	27%	0.266	S	S	.	.			trans	-89.6	108.6	179.4	179.2	0	0	0	0	110.4	S36 V40 W41 L42 Q63	S36-S38 PolarHBondContact O-N 3.29Å; S36-S38 WeakPolarHBondContact OG-CB 3.22Å; S36-S38 PolarHBondContact OG-N 2.64Å; S38-V40 VanDerWaalsContact C-N 3.25Å; S38-V40 PolarHBondContact O-N 3.33Å; S38-W41 PolarHBondContact O-N 3.44Å; S38-W41 PolarHBondContact OG-N 2.91Å; S38-L42 WeakPolarHBondContact O-CB 3.16Å; S38-L42 PolarHBondContact O-N 3.37Å; S38-Q63 PolarHBondContact O-NE2 2.62Å
39	R	92.3	Very high	87.6	Confident	132 Å²	132	51.8 Å²	51.8	50%	0.498	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-38.5	172.5	-176	-177.2	179.5	163.1	0.6	112.1	L42 Y43 E60	R39-L42 PolarHBondContact O-N 2.96Å; R39-Y43 HydrophobicContact CG-CD1 3.91Å; R39-Y43 HydrophobicContact CG-CE1 3.77Å; R39-Y43 PolarHBondContact NE-OH 2.89Å; R39-Y43 PolarHBondContact NH2-OH 3.11Å; R39-Y43 WeakPolarHBondContact O-CB 3.26Å; R39-Y43 VanDerWaalsContact O-CD1 3.32Å; R39-Y43 WeakPolarHBondContact O-CD1 3.32Å; R39-Y43 PolarHBondContact O-N 3.1Å; R39-E60 VanDerWaalsContact CD-OE1 3.22Å; R39-E60 WeakPolarHBondContact CD-OE1 3.47Å; R39-E60 IonicContact CZ-OE1 3.14Å; R39-E60 IonicContact CZ-OE2 3.43Å; R39-E60 IonicContact NE-OE1 3.2Å; R39-E60 PolarHBondContact NE-OE1 3.27Å; R39-E60 IonicContact NE-OE2 3.39Å; R39-E60 PolarHBondContact NE-OE2 3.32Å; R39-E60 IonicContact NH1-OE1 3.03Å; R39-E60 PolarHBondContact NH1-OE1 3.08Å; R39-E60 IonicContact NH2-OE1 3.88Å; R39-E60 IonicContact NH2-OE2 3.53Å
40	V	93.3	Very high	87.7	Confident	114 Å²	114	54 Å²	54	69%	0.691	29%	0.289	S	S	*	.	H	α-helix	trans	-62.1	-47.5	-179.7	176.5	0	0	0	0	110.1	S38 Y43 Q44	S38-V40 VanDerWaalsContact C-N 3.25Å; S38-V40 PolarHBondContact O-N 3.33Å; V40-Y43 PolarHBondContact O-N 3.06Å; V40-Q44 WeakPolarHBondContact O-CB 3.39Å; V40-Q44 PolarHBondContact O-N 3.36Å
41	W	91.9	Very high	87.6	Confident	89 Å²	89	53.7 Å²	53.7	34%	0.337	29%	0.285	S	S	.	.	H	α-helix	trans	-66.2	-47.4	178.9	-170.4	5.9	0	0	0	111.1	S36 S38 Y43 Q44 E45 L109	S36-W41 VanDerWaalsContact CB-CE3 3.46Å; S38-W41 PolarHBondContact O-N 3.44Å; S38-W41 PolarHBondContact OG-N 2.91Å; W41-Y43 VanDerWaalsContact C-N 3.3Å; W41-Y43 PolarHBondContact O-N 3.41Å; W41-Q44 WeakPolarHBondContact O-CB 3.35Å; W41-Q44 PolarHBondContact O-N 3.17Å; W41-Q44 VanDerWaalsContact O-N 3.1Å; W41-E45 PolarHBondContact NE1-OE1 3.15Å; W41-E45 PolarHBondContact O-N 3.01Å; W41-L109 HydrophobicContact CH2-CD2 4.39Å
42	L	90.7	Very high	87.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-52	-49.8	175.3	176.9	63.4	0	0	0	111.5	S33 V34 S38 R39 Q44 E45 L46 L59 E60 Q63	S33-L42 VanDerWaalsContact OG-CD1 3.26Å; S33-L42 WeakPolarHBondContact OG-CD1 3.42Å; V34-L42 HydrophobicContact CG2-CD1 3.78Å; S38-L42 WeakPolarHBondContact O-CB 3.16Å; S38-L42 PolarHBondContact O-N 3.37Å; R39-L42 PolarHBondContact O-N 2.96Å; L42-Q44 VanDerWaalsContact C-N 3.3Å; L42-Q44 PolarHBondContact O-N 3.48Å; L42-E45 PolarHBondContact O-N 3.45Å; L42-L46 HydrophobicContact CD1-CD1 3.74Å; L42-L46 HydrophobicContact CD1-CG 4.02Å; L42-L46 HydrophobicContact CG-CD1 3.83Å; L42-L46 HydrophobicContact CG-CG 4.41Å; L42-L46 WeakPolarHBondContact O-CB 3.13Å; L42-L46 WeakPolarHBondContact O-CG 3.32Å; L42-L46 PolarHBondContact O-N 2.94Å; L42-L59 HydrophobicContact CD1-CB 4.14Å; L42-L59 HydrophobicContact CD2-CB 4.2Å; L42-E60 HydrophobicContact CD2-CB 4.22Å; L42-Q63 HydrophobicContact CD2-CB 4.36Å
43	Y	92	Very high	87.9	Confident	57 Å²	57	56.7 Å²	56.7	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-69	-29.9	-177.1	-84	41.3	0	0	0	112.9	R39 V40 W41 Q47 K56 E60	R39-Y43 HydrophobicContact CG-CD1 3.91Å; R39-Y43 HydrophobicContact CG-CE1 3.77Å; R39-Y43 PolarHBondContact NE-OH 2.89Å; R39-Y43 PolarHBondContact NH2-OH 3.11Å; R39-Y43 WeakPolarHBondContact O-CB 3.26Å; R39-Y43 VanDerWaalsContact O-CD1 3.32Å; R39-Y43 WeakPolarHBondContact O-CD1 3.32Å; R39-Y43 PolarHBondContact O-N 3.1Å; V40-Y43 PolarHBondContact O-N 3.06Å; W41-Y43 VanDerWaalsContact C-N 3.3Å; W41-Y43 PolarHBondContact O-N 3.41Å; Y43-Q47 WeakPolarHBondContact O-CB 3.44Å; Y43-Q47 PolarHBondContact O-N 2.63Å; Y43-K56 HydrophobicContact CD2-CD 4.09Å; Y43-K56 HydrophobicContact CE1-CB 4.07Å; Y43-K56 HydrophobicContact CE2-CB 4.42Å; Y43-K56 HydrophobicContact CE2-CD 4.13Å; Y43-K56 HydrophobicContact CG-CD 4.41Å; Y43-E60 HydrophobicContact CE1-CB 4.47Å; Y43-E60 WeakPolarHBondContact CE1-OE2 3.09Å; Y43-E60 PolarHBondContact OH-OE2 3.09Å
44	Q	90.8	Very high	88	Confident	122 Å²	122	63.4 Å²	63.4	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-67.8	-47.6	173.8	-179.5	179.4	-22.4	0	0	111	V40 W41 L42 L46 Q47	V40-Q44 WeakPolarHBondContact O-CB 3.39Å; V40-Q44 PolarHBondContact O-N 3.36Å; W41-Q44 WeakPolarHBondContact O-CB 3.35Å; W41-Q44 PolarHBondContact O-N 3.17Å; W41-Q44 VanDerWaalsContact O-N 3.1Å; L42-Q44 VanDerWaalsContact C-N 3.3Å; L42-Q44 PolarHBondContact O-N 3.48Å; Q44-L46 VanDerWaalsContact C-N 3.33Å; Q44-L46 PolarHBondContact O-N 3.41Å; Q44-Q47 WeakPolarHBondContact O-CB 3.44Å; Q44-Q47 PolarHBondContact O-N 3.05Å; Q44-Q47 VanDerWaalsContact O-N 3.16Å
45	E	86.9	Confident	87.9	Confident	34 Å²	34	64.2 Å²	64.2	16%	0.159	35%	0.348	C	S	.	.	H	α-helix	trans	-59.9	-46.7	175.5	-66.5	-49.6	143.4	0	0	110.7	W41 L42 Q47 A48 F49	W41-E45 PolarHBondContact NE1-OE1 3.15Å; W41-E45 PolarHBondContact O-N 3.01Å; L42-E45 PolarHBondContact O-N 3.45Å; E45-Q47 PolarHBondContact O-N 3.37Å; E45-A48 WeakPolarHBondContact O-CB 3.37Å; E45-A48 PolarHBondContact O-N 3.08Å; E45-F49 WeakPolarHBondContact O-CD2 3.36Å; E45-F49 WeakPolarHBondContact O-CE2 3.41Å
46	L	87.9	Confident	88.1	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	35%	0.353	C	S	.	.	H	α-helix	trans	-67	-20.3	179.5	-62.8	178.8	0	0	0	113.8	L6 L42 Q44 A48 F49 D50 A51 K56 L59	L6-L46 HydrophobicContact CD1-CD2 3.75Å; L6-L46 HydrophobicContact CD2-CD2 3.86Å; L6-L46 HydrophobicContact CG-CD2 4.33Å; L42-L46 HydrophobicContact CD1-CD1 3.74Å; L42-L46 HydrophobicContact CD1-CG 4.02Å; L42-L46 HydrophobicContact CG-CD1 3.83Å; L42-L46 HydrophobicContact CG-CG 4.41Å; L42-L46 WeakPolarHBondContact O-CB 3.13Å; L42-L46 WeakPolarHBondContact O-CG 3.32Å; L42-L46 PolarHBondContact O-N 2.94Å; Q44-L46 VanDerWaalsContact C-N 3.33Å; Q44-L46 PolarHBondContact O-N 3.41Å; L46-A48 VanDerWaalsContact C-N 3.31Å; L46-F49 PolarHBondContact O-N 3.25Å; L46-D50 PolarHBondContact O-N 3.37Å; L46-A51 HydrophobicContact CB-CB 3.7Å; L46-A51 VanDerWaalsContact O-CB 3.22Å; L46-A51 WeakPolarHBondContact O-CB 3.42Å; L46-A51 PolarHBondContact O-N 2.98Å; L46-A51 VanDerWaalsContact O-N 3.13Å; L46-K56 HydrophobicContact CB-CG 4.29Å; L46-K56 HydrophobicContact CD1-CB 4.32Å; L46-K56 HydrophobicContact CD1-CG 3.86Å; L46-L59 HydrophobicContact CD1-CB 4.21Å; L46-L59 HydrophobicContact CD1-CD1 3.61Å; L46-L59 HydrophobicContact CD2-CD1 3.27Å; L46-L59 HydrophobicContact CG-CD1 4.06Å
47	Q	87.4	Confident	88.4	Confident	134 Å²	134	67.3 Å²	67.3	63%	0.626	36%	0.362	S	S	*	.	H	α-helix	trans	-68.1	-33.6	172.9	-173.5	173.9	20.4	0	0	111.6	Y43 Q44 E45 F49 D50	Y43-Q47 WeakPolarHBondContact O-CB 3.44Å; Y43-Q47 PolarHBondContact O-N 2.63Å; Q44-Q47 WeakPolarHBondContact O-CB 3.44Å; Q44-Q47 PolarHBondContact O-N 3.05Å; Q44-Q47 VanDerWaalsContact O-N 3.16Å; E45-Q47 PolarHBondContact O-N 3.37Å; Q47-F49 PolarHBondContact O-N 3.2Å; Q47-D50 PolarHBondContact O-N 2.82Å
48	A	82.4	Confident	88.6	Confident	77 Å²	77	67.8 Å²	67.8	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-62.8	-21.2	176.6	0	0	0	0	0	112.8	E45 L46	E45-A48 WeakPolarHBondContact O-CB 3.37Å; E45-A48 PolarHBondContact O-N 3.08Å; L46-A48 VanDerWaalsContact C-N 3.31Å
49	F	80.7	Confident	88.6	Confident	56 Å²	56	66.8 Å²	66.8	25%	0.246	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	12.2	-178.8	-54	-76.8	0	0	0	113.9	L6 S26 E45 L46 Q47 A51	L6-F49 HydrophobicContact CG-CB 4.31Å; S26-F49 VanDerWaalsContact CB-CZ 3.49Å; E45-F49 WeakPolarHBondContact O-CD2 3.36Å; E45-F49 WeakPolarHBondContact O-CE2 3.41Å; L46-F49 PolarHBondContact O-N 3.25Å; Q47-F49 PolarHBondContact O-N 3.2Å; F49-A51 PolarHBondContact O-N 3.47Å
50	D	83.6	Confident	88.5	Confident	112 Å²	112	63 Å²	63	60%	0.599	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	35.7	-178.3	-74.5	-47.9	0	0	0	113.8	L46 Q47 T52	L46-D50 PolarHBondContact O-N 3.37Å; Q47-D50 PolarHBondContact O-N 2.82Å; D50-T52 PolarHBondContact O-N 3.28Å
51	A	83.1	Confident	88.4	Confident	11 Å²	11	64.5 Å²	64.5	9%	0.091	34%	0.338	C	S	.	.			trans	-54.6	136.9	-175.7	0	0	0	0	0	113.9	L6 L46 F49 E55 K56	L6-A51 HydrophobicContact CD1-CB 3.19Å; L6-A51 HydrophobicContact CG-CB 4.45Å; L46-A51 HydrophobicContact CB-CB 3.7Å; L46-A51 VanDerWaalsContact O-CB 3.22Å; L46-A51 WeakPolarHBondContact O-CB 3.42Å; L46-A51 PolarHBondContact O-N 2.98Å; L46-A51 VanDerWaalsContact O-N 3.13Å; F49-A51 PolarHBondContact O-N 3.47Å; A51-E55 WeakPolarHBondContact CA-OE2 3.45Å; A51-E55 HydrophobicContact CB-CB 4.46Å; A51-K56 HydrophobicContact CB-CG 3.92Å; A51-K56 WeakPolarHBondContact O-CE 3.48Å
52	T	88	Confident	88.3	Confident	37 Å²	37	64.2 Å²	64.2	23%	0.227	34%	0.342	C	S	.	.			trans	-68.4	163.6	173.3	86.3	0	0	0	0	111.7	D50 E54 E55 K56	D50-T52 PolarHBondContact O-N 3.28Å; T52-E54 VanDerWaalsContact CB-OE2 3.24Å; T52-E54 WeakPolarHBondContact CB-OE2 3.26Å; T52-E54 PolarHBondContact O-N 3.03Å; T52-E54 PolarHBondContact OG1-N 2.84Å; T52-E54 PolarHBondContact OG1-OE2 3.37Å; T52-E55 PolarHBondContact N-OE2 3.24Å; T52-E55 PolarHBondContact O-N 3.28Å; T52-E55 PolarHBondContact OG1-N 3.06Å; T52-K56 WeakPolarHBondContact O-CG 3.41Å; T52-K56 PolarHBondContact O-N 3.46Å
53	A	90.3	Very high	88.2	Confident	67 Å²	67	64.7 Å²	64.7	55%	0.554	35%	0.345	S	S	*	.	H	α-helix	trans	-60.1	-37.6	176	0	0	0	0	0	111.4	K56 V57	A53-K56 PolarHBondContact O-N 3.41Å; A53-V57 VanDerWaalsContact O-CG2 3.29Å; A53-V57 WeakPolarHBondContact O-CG2 3.41Å; A53-V57 PolarHBondContact O-N 3.28Å
54	E	89.3	Confident	88	Confident	140 Å²	140	63.2 Å²	63.2	65%	0.654	35%	0.347	S	S	*	.	H	α-helix	trans	-67.6	-41.9	178.6	-57.8	72.2	-155.1	0	0	111.6	T52 V57 A58	T52-E54 VanDerWaalsContact CB-OE2 3.24Å; T52-E54 WeakPolarHBondContact CB-OE2 3.26Å; T52-E54 PolarHBondContact O-N 3.03Å; T52-E54 PolarHBondContact OG1-N 2.84Å; T52-E54 PolarHBondContact OG1-OE2 3.37Å; E54-V57 PolarHBondContact O-N 3.08Å; E54-A58 WeakPolarHBondContact O-CB 3.41Å; E54-A58 PolarHBondContact O-N 2.88Å
55	E	87.5	Confident	87.8	Confident	27 Å²	27	61.1 Å²	61.1	13%	0.126	35%	0.345	C	S	.	.	H	α-helix	trans	-63.9	-43	176.1	-70	174.3	145.1	0	0	111.7	L6 A51 T52 V57 A58 L59	L6-E55 WeakPolarHBondContact CB-OE1 3.01Å; L6-E55 HydrophobicContact CD1-CB 3.86Å; L6-E55 HydrophobicContact CD1-CG 4.4Å; A51-E55 WeakPolarHBondContact CA-OE2 3.45Å; A51-E55 HydrophobicContact CB-CB 4.46Å; T52-E55 PolarHBondContact N-OE2 3.24Å; T52-E55 PolarHBondContact O-N 3.28Å; T52-E55 PolarHBondContact OG1-N 3.06Å; E55-V57 PolarHBondContact O-N 2.68Å; E55-A58 WeakPolarHBondContact O-CB 3.42Å; E55-A58 PolarHBondContact O-N 2.96Å; E55-L59 PolarHBondContact O-N 2.92Å
56	K	90	Very high	87.7	Confident	46 Å²	46	61.9 Å²	61.9	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-60.4	-45.8	175.5	-70.1	178.9	-175.4	-173.7	0	111.8	Y43 L46 A51 T52 A53 A58 L59 E60	Y43-K56 HydrophobicContact CD2-CD 4.09Å; Y43-K56 HydrophobicContact CE1-CB 4.07Å; Y43-K56 HydrophobicContact CE2-CB 4.42Å; Y43-K56 HydrophobicContact CE2-CD 4.13Å; Y43-K56 HydrophobicContact CG-CD 4.41Å; L46-K56 HydrophobicContact CB-CG 4.29Å; L46-K56 HydrophobicContact CD1-CB 4.32Å; L46-K56 HydrophobicContact CD1-CG 3.86Å; A51-K56 HydrophobicContact CB-CG 3.92Å; A51-K56 WeakPolarHBondContact O-CE 3.48Å; T52-K56 WeakPolarHBondContact O-CG 3.41Å; T52-K56 PolarHBondContact O-N 3.46Å; A53-K56 PolarHBondContact O-N 3.41Å; K56-A58 VanDerWaalsContact C-N 3.31Å; K56-A58 PolarHBondContact O-N 3.42Å; K56-L59 PolarHBondContact O-N 3.39Å; K56-E60 VanDerWaalsContact O-CB 3.31Å; K56-E60 WeakPolarHBondContact O-CB 3.46Å; K56-E60 PolarHBondContact O-N 3.19Å
57	V	91.6	Very high	87.2	Confident	67 Å²	67	64.8 Å²	64.8	41%	0.406	37%	0.367	S	S	.	.	H	α-helix	trans	-65	-36.6	177.4	170.1	0	0	0	0	111.4	A53 E54 E55 K61	A53-V57 VanDerWaalsContact O-CG2 3.29Å; A53-V57 WeakPolarHBondContact O-CG2 3.41Å; A53-V57 PolarHBondContact O-N 3.28Å; E54-V57 PolarHBondContact O-N 3.08Å; E55-V57 PolarHBondContact O-N 2.68Å; V57-K61 WeakPolarHBondContact O-CG 3.34Å; V57-K61 PolarHBondContact O-N 3.3Å; V57-K61 VanDerWaalsContact O-N 3.1Å
58	A	91	Very high	86.8	Confident	50 Å²	50	66.1 Å²	66.1	41%	0.413	37%	0.374	S	S	.	.	H	α-helix	trans	-63	-48.2	176.6	0	0	0	0	0	111.6	E54 E55 K56 K61 I62	E54-A58 WeakPolarHBondContact O-CB 3.41Å; E54-A58 PolarHBondContact O-N 2.88Å; E55-A58 WeakPolarHBondContact O-CB 3.42Å; E55-A58 PolarHBondContact O-N 2.96Å; K56-A58 VanDerWaalsContact C-N 3.31Å; K56-A58 PolarHBondContact O-N 3.42Å; A58-K61 WeakPolarHBondContact O-CB 3.49Å; A58-K61 PolarHBondContact O-N 2.67Å; A58-I62 PolarHBondContact O-N 3.44Å
59	L	89.6	Confident	86.6	Confident	26 Å²	26	67.2 Å²	67.2	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-70.2	-32.9	178.4	-71.6	167.2	0	0	0	112.8	L6 V34 L42 L46 E55 K56 K61 I62 Q63	L6-L59 HydrophobicContact CD1-CD1 4.47Å; L6-L59 HydrophobicContact CD2-CD1 4.15Å; V34-L59 HydrophobicContact CG2-CB 4.48Å; V34-L59 HydrophobicContact CG2-CD2 4.08Å; L42-L59 HydrophobicContact CD1-CB 4.14Å; L42-L59 HydrophobicContact CD2-CB 4.2Å; L46-L59 HydrophobicContact CD1-CB 4.21Å; L46-L59 HydrophobicContact CD1-CD1 3.61Å; L46-L59 HydrophobicContact CD2-CD1 3.27Å; L46-L59 HydrophobicContact CG-CD1 4.06Å; E55-L59 PolarHBondContact O-N 2.92Å; K56-L59 PolarHBondContact O-N 3.39Å; L59-K61 VanDerWaalsContact C-N 3.27Å; L59-K61 PolarHBondContact O-N 3.19Å; L59-I62 HydrophobicContact CD2-CD1 4.25Å; L59-I62 PolarHBondContact O-N 2.99Å; L59-I62 VanDerWaalsContact O-N 3.17Å; L59-Q63 PolarHBondContact O-N 3.5Å
60	E	90.5	Very high	86.1	Confident	52 Å²	52	71.9 Å²	71.9	24%	0.243	38%	0.382	C	S	.	.	H	α-helix	trans	-62.8	-34.6	173.1	-173.9	173.9	177.2	0	0	111.6	R39 L42 Y43 K56 Q63 G64	R39-E60 VanDerWaalsContact CD-OE1 3.22Å; R39-E60 WeakPolarHBondContact CD-OE1 3.47Å; R39-E60 IonicContact CZ-OE1 3.14Å; R39-E60 IonicContact CZ-OE2 3.43Å; R39-E60 IonicContact NE-OE1 3.2Å; R39-E60 PolarHBondContact NE-OE1 3.27Å; R39-E60 IonicContact NE-OE2 3.39Å; R39-E60 PolarHBondContact NE-OE2 3.32Å; R39-E60 IonicContact NH1-OE1 3.03Å; R39-E60 PolarHBondContact NH1-OE1 3.08Å; R39-E60 IonicContact NH2-OE1 3.88Å; R39-E60 IonicContact NH2-OE2 3.53Å; L42-E60 HydrophobicContact CD2-CB 4.22Å; Y43-E60 HydrophobicContact CE1-CB 4.47Å; Y43-E60 WeakPolarHBondContact CE1-OE2 3.09Å; Y43-E60 PolarHBondContact OH-OE2 3.09Å; K56-E60 VanDerWaalsContact O-CB 3.31Å; K56-E60 WeakPolarHBondContact O-CB 3.46Å; K56-E60 PolarHBondContact O-N 3.19Å; E60-Q63 PolarHBondContact O-N 3.35Å; E60-G64 PolarHBondContact O-N 3.24Å
61	K	91.2	Very high	85.3	Confident	145 Å²	145	73.8 Å²	73.8	63%	0.63	39%	0.39	S	S	*	.	H	α-helix	trans	-65.8	-41.1	172.5	-72.7	173.8	179.4	-178.4	0	112.2	V57 A58 L59 G64 C65	V57-K61 WeakPolarHBondContact O-CG 3.34Å; V57-K61 PolarHBondContact O-N 3.3Å; V57-K61 VanDerWaalsContact O-N 3.1Å; A58-K61 WeakPolarHBondContact O-CB 3.49Å; A58-K61 PolarHBondContact O-N 2.67Å; L59-K61 VanDerWaalsContact C-N 3.27Å; L59-K61 PolarHBondContact O-N 3.19Å; K61-G64 WeakPolarHBondContact O-CA 3.45Å; K61-G64 PolarHBondContact O-N 3.27Å; K61-G64 VanDerWaalsContact O-N 3.15Å; K61-C65 PolarHBondContact O-N 3.15Å; K61-C65 PolarHBondContact O-SG 3.24Å; K61-C65 VanDerWaalsContact O-SG 3.41Å
62	I	89.7	Confident	84.8	Confident	83 Å²	83	80.4 Å²	80.4	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-64.1	-43.5	175.9	-59.4	179.8	0	0	0	110.3	V34 A58 L59 G64 C65 Y66	V34-I62 HydrophobicContact CG1-CB 4.25Å; V34-I62 HydrophobicContact CG1-CG2 3.73Å; A58-I62 PolarHBondContact O-N 3.44Å; L59-I62 HydrophobicContact CD2-CD1 4.25Å; L59-I62 PolarHBondContact O-N 2.99Å; L59-I62 VanDerWaalsContact O-N 3.17Å; I62-G64 PolarHBondContact O-N 2.82Å; I62-C65 WeakPolarHBondContact O-CB 3.23Å; I62-C65 PolarHBondContact O-N 3.35Å; I62-C65 VanDerWaalsContact O-N 3.09Å; I62-Y66 HydrophobicContact CG2-CD2 4.05Å; I62-Y66 HydrophobicContact CG2-CE2 3.78Å; I62-Y66 WeakPolarHBondContact O-CD2 3.17Å; I62-Y66 PolarHBondContact O-N 3.37Å; I62-Y66 VanDerWaalsContact O-N 3.11Å
63	Q	88.5	Confident	84.1	Confident	11 Å²	11	79.6 Å²	79.6	5%	0.051	41%	0.407	C	S	.	.	H	α-helix	trans	-57.6	-40.3	172.4	174.9	171.5	90.8	0	0	111.3	S33 V34 G37 S38 L42 L59 E60 Y66 S67	S33-Q63 PolarHBondContact O-NE2 3.44Å; V34-Q63 HydrophobicContact CG1-CB 4.25Å; V34-Q63 VanDerWaalsContact O-CG 3.26Å; V34-Q63 WeakPolarHBondContact O-CG 3.33Å; V34-Q63 PolarHBondContact O-NE2 3Å; G37-Q63 VanDerWaalsContact C-CD 3.49Å; S38-Q63 PolarHBondContact O-NE2 2.62Å; L42-Q63 HydrophobicContact CD2-CB 4.36Å; L59-Q63 PolarHBondContact O-N 3.5Å; E60-Q63 PolarHBondContact O-N 3.35Å; Q63-Y66 PolarHBondContact O-N 3.48Å; Q63-S67 PolarHBondContact O-N 3.41Å; Q63-S67 VanDerWaalsContact O-N 3.08Å
64	G	88.8	Confident	83.2	Confident	27 Å²	27	80 Å²	80	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-56.3	-46.9	171.6	0	0	0	0	0	112.9	E60 K61 I62 Y66 S67 E68	E60-G64 PolarHBondContact O-N 3.24Å; K61-G64 WeakPolarHBondContact O-CA 3.45Å; K61-G64 PolarHBondContact O-N 3.27Å; K61-G64 VanDerWaalsContact O-N 3.15Å; I62-G64 PolarHBondContact O-N 2.82Å; G64-Y66 VanDerWaalsContact C-N 3.31Å; G64-Y66 PolarHBondContact O-N 3.47Å; G64-S67 WeakPolarHBondContact O-CB 3.29Å; G64-S67 PolarHBondContact O-N 3.29Å; G64-S67 PolarHBondContact O-OG 3.41Å; G64-E68 PolarHBondContact O-N 3.16Å
65	C	86.6	Confident	82.5	Confident	77 Å²	77	77.7 Å²	77.7	52%	0.52	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-41.5	176.2	-63.5	0	0	0	0	112.3	K61 I62 S67 E68	K61-C65 PolarHBondContact O-N 3.15Å; K61-C65 PolarHBondContact O-SG 3.24Å; K61-C65 VanDerWaalsContact O-SG 3.41Å; I62-C65 WeakPolarHBondContact O-CB 3.23Å; I62-C65 PolarHBondContact O-N 3.35Å; I62-C65 VanDerWaalsContact O-N 3.09Å; C65-S67 VanDerWaalsContact C-N 3.26Å; C65-S67 PolarHBondContact O-N 2.96Å; C65-E68 PolarHBondContact O-N 3.11Å
66	Y	84	Confident	82.3	Confident	50 Å²	50	80 Å²	80	20%	0.196	40%	0.404	C	S	.	.	H	α-helix	trans	-67.2	-28.1	176.7	-76.1	-61.7	0	0	0	113.2	V34 L35 I62 Q63 G64 E68 R70 N73 E77	V34-Y66 HydrophobicContact CG1-CD2 3.73Å; V34-Y66 HydrophobicContact CG1-CE2 3.88Å; L35-Y66 HydrophobicContact CD2-CD1 3.71Å; L35-Y66 HydrophobicContact CD2-CD2 3.79Å; L35-Y66 HydrophobicContact CD2-CE1 3.68Å; L35-Y66 HydrophobicContact CD2-CE2 3.73Å; L35-Y66 HydrophobicContact CD2-CG 3.74Å; I62-Y66 HydrophobicContact CG2-CD2 4.05Å; I62-Y66 HydrophobicContact CG2-CE2 3.78Å; I62-Y66 WeakPolarHBondContact O-CD2 3.17Å; I62-Y66 PolarHBondContact O-N 3.37Å; I62-Y66 VanDerWaalsContact O-N 3.11Å; Q63-Y66 PolarHBondContact O-N 3.48Å; G64-Y66 VanDerWaalsContact C-N 3.31Å; G64-Y66 PolarHBondContact O-N 3.47Å; Y66-E68 VanDerWaalsContact C-N 3.32Å; Y66-E68 PolarHBondContact O-N 3.29Å; Y66-R70 WeakPolarHBondContact O-CA 3.39Å; Y66-R70 PolarHBondContact O-N 3.28Å; Y66-N73 WeakPolarHBondContact CA-ND2 3.47Å; Y66-N73 HydrophobicContact CD1-CB 3.86Å; Y66-N73 PolarHBondContact O-ND2 3.46Å; Y66-E77 HydrophobicContact CD1-CG 4.07Å; Y66-E77 HydrophobicContact CE1-CB 4.41Å; Y66-E77 VanDerWaalsContact CE1-CD 3.48Å; Y66-E77 HydrophobicContact CE1-CG 3.51Å; Y66-E77 PolarHBondContact OH-OE2 3.24Å
67	S	77.9	Confident	82	Confident	65 Å²	65	79.9 Å²	79.9	46%	0.455	40%	0.404	S	S	.	.	H	α-helix	trans	-71.6	-22.5	178.4	79.3	0	0	0	0	114.1	Q63 G64 C65 R70	Q63-S67 PolarHBondContact O-N 3.41Å; Q63-S67 VanDerWaalsContact O-N 3.08Å; G64-S67 WeakPolarHBondContact O-CB 3.29Å; G64-S67 PolarHBondContact O-N 3.29Å; G64-S67 PolarHBondContact O-OG 3.41Å; C65-S67 VanDerWaalsContact C-N 3.26Å; C65-S67 PolarHBondContact O-N 2.96Å; S67-R70 PolarHBondContact O-N 3Å
68	E	78.8	Confident	81.5	Confident	163 Å²	163	77.2 Å²	77.2	76%	0.762	39%	0.388	S	S	*	.	H	α-helix	trans	-66.3	-40.7	-178.7	-67.3	178.4	-179.4	0	0	112.4	G64 C65 Y66	G64-E68 PolarHBondContact O-N 3.16Å; C65-E68 PolarHBondContact O-N 3.11Å; Y66-E68 VanDerWaalsContact C-N 3.32Å; Y66-E68 PolarHBondContact O-N 3.29Å
69	E	78.8	Confident	81.1	Confident	100 Å²	100	79 Å²	79	47%	0.467	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	43.7	172.9	-62.6	-164.6	176	0	0	111.4	I71 R72 N73	E69-I71 VanDerWaalsContact C-N 3.3Å; E69-I71 PolarHBondContact O-N 2.99Å; E69-R72 HydrophobicContact CB-CB 4.37Å; E69-R72 PolarHBondContact O-N 3.17Å; E69-R72 WeakPolarHBondContact OE2-CD 3.42Å; E69-R72 IonicContact OE2-CZ 3.82Å; E69-R72 IonicContact OE2-NE 3.96Å; E69-R72 IonicContact OE2-NH1 2.91Å; E69-R72 PolarHBondContact OE2-NH1 2.92Å; E69-N73 PolarHBondContact O-N 3.24Å
70	R	70.2	Confident	80.9	Confident	153 Å²	153	81.7 Å²	81.7	58%	0.577	40%	0.4	S	S	*	.	H	α-helix	trans	-41.4	-50	-167.8	-171.8	174.9	-174	-140.8	0.8	114.8	Y66 S67 I74	Y66-R70 WeakPolarHBondContact O-CA 3.39Å; Y66-R70 PolarHBondContact O-N 3.28Å; S67-R70 PolarHBondContact O-N 3Å; R70-I74 HydrophobicContact CG-CD1 3.42Å; R70-I74 VanDerWaalsContact CG-CD1 3.42Å; R70-I74 HydrophobicContact CG-CG1 4.18Å; R70-I74 VanDerWaalsContact O-CB 3.26Å; R70-I74 WeakPolarHBondContact O-CB 3.48Å; R70-I74 WeakPolarHBondContact O-CG1 3.21Å; R70-I74 PolarHBondContact O-N 2.8Å
71	I	66.7	Low	80.6	Confident	153 Å²	153	80 Å²	80	79%	0.785	39%	0.392	S	S	*	.	H	α-helix	trans	-66.4	-43.8	-175.5	-63.6	175.3	0	0	0	111.3	E69	E69-I71 VanDerWaalsContact C-N 3.3Å; E69-I71 PolarHBondContact O-N 2.99Å
72	R	72.8	Confident	80.1	Confident	149 Å²	149	75.6 Å²	75.6	56%	0.562	37%	0.374	S	S	*	.	H	α-helix	trans	-68.4	-44	-179.4	-176	-175.4	-179.2	-166.4	-0.7	110.4	E69 L75 L76	E69-R72 HydrophobicContact CB-CB 4.37Å; E69-R72 PolarHBondContact O-N 3.17Å; E69-R72 WeakPolarHBondContact OE2-CD 3.42Å; E69-R72 IonicContact OE2-CZ 3.82Å; E69-R72 IonicContact OE2-NE 3.96Å; E69-R72 IonicContact OE2-NH1 2.91Å; E69-R72 PolarHBondContact OE2-NH1 2.92Å; R72-L75 PolarHBondContact O-N 2.85Å; R72-L76 HydrophobicContact CG-CD1 3.47Å; R72-L76 VanDerWaalsContact CG-CD1 3.47Å; R72-L76 HydrophobicContact CG-CG 4.17Å; R72-L76 VanDerWaalsContact O-CB 3.3Å; R72-L76 WeakPolarHBondContact O-CB 3.17Å; R72-L76 WeakPolarHBondContact O-CG 3.22Å; R72-L76 PolarHBondContact O-N 3.43Å
73	N	72.5	Confident	79.9	Confident	20 Å²	20	74.7 Å²	74.7	11%	0.107	38%	0.379	C	S	.	.	H	α-helix	trans	-69.9	-44	-175.9	-68.3	-13.1	0	0	0	112	Y66 E69 L75 E77	Y66-N73 WeakPolarHBondContact CA-ND2 3.47Å; Y66-N73 HydrophobicContact CD1-CB 3.86Å; Y66-N73 PolarHBondContact O-ND2 3.46Å; E69-N73 PolarHBondContact O-N 3.24Å; N73-L75 PolarHBondContact O-N 3.39Å; N73-L75 VanDerWaalsContact O-N 3.17Å; N73-E77 HydrophobicContact CB-CG 4.16Å; N73-E77 WeakPolarHBondContact O-CB 3.27Å; N73-E77 WeakPolarHBondContact O-CG 3.29Å; N73-E77 PolarHBondContact O-N 2.91Å
74	I	70.9	Confident	79.6	Confident	75 Å²	75	78.8 Å²	78.8	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-59.3	-31.5	178.6	-72.9	175	0	0	0	112	R70 P78	R70-I74 HydrophobicContact CG-CD1 3.42Å; R70-I74 VanDerWaalsContact CG-CD1 3.42Å; R70-I74 HydrophobicContact CG-CG1 4.18Å; R70-I74 VanDerWaalsContact O-CB 3.26Å; R70-I74 WeakPolarHBondContact O-CB 3.48Å; R70-I74 WeakPolarHBondContact O-CG1 3.21Å; R70-I74 PolarHBondContact O-N 2.8Å; I74-P78 WeakPolarHBondContact O-CD 3.11Å; I74-P78 WeakPolarHBondContact O-CG 3.12Å
75	L	74.6	Confident	79.1	Confident	93 Å²	93	77.7 Å²	77.7	49%	0.487	39%	0.388	S	S	.	.	H	α-helix	trans	-92.5	-43.1	-179.2	-171.1	66.9	0	0	0	113.4	R72 N73 K79	R72-L75 PolarHBondContact O-N 2.85Å; N73-L75 PolarHBondContact O-N 3.39Å; N73-L75 VanDerWaalsContact O-N 3.17Å; L75-K79 WeakPolarHBondContact O-CG 3.15Å
76	L	83.7	Confident	78.7	Confident	75 Å²	75	75.4 Å²	75.4	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-76.8	-39.1	-175.3	-66.9	-176.9	0	0	0	111.9	R72 K79 I80	R72-L76 HydrophobicContact CG-CD1 3.47Å; R72-L76 VanDerWaalsContact CG-CD1 3.47Å; R72-L76 HydrophobicContact CG-CG 4.17Å; R72-L76 VanDerWaalsContact O-CB 3.3Å; R72-L76 WeakPolarHBondContact O-CB 3.17Å; R72-L76 WeakPolarHBondContact O-CG 3.22Å; R72-L76 PolarHBondContact O-N 3.43Å; L76-K79 PolarHBondContact O-N 3.07Å; L76-I80 HydrophobicContact CB-CD1 4.38Å; L76-I80 VanDerWaalsContact O-CG1 3.23Å; L76-I80 WeakPolarHBondContact O-CG1 3.26Å; L76-I80 PolarHBondContact O-N 2.92Å
77	E	84.2	Confident	78.5	Confident	43 Å²	43	74.2 Å²	74.2	20%	0.201	37%	0.373	C	S	.	.	H	α-helix	trans	-67.6	-42.9	-172.4	-63.2	-70.2	159.8	0	0	113	Y31 L35 Y66 N73 K79 I80 M81	Y31-E77 PolarHBondContact OH-O 3.11Å; L35-E77 HydrophobicContact CD1-CB 3.95Å; L35-E77 HydrophobicContact CD2-CB 3.81Å; L35-E77 HydrophobicContact CD2-CG 4.19Å; Y66-E77 HydrophobicContact CD1-CG 4.07Å; Y66-E77 HydrophobicContact CE1-CB 4.41Å; Y66-E77 VanDerWaalsContact CE1-CD 3.48Å; Y66-E77 HydrophobicContact CE1-CG 3.51Å; Y66-E77 PolarHBondContact OH-OE2 3.24Å; N73-E77 HydrophobicContact CB-CG 4.16Å; N73-E77 WeakPolarHBondContact O-CB 3.27Å; N73-E77 WeakPolarHBondContact O-CG 3.29Å; N73-E77 PolarHBondContact O-N 2.91Å; E77-K79 VanDerWaalsContact C-N 3.32Å; E77-K79 PolarHBondContact O-N 3.32Å; E77-I80 PolarHBondContact O-N 3Å; E77-M81 WeakPolarHBondContact O-CB 3.41Å; E77-M81 PolarHBondContact O-N 3.02Å
78	P	80.7	Confident	78.5	Confident	12 Å²	12	75 Å²	75	8%	0.078	38%	0.377	C	S	.	.	H	α-helix	trans	-68.4	-31.9	174.3	-15.4	29.2	0	0	0	112.2	L35 I74 M81 E82 I106 L110	L35-P78 HydrophobicContact CD1-CG 3.91Å; I74-P78 WeakPolarHBondContact O-CD 3.11Å; I74-P78 WeakPolarHBondContact O-CG 3.12Å; P78-M81 WeakPolarHBondContact O-CB 3.34Å; P78-M81 PolarHBondContact O-N 2.92Å; P78-E82 WeakPolarHBondContact O-CB 3.23Å; P78-E82 PolarHBondContact O-N 3.11Å; P78-I106 HydrophobicContact CB-CG2 4.49Å; P78-L110 HydrophobicContact CB-CD1 4.49Å; P78-L110 HydrophobicContact CB-CD2 3.64Å; P78-L110 HydrophobicContact CB-CG 3.95Å; P78-L110 HydrophobicContact CG-CD2 4.12Å
79	K	82.9	Confident	78.3	Confident	88 Å²	88	73 Å²	73	38%	0.383	37%	0.367	S	S	.	.	H	α-helix	trans	-67.8	-40.6	174.5	-73.7	-171.9	175.2	-164.6	0	112.9	L75 L76 E77 M81 E82 A83 L110	L75-K79 WeakPolarHBondContact O-CG 3.15Å; L76-K79 PolarHBondContact O-N 3.07Å; E77-K79 VanDerWaalsContact C-N 3.32Å; E77-K79 PolarHBondContact O-N 3.32Å; K79-M81 VanDerWaalsContact C-N 3.3Å; K79-E82 PolarHBondContact O-N 3.48Å; K79-A83 WeakPolarHBondContact O-CB 3.33Å; K79-A83 PolarHBondContact O-N 3.24Å; K79-L110 HydrophobicContact CG-CD1 4.18Å; K79-L110 HydrophobicContact CG-CD2 4.09Å
80	I	85.7	Confident	78.1	Confident	82 Å²	82	69.6 Å²	69.6	42%	0.421	35%	0.354	S	S	.	.	H	α-helix	trans	-62.9	-44.2	173.6	-68.4	163.7	0	0	0	108.9	L76 E77 A83 M84	L76-I80 HydrophobicContact CB-CD1 4.38Å; L76-I80 VanDerWaalsContact O-CG1 3.23Å; L76-I80 WeakPolarHBondContact O-CG1 3.26Å; L76-I80 PolarHBondContact O-N 2.92Å; E77-I80 PolarHBondContact O-N 3Å; I80-A83 PolarHBondContact O-N 3.17Å; I80-M84 HydrophobicContact CG2-CE 4.03Å; I80-M84 HydrophobicContact CG2-CG 4.49Å; I80-M84 HydrophobicContact CG2-SD 4.31Å; I80-M84 VanDerWaalsContact O-CG 3.29Å; I80-M84 WeakPolarHBondContact O-CG 3.21Å; I80-M84 PolarHBondContact O-N 2.95Å
81	M	83.1	Confident	78.1	Confident	16 Å²	16	67.7 Å²	67.7	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-59.7	-49.1	175.4	-171	59.8	74.9	0	0	112.1	F27 F28 Y31 E77 P78 K79 A83 M84 V85 I106	F27-M81 HydrophobicContact CE1-CE 4.21Å; F28-M81 HydrophobicContact CD1-CG 4.04Å; F28-M81 HydrophobicContact CD1-SD 4.3Å; F28-M81 HydrophobicContact CE1-CG 3.69Å; F28-M81 HydrophobicContact CE1-SD 3.6Å; F28-M81 VanDerWaalsContact CE1-SD 3.6Å; Y31-M81 HydrophobicContact CD1-CE 3.79Å; Y31-M81 HydrophobicContact CD1-CG 4.39Å; Y31-M81 HydrophobicContact CD2-CE 3.94Å; Y31-M81 HydrophobicContact CE1-CB 3.96Å; Y31-M81 HydrophobicContact CE1-CE 3.51Å; Y31-M81 HydrophobicContact CE1-CG 4Å; Y31-M81 HydrophobicContact CE2-CE 3.7Å; Y31-M81 HydrophobicContact CG-CE 3.97Å; Y31-M81 VanDerWaalsContact CZ-CE 3.45Å; E77-M81 WeakPolarHBondContact O-CB 3.41Å; E77-M81 PolarHBondContact O-N 3.02Å; P78-M81 WeakPolarHBondContact O-CB 3.34Å; P78-M81 PolarHBondContact O-N 2.92Å; K79-M81 VanDerWaalsContact C-N 3.3Å; M81-A83 VanDerWaalsContact C-N 3.32Å; M81-A83 PolarHBondContact O-N 2.96Å; M81-M84 HydrophobicContact CB-CE 4.43Å; M81-M84 HydrophobicContact CE-CE 3.97Å; M81-M84 PolarHBondContact O-N 3.17Å; M81-M84 VanDerWaalsContact O-N 3.16Å; M81-M84 HydrophobicContact SD-CE 3.66Å; M81-V85 HydrophobicContact CG-CG2 4.45Å; M81-V85 WeakPolarHBondContact O-CG2 3.29Å; M81-V85 PolarHBondContact O-N 3.32Å; M81-V85 HydrophobicContact SD-CG2 4.37Å; M81-I106 HydrophobicContact CG-CD1 4.04Å
82	E	81.3	Confident	78.3	Confident	52 Å²	52	64.8 Å²	64.8	24%	0.243	34%	0.34	C	S	.	.	H	α-helix	trans	-55.4	-47.9	175.9	-164.4	-166.5	164.2	0	0	111.3	P78 K79 M84 V85 A86 L103 I106	P78-E82 WeakPolarHBondContact O-CB 3.23Å; P78-E82 PolarHBondContact O-N 3.11Å; K79-E82 PolarHBondContact O-N 3.48Å; E82-M84 VanDerWaalsContact C-N 3.32Å; E82-M84 PolarHBondContact O-N 3.04Å; E82-V85 PolarHBondContact O-N 2.63Å; E82-A86 WeakPolarHBondContact O-CB 3.33Å; E82-A86 PolarHBondContact O-N 2.78Å; E82-L103 HydrophobicContact CG-CD2 3.83Å; E82-I106 HydrophobicContact CB-CG2 3.83Å; E82-I106 HydrophobicContact CG-CG2 4.17Å
83	A	84.9	Confident	78	Confident	65 Å²	65	66.7 Å²	66.7	54%	0.537	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-37.6	179	0	0	0	0	0	112.5	K79 I80 M81 A86 S87	K79-A83 WeakPolarHBondContact O-CB 3.33Å; K79-A83 PolarHBondContact O-N 3.24Å; I80-A83 PolarHBondContact O-N 3.17Å; M81-A83 VanDerWaalsContact C-N 3.32Å; M81-A83 PolarHBondContact O-N 2.96Å; A83-A86 CarbonylContact O-C 3.59Å; A83-S87 PolarHBondContact O-N 3.3Å; A83-S87 VanDerWaalsContact O-N 3.1Å
84	M	82.1	Confident	77.6	Confident	97 Å²	97	68.5 Å²	68.5	48%	0.478	36%	0.356	S	S	.	.	H	α-helix	trans	-66.8	-46.8	175.1	-72.3	-173.4	-58.7	0	0	111.4	I80 M81 E82 S87 C90	I80-M84 HydrophobicContact CG2-CE 4.03Å; I80-M84 HydrophobicContact CG2-CG 4.49Å; I80-M84 HydrophobicContact CG2-SD 4.31Å; I80-M84 VanDerWaalsContact O-CG 3.29Å; I80-M84 WeakPolarHBondContact O-CG 3.21Å; I80-M84 PolarHBondContact O-N 2.95Å; M81-M84 HydrophobicContact CB-CE 4.43Å; M81-M84 HydrophobicContact CE-CE 3.97Å; M81-M84 PolarHBondContact O-N 3.17Å; M81-M84 VanDerWaalsContact O-N 3.16Å; M81-M84 HydrophobicContact SD-CE 3.66Å; E82-M84 VanDerWaalsContact C-N 3.32Å; E82-M84 PolarHBondContact O-N 3.04Å; M84-S87 WeakPolarHBondContact O-CB 3.48Å; M84-S87 PolarHBondContact O-N 3.13Å; M84-S87 PolarHBondContact O-OG 3.22Å; M84-C90 WeakPolarHBondContact O-CB 3.4Å
85	V	78.1	Confident	77.3	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.024	36%	0.359	C	S	.	.	H	α-helix	trans	-64.5	-44.3	177.9	179.7	0	0	0	0	110	F28 M81 E82 S87 C90 F99 I102 L103 I106	F28-V85 HydrophobicContact CE1-CG2 3.57Å; F28-V85 HydrophobicContact CZ-CG2 3.41Å; F28-V85 VanDerWaalsContact CZ-CG2 3.41Å; M81-V85 HydrophobicContact CG-CG2 4.45Å; M81-V85 WeakPolarHBondContact O-CG2 3.29Å; M81-V85 PolarHBondContact O-N 3.32Å; M81-V85 HydrophobicContact SD-CG2 4.37Å; E82-V85 PolarHBondContact O-N 2.63Å; V85-S87 PolarHBondContact O-N 3.19Å; V85-C90 VanDerWaalsContact O-CB 3.29Å; V85-C90 WeakPolarHBondContact O-CB 3.06Å; V85-F99 HydrophobicContact CG1-CD2 3.87Å; V85-F99 HydrophobicContact CG1-CE2 3.84Å; V85-F99 WeakPolarHBondContact O-CE2 3.19Å; V85-I102 HydrophobicContact CB-CG2 4.4Å; V85-I102 HydrophobicContact CG1-CB 4.33Å; V85-I102 HydrophobicContact CG1-CG2 3.63Å; V85-I102 HydrophobicContact CG2-CG2 4.05Å; V85-L103 HydrophobicContact CG1-CD2 4.37Å; V85-I106 HydrophobicContact CG2-CD1 4.12Å
86	A	79.9	Confident	76.8	Confident	28 Å²	28	69.2 Å²	69.2	23%	0.231	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	5.5	177.8	0	0	0	0	0	114.3	E82 A83 R91 F99 L103	E82-A86 WeakPolarHBondContact O-CB 3.33Å; E82-A86 PolarHBondContact O-N 2.78Å; A83-A86 CarbonylContact O-C 3.59Å; A86-R91 PolarHBondContact O-NH1 2.9Å; A86-R91 PolarHBondContact O-NH2 3.3Å; A86-R91 VanDerWaalsContact O-NH2 3.13Å; A86-F99 HydrophobicContact CB-CE2 4.46Å; A86-F99 HydrophobicContact CB-CZ 4.21Å; A86-L103 HydrophobicContact CB-CD2 4.4Å
87	S	79.2	Confident	76	Confident	26 Å²	26	70.9 Å²	70.9	18%	0.182	38%	0.375	C	S	.	.	S	Bend	trans	-67.6	147.7	172.6	70.5	0	0	0	0	111	A83 M84 V85 E89 C90 R91	A83-S87 PolarHBondContact O-N 3.3Å; A83-S87 VanDerWaalsContact O-N 3.1Å; M84-S87 WeakPolarHBondContact O-CB 3.48Å; M84-S87 PolarHBondContact O-N 3.13Å; M84-S87 PolarHBondContact O-OG 3.22Å; V85-S87 PolarHBondContact O-N 3.19Å; S87-E89 VanDerWaalsContact CB-OE2 3.27Å; S87-E89 WeakPolarHBondContact CB-OE2 3.41Å; S87-E89 PolarHBondContact O-N 3.41Å; S87-C90 PolarHBondContact O-N 3.44Å; S87-C90 WeakPolarHBondContact OG-CB 3.15Å; S87-C90 PolarHBondContact OG-N 3.34Å; S87-C90 VanDerWaalsContact OG-N 3.13Å; S87-R91 PolarHBondContact O-N 3.18Å
88	P	77.5	Confident	75.2	Confident	82 Å²	82	70 Å²	70	53%	0.532	37%	0.372	S	S	.	.	H	α-helix	trans	-53.3	-35.4	172.1	-23.8	32.2	0	0	0	113.1	S92	P88-S92 PolarHBondContact O-N 3.16Å
89	E	75.3	Confident	74.7	Confident	121 Å²	121	70.5 Å²	70.5	57%	0.565	37%	0.373	S	S	*	.	H	α-helix	trans	-63.2	-53.6	179.7	-62.3	72	-157.9	0	0	110	S87 R91 S92 Y93	S87-E89 VanDerWaalsContact CB-OE2 3.27Å; S87-E89 WeakPolarHBondContact CB-OE2 3.41Å; S87-E89 PolarHBondContact O-N 3.41Å; E89-R91 PolarHBondContact O-N 3.38Å; E89-S92 WeakPolarHBondContact O-CB 3.31Å; E89-S92 PolarHBondContact O-N 2.79Å; E89-S92 VanDerWaalsContact O-N 3.11Å; E89-S92 PolarHBondContact O-OG 3.39Å; E89-Y93 WeakPolarHBondContact O-CD2 3.41Å
90	C	73.1	Confident	74.4	Confident	27 Å²	27	73.5 Å²	73.5	18%	0.182	38%	0.382	C	S	.	.	H	α-helix	trans	-67.9	-37.3	-178.9	-171.8	0	0	0	0	112.3	M84 V85 S87 S92 Y93 H94	M84-C90 WeakPolarHBondContact O-CB 3.4Å; V85-C90 VanDerWaalsContact O-CB 3.29Å; V85-C90 WeakPolarHBondContact O-CB 3.06Å; S87-C90 PolarHBondContact O-N 3.44Å; S87-C90 WeakPolarHBondContact OG-CB 3.15Å; S87-C90 PolarHBondContact OG-N 3.34Å; S87-C90 VanDerWaalsContact OG-N 3.13Å; C90-S92 PolarHBondContact O-N 2.94Å; C90-Y93 PolarHBondContact O-N 3.04Å; C90-H94 PolarHBondContact O-N 3.44Å; C90-H94 PolarHBondContact SG-CD2 3.47Å
91	R	71	Confident	73.8	Confident	113 Å²	113	72.4 Å²	72.4	43%	0.426	38%	0.381	S	S	.	.	H	α-helix	trans	-58.9	-26.7	171.9	-78.5	-166.6	-67	-101.7	-11.7	113.6	A86 S87 E89 Y93 F99	A86-R91 PolarHBondContact O-NH1 2.9Å; A86-R91 PolarHBondContact O-NH2 3.3Å; A86-R91 VanDerWaalsContact O-NH2 3.13Å; S87-R91 PolarHBondContact O-N 3.18Å; E89-R91 PolarHBondContact O-N 3.38Å; R91-Y93 VanDerWaalsContact C-N 3.3Å; R91-F99 HydrophobicContact CG-CD1 4.49Å; R91-F99 HydrophobicContact CG-CD2 3.92Å; R91-F99 HydrophobicContact CG-CE1 4.17Å; R91-F99 HydrophobicContact CG-CE2 3.59Å; R91-F99 HydrophobicContact CG-CG 4.36Å; R91-F99 HydrophobicContact CG-CZ 3.7Å
92	S	71.8	Confident	73.3	Confident	92 Å²	92	71.7 Å²	71.7	64%	0.643	38%	0.378	S	S	*	.	H	α-helix	trans	-74.5	-21.3	176.8	78.5	0	0	0	0	113.3	P88 E89 C90	P88-S92 PolarHBondContact O-N 3.16Å; E89-S92 WeakPolarHBondContact O-CB 3.31Å; E89-S92 PolarHBondContact O-N 2.79Å; E89-S92 VanDerWaalsContact O-N 3.11Å; E89-S92 PolarHBondContact O-OG 3.39Å; C90-S92 PolarHBondContact O-N 2.94Å
93	Y	65.2	Low	72.9	Confident	189 Å²	189	71 Å²	71	74%	0.741	38%	0.375	S	S	*	.	H	α-helix	trans	-94.9	-30.3	-178.4	-73.9	-77.6	0	0	0	114	E89 C90 R91	E89-Y93 WeakPolarHBondContact O-CD2 3.41Å; C90-Y93 PolarHBondContact O-N 3.04Å; R91-Y93 VanDerWaalsContact C-N 3.3Å
94	H	64.2	Low	72.7	Confident	58 Å²	58	73.9 Å²	73.9	27%	0.269	38%	0.378	S	S	.	.	S	Bend	trans	-99.3	143	-179.6	-65.2	-71.5	0	0	0	112.5	C24 C90 N98	C24-H94 PolarHBondContact SG-CE1 3.03Å; C90-H94 PolarHBondContact O-N 3.44Å; C90-H94 PolarHBondContact SG-CD2 3.47Å; H94-N98 HydrophobicContact CB-CB 4.46Å
95	S	64.3	Low	72.3	Confident	63 Å²	63	71.8 Å²	71.8	44%	0.441	37%	0.366	S	S	.	.			trans	-60.3	146.8	166.8	77.3	0	0	0	0	109.6	N97 N98 F99	S95-N97 PolarHBondContact O-N 3.3Å; S95-N98 PolarHBondContact O-N 2.99Å; S95-N98 VanDerWaalsContact OG-CG 3.32Å; S95-N98 PolarHBondContact OG-N 3Å; S95-N98 PolarHBondContact OG-OD1 3.41Å; S95-F99 PolarHBondContact O-N 3.27Å
96	L	65.6	Low	72.1	Confident	121 Å²	121	71.8 Å²	71.8	63%	0.634	37%	0.366	S	S	*	.	H	α-helix	trans	-52.1	-31.3	179.3	-83.2	161.3	0	0	0	113.2	R100	L96-R100 WeakPolarHBondContact O-CG 3.39Å; L96-R100 PolarHBondContact O-N 2.84Å
97	N	66.2	Low	71.9	Confident	110 Å²	110	71.9 Å²	71.9	59%	0.588	37%	0.365	S	S	*	.	H	α-helix	trans	-71.6	-46.7	179.3	-67.8	-19.4	0	0	0	111.6	S95 F99 R100 S101	S95-N97 PolarHBondContact O-N 3.3Å; N97-F99 VanDerWaalsContact C-N 3.31Å; N97-F99 PolarHBondContact O-N 3.15Å; N97-R100 PolarHBondContact O-N 2.91Å; N97-S101 PolarHBondContact O-N 2.97Å; N97-S101 VanDerWaalsContact O-N 3.15Å; N97-S101 PolarHBondContact O-OG 3.42Å
98	N	67.6	Low	71.8	Confident	25 Å²	25	76.1 Å²	76.1	13%	0.134	39%	0.386	C	S	.	.	H	α-helix	trans	-62.7	-43.2	177.7	-63.9	0.3	0	0	0	110.4	S21 H94 S95 R100 S101 I102	S21-N98 VanDerWaalsContact CA-ND2 3.34Å; S21-N98 WeakPolarHBondContact CA-ND2 2.99Å; S21-N98 VanDerWaalsContact CB-CG 3.48Å; S21-N98 WeakPolarHBondContact CB-ND2 3.35Å; S21-N98 WeakPolarHBondContact CB-OD1 2.87Å; H94-N98 HydrophobicContact CB-CB 4.46Å; S95-N98 PolarHBondContact O-N 2.99Å; S95-N98 VanDerWaalsContact OG-CG 3.32Å; S95-N98 PolarHBondContact OG-N 3Å; S95-N98 PolarHBondContact OG-OD1 3.41Å; N98-R100 VanDerWaalsContact C-N 3.34Å; N98-R100 PolarHBondContact O-N 3.14Å; N98-S101 PolarHBondContact O-N 3.38Å; N98-I102 WeakPolarHBondContact O-CD1 3.36Å; N98-I102 WeakPolarHBondContact O-CG1 3.47Å; N98-I102 PolarHBondContact O-N 3.49Å
99	F	70.6	Confident	71.5	Confident	21 Å²	21	75.8 Å²	75.8	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-56.2	-45.5	177.4	177.8	-104.6	0	0	0	112.6	V85 A86 R91 S95 N97 I102 L103	V85-F99 HydrophobicContact CG1-CD2 3.87Å; V85-F99 HydrophobicContact CG1-CE2 3.84Å; V85-F99 WeakPolarHBondContact O-CE2 3.19Å; A86-F99 HydrophobicContact CB-CE2 4.46Å; A86-F99 HydrophobicContact CB-CZ 4.21Å; R91-F99 HydrophobicContact CG-CD1 4.49Å; R91-F99 HydrophobicContact CG-CD2 3.92Å; R91-F99 HydrophobicContact CG-CE1 4.17Å; R91-F99 HydrophobicContact CG-CE2 3.59Å; R91-F99 HydrophobicContact CG-CG 4.36Å; R91-F99 HydrophobicContact CG-CZ 3.7Å; S95-F99 PolarHBondContact O-N 3.27Å; N97-F99 VanDerWaalsContact C-N 3.31Å; N97-F99 PolarHBondContact O-N 3.15Å; F99-I102 PolarHBondContact O-N 3.05Å; F99-L103 HydrophobicContact CD1-CD1 4.1Å; F99-L103 HydrophobicContact CE1-CD1 3.35Å; F99-L103 HydrophobicContact CE1-CG 4.17Å; F99-L103 HydrophobicContact CE2-CD1 4Å; F99-L103 HydrophobicContact CE2-CD2 4.41Å; F99-L103 HydrophobicContact CE2-CG 4.1Å; F99-L103 HydrophobicContact CZ-CD1 3.3Å; F99-L103 HydrophobicContact CZ-CD2 4.38Å; F99-L103 HydrophobicContact CZ-CG 3.91Å; F99-L103 WeakPolarHBondContact O-CG 3.34Å; F99-L103 PolarHBondContact O-N 3.4Å
100	R	75.1	Confident	71.1	Confident	151 Å²	151	71.6 Å²	71.6	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-64.8	-44.7	177.9	-75.3	176.9	-172.8	148.6	0.6	112.4	L96 N97 N98 I102 L103 E104	L96-R100 WeakPolarHBondContact O-CG 3.39Å; L96-R100 PolarHBondContact O-N 2.84Å; N97-R100 PolarHBondContact O-N 2.91Å; N98-R100 VanDerWaalsContact C-N 3.34Å; N98-R100 PolarHBondContact O-N 3.14Å; R100-I102 VanDerWaalsContact C-N 3.29Å; R100-I102 PolarHBondContact O-N 3.32Å; R100-L103 PolarHBondContact O-N 3.32Å; R100-E104 VanDerWaalsContact O-CB 3.3Å; R100-E104 WeakPolarHBondContact O-CB 3.3Å; R100-E104 PolarHBondContact O-N 3.26Å
101	S	74.3	Confident	70.9	Confident	59 Å²	59	73.6 Å²	73.6	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-37.6	178.4	-61	0	0	0	0	112.3	N97 N98 F105	N97-S101 PolarHBondContact O-N 2.97Å; N97-S101 VanDerWaalsContact O-N 3.15Å; N97-S101 PolarHBondContact O-OG 3.42Å; N98-S101 PolarHBondContact O-N 3.38Å; S101-F105 WeakPolarHBondContact O-CB 3.3Å; S101-F105 PolarHBondContact O-N 2.91Å
102	I	71.7	Confident	70.2	Confident	2 Å²	2	76 Å²	76	1%	0.01	40%	0.402	C	S	.	.	H	α-helix	trans	-66.4	-48.1	175.8	-65.1	155.5	0	0	0	110.7	C24 F28 V85 N98 F99 R100 E104 F105 I106	C24-I102 HydrophobicContact CB-CD1 4.4Å; C24-I102 WeakPolarHBondContact SG-CD1 3.34Å; F28-I102 HydrophobicContact CD1-CG2 4.19Å; F28-I102 HydrophobicContact CD2-CB 4.25Å; F28-I102 HydrophobicContact CD2-CD1 4.34Å; F28-I102 HydrophobicContact CD2-CG1 3.78Å; F28-I102 HydrophobicContact CD2-CG2 3.56Å; F28-I102 HydrophobicContact CE1-CG2 3.91Å; F28-I102 HydrophobicContact CE2-CB 4.1Å; F28-I102 HydrophobicContact CE2-CD1 3.72Å; F28-I102 HydrophobicContact CE2-CG1 3.63Å; F28-I102 HydrophobicContact CE2-CG2 3.28Å; F28-I102 HydrophobicContact CG-CG2 4.04Å; F28-I102 HydrophobicContact CZ-CG2 3.49Å; F28-I102 VanDerWaalsContact CZ-CG2 3.49Å; V85-I102 HydrophobicContact CB-CG2 4.4Å; V85-I102 HydrophobicContact CG1-CB 4.33Å; V85-I102 HydrophobicContact CG1-CG2 3.63Å; V85-I102 HydrophobicContact CG2-CG2 4.05Å; N98-I102 WeakPolarHBondContact O-CD1 3.36Å; N98-I102 WeakPolarHBondContact O-CG1 3.47Å; N98-I102 PolarHBondContact O-N 3.49Å; F99-I102 PolarHBondContact O-N 3.05Å; R100-I102 VanDerWaalsContact C-N 3.29Å; R100-I102 PolarHBondContact O-N 3.32Å; I102-E104 VanDerWaalsContact C-N 3.34Å; I102-E104 PolarHBondContact O-N 3.43Å; I102-F105 WeakPolarHBondContact O-CB 3.15Å; I102-F105 PolarHBondContact O-N 3.44Å; I102-I106 HydrophobicContact CG2-CD1 3.74Å; I102-I106 HydrophobicContact CG2-CG1 4.44Å; I102-I106 VanDerWaalsContact O-CG1 3.31Å; I102-I106 WeakPolarHBondContact O-CG1 3.39Å; I102-I106 PolarHBondContact O-N 2.65Å
103	L	74.1	Confident	70.1	Confident	36 Å²	36	75.2 Å²	75.2	19%	0.188	39%	0.39	C	S	.	.	H	α-helix	trans	-61.9	-44.2	177.7	-74.4	-173.5	0	0	0	111.5	E82 V85 A86 F99 R100 F105 I106 S107	E82-L103 HydrophobicContact CG-CD2 3.83Å; V85-L103 HydrophobicContact CG1-CD2 4.37Å; A86-L103 HydrophobicContact CB-CD2 4.4Å; F99-L103 HydrophobicContact CD1-CD1 4.1Å; F99-L103 HydrophobicContact CE1-CD1 3.35Å; F99-L103 HydrophobicContact CE1-CG 4.17Å; F99-L103 HydrophobicContact CE2-CD1 4Å; F99-L103 HydrophobicContact CE2-CD2 4.41Å; F99-L103 HydrophobicContact CE2-CG 4.1Å; F99-L103 HydrophobicContact CZ-CD1 3.3Å; F99-L103 HydrophobicContact CZ-CD2 4.38Å; F99-L103 HydrophobicContact CZ-CG 3.91Å; F99-L103 WeakPolarHBondContact O-CG 3.34Å; F99-L103 PolarHBondContact O-N 3.4Å; R100-L103 PolarHBondContact O-N 3.32Å; L103-F105 VanDerWaalsContact C-N 3.29Å; L103-F105 PolarHBondContact O-N 3.13Å; L103-I106 PolarHBondContact O-N 2.92Å; L103-I106 VanDerWaalsContact O-N 3.14Å; L103-S107 WeakPolarHBondContact O-CB 3.48Å; L103-S107 PolarHBondContact O-N 3.5Å; L103-S107 PolarHBondContact O-OG 3.07Å; L103-S107 VanDerWaalsContact O-OG 3.07Å
104	E	79.3	Confident	70.4	Confident	126 Å²	126	69.2 Å²	69.2	59%	0.589	37%	0.371	S	S	*	.	H	α-helix	trans	-58.8	-42.3	176.3	-175.1	176.9	-173.5	0	0	111.4	R100 I102 N108	R100-E104 VanDerWaalsContact O-CB 3.3Å; R100-E104 WeakPolarHBondContact O-CB 3.3Å; R100-E104 PolarHBondContact O-N 3.26Å; I102-E104 VanDerWaalsContact C-N 3.34Å; I102-E104 PolarHBondContact O-N 3.43Å; E104-N108 WeakPolarHBondContact O-CB 3.35Å; E104-N108 PolarHBondContact O-N 2.85Å; E104-N108 PolarHBondContact O-ND2 3.25Å
105	F	75	Confident	70.7	Confident	53 Å²	53	69.8 Å²	69.8	23%	0.232	38%	0.377	C	S	.	.	H	α-helix	trans	-61.6	-45.7	173.7	177.6	-99.4	0	0	0	112.3	F28 E29 A32 S101 I102 L103 N108 L109	F28-F105 HydrophobicContact CB-CD1 3.85Å; F28-F105 HydrophobicContact CB-CE1 3.76Å; F28-F105 WeakPolarHBondContact O-CE1 3.38Å; E29-F105 HydrophobicContact CG-CE2 4.04Å; E29-F105 HydrophobicContact CG-CZ 3.95Å; A32-F105 HydrophobicContact CB-CE1 3.96Å; A32-F105 HydrophobicContact CB-CZ 3.81Å; S101-F105 WeakPolarHBondContact O-CB 3.3Å; S101-F105 PolarHBondContact O-N 2.91Å; I102-F105 WeakPolarHBondContact O-CB 3.15Å; I102-F105 PolarHBondContact O-N 3.44Å; L103-F105 VanDerWaalsContact C-N 3.29Å; L103-F105 PolarHBondContact O-N 3.13Å; F105-N108 PolarHBondContact O-N 3.1Å; F105-L109 HydrophobicContact CD1-CD1 3.83Å; F105-L109 HydrophobicContact CE1-CD1 3.33Å; F105-L109 HydrophobicContact CE1-CG 4.25Å; F105-L109 HydrophobicContact CZ-CD1 3.73Å; F105-L109 HydrophobicContact CZ-CG 4.3Å; F105-L109 WeakPolarHBondContact O-CG 3.44Å; F105-L109 PolarHBondContact O-N 2.78Å
106	I	72.9	Confident	71.1	Confident	4 Å²	4	70.2 Å²	70.2	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-66.6	-42	178.9	-64.4	167.2	0	0	0	111.4	F28 P78 M81 E82 V85 I102 L103 N108 L109 L110	F28-I106 HydrophobicContact CD1-CD1 4.23Å; F28-I106 HydrophobicContact CE1-CD1 4.17Å; P78-I106 HydrophobicContact CB-CG2 4.49Å; M81-I106 HydrophobicContact CG-CD1 4.04Å; E82-I106 HydrophobicContact CB-CG2 3.83Å; E82-I106 HydrophobicContact CG-CG2 4.17Å; V85-I106 HydrophobicContact CG2-CD1 4.12Å; I102-I106 HydrophobicContact CG2-CD1 3.74Å; I102-I106 HydrophobicContact CG2-CG1 4.44Å; I102-I106 VanDerWaalsContact O-CG1 3.31Å; I102-I106 WeakPolarHBondContact O-CG1 3.39Å; I102-I106 PolarHBondContact O-N 2.65Å; L103-I106 PolarHBondContact O-N 2.92Å; L103-I106 VanDerWaalsContact O-N 3.14Å; I106-N108 PolarHBondContact O-N 2.92Å; I106-L109 WeakPolarHBondContact O-CB 3.48Å; I106-L109 PolarHBondContact O-N 3.07Å; I106-L109 VanDerWaalsContact O-N 3.14Å; I106-L110 HydrophobicContact CG2-CD1 4.07Å; I106-L110 HydrophobicContact CG2-CG 4.5Å; I106-L110 WeakPolarHBondContact O-CG 3.34Å; I106-L110 PolarHBondContact O-N 2.94Å
107	S	76.6	Confident	71.4	Confident	31 Å²	31	67 Å²	67	22%	0.217	36%	0.357	C	S	.	.	H	α-helix	trans	-61.7	-43.3	175.3	-61.5	0	0	0	0	111.3	L103 L109 L110 G111 E112	L103-S107 WeakPolarHBondContact O-CB 3.48Å; L103-S107 PolarHBondContact O-N 3.5Å; L103-S107 PolarHBondContact O-OG 3.07Å; L103-S107 VanDerWaalsContact O-OG 3.07Å; S107-L109 VanDerWaalsContact C-N 3.26Å; S107-L109 PolarHBondContact O-N 3Å; S107-L110 CarbonylContact O-C 3.53Å; S107-L110 PolarHBondContact O-N 3.5Å; S107-L110 VanDerWaalsContact O-N 3.07Å; S107-G111 PolarHBondContact O-N 2.9Å; S107-E112 PolarHBondContact O-N 3.14Å; S107-E112 VanDerWaalsContact O-N 3.09Å
108	N	77.6	Confident	71.8	Confident	115 Å²	115	64.1 Å²	64.1	62%	0.615	34%	0.341	S	S	*	.	H	α-helix	trans	-60.4	-35.3	173.9	-75.9	-37.1	0	0	0	112.4	E104 F105 I106 G111	E104-N108 WeakPolarHBondContact O-CB 3.35Å; E104-N108 PolarHBondContact O-N 2.85Å; E104-N108 PolarHBondContact O-ND2 3.25Å; F105-N108 PolarHBondContact O-N 3.1Å; I106-N108 PolarHBondContact O-N 2.92Å; N108-G111 PolarHBondContact O-N 3.09Å
109	L	70.5	Confident	72.1	Confident	75 Å²	75	66.9 Å²	66.9	39%	0.393	36%	0.356	S	S	.	.	H	α-helix	trans	-71.1	-34.7	173.8	-73.5	170.7	0	0	0	113	A32 W41 F105 I106 S107 G111	A32-L109 HydrophobicContact CB-CD1 3.54Å; A32-L109 HydrophobicContact CB-CD2 4.09Å; A32-L109 HydrophobicContact CB-CG 4.48Å; W41-L109 HydrophobicContact CH2-CD2 4.39Å; F105-L109 HydrophobicContact CD1-CD1 3.83Å; F105-L109 HydrophobicContact CE1-CD1 3.33Å; F105-L109 HydrophobicContact CE1-CG 4.25Å; F105-L109 HydrophobicContact CZ-CD1 3.73Å; F105-L109 HydrophobicContact CZ-CG 4.3Å; F105-L109 WeakPolarHBondContact O-CG 3.44Å; F105-L109 PolarHBondContact O-N 2.78Å; I106-L109 WeakPolarHBondContact O-CB 3.48Å; I106-L109 PolarHBondContact O-N 3.07Å; I106-L109 VanDerWaalsContact O-N 3.14Å; S107-L109 VanDerWaalsContact C-N 3.26Å; S107-L109 PolarHBondContact O-N 3Å; L109-G111 VanDerWaalsContact C-N 3.29Å
110	L	67.4	Low	72.2	Confident	32 Å²	32	70.5 Å²	70.5	17%	0.168	38%	0.376	C	S	.	.	H	α-helix	trans	-76.1	-17.3	176.2	-75.4	172.9	0	0	0	113	P78 K79 I106 S107 E112	P78-L110 HydrophobicContact CB-CD1 4.49Å; P78-L110 HydrophobicContact CB-CD2 3.64Å; P78-L110 HydrophobicContact CB-CG 3.95Å; P78-L110 HydrophobicContact CG-CD2 4.12Å; K79-L110 HydrophobicContact CG-CD1 4.18Å; K79-L110 HydrophobicContact CG-CD2 4.09Å; I106-L110 HydrophobicContact CG2-CD1 4.07Å; I106-L110 HydrophobicContact CG2-CG 4.5Å; I106-L110 WeakPolarHBondContact O-CG 3.34Å; I106-L110 PolarHBondContact O-N 2.94Å; S107-L110 CarbonylContact O-C 3.53Å; S107-L110 PolarHBondContact O-N 3.5Å; S107-L110 VanDerWaalsContact O-N 3.07Å; L110-E112 HydrophobicContact CB-CG 4.07Å
111	G	68.4	Low	72	Confident	70 Å²	70	63.8 Å²	63.8	72%	0.722	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	27.6	-174.5	0	0	0	0	0	113.2	S107 N108 L109	S107-G111 PolarHBondContact O-N 2.9Å; N108-G111 PolarHBondContact O-N 3.09Å; L109-G111 VanDerWaalsContact C-N 3.29Å
112	E	56	Low	71.8	Confident	162 Å²	162	64.2 Å²	64.2	76%	0.757	36%	0.356	S	S	*	.			trans	-96.2	0	177.9	-66.3	-173.1	174.9	0	0	112.7	S107 L110	S107-E112 PolarHBondContact O-N 3.14Å; S107-E112 VanDerWaalsContact O-N 3.09Å; L110-E112 HydrophobicContact CB-CG 4.07Å

Retrieved 112 of 112 residues in 104.6 ms (Link to these results)

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