A0A077ZJK4_TRITR Loading...

Cullin domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZJK4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 262 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.2	Low	59.3	Low	207 Å²	207	96.5 Å²	96.5	100%	1.02	51%	0.512	S	S	*	.				0	74.3	0	-78.6	-165.9	-122.4	0	0	110.5	I4	M1-I4 HydrophobicContact SD-CD1 4.36Å
2	L	58.4	Low	61	Low	107 Å²	107	95.8 Å²	95.8	56%	0.56	51%	0.507	S	S	*	.			trans	-91.3	-27.7	174.2	-83.3	159	0	0	0	112.6	I4	L2-I4 VanDerWaalsContact C-N 3.3Å; L2-I4 PolarHBondContact O-N 3.38Å
3	C	56.8	Low	62.8	Low	32 Å²	32	100.8 Å²	100.8	22%	0.216	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-10.3	-177.1	-62.6	0	0	0	0	114.4	Y65	C3-Y65 HydrophobicContact CB-CD1 3.93Å; C3-Y65 HydrophobicContact CB-CE1 3.6Å
4	I	56.5	Low	64.3	Low	106 Å²	106	96.7 Å²	96.7	54%	0.544	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	10.8	-177.4	-43.1	173.9	0	0	0	110.2	M1 L2 H6	M1-I4 HydrophobicContact SD-CD1 4.36Å; L2-I4 VanDerWaalsContact C-N 3.3Å; L2-I4 PolarHBondContact O-N 3.38Å; I4-H6 PolarHBondContact O-N 3.17Å
5	A	54.5	Low	65.8	Low	29 Å²	29	91 Å²	91	24%	0.24	46%	0.464	C	S	.	.			trans	-69.2	123.8	178.4	0	0	0	0	0	110.2	H8	A5-H8 CarbonylContact O-C 3.36Å; A5-H8 VanDerWaalsContact O-C 3.32Å; A5-H8 VanDerWaalsContact O-O 3.07Å
6	H	46.8	Very low	67.1	Low	182 Å²	182	90 Å²	90	84%	0.843	46%	0.46	S	S	*	.	S	Bend	trans	-92.1	146.9	164.8	-96.4	-14.2	0	0	0	109.7	I4	I4-H6 PolarHBondContact O-N 3.17Å
7	P	55.6	Low	68.4	Low	111 Å²	111	90.9 Å²	90.9	72%	0.721	46%	0.462	S	S	*	.	S	Bend	cis	-90.4	-8.2	10.1	29.4	-29.5	0	0	0	116.2
8	H	55.9	Low	69.6	Low	141 Å²	141	86.4 Å²	86.4	65%	0.653	44%	0.44	S	S	*	.	S	Bend	trans	-128.2	127.1	-179.4	-59.5	88.9	0	0	0	110.4	A5 H10	A5-H8 CarbonylContact O-C 3.36Å; A5-H8 VanDerWaalsContact O-C 3.32Å; A5-H8 VanDerWaalsContact O-O 3.07Å; H8-H10 PolarHBondContact O-N 3.23Å; H8-H10 VanDerWaalsContact O-N 3.11Å
9	S	63.9	Low	70.6	Confident	62 Å²	62	85.7 Å²	85.7	43%	0.434	43%	0.433	S	S	.	.			trans	-60.3	118.5	173.3	64.7	0	0	0	0	109.4	S11	S9-S11 PolarHBondContact O-N 2.84Å; S9-S11 VanDerWaalsContact O-N 3.15Å
10	H	74.9	Confident	71.7	Confident	80 Å²	80	85 Å²	85	37%	0.37	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	6.7	176.4	-64.9	-55.3	0	0	0	113.2	H8 I12 R13 L14	H8-H10 PolarHBondContact O-N 3.23Å; H8-H10 VanDerWaalsContact O-N 3.11Å; H10-I12 PolarHBondContact O-N 2.67Å; H10-R13 PolarHBondContact O-N 3.19Å; H10-L14 WeakPolarHBondContact O-CB 3.25Å; H10-L14 PolarHBondContact O-N 3.11Å
11	S	77.6	Confident	72.6	Confident	5 Å²	5	88 Å²	88	4%	0.035	44%	0.438	C	S	.	.	H	α-helix	trans	-55.4	-44.8	-179.7	-53.1	0	0	0	0	112.9	S9 L14 Y15	S9-S11 PolarHBondContact O-N 2.84Å; S9-S11 VanDerWaalsContact O-N 3.15Å; S11-L14 PolarHBondContact O-N 3.37Å; S11-Y15 WeakPolarHBondContact O-CB 3.42Å; S11-Y15 PolarHBondContact O-N 2.8Å
12	I	79.7	Confident	74.6	Confident	88 Å²	88	78.6 Å²	78.6	45%	0.451	39%	0.391	S	S	.	.	H	α-helix	trans	-68.4	-40.2	179.1	-162.5	153.4	0	0	0	112.4	H10 Y15 N16 Y70	H10-I12 PolarHBondContact O-N 2.67Å; I12-Y15 PolarHBondContact O-N 2.84Å; I12-N16 WeakPolarHBondContact O-CB 3.13Å; I12-N16 VanDerWaalsContact O-CG 3.28Å; I12-N16 PolarHBondContact O-N 3.46Å; I12-N16 PolarHBondContact O-ND2 2.66Å; I12-Y70 WeakPolarHBondContact CB-OH 3.24Å; I12-Y70 WeakPolarHBondContact CD1-OH 3.24Å
13	R	84.2	Confident	76.3	Confident	161 Å²	161	75.4 Å²	75.4	61%	0.608	37%	0.373	S	S	*	.	H	α-helix	trans	-64.4	-46.9	177.4	-175.5	177.4	178.1	-173.6	-0.9	109.3	H10 Y15 N16 E17	H10-R13 PolarHBondContact O-N 3.19Å; R13-Y15 VanDerWaalsContact C-N 3.32Å; R13-Y15 PolarHBondContact O-N 3.17Å; R13-N16 PolarHBondContact O-N 3.19Å; R13-E17 HydrophobicContact CG-CG 4.2Å; R13-E17 WeakPolarHBondContact O-CB 3.37Å; R13-E17 VanDerWaalsContact O-CG 3.22Å; R13-E17 WeakPolarHBondContact O-CG 3.45Å; R13-E17 PolarHBondContact O-N 3.44Å
14	L	84.7	Confident	78	Confident	43 Å²	43	79.4 Å²	79.4	23%	0.225	39%	0.393	C	S	.	.	H	α-helix	trans	-58.7	-43.7	176.9	-175.9	63.6	0	0	0	111.8	H10 S11 T18 Y63 L66	H10-L14 WeakPolarHBondContact O-CB 3.25Å; H10-L14 PolarHBondContact O-N 3.11Å; S11-L14 PolarHBondContact O-N 3.37Å; L14-T18 WeakPolarHBondContact O-CB 3.46Å; L14-T18 PolarHBondContact O-N 2.79Å; L14-T18 PolarHBondContact O-OG1 3.29Å; L14-Y63 HydrophobicContact CD1-CE1 4.16Å; L14-Y63 WeakPolarHBondContact CD1-OH 3.5Å; L14-Y63 HydrophobicContact CD2-CD1 4.47Å; L14-Y63 HydrophobicContact CD2-CE1 3.83Å; L14-Y63 HydrophobicContact CG-CE1 3.73Å; L14-L66 HydrophobicContact CD2-CD2 4.39Å
15	Y	86.3	Confident	79.7	Confident	11 Å²	11	78.1 Å²	78.1	4%	0.043	38%	0.382	C	S	.	.	H	α-helix	trans	-60.4	-49.5	175.3	-175.6	-89.7	0	0	0	111.9	S11 I12 R13 T18 K19 I71 L93 L94 I96 L99	S11-Y15 WeakPolarHBondContact O-CB 3.42Å; S11-Y15 PolarHBondContact O-N 2.8Å; I12-Y15 PolarHBondContact O-N 2.84Å; R13-Y15 VanDerWaalsContact C-N 3.32Å; R13-Y15 PolarHBondContact O-N 3.17Å; Y15-T18 PolarHBondContact O-N 3.41Å; Y15-K19 PolarHBondContact O-N 3.47Å; Y15-I71 HydrophobicContact CD2-CD1 3.82Å; Y15-I71 HydrophobicContact CD2-CG1 4.4Å; Y15-I71 HydrophobicContact CE2-CD1 3.74Å; Y15-I71 HydrophobicContact CE2-CG1 4.47Å; Y15-L93 HydrophobicContact CD1-CD2 3.95Å; Y15-L93 HydrophobicContact CE1-CD2 3.54Å; Y15-L93 HydrophobicContact CE2-CD2 4.42Å; Y15-L94 VanDerWaalsContact CE2-O 3.3Å; Y15-L94 WeakPolarHBondContact CE2-O 3.32Å; Y15-L94 PolarHBondContact OH-N 3.25Å; Y15-L94 PolarHBondContact OH-O 3.1Å; Y15-I96 HydrophobicContact CD2-CD1 3.63Å; Y15-I96 HydrophobicContact CE2-CD1 3.85Å; Y15-L99 HydrophobicContact CE1-CD2 4.24Å; Y15-L99 HydrophobicContact CE2-CD2 3.91Å
16	N	86.6	Confident	81.5	Confident	75 Å²	75	76.7 Å²	76.7	40%	0.401	37%	0.37	S	S	.	.	H	α-helix	trans	-64.7	-41	-179.8	-70.4	-16.9	0	0	0	112.6	I12 R13 T18 K19 N20	I12-N16 WeakPolarHBondContact O-CB 3.13Å; I12-N16 VanDerWaalsContact O-CG 3.28Å; I12-N16 PolarHBondContact O-N 3.46Å; I12-N16 PolarHBondContact O-ND2 2.66Å; R13-N16 PolarHBondContact O-N 3.19Å; N16-T18 VanDerWaalsContact C-N 3.31Å; N16-T18 PolarHBondContact O-N 3.21Å; N16-K19 WeakPolarHBondContact O-CB 3.5Å; N16-K19 PolarHBondContact O-N 2.84Å; N16-N20 WeakPolarHBondContact O-CB 3.46Å; N16-N20 PolarHBondContact O-N 3.31Å; N16-N20 PolarHBondContact O-ND2 2.99Å; N16-N20 PolarHBondContact O-OD1 3.44Å
17	E	89.1	Confident	83.7	Confident	105 Å²	105	71.8 Å²	71.8	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-38.9	174.8	-66.3	-62.9	165.5	0	0	111.2	R13 N20 Y21	R13-E17 HydrophobicContact CG-CG 4.2Å; R13-E17 WeakPolarHBondContact O-CB 3.37Å; R13-E17 VanDerWaalsContact O-CG 3.22Å; R13-E17 WeakPolarHBondContact O-CG 3.45Å; R13-E17 PolarHBondContact O-N 3.44Å; E17-N20 PolarHBondContact O-N 3.25Å; E17-Y21 WeakPolarHBondContact O-CB 3.32Å; E17-Y21 PolarHBondContact O-N 3.47Å
18	T	89.7	Confident	85.5	Confident	10 Å²	10	68.4 Å²	68.4	6%	0.061	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-41.1	176.4	-52.6	0	0	0	0	111	L14 Y15 N16 Y21 F22 Y63 I96	L14-T18 WeakPolarHBondContact O-CB 3.46Å; L14-T18 PolarHBondContact O-N 2.79Å; L14-T18 PolarHBondContact O-OG1 3.29Å; Y15-T18 PolarHBondContact O-N 3.41Å; N16-T18 VanDerWaalsContact C-N 3.31Å; N16-T18 PolarHBondContact O-N 3.21Å; T18-Y21 WeakPolarHBondContact O-CB 3.43Å; T18-Y21 PolarHBondContact O-N 3.12Å; T18-F22 HydrophobicContact CG2-CD2 4.15Å; T18-F22 HydrophobicContact CG2-CE2 3.59Å; T18-F22 HydrophobicContact CG2-CZ 3.96Å; T18-F22 WeakPolarHBondContact O-CD2 3.24Å; T18-F22 PolarHBondContact O-N 3.38Å; T18-Y63 HydrophobicContact CG2-CE1 4.38Å; T18-Y63 WeakPolarHBondContact OG1-CE1 3.39Å; T18-Y63 PolarHBondContact OG1-OH 2.68Å; T18-I96 HydrophobicContact CG2-CD1 4.25Å; T18-I96 HydrophobicContact CG2-CG2 4.21Å
19	K	90	Very high	87.2	Confident	73 Å²	73	62 Å²	62	32%	0.317	30%	0.303	S	S	.	.	H	α-helix	trans	-59	-52.8	173.1	-177.3	175.3	169.8	176	0	111.4	Y15 N16 Y21 F22 E23 L99	Y15-K19 PolarHBondContact O-N 3.47Å; N16-K19 WeakPolarHBondContact O-CB 3.5Å; N16-K19 PolarHBondContact O-N 2.84Å; K19-Y21 PolarHBondContact O-N 3.17Å; K19-F22 PolarHBondContact O-N 3.27Å; K19-F22 VanDerWaalsContact O-N 3.13Å; K19-E23 WeakPolarHBondContact CE-OE1 3.32Å; K19-E23 IonicContact NZ-OE1 3.31Å; K19-E23 WeakPolarHBondContact O-CG 3.43Å; K19-E23 PolarHBondContact O-N 3.3Å; K19-L99 HydrophobicContact CB-CD2 3.99Å; K19-L99 HydrophobicContact CD-CD1 4.27Å; K19-L99 HydrophobicContact CG-CD1 4.22Å; K19-L99 HydrophobicContact CG-CD2 4.4Å
20	N	91.4	Very high	88.5	Confident	71 Å²	71	62.6 Å²	62.6	38%	0.38	30%	0.297	S	S	.	.	H	α-helix	trans	-58.7	-38.2	178.5	-69	-14.5	0	0	0	111.4	N16 E17 N24	N16-N20 WeakPolarHBondContact O-CB 3.46Å; N16-N20 PolarHBondContact O-N 3.31Å; N16-N20 PolarHBondContact O-ND2 2.99Å; N16-N20 PolarHBondContact O-OD1 3.44Å; E17-N20 PolarHBondContact O-N 3.25Å; N20-N24 WeakPolarHBondContact O-CB 3.32Å; N20-N24 VanDerWaalsContact O-CG 3.23Å; N20-N24 PolarHBondContact O-N 3.38Å; N20-N24 PolarHBondContact O-ND2 3.36Å
21	Y	91.9	Very high	89.3	Confident	150 Å²	150	63 Å²	63	59%	0.588	31%	0.305	S	S	*	.	H	α-helix	trans	-62.1	-48.3	175.4	177.5	-94.7	0	0	0	111.8	E17 T18 K19 N24 Y25	E17-Y21 WeakPolarHBondContact O-CB 3.32Å; E17-Y21 PolarHBondContact O-N 3.47Å; T18-Y21 WeakPolarHBondContact O-CB 3.43Å; T18-Y21 PolarHBondContact O-N 3.12Å; K19-Y21 PolarHBondContact O-N 3.17Å; Y21-N24 PolarHBondContact O-N 3.26Å; Y21-Y25 WeakPolarHBondContact O-CB 3.3Å; Y21-Y25 PolarHBondContact O-N 2.97Å
22	F	92.2	Very high	90	Very high	8 Å²	8	67.1 Å²	67.1	4%	0.035	32%	0.324	C	S	.	.	H	α-helix	trans	-61.3	-45.3	176.3	-68.2	-43	0	0	0	111.9	T18 K19 N24 Y25 V26 F52 V59 I96 L99 A100 T103	T18-F22 HydrophobicContact CG2-CD2 4.15Å; T18-F22 HydrophobicContact CG2-CE2 3.59Å; T18-F22 HydrophobicContact CG2-CZ 3.96Å; T18-F22 WeakPolarHBondContact O-CD2 3.24Å; T18-F22 PolarHBondContact O-N 3.38Å; K19-F22 PolarHBondContact O-N 3.27Å; K19-F22 VanDerWaalsContact O-N 3.13Å; F22-N24 PolarHBondContact O-N 3.01Å; F22-Y25 PolarHBondContact O-N 3.41Å; F22-V26 WeakPolarHBondContact O-CB 3.13Å; F22-V26 WeakPolarHBondContact O-CG2 3.46Å; F22-V26 PolarHBondContact O-N 3.2Å; F22-F52 AromaticContact CD1-CE2 3.91Å; F22-F52 HydrophobicContact CD1-CE2 3.91Å; F22-F52 HydrophobicContact CD1-CZ 4.12Å; F22-F52 HydrophobicContact CE1-CE2 4.44Å; F22-V59 HydrophobicContact CZ-CG1 4.26Å; F22-I96 HydrophobicContact CE2-CG2 3.93Å; F22-I96 HydrophobicContact CZ-CG2 4.08Å; F22-L99 HydrophobicContact CD2-CD2 4.34Å; F22-L99 HydrophobicContact CD2-CG 4.47Å; F22-A100 HydrophobicContact CD1-CB 4.37Å; F22-A100 HydrophobicContact CD2-CB 4.03Å; F22-A100 HydrophobicContact CE1-CB 4.09Å; F22-A100 HydrophobicContact CE2-CB 3.7Å; F22-A100 HydrophobicContact CG-CB 4.36Å; F22-A100 HydrophobicContact CZ-CB 3.74Å; F22-T103 HydrophobicContact CB-CG2 3.99Å
23	E	93	Very high	90.5	Very high	40 Å²	40	63.4 Å²	63.4	19%	0.187	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-48.6	178.9	-72.2	177.3	173.7	0	0	111.5	K19 Y25 V26 H27 T103 F107	K19-E23 WeakPolarHBondContact CE-OE1 3.32Å; K19-E23 IonicContact NZ-OE1 3.31Å; K19-E23 WeakPolarHBondContact O-CG 3.43Å; K19-E23 PolarHBondContact O-N 3.3Å; E23-Y25 VanDerWaalsContact C-N 3.35Å; E23-Y25 PolarHBondContact O-N 3.36Å; E23-V26 PolarHBondContact O-N 2.91Å; E23-H27 WeakPolarHBondContact O-CB 3.36Å; E23-H27 PolarHBondContact O-CD2 3.05Å; E23-H27 PolarHBondContact O-N 2.85Å; E23-T103 HydrophobicContact CB-CG2 4.34Å; E23-T103 HydrophobicContact CG-CG2 3.71Å; E23-F107 HydrophobicContact CG-CD2 4.26Å; E23-F107 HydrophobicContact CG-CE2 3.71Å; E23-F107 HydrophobicContact CG-CZ 4.19Å
24	N	92.9	Very high	90.8	Very high	117 Å²	117	58.6 Å²	58.6	63%	0.626	30%	0.295	S	S	*	.	H	α-helix	trans	-62.4	-41.6	177.9	-73.4	-38.1	0	0	0	112.3	N20 Y21 F22 G28	N20-N24 WeakPolarHBondContact O-CB 3.32Å; N20-N24 VanDerWaalsContact O-CG 3.23Å; N20-N24 PolarHBondContact O-N 3.38Å; N20-N24 PolarHBondContact O-ND2 3.36Å; Y21-N24 PolarHBondContact O-N 3.26Å; F22-N24 PolarHBondContact O-N 3.01Å; N24-G28 PolarHBondContact O-N 3.2Å
25	Y	92.7	Very high	91	Very high	78 Å²	78	61 Å²	61	31%	0.306	32%	0.316	S	S	.	.	H	α-helix	trans	-62.9	-50	176.8	-178.8	-93.4	0	0	0	111.2	Y21 F22 E23 H27 G28 V29 F52	Y21-Y25 WeakPolarHBondContact O-CB 3.3Å; Y21-Y25 PolarHBondContact O-N 2.97Å; F22-Y25 PolarHBondContact O-N 3.41Å; E23-Y25 VanDerWaalsContact C-N 3.35Å; E23-Y25 PolarHBondContact O-N 3.36Å; Y25-H27 VanDerWaalsContact C-N 3.32Å; Y25-H27 PolarHBondContact O-N 3.21Å; Y25-G28 WeakPolarHBondContact O-CA 3.42Å; Y25-G28 PolarHBondContact O-N 3.48Å; Y25-G28 VanDerWaalsContact O-N 3.08Å; Y25-V29 HydrophobicContact CD1-CG2 4Å; Y25-V29 HydrophobicContact CE1-CG2 3.56Å; Y25-V29 WeakPolarHBondContact O-CG2 3.46Å; Y25-V29 PolarHBondContact O-N 2.99Å; Y25-F52 AromaticContact CD1-CD2 3.61Å; Y25-F52 HydrophobicContact CD1-CD2 3.61Å; Y25-F52 AromaticContact CD1-CE2 3.87Å; Y25-F52 HydrophobicContact CD1-CE2 3.87Å; Y25-F52 HydrophobicContact CE1-CB 4.36Å; Y25-F52 AromaticContact CE1-CD2 3.5Å; Y25-F52 HydrophobicContact CE1-CD2 3.5Å; Y25-F52 HydrophobicContact CE1-CE2 4.25Å; Y25-F52 HydrophobicContact CE1-CG 4.33Å
26	V	92.8	Very high	91.1	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-38.1	-179	175	0	0	0	0	111.2	F22 E23 V29 Y30 F52 T103 W104 F107 L108	F22-V26 WeakPolarHBondContact O-CB 3.13Å; F22-V26 WeakPolarHBondContact O-CG2 3.46Å; F22-V26 PolarHBondContact O-N 3.2Å; E23-V26 PolarHBondContact O-N 2.91Å; V26-V29 PolarHBondContact O-N 3.39Å; V26-Y30 WeakPolarHBondContact O-CB 3.36Å; V26-Y30 PolarHBondContact O-N 2.9Å; V26-F52 HydrophobicContact CG2-CE2 4.05Å; V26-F52 HydrophobicContact CG2-CZ 4.05Å; V26-T103 HydrophobicContact CB-CG2 4.36Å; V26-T103 HydrophobicContact CG2-CG2 4.09Å; V26-W104 HydrophobicContact CG2-CE3 3.99Å; V26-F107 HydrophobicContact CG1-CB 3.71Å; V26-L108 HydrophobicContact CG1-CB 3.57Å; V26-L108 HydrophobicContact CG1-CD1 4.19Å
27	H	92.7	Very high	91.1	Very high	79 Å²	79	62.2 Å²	62.2	37%	0.366	34%	0.337	S	S	.	.	H	α-helix	trans	-63.1	-39.7	172.1	-81.7	-54.6	0	0	0	113.2	E23 Y25 Y30 T31 F107	E23-H27 WeakPolarHBondContact O-CB 3.36Å; E23-H27 PolarHBondContact O-CD2 3.05Å; E23-H27 PolarHBondContact O-N 2.85Å; Y25-H27 VanDerWaalsContact C-N 3.32Å; Y25-H27 PolarHBondContact O-N 3.21Å; H27-Y30 PolarHBondContact O-N 2.88Å; H27-T31 PolarHBondContact O-N 2.67Å; H27-T31 PolarHBondContact O-OG1 3.41Å; H27-F107 AromaticContact CE1-CD1 3.41Å; H27-F107 VanDerWaalsContact CE1-CD1 3.41Å; H27-F107 WeakPolarHBondContact CE1-CD1 3.48Å; H27-F107 AromaticContact NE2-CD1 3.45Å; H27-F107 WeakPolarHBondContact NE2-CD1 3.49Å; H27-F107 AromaticContact NE2-CE1 3.75Å
28	G	92.3	Very high	90.9	Very high	40 Å²	40	61.5 Å²	61.5	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-47.3	173.1	0	0	0	0	0	111.8	N24 Y25 T31 E32	N24-G28 PolarHBondContact O-N 3.2Å; Y25-G28 WeakPolarHBondContact O-CA 3.42Å; Y25-G28 PolarHBondContact O-N 3.48Å; Y25-G28 VanDerWaalsContact O-N 3.08Å; G28-T31 PolarHBondContact O-N 3.34Å; G28-E32 PolarHBondContact O-N 2.99Å
29	V	92.5	Very high	90.6	Very high	5 Å²	5	65.3 Å²	65.3	3%	0.03	37%	0.369	C	S	.	.	H	α-helix	trans	-64.3	-42.6	177.1	179.1	0	0	0	0	111.4	Y25 V26 T31 E32 I33 K48 W104 L108	Y25-V29 HydrophobicContact CD1-CG2 4Å; Y25-V29 HydrophobicContact CE1-CG2 3.56Å; Y25-V29 WeakPolarHBondContact O-CG2 3.46Å; Y25-V29 PolarHBondContact O-N 2.99Å; V26-V29 PolarHBondContact O-N 3.39Å; V29-T31 VanDerWaalsContact C-N 3.31Å; V29-T31 PolarHBondContact O-N 3.2Å; V29-E32 WeakPolarHBondContact O-CB 3.28Å; V29-E32 PolarHBondContact O-N 2.95Å; V29-I33 HydrophobicContact CG1-CD1 3.72Å; V29-I33 HydrophobicContact CG1-CG1 4.26Å; V29-I33 WeakPolarHBondContact O-CG1 3.39Å; V29-I33 PolarHBondContact O-N 3.05Å; V29-K48 HydrophobicContact CG1-CB 3.78Å; V29-K48 HydrophobicContact CG1-CD 4.2Å; V29-K48 HydrophobicContact CG1-CG 3.9Å; V29-W104 HydrophobicContact CG1-CH2 4.05Å; V29-W104 HydrophobicContact CG1-CZ3 4.35Å; V29-L108 HydrophobicContact CB-CD1 3.96Å; V29-L108 HydrophobicContact CG1-CD1 3.55Å
30	Y	92.3	Very high	90.6	Very high	76 Å²	76	68 Å²	68	30%	0.298	38%	0.381	S	S	.	.	H	α-helix	trans	-57.1	-46.8	175.2	172.6	-98.3	0	0	0	110.9	V26 H27 E32 I33 S34 P111 L112	V26-Y30 WeakPolarHBondContact O-CB 3.36Å; V26-Y30 PolarHBondContact O-N 2.9Å; H27-Y30 PolarHBondContact O-N 2.88Å; Y30-E32 VanDerWaalsContact C-N 3.33Å; Y30-E32 PolarHBondContact O-N 3.19Å; Y30-I33 PolarHBondContact O-N 3.39Å; Y30-S34 WeakPolarHBondContact CE2-OG 3.48Å; Y30-S34 VanDerWaalsContact O-CB 3.3Å; Y30-S34 WeakPolarHBondContact O-CB 2.98Å; Y30-S34 PolarHBondContact O-N 2.89Å; Y30-S34 PolarHBondContact O-OG 3.35Å; Y30-S34 VanDerWaalsContact O-OG 3.06Å; Y30-P111 HydrophobicContact CD2-CB 4.37Å; Y30-P111 HydrophobicContact CE2-CB 3.6Å; Y30-P111 HydrophobicContact CE2-CG 4.4Å; Y30-L112 HydrophobicContact CD2-CD1 4.07Å; Y30-L112 HydrophobicContact CD2-CD2 4.06Å; Y30-L112 HydrophobicContact CD2-CG 3.86Å; Y30-L112 HydrophobicContact CE2-CD1 4.4Å; Y30-L112 HydrophobicContact CE2-CD2 3.57Å; Y30-L112 HydrophobicContact CE2-CG 3.72Å
31	T	91.7	Very high	90.6	Very high	88 Å²	88	65.1 Å²	65.1	54%	0.54	37%	0.365	S	S	.	.	H	α-helix	trans	-62.8	-40	178.5	-54	0	0	0	0	111.8	H27 G28 V29 S35	H27-T31 PolarHBondContact O-N 2.67Å; H27-T31 PolarHBondContact O-OG1 3.41Å; G28-T31 PolarHBondContact O-N 3.34Å; V29-T31 VanDerWaalsContact C-N 3.31Å; V29-T31 PolarHBondContact O-N 3.2Å; T31-S35 VanDerWaalsContact O-CB 3.27Å; T31-S35 WeakPolarHBondContact O-CB 3.39Å; T31-S35 PolarHBondContact O-N 3.44Å; T31-S35 PolarHBondContact O-OG 2.86Å
32	E	91.6	Very high	90.6	Very high	92 Å²	92	58.5 Å²	58.5	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-44.9	175.7	-171	-176.4	166.7	0	0	111.7	G28 V29 Y30 S35 G36 K48	G28-E32 PolarHBondContact O-N 2.99Å; V29-E32 WeakPolarHBondContact O-CB 3.28Å; V29-E32 PolarHBondContact O-N 2.95Å; Y30-E32 VanDerWaalsContact C-N 3.33Å; Y30-E32 PolarHBondContact O-N 3.19Å; E32-S35 PolarHBondContact O-OG 3.14Å; E32-G36 PolarHBondContact O-N 2.96Å; E32-G36 VanDerWaalsContact O-N 3.15Å; E32-K48 WeakPolarHBondContact OE1-CE 3.43Å; E32-K48 IonicContact OE1-NZ 3.97Å; E32-K48 PolarHBondContact OE1-NZ 3.34Å; E32-K48 WeakPolarHBondContact OE2-CE 3.47Å; E32-K48 IonicContact OE2-NZ 2.68Å; E32-K48 PolarHBondContact OE2-NZ 2.96Å
33	I	90.9	Very high	90.6	Very high	9 Å²	9	61.4 Å²	61.4	5%	0.046	36%	0.358	C	S	.	.	H	α-helix	trans	-69.4	-44.1	179.1	-65.5	172.1	0	0	0	111.1	V29 Y30 S35 G36 I41 V44 L108 L112	V29-I33 HydrophobicContact CG1-CD1 3.72Å; V29-I33 HydrophobicContact CG1-CG1 4.26Å; V29-I33 WeakPolarHBondContact O-CG1 3.39Å; V29-I33 PolarHBondContact O-N 3.05Å; Y30-I33 PolarHBondContact O-N 3.39Å; I33-S35 VanDerWaalsContact C-N 3.34Å; I33-S35 PolarHBondContact O-N 3.32Å; I33-G36 PolarHBondContact O-N 3.35Å; I33-I41 HydrophobicContact CG2-CD1 4.25Å; I33-I41 HydrophobicContact CG2-CG1 3.53Å; I33-V44 HydrophobicContact CG1-CG1 3.97Å; I33-L108 HydrophobicContact CD1-CD1 4.2Å; I33-L108 HydrophobicContact CD1-CD2 4.47Å; I33-L112 HydrophobicContact CB-CD1 4.22Å; I33-L112 HydrophobicContact CD1-CD1 4.4Å; I33-L112 HydrophobicContact CG2-CD1 3.68Å
34	S	89.1	Confident	90.6	Very high	60 Å²	60	61.5 Å²	61.5	42%	0.42	36%	0.361	S	S	.	.	H	α-helix	trans	-68.5	-30.2	-179.4	-66	0	0	0	0	113.5	Y30	Y30-S34 WeakPolarHBondContact CE2-OG 3.48Å; Y30-S34 VanDerWaalsContact O-CB 3.3Å; Y30-S34 WeakPolarHBondContact O-CB 2.98Å; Y30-S34 PolarHBondContact O-N 2.89Å; Y30-S34 PolarHBondContact O-OG 3.35Å; Y30-S34 VanDerWaalsContact O-OG 3.06Å
35	S	90	Very high	90.7	Very high	94 Å²	94	56 Å²	56	66%	0.657	33%	0.332	S	S	*	.	H	α-helix	trans	-84.9	-12.7	174.8	59.9	0	0	0	0	113.4	T31 E32 I33	T31-S35 VanDerWaalsContact O-CB 3.27Å; T31-S35 WeakPolarHBondContact O-CB 3.39Å; T31-S35 PolarHBondContact O-N 3.44Å; T31-S35 PolarHBondContact O-OG 2.86Å; E32-S35 PolarHBondContact O-OG 3.14Å; I33-S35 VanDerWaalsContact C-N 3.34Å; I33-S35 PolarHBondContact O-N 3.32Å
36	G	87.9	Confident	90.7	Very high	38 Å²	38	53.2 Å²	53.2	39%	0.392	32%	0.322	S	S	.	.	S	Bend	trans	-73.7	-176	179.3	0	0	0	0	0	114.2	E32 I33 P38	E32-G36 PolarHBondContact O-N 2.96Å; E32-G36 VanDerWaalsContact O-N 3.15Å; I33-G36 PolarHBondContact O-N 3.35Å; G36-P38 WeakPolarHBondContact O-CD 3.4Å
37	C	86.7	Confident	90.8	Very high	73 Å²	73	59 Å²	59	49%	0.493	35%	0.349	S	S	.	.			trans	-73.2	125.1	176.2	-171.8	0	0	0	0	110.1	S39 K40	C37-S39 VanDerWaalsContact C-N 3.26Å; C37-S39 PolarHBondContact O-N 2.91Å; C37-S39 PolarHBondContact SG-OG 3.43Å; C37-K40 PolarHBondContact O-N 3.49Å
38	P	84.3	Confident	90.9	Very high	91 Å²	91	57 Å²	57	59%	0.591	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-53.3	-41.8	-179.9	-28.7	35.2	0	0	0	112.9	G36 K40 I41 Q119	G36-P38 WeakPolarHBondContact O-CD 3.4Å; P38-K40 PolarHBondContact O-N 3.13Å; P38-K40 VanDerWaalsContact O-N 3.09Å; P38-I41 WeakPolarHBondContact O-CB 3.41Å; P38-I41 PolarHBondContact O-N 3.03Å; P38-I41 VanDerWaalsContact O-N 3.1Å; P38-Q119 PolarHBondContact O-NE2 3.33Å; P38-Q119 PolarHBondContact O-OE1 3.21Å; P38-Q119 VanDerWaalsContact O-OE1 3.08Å
39	S	84.5	Confident	91	Very high	90 Å²	90	55.3 Å²	55.3	63%	0.629	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-62.1	-17.8	-179.3	65	0	0	0	0	115.3	C37	C37-S39 VanDerWaalsContact C-N 3.26Å; C37-S39 PolarHBondContact O-N 2.91Å; C37-S39 PolarHBondContact SG-OG 3.43Å
40	K	88.6	Confident	91	Very high	130 Å²	130	59.9 Å²	59.9	57%	0.565	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-106.1	8	-179.7	-62.2	-170.2	177.3	-176.7	0	112.7	C37 P38 L42 T43 V44	C37-K40 PolarHBondContact O-N 3.49Å; P38-K40 PolarHBondContact O-N 3.13Å; P38-K40 VanDerWaalsContact O-N 3.09Å; K40-L42 VanDerWaalsContact C-N 3.25Å; K40-L42 PolarHBondContact O-N 2.92Å; K40-T43 PolarHBondContact O-N 3.36Å; K40-V44 HydrophobicContact CB-CG2 4.21Å; K40-V44 WeakPolarHBondContact O-CG2 3.49Å; K40-V44 PolarHBondContact O-N 2.96Å
41	I	91.7	Very high	91.1	Very high	10 Å²	10	60.4 Å²	60.4	5%	0.051	36%	0.355	C	S	.	.	H	α-helix	trans	-54.9	-42.9	-174.1	-161.5	178	0	0	0	111.4	I33 P38 Y45 L112 M116 Q119	I33-I41 HydrophobicContact CG2-CD1 4.25Å; I33-I41 HydrophobicContact CG2-CG1 3.53Å; P38-I41 WeakPolarHBondContact O-CB 3.41Å; P38-I41 PolarHBondContact O-N 3.03Å; P38-I41 VanDerWaalsContact O-N 3.1Å; I41-Y45 WeakPolarHBondContact O-CB 3.32Å; I41-Y45 PolarHBondContact O-N 3.19Å; I41-L112 HydrophobicContact CD1-CD2 4.24Å; I41-M116 HydrophobicContact CD1-CG 4.18Å; I41-Q119 HydrophobicContact CG2-CG 4.46Å
42	L	92.2	Very high	91.1	Very high	10 Å²	10	56.7 Å²	56.7	5%	0.052	33%	0.332	C	S	.	.	H	α-helix	trans	-68.9	-43.4	-176.3	-61.7	179.3	0	0	0	111.7	K40 L46 M116 Q119 M120 T137 L138 V141	K40-L42 VanDerWaalsContact C-N 3.25Å; K40-L42 PolarHBondContact O-N 2.92Å; L42-L46 VanDerWaalsContact O-CB 3.32Å; L42-L46 WeakPolarHBondContact O-CB 3.36Å; L42-L46 PolarHBondContact O-N 3.2Å; L42-M116 HydrophobicContact CD2-CB 3.91Å; L42-M116 HydrophobicContact CD2-CE 4.2Å; L42-M116 HydrophobicContact CD2-CG 4.09Å; L42-Q119 HydrophobicContact CD1-CB 4.11Å; L42-Q119 HydrophobicContact CG-CB 4.39Å; L42-M120 HydrophobicContact CD1-CG 3.72Å; L42-M120 HydrophobicContact CD2-CG 3.82Å; L42-M120 HydrophobicContact CD2-SD 4.42Å; L42-M120 HydrophobicContact CG-CG 4.45Å; L42-T137 HydrophobicContact CB-CG2 3.72Å; L42-L138 HydrophobicContact CD1-CD2 4.23Å; L42-V141 HydrophobicContact CB-CG2 4.35Å; L42-V141 HydrophobicContact CD2-CG2 4.35Å
43	T	92.9	Very high	91.2	Very high	70 Å²	70	54.7 Å²	54.7	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-66.8	-47.7	179.5	-50.4	0	0	0	0	111.2	K40 L46 E47	K40-T43 PolarHBondContact O-N 3.36Å; T43-L46 PolarHBondContact O-N 3.5Å; T43-E47 PolarHBondContact O-N 3.4Å
44	V	92.9	Very high	91.2	Very high	42 Å²	42	59.7 Å²	59.7	26%	0.255	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-43.2	179.2	179.7	0	0	0	0	110.2	I33 K40 L46 E47 K48	I33-V44 HydrophobicContact CG1-CG1 3.97Å; K40-V44 HydrophobicContact CB-CG2 4.21Å; K40-V44 WeakPolarHBondContact O-CG2 3.49Å; K40-V44 PolarHBondContact O-N 2.96Å; V44-L46 VanDerWaalsContact C-N 3.33Å; V44-L46 PolarHBondContact O-N 3.2Å; V44-E47 PolarHBondContact O-N 2.82Å; V44-K48 HydrophobicContact CG1-CG 4.32Å; V44-K48 WeakPolarHBondContact O-CG 3.21Å; V44-K48 PolarHBondContact O-N 3.26Å
45	Y	94.2	Very high	91.3	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-54.8	-49	173.6	166.6	-89.9	0	0	0	111.5	I41 E47 K48 W49 W104 L108 V109 M116 V141 S144 M148	I41-Y45 WeakPolarHBondContact O-CB 3.32Å; I41-Y45 PolarHBondContact O-N 3.19Å; Y45-E47 PolarHBondContact O-N 3.29Å; Y45-K48 PolarHBondContact O-N 3.06Å; Y45-W49 HydrophobicContact CE1-CB 4.32Å; Y45-W49 WeakPolarHBondContact O-CB 3.23Å; Y45-W49 PolarHBondContact O-N 3.05Å; Y45-W104 HydrophobicContact CD2-CZ2 4.18Å; Y45-W104 AromaticContact CE2-CE2 3.98Å; Y45-W104 AromaticContact CE2-CZ2 3.85Å; Y45-W104 HydrophobicContact CE2-CZ2 3.85Å; Y45-W104 AromaticContact CE2-NE1 3.51Å; Y45-W104 AromaticContact CZ-NE1 3.83Å; Y45-W104 PolarHBondContact OH-NE1 3.35Å; Y45-L108 HydrophobicContact CD2-CD2 3.58Å; Y45-L108 HydrophobicContact CE2-CD2 3.52Å; Y45-V109 HydrophobicContact CE2-CG2 4.01Å; Y45-M116 HydrophobicContact CD1-CE 3.38Å; Y45-M116 HydrophobicContact CD2-CE 3.67Å; Y45-M116 HydrophobicContact CD2-SD 3.89Å; Y45-M116 HydrophobicContact CE1-CE 3.52Å; Y45-M116 HydrophobicContact CE2-CE 3.8Å; Y45-M116 HydrophobicContact CE2-SD 4.12Å; Y45-M116 HydrophobicContact CG-CE 3.47Å; Y45-M116 VanDerWaalsContact CG-CE 3.47Å; Y45-M116 HydrophobicContact CG-SD 4.16Å; Y45-V141 HydrophobicContact CD1-CG1 4.44Å; Y45-V141 HydrophobicContact CD1-CG2 3.93Å; Y45-V141 HydrophobicContact CE1-CG1 4.16Å; Y45-V141 HydrophobicContact CE1-CG2 4.23Å; Y45-S144 WeakPolarHBondContact CE1-OG 3.22Å; Y45-S144 PolarHBondContact OH-OG 2.82Å; Y45-M148 WeakPolarHBondContact OH-CE 3.48Å
46	L	93.9	Very high	91.4	Very high	21 Å²	21	54.1 Å²	54.1	11%	0.11	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-43.6	-176.1	179.3	58.8	0	0	0	111.5	L42 T43 V44 K48 W49 L50 T137 G140 V141	L42-L46 VanDerWaalsContact O-CB 3.32Å; L42-L46 WeakPolarHBondContact O-CB 3.36Å; L42-L46 PolarHBondContact O-N 3.2Å; T43-L46 PolarHBondContact O-N 3.5Å; V44-L46 VanDerWaalsContact C-N 3.33Å; V44-L46 PolarHBondContact O-N 3.2Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-K48 PolarHBondContact O-N 2.92Å; L46-W49 PolarHBondContact O-N 3.29Å; L46-L50 HydrophobicContact CD1-CD1 4.16Å; L46-L50 HydrophobicContact CD1-CG 4.08Å; L46-L50 HydrophobicContact CG-CD1 4.13Å; L46-L50 HydrophobicContact CG-CG 4.48Å; L46-L50 VanDerWaalsContact O-CG 3.29Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.05Å; L46-T137 HydrophobicContact CD2-CG2 4.3Å; L46-G140 VanDerWaalsContact CD1-C 3.48Å; L46-V141 HydrophobicContact CB-CG2 4.37Å
47	E	94.3	Very high	91.5	Very high	120 Å²	120	56.4 Å²	56.4	56%	0.561	32%	0.315	S	S	*	.	H	α-helix	trans	-58.6	-46.2	176.2	-175.5	-176.1	164.4	0	0	111.7	T43 V44 Y45 T51	T43-E47 PolarHBondContact O-N 3.4Å; V44-E47 PolarHBondContact O-N 2.82Å; Y45-E47 PolarHBondContact O-N 3.29Å; E47-T51 PolarHBondContact O-N 3.33Å; E47-T51 VanDerWaalsContact O-N 3.15Å; E47-T51 PolarHBondContact O-OG1 3.4Å
48	K	93.5	Very high	91.7	Very high	39 Å²	39	55.8 Å²	55.8	17%	0.17	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-39.7	179.4	-62.4	-73.9	174.6	164.6	0	111.5	V29 E32 V44 Y45 L46 T51 F52 W104	V29-K48 HydrophobicContact CG1-CB 3.78Å; V29-K48 HydrophobicContact CG1-CD 4.2Å; V29-K48 HydrophobicContact CG1-CG 3.9Å; E32-K48 WeakPolarHBondContact OE1-CE 3.43Å; E32-K48 IonicContact OE1-NZ 3.97Å; E32-K48 PolarHBondContact OE1-NZ 3.34Å; E32-K48 WeakPolarHBondContact OE2-CE 3.47Å; E32-K48 IonicContact OE2-NZ 2.68Å; E32-K48 PolarHBondContact OE2-NZ 2.96Å; V44-K48 HydrophobicContact CG1-CG 4.32Å; V44-K48 WeakPolarHBondContact O-CG 3.21Å; V44-K48 PolarHBondContact O-N 3.26Å; Y45-K48 PolarHBondContact O-N 3.06Å; L46-K48 VanDerWaalsContact C-N 3.34Å; L46-K48 PolarHBondContact O-N 2.92Å; K48-T51 PolarHBondContact O-N 2.93Å; K48-F52 WeakPolarHBondContact O-CB 3.2Å; K48-F52 PolarHBondContact O-N 3.03Å; K48-W104 HydrophobicContact CB-CH2 3.85Å
49	W	94.3	Very high	91.9	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.011	30%	0.299	C	S	.	.	H	α-helix	trans	-61.1	-48.9	175.4	169.5	-109	0	0	0	111.5	Y45 L46 T51 F52 Y53 V101 W104 D147 M148	Y45-W49 HydrophobicContact CE1-CB 4.32Å; Y45-W49 WeakPolarHBondContact O-CB 3.23Å; Y45-W49 PolarHBondContact O-N 3.05Å; L46-W49 PolarHBondContact O-N 3.29Å; W49-T51 VanDerWaalsContact C-N 3.33Å; W49-T51 PolarHBondContact O-N 3.19Å; W49-F52 HydrophobicContact CE3-CD1 4.42Å; W49-F52 HydrophobicContact CZ3-CD1 4.38Å; W49-F52 PolarHBondContact O-N 3.14Å; W49-Y53 AromaticContact CH2-CD2 3.68Å; W49-Y53 HydrophobicContact CH2-CD2 3.68Å; W49-Y53 HydrophobicContact CH2-CE2 4.32Å; W49-Y53 HydrophobicContact CH2-CG 4.43Å; W49-Y53 AromaticContact CZ2-CD2 3.54Å; W49-Y53 HydrophobicContact CZ2-CD2 3.54Å; W49-Y53 HydrophobicContact CZ2-CE2 4.11Å; W49-Y53 HydrophobicContact CZ2-CG 4Å; W49-Y53 HydrophobicContact CZ3-CD2 4.42Å; W49-Y53 WeakPolarHBondContact O-CB 3.47Å; W49-Y53 PolarHBondContact O-N 3.11Å; W49-V101 HydrophobicContact CH2-CG1 4.44Å; W49-V101 HydrophobicContact CH2-CG2 4.25Å; W49-W104 HydrophobicContact CB-CH2 4.36Å; W49-W104 HydrophobicContact CB-CZ2 3.75Å; W49-W104 AromaticContact CE3-CD1 3.44Å; W49-W104 VanDerWaalsContact CE3-CD1 3.44Å; W49-W104 AromaticContact CE3-CD2 3.64Å; W49-W104 HydrophobicContact CE3-CD2 3.64Å; W49-W104 AromaticContact CE3-CE2 3.42Å; W49-W104 VanDerWaalsContact CE3-CE2 3.42Å; W49-W104 HydrophobicContact CE3-CE3 4.41Å; W49-W104 AromaticContact CE3-CG 3.68Å; W49-W104 HydrophobicContact CE3-CG 3.68Å; W49-W104 HydrophobicContact CE3-CZ2 4.04Å; W49-W104 AromaticContact CE3-NE1 3.25Å; W49-W104 VanDerWaalsContact CE3-NE1 3.25Å; W49-W104 HydrophobicContact CZ3-CB 4.03Å; W49-W104 AromaticContact CZ3-CD1 3.37Å; W49-W104 AromaticContact CZ3-CD2 3.97Å; W49-W104 HydrophobicContact CZ3-CD2 3.97Å; W49-W104 AromaticContact CZ3-CG 3.52Å; W49-W104 HydrophobicContact CZ3-CG 3.52Å; W49-W104 AromaticContact CZ3-NE1 3.73Å; W49-D147 HydrophobicContact CZ2-CB 4.21Å; W49-M148 HydrophobicContact CE3-CE 4.49Å; W49-M148 HydrophobicContact CH2-CE 4.26Å; W49-M148 HydrophobicContact CH2-CG 3.9Å; W49-M148 HydrophobicContact CZ2-CG 4.45Å; W49-M148 HydrophobicContact CZ3-CE 4.25Å; W49-M148 HydrophobicContact CZ3-CG 4.49Å
50	L	93.7	Very high	92.2	Very high	102 Å²	102	51.2 Å²	51.2	53%	0.534	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-44.1	-179.3	-70.5	172.9	0	0	0	111.5	L46 D54	L46-L50 HydrophobicContact CD1-CD1 4.16Å; L46-L50 HydrophobicContact CD1-CG 4.08Å; L46-L50 HydrophobicContact CG-CD1 4.13Å; L46-L50 HydrophobicContact CG-CG 4.48Å; L46-L50 VanDerWaalsContact O-CG 3.29Å; L46-L50 WeakPolarHBondContact O-CG 3.46Å; L46-L50 PolarHBondContact O-N 3.05Å; L50-D54 WeakPolarHBondContact O-CB 3.26Å; L50-D54 PolarHBondContact O-N 2.94Å; L50-D54 VanDerWaalsContact O-N 3.08Å
51	T	93.7	Very high	92.1	Very high	86 Å²	86	50.2 Å²	50.2	53%	0.528	28%	0.28	S	S	.	.	H	α-helix	trans	-64.2	-44.7	177.3	-53.9	0	0	0	0	111.5	E47 K48 W49 G55	E47-T51 PolarHBondContact O-N 3.33Å; E47-T51 VanDerWaalsContact O-N 3.15Å; E47-T51 PolarHBondContact O-OG1 3.4Å; K48-T51 PolarHBondContact O-N 2.93Å; W49-T51 VanDerWaalsContact C-N 3.33Å; W49-T51 PolarHBondContact O-N 3.19Å; T51-G55 PolarHBondContact O-N 3.4Å; T51-G55 VanDerWaalsContact O-N 3.08Å
52	F	93.1	Very high	92	Very high	11 Å²	11	56.4 Å²	56.4	5%	0.048	31%	0.313	C	S	.	.	H	α-helix	trans	-67.5	-43.3	179.6	177.8	-100	0	0	0	112.1	F22 Y25 V26 K48 W49 G55 A56 A100 W104	F22-F52 AromaticContact CD1-CE2 3.91Å; F22-F52 HydrophobicContact CD1-CE2 3.91Å; F22-F52 HydrophobicContact CD1-CZ 4.12Å; F22-F52 HydrophobicContact CE1-CE2 4.44Å; Y25-F52 AromaticContact CD1-CD2 3.61Å; Y25-F52 HydrophobicContact CD1-CD2 3.61Å; Y25-F52 AromaticContact CD1-CE2 3.87Å; Y25-F52 HydrophobicContact CD1-CE2 3.87Å; Y25-F52 HydrophobicContact CE1-CB 4.36Å; Y25-F52 AromaticContact CE1-CD2 3.5Å; Y25-F52 HydrophobicContact CE1-CD2 3.5Å; Y25-F52 HydrophobicContact CE1-CE2 4.25Å; Y25-F52 HydrophobicContact CE1-CG 4.33Å; V26-F52 HydrophobicContact CG2-CE2 4.05Å; V26-F52 HydrophobicContact CG2-CZ 4.05Å; K48-F52 WeakPolarHBondContact O-CB 3.2Å; K48-F52 PolarHBondContact O-N 3.03Å; W49-F52 HydrophobicContact CE3-CD1 4.42Å; W49-F52 HydrophobicContact CZ3-CD1 4.38Å; W49-F52 PolarHBondContact O-N 3.14Å; F52-G55 PolarHBondContact O-N 2.82Å; F52-A56 HydrophobicContact CE1-CB 4.49Å; F52-A56 WeakPolarHBondContact O-CB 3.49Å; F52-A56 PolarHBondContact O-N 3.49Å; F52-A100 HydrophobicContact CE1-CB 4.14Å; F52-A100 WeakPolarHBondContact CE1-O 3.47Å; F52-A100 HydrophobicContact CZ-CB 3.92Å; F52-A100 WeakPolarHBondContact CZ-O 3.48Å; F52-W104 HydrophobicContact CB-CE3 3.93Å; F52-W104 HydrophobicContact CB-CH2 4.27Å; F52-W104 HydrophobicContact CB-CZ3 3.56Å; F52-W104 HydrophobicContact CD1-CB 4.34Å; F52-W104 AromaticContact CD1-CD2 3.93Å; F52-W104 HydrophobicContact CD1-CD2 3.93Å; F52-W104 AromaticContact CD1-CE3 3.29Å; F52-W104 HydrophobicContact CD1-CE3 3.29Å; F52-W104 HydrophobicContact CD1-CG 4.37Å; F52-W104 AromaticContact CD1-CZ3 3.88Å; F52-W104 HydrophobicContact CD1-CZ3 3.88Å; F52-W104 HydrophobicContact CD2-CE3 4.09Å; F52-W104 HydrophobicContact CD2-CZ3 4.19Å; F52-W104 HydrophobicContact CE1-CB 3.83Å; F52-W104 HydrophobicContact CE1-CD2 4.27Å; F52-W104 AromaticContact CE1-CE3 3.73Å; F52-W104 HydrophobicContact CE1-CE3 3.73Å; F52-W104 HydrophobicContact CE1-CG 4.34Å; F52-W104 HydrophobicContact CE2-CE3 4.44Å; F52-W104 HydrophobicContact CG-CD2 4.5Å; F52-W104 AromaticContact CG-CE3 3.49Å; F52-W104 HydrophobicContact CG-CE3 3.49Å; F52-W104 VanDerWaalsContact CG-CE3 3.49Å; F52-W104 AromaticContact CG-CZ3 3.6Å; F52-W104 HydrophobicContact CG-CZ3 3.6Å; F52-W104 HydrophobicContact CZ-CE3 4.27Å
53	Y	91.8	Very high	91.8	Very high	50 Å²	50	58 Å²	58	20%	0.196	32%	0.318	C	S	.	.	H	α-helix	trans	-66.5	-43.9	-177.6	-174.3	-105.3	0	0	0	111.5	W49 A56 Q57 V101	W49-Y53 AromaticContact CH2-CD2 3.68Å; W49-Y53 HydrophobicContact CH2-CD2 3.68Å; W49-Y53 HydrophobicContact CH2-CE2 4.32Å; W49-Y53 HydrophobicContact CH2-CG 4.43Å; W49-Y53 AromaticContact CZ2-CD2 3.54Å; W49-Y53 HydrophobicContact CZ2-CD2 3.54Å; W49-Y53 HydrophobicContact CZ2-CE2 4.11Å; W49-Y53 HydrophobicContact CZ2-CG 4Å; W49-Y53 HydrophobicContact CZ3-CD2 4.42Å; W49-Y53 WeakPolarHBondContact O-CB 3.47Å; W49-Y53 PolarHBondContact O-N 3.11Å; Y53-A56 PolarHBondContact O-N 2.97Å; Y53-Q57 HydrophobicContact CE1-CG 4.34Å; Y53-Q57 WeakPolarHBondContact O-CG 3.49Å; Y53-Q57 PolarHBondContact O-N 2.63Å; Y53-Q57 PolarHBondContact OH-NE2 3.38Å; Y53-V101 HydrophobicContact CD2-CG2 4.21Å; Y53-V101 HydrophobicContact CE2-CG2 4.08Å
54	D	92	Very high	91.4	Very high	114 Å²	114	63.7 Å²	63.7	61%	0.61	33%	0.332	S	S	*	.	H	α-helix	trans	-62.1	-45.5	173.8	-172.4	49.7	0	0	0	111.3	L50 A56 Q57 A58	L50-D54 WeakPolarHBondContact O-CB 3.26Å; L50-D54 PolarHBondContact O-N 2.94Å; L50-D54 VanDerWaalsContact O-N 3.08Å; D54-A56 PolarHBondContact O-N 3.21Å; D54-Q57 PolarHBondContact O-N 3.21Å; D54-A58 PolarHBondContact O-N 2.93Å
55	G	91.8	Very high	90.9	Very high	33 Å²	33	67.4 Å²	67.4	34%	0.34	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-43.1	173.8	0	0	0	0	0	113.1	T51 F52 A58 V59	T51-G55 PolarHBondContact O-N 3.4Å; T51-G55 VanDerWaalsContact O-N 3.08Å; F52-G55 PolarHBondContact O-N 2.82Å; G55-A58 PolarHBondContact O-N 3.36Å; G55-V59 WeakPolarHBondContact O-CG2 3.5Å; G55-V59 PolarHBondContact O-N 3.08Å
56	A	91.4	Very high	90.3	Very high	3 Å²	3	67.6 Å²	67.6	3%	0.025	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-40.7	178.2	0	0	0	0	0	111.7	F52 Y53 D54 V59 D60 A100	F52-A56 HydrophobicContact CE1-CB 4.49Å; F52-A56 WeakPolarHBondContact O-CB 3.49Å; F52-A56 PolarHBondContact O-N 3.49Å; Y53-A56 PolarHBondContact O-N 2.97Å; D54-A56 PolarHBondContact O-N 3.21Å; A56-V59 PolarHBondContact O-N 3.35Å; A56-D60 VanDerWaalsContact O-CB 3.31Å; A56-D60 WeakPolarHBondContact O-CB 3.32Å; A56-D60 PolarHBondContact O-N 2.95Å; A56-A100 HydrophobicContact CB-CB 3.61Å
57	Q	89.8	Confident	89.8	Confident	87 Å²	87	67.7 Å²	67.7	41%	0.407	34%	0.344	S	S	.	.	H	α-helix	trans	-64.8	-40.2	173.3	-72.7	-167.4	-1.6	0	0	112.1	Y53 D54 D60 N61	Y53-Q57 HydrophobicContact CE1-CG 4.34Å; Y53-Q57 WeakPolarHBondContact O-CG 3.49Å; Y53-Q57 PolarHBondContact O-N 2.63Å; Y53-Q57 PolarHBondContact OH-NE2 3.38Å; D54-Q57 PolarHBondContact O-N 3.21Å; Q57-D60 PolarHBondContact O-N 2.79Å; Q57-N61 WeakPolarHBondContact O-CB 3.45Å; Q57-N61 VanDerWaalsContact O-CG 3.31Å; Q57-N61 PolarHBondContact O-N 3.36Å; Q57-N61 PolarHBondContact O-ND2 3Å
58	A	90.6	Very high	89.2	Confident	59 Å²	59	64.4 Å²	64.4	49%	0.488	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-43.2	175.7	0	0	0	0	0	111.8	D54 G55 N61 L62	D54-A58 PolarHBondContact O-N 2.93Å; G55-A58 PolarHBondContact O-N 3.36Å; A58-N61 PolarHBondContact O-N 2.89Å; A58-L62 PolarHBondContact O-N 3.01Å
59	V	89.6	Confident	88.4	Confident	44 Å²	44	66.6 Å²	66.6	27%	0.267	35%	0.348	S	S	.	.	H	α-helix	trans	-65.9	-43.6	175.4	176.9	0	0	0	0	110.9	F22 G55 A56 N61 L62 Y63 I96	F22-V59 HydrophobicContact CZ-CG1 4.26Å; G55-V59 WeakPolarHBondContact O-CG2 3.5Å; G55-V59 PolarHBondContact O-N 3.08Å; A56-V59 PolarHBondContact O-N 3.35Å; V59-N61 VanDerWaalsContact C-N 3.3Å; V59-N61 PolarHBondContact O-N 3.46Å; V59-L62 WeakPolarHBondContact O-CB 3.38Å; V59-L62 PolarHBondContact O-N 3.22Å; V59-L62 VanDerWaalsContact O-N 3.14Å; V59-Y63 HydrophobicContact CG1-CD2 3.86Å; V59-Y63 HydrophobicContact CG1-CE2 3.9Å; V59-Y63 HydrophobicContact CG1-CG 4.48Å; V59-Y63 WeakPolarHBondContact O-CB 3.23Å; V59-Y63 VanDerWaalsContact O-CD2 3.24Å; V59-Y63 WeakPolarHBondContact O-CD2 3.49Å; V59-Y63 PolarHBondContact O-N 3.33Å; V59-I96 HydrophobicContact CG1-CG2 3.81Å
60	D	89.3	Confident	87.4	Confident	42 Å²	42	67.8 Å²	67.8	23%	0.225	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-42.9	177.1	-170.4	63.5	0	0	0	111.8	A56 Q57 L62 Y63 R64 N67 I96 G97	A56-D60 VanDerWaalsContact O-CB 3.31Å; A56-D60 WeakPolarHBondContact O-CB 3.32Å; A56-D60 PolarHBondContact O-N 2.95Å; Q57-D60 PolarHBondContact O-N 2.79Å; D60-L62 PolarHBondContact O-N 3.32Å; D60-Y63 CarbonylContact O-C 3.56Å; D60-Y63 PolarHBondContact O-N 2.85Å; D60-Y63 VanDerWaalsContact O-N 3.16Å; D60-R64 PolarHBondContact O-N 3Å; D60-N67 PolarHBondContact OD1-ND2 3.38Å; D60-I96 PolarHBondContact OD1-N 3.23Å; D60-G97 PolarHBondContact OD1-N 2.91Å
61	N	88.5	Confident	86.6	Confident	109 Å²	109	63 Å²	63	58%	0.583	33%	0.328	S	S	*	.	H	α-helix	trans	-62.3	-42.1	174.5	-78.5	-40.9	0	0	0	112.6	Q57 A58 V59 Y63 R64	Q57-N61 WeakPolarHBondContact O-CB 3.45Å; Q57-N61 VanDerWaalsContact O-CG 3.31Å; Q57-N61 PolarHBondContact O-N 3.36Å; Q57-N61 PolarHBondContact O-ND2 3Å; A58-N61 PolarHBondContact O-N 2.89Å; V59-N61 VanDerWaalsContact C-N 3.3Å; V59-N61 PolarHBondContact O-N 3.46Å; N61-Y63 VanDerWaalsContact C-N 3.26Å; N61-Y63 PolarHBondContact O-N 3.27Å; N61-R64 VanDerWaalsContact O-CB 3.29Å; N61-R64 WeakPolarHBondContact O-CB 3.34Å; N61-R64 PolarHBondContact O-N 3.42Å
62	L	88.8	Confident	85.6	Confident	139 Å²	139	61.3 Å²	61.3	73%	0.728	32%	0.322	S	S	*	.	H	α-helix	trans	-64.3	-35.3	175.2	-178.3	64.7	0	0	0	111.5	A58 V59 D60 R64	A58-L62 PolarHBondContact O-N 3.01Å; V59-L62 WeakPolarHBondContact O-CB 3.38Å; V59-L62 PolarHBondContact O-N 3.22Å; V59-L62 VanDerWaalsContact O-N 3.14Å; D60-L62 PolarHBondContact O-N 3.32Å; L62-R64 VanDerWaalsContact C-N 3.31Å; L62-R64 PolarHBondContact O-N 2.98Å
63	Y	87	Confident	84.6	Confident	43 Å²	43	66.4 Å²	66.4	17%	0.169	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	10.6	-178.2	-79.7	-125.5	0	0	0	113.2	L14 T18 V59 D60 N61 Y65 L66 N67 I96	L14-Y63 HydrophobicContact CD1-CE1 4.16Å; L14-Y63 WeakPolarHBondContact CD1-OH 3.5Å; L14-Y63 HydrophobicContact CD2-CD1 4.47Å; L14-Y63 HydrophobicContact CD2-CE1 3.83Å; L14-Y63 HydrophobicContact CG-CE1 3.73Å; T18-Y63 HydrophobicContact CG2-CE1 4.38Å; T18-Y63 WeakPolarHBondContact OG1-CE1 3.39Å; T18-Y63 PolarHBondContact OG1-OH 2.68Å; V59-Y63 HydrophobicContact CG1-CD2 3.86Å; V59-Y63 HydrophobicContact CG1-CE2 3.9Å; V59-Y63 HydrophobicContact CG1-CG 4.48Å; V59-Y63 WeakPolarHBondContact O-CB 3.23Å; V59-Y63 VanDerWaalsContact O-CD2 3.24Å; V59-Y63 WeakPolarHBondContact O-CD2 3.49Å; V59-Y63 PolarHBondContact O-N 3.33Å; D60-Y63 CarbonylContact O-C 3.56Å; D60-Y63 PolarHBondContact O-N 2.85Å; D60-Y63 VanDerWaalsContact O-N 3.16Å; N61-Y63 VanDerWaalsContact C-N 3.26Å; N61-Y63 PolarHBondContact O-N 3.27Å; Y63-Y65 PolarHBondContact O-N 3.08Å; Y63-L66 HydrophobicContact CD1-CB 4.29Å; Y63-L66 HydrophobicContact CD1-CD2 3.52Å; Y63-L66 HydrophobicContact CE1-CD2 4.04Å; Y63-L66 WeakPolarHBondContact O-CA 3.06Å; Y63-L66 WeakPolarHBondContact O-CB 3.32Å; Y63-L66 PolarHBondContact O-N 2.97Å; Y63-N67 PolarHBondContact O-N 2.69Å; Y63-I96 HydrophobicContact CD1-CD1 4.12Å; Y63-I96 HydrophobicContact CD1-CG1 3.75Å; Y63-I96 HydrophobicContact CG-CG1 4.13Å
64	R	85	Confident	83.5	Confident	191 Å²	191	68.9 Å²	68.9	72%	0.721	36%	0.358	S	S	*	.	H	α-helix	trans	-49.8	-38.9	179.3	-175	174.5	62.6	135.2	1.3	113.7	D60 N61 L62 A68	D60-R64 PolarHBondContact O-N 3Å; N61-R64 VanDerWaalsContact O-CB 3.29Å; N61-R64 WeakPolarHBondContact O-CB 3.34Å; N61-R64 PolarHBondContact O-N 3.42Å; L62-R64 VanDerWaalsContact C-N 3.31Å; L62-R64 PolarHBondContact O-N 2.98Å; R64-A68 WeakPolarHBondContact O-CB 3.43Å; R64-A68 PolarHBondContact O-N 3.16Å
65	Y	82.5	Confident	82.1	Confident	119 Å²	119	69 Å²	69	47%	0.467	35%	0.35	S	S	.	.	H	α-helix	trans	-66.6	-42.4	175.2	-175.1	-87.9	0	0	0	112.1	C3 Y63 A68 E69	C3-Y65 HydrophobicContact CB-CD1 3.93Å; C3-Y65 HydrophobicContact CB-CE1 3.6Å; Y63-Y65 PolarHBondContact O-N 3.08Å; Y65-A68 PolarHBondContact O-N 3.22Å; Y65-E69 HydrophobicContact CD1-CB 4.33Å; Y65-E69 HydrophobicContact CD1-CG 4.25Å; Y65-E69 HydrophobicContact CD2-CG 4.03Å; Y65-E69 HydrophobicContact CE1-CB 3.99Å; Y65-E69 HydrophobicContact CE1-CG 3.89Å; Y65-E69 HydrophobicContact CE2-CG 3.69Å; Y65-E69 HydrophobicContact CG-CG 4.32Å; Y65-E69 VanDerWaalsContact O-CB 3.29Å; Y65-E69 WeakPolarHBondContact O-CB 3.35Å; Y65-E69 PolarHBondContact O-N 3.21Å
66	L	82.7	Confident	80.4	Confident	4 Å²	4	72.7 Å²	72.7	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-44.9	176.3	-174.5	74.2	0	0	0	110.8	L14 Y63 A68 Y70 I71 I96	L14-L66 HydrophobicContact CD2-CD2 4.39Å; Y63-L66 HydrophobicContact CD1-CB 4.29Å; Y63-L66 HydrophobicContact CD1-CD2 3.52Å; Y63-L66 HydrophobicContact CE1-CD2 4.04Å; Y63-L66 WeakPolarHBondContact O-CA 3.06Å; Y63-L66 WeakPolarHBondContact O-CB 3.32Å; Y63-L66 PolarHBondContact O-N 2.97Å; L66-A68 VanDerWaalsContact C-N 3.34Å; L66-A68 PolarHBondContact O-N 3.35Å; L66-Y70 HydrophobicContact CD1-CD1 4.19Å; L66-Y70 HydrophobicContact CD1-CG 4.19Å; L66-Y70 WeakPolarHBondContact O-CB 3.3Å; L66-Y70 PolarHBondContact O-N 3.39Å; L66-I71 PolarHBondContact O-N 3.31Å; L66-I71 VanDerWaalsContact O-N 3.12Å; L66-I96 HydrophobicContact CD2-CD1 4.32Å; L66-I96 HydrophobicContact CD2-CG1 4.45Å
67	N	83.5	Confident	78.6	Confident	23 Å²	23	76.4 Å²	76.4	12%	0.123	39%	0.385	C	S	.	.	I	π-helix	trans	-56.6	-47.4	177	-73.4	-15.1	0	0	0	111.4	D60 Y63 I71 A72 I96	D60-N67 PolarHBondContact OD1-ND2 3.38Å; Y63-N67 PolarHBondContact O-N 2.69Å; N67-I71 WeakPolarHBondContact O-CB 3.43Å; N67-I71 VanDerWaalsContact OD1-CD1 3.32Å; N67-I71 WeakPolarHBondContact OD1-CD1 3.14Å; N67-A72 PolarHBondContact O-N 3.03Å; N67-I96 WeakPolarHBondContact OD1-CG1 3.28Å; N67-I96 PolarHBondContact OD1-N 3.33Å
68	A	81	Confident	76.6	Confident	52 Å²	52	77.2 Å²	77.2	43%	0.43	39%	0.391	S	S	.	.	I	π-helix	trans	-74.9	-46.9	-177.9	0	0	0	0	0	113.5	R64 Y65 L66 A72	R64-A68 WeakPolarHBondContact O-CB 3.43Å; R64-A68 PolarHBondContact O-N 3.16Å; Y65-A68 PolarHBondContact O-N 3.22Å; L66-A68 VanDerWaalsContact C-N 3.34Å; L66-A68 PolarHBondContact O-N 3.35Å; A68-A72 WeakPolarHBondContact O-CB 3.44Å
69	E	77.1	Confident	74.6	Confident	84 Å²	84	80.4 Å²	80.4	39%	0.393	40%	0.4	S	S	.	.	I	π-helix	trans	-89.2	-24.4	-168.5	-70	-62.6	133.5	0	0	114	Y65 K73	Y65-E69 HydrophobicContact CD1-CB 4.33Å; Y65-E69 HydrophobicContact CD1-CG 4.25Å; Y65-E69 HydrophobicContact CD2-CG 4.03Å; Y65-E69 HydrophobicContact CE1-CB 3.99Å; Y65-E69 HydrophobicContact CE1-CG 3.89Å; Y65-E69 HydrophobicContact CE2-CG 3.69Å; Y65-E69 HydrophobicContact CG-CG 4.32Å; Y65-E69 VanDerWaalsContact O-CB 3.29Å; Y65-E69 WeakPolarHBondContact O-CB 3.35Å; Y65-E69 PolarHBondContact O-N 3.21Å; E69-K73 WeakPolarHBondContact O-CD 3.4Å; E69-K73 WeakPolarHBondContact O-CE 3.3Å; E69-K73 WeakPolarHBondContact OE2-CE 3.49Å; E69-K73 IonicContact OE2-NZ 2.65Å; E69-K73 PolarHBondContact OE2-NZ 2.98Å
70	Y	73.7	Confident	72.7	Confident	29 Å²	29	84.7 Å²	84.7	11%	0.114	42%	0.421	C	S	.	.	I	π-helix	trans	-112.4	-58	-177.2	-175.4	-102.9	0	0	0	111.3	I12 L66 K73 Q74 L93	I12-Y70 WeakPolarHBondContact CB-OH 3.24Å; I12-Y70 WeakPolarHBondContact CD1-OH 3.24Å; L66-Y70 HydrophobicContact CD1-CD1 4.19Å; L66-Y70 HydrophobicContact CD1-CG 4.19Å; L66-Y70 WeakPolarHBondContact O-CB 3.3Å; L66-Y70 PolarHBondContact O-N 3.39Å; Y70-K73 PolarHBondContact O-N 3.02Å; Y70-Q74 WeakPolarHBondContact O-CG 3.26Å; Y70-Q74 PolarHBondContact O-N 3.4Å; Y70-Q74 VanDerWaalsContact O-N 3.1Å; Y70-Q74 PolarHBondContact OH-NE2 2.91Å; Y70-L93 HydrophobicContact CD1-CD1 4.2Å; Y70-L93 HydrophobicContact CE1-CD1 3.67Å
71	I	75.3	Confident	70.9	Confident	1 Å²	1	85.5 Å²	85.5	1%	0.005	43%	0.425	C	S	.	.	I	π-helix	trans	-68.5	-47.9	-172.5	-58.4	178.8	0	0	0	110.9	Y15 L66 N67 K73 Q74 R75 L93 L94 I96	Y15-I71 HydrophobicContact CD2-CD1 3.82Å; Y15-I71 HydrophobicContact CD2-CG1 4.4Å; Y15-I71 HydrophobicContact CE2-CD1 3.74Å; Y15-I71 HydrophobicContact CE2-CG1 4.47Å; L66-I71 PolarHBondContact O-N 3.31Å; L66-I71 VanDerWaalsContact O-N 3.12Å; N67-I71 WeakPolarHBondContact O-CB 3.43Å; N67-I71 VanDerWaalsContact OD1-CD1 3.32Å; N67-I71 WeakPolarHBondContact OD1-CD1 3.14Å; I71-K73 VanDerWaalsContact C-N 3.29Å; I71-K73 PolarHBondContact O-N 3.4Å; I71-Q74 PolarHBondContact O-N 3.22Å; I71-R75 HydrophobicContact CG2-CG 4.47Å; I71-R75 WeakPolarHBondContact O-CG 3.44Å; I71-R75 PolarHBondContact O-N 2.92Å; I71-L93 HydrophobicContact CG2-CB 3.97Å; I71-L94 WeakPolarHBondContact CD1-O 3.33Å; I71-I96 HydrophobicContact CD1-CD1 4.43Å; I71-I96 HydrophobicContact CD1-CG1 4.35Å
72	A	73.7	Confident	69.2	Low	50 Å²	50	86.1 Å²	86.1	41%	0.413	43%	0.428	S	S	.	.	H	α-helix	trans	-61.6	-37.5	179.6	0	0	0	0	0	112.3	N67 A68 R75	N67-A72 PolarHBondContact O-N 3.03Å; A68-A72 WeakPolarHBondContact O-CB 3.44Å; A72-R75 PolarHBondContact O-N 3.49Å
73	K	71.3	Confident	67.5	Low	118 Å²	118	88.2 Å²	88.2	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-68.9	-36.4	178	-64.2	-170.3	-167.7	160.1	0	112.6	E69 Y70 I71 R75 I76	E69-K73 WeakPolarHBondContact O-CD 3.4Å; E69-K73 WeakPolarHBondContact O-CE 3.3Å; E69-K73 WeakPolarHBondContact OE2-CE 3.49Å; E69-K73 IonicContact OE2-NZ 2.65Å; E69-K73 PolarHBondContact OE2-NZ 2.98Å; Y70-K73 PolarHBondContact O-N 3.02Å; I71-K73 VanDerWaalsContact C-N 3.29Å; I71-K73 PolarHBondContact O-N 3.4Å; K73-R75 VanDerWaalsContact C-N 3.34Å; K73-I76 PolarHBondContact O-N 3.46Å
74	Q	68.4	Low	65.4	Low	103 Å²	103	88.4 Å²	88.4	48%	0.481	45%	0.446	S	S	.	.	H	α-helix	trans	-77.3	-18.2	176.6	-70.3	-160.4	3.9	0	0	114.2	Y70 I71 I76 L93	Y70-Q74 WeakPolarHBondContact O-CG 3.26Å; Y70-Q74 PolarHBondContact O-N 3.4Å; Y70-Q74 VanDerWaalsContact O-N 3.1Å; Y70-Q74 PolarHBondContact OH-NE2 2.91Å; I71-Q74 PolarHBondContact O-N 3.22Å; Q74-I76 VanDerWaalsContact C-N 3.33Å; Q74-L93 HydrophobicContact CB-CD1 4.04Å; Q74-L93 HydrophobicContact CG-CD1 4.38Å
75	R	64.2	Low	63.6	Low	117 Å²	117	83.6 Å²	83.6	44%	0.442	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-14	173.1	-72.5	-177.2	78	153.7	2.9	113.3	I71 A72 K73 P77 L93 E98	I71-R75 HydrophobicContact CG2-CG 4.47Å; I71-R75 WeakPolarHBondContact O-CG 3.44Å; I71-R75 PolarHBondContact O-N 2.92Å; A72-R75 PolarHBondContact O-N 3.49Å; K73-R75 VanDerWaalsContact C-N 3.34Å; R75-P77 WeakPolarHBondContact O-CD 3.49Å; R75-L93 WeakPolarHBondContact CD-O 3.43Å; R75-L93 WeakPolarHBondContact CG-O 3.35Å; R75-E98 IonicContact NH1-OE2 2.97Å; R75-E98 PolarHBondContact NH1-OE2 3.26Å
76	I	55.6	Low	62.1	Low	110 Å²	110	80.7 Å²	80.7	56%	0.564	46%	0.457	S	S	*	.	S	Bend	trans	-69.5	118.2	171.4	-58.8	168.6	0	0	0	105.9	K73 Q74 D78	K73-I76 PolarHBondContact O-N 3.46Å; Q74-I76 VanDerWaalsContact C-N 3.33Å; I76-D78 PolarHBondContact O-N 2.93Å
77	P	52.2	Low	60.4	Low	81 Å²	81	88.8 Å²	88.8	53%	0.526	49%	0.494	S	S	.	.			trans	-58.7	115.1	169.7	-12.8	26.3	0	0	0	106.1	R75 L79 L82	R75-P77 WeakPolarHBondContact O-CD 3.49Å; P77-L79 PolarHBondContact O-N 2.95Å; P77-L79 VanDerWaalsContact O-N 3.17Å; P77-L82 HydrophobicContact CB-CD1 4.26Å
78	D	48.1	Very low	58.7	Low	103 Å²	103	93.8 Å²	93.8	55%	0.551	52%	0.52	S	S	*	.			trans	-53.5	129	170.4	-111.4	-28	0	0	0	106.6	I76 D80 L81 L82	I76-D78 PolarHBondContact O-N 2.93Å; D78-D80 PolarHBondContact O-N 3.42Å; D78-L81 HydrophobicContact CB-CB 4.34Å; D78-L81 HydrophobicContact CB-CD1 3.97Å; D78-L81 WeakPolarHBondContact O-CA 3.16Å; D78-L81 WeakPolarHBondContact O-CB 3.3Å; D78-L81 PolarHBondContact O-N 2.84Å; D78-L82 PolarHBondContact O-N 3.24Å
79	L	49.4	Very low	57	Low	127 Å²	127	96 Å²	96	67%	0.665	53%	0.53	S	S	*	.	H	α-helix	trans	-55	-27.3	177.4	-130.9	86.3	0	0	0	110.1	P77 L82 F83	P77-L79 PolarHBondContact O-N 2.95Å; P77-L79 VanDerWaalsContact O-N 3.17Å; L79-L82 PolarHBondContact O-N 3.4Å; L79-F83 WeakPolarHBondContact O-CD2 3.33Å
80	D	49.6	Very low	55.7	Low	134 Å²	134	101.5 Å²	101.5	72%	0.717	55%	0.553	S	S	*	*	H	α-helix	trans	-66.6	-31.3	173.6	-72.3	-16.6	0	0	0	113.7	D78 L82 F83 G84	D78-D80 PolarHBondContact O-N 3.42Å; D80-L82 VanDerWaalsContact C-N 3.35Å; D80-F83 PolarHBondContact O-N 3.38Å; D80-G84 PolarHBondContact O-N 2.99Å
81	L	52.1	Low	55	Low	59 Å²	59	104 Å²	104	31%	0.309	58%	0.575	S	S	.	*	H	α-helix	trans	-73.3	-25.4	174.3	-103.2	134.7	0	0	0	112.6	D78 F83 A86 L88	D78-L81 HydrophobicContact CB-CB 4.34Å; D78-L81 HydrophobicContact CB-CD1 3.97Å; D78-L81 WeakPolarHBondContact O-CA 3.16Å; D78-L81 WeakPolarHBondContact O-CB 3.3Å; D78-L81 PolarHBondContact O-N 2.84Å; L81-F83 VanDerWaalsContact C-N 3.31Å; L81-A86 HydrophobicContact CD2-CB 3.91Å; L81-A86 WeakPolarHBondContact CD2-O 3.25Å; L81-A86 HydrophobicContact CG-CB 4.11Å; L81-L88 HydrophobicContact CD2-CD2 4.05Å; L81-L88 HydrophobicContact CD2-CG 4.24Å
82	L	52.2	Low	54.6	Low	121 Å²	121	108.4 Å²	108.4	63%	0.634	60%	0.604	S	S	*	*	H	α-helix	trans	-76.3	-16.6	175	-77.4	160.2	0	0	0	113	P77 D78 L79 D80	P77-L82 HydrophobicContact CB-CD1 4.26Å; D78-L82 PolarHBondContact O-N 3.24Å; L79-L82 PolarHBondContact O-N 3.4Å; D80-L82 VanDerWaalsContact C-N 3.35Å
83	F	53	Low	54.8	Low	184 Å²	184	107.7 Å²	107.7	81%	0.807	59%	0.592	S	S	*	*	H	α-helix	trans	-117.3	-8.9	-179	-73.4	-75.6	0	0	0	115.2	L79 D80 L81	L79-F83 WeakPolarHBondContact O-CD2 3.33Å; D80-F83 PolarHBondContact O-N 3.38Å; L81-F83 VanDerWaalsContact C-N 3.31Å
84	G	42.8	Very low	55.3	Low	46 Å²	46	102.8 Å²	102.8	47%	0.474	57%	0.572	S	S	.	*	S	Bend	trans	-152.2	87.5	-175.4	0	0	0	0	0	115.4	D80 A86	D80-G84 PolarHBondContact O-N 2.99Å; G84-A86 PolarHBondContact O-N 3.11Å
85	G	48.1	Very low	56.1	Low	90 Å²	90	99.3 Å²	99.3	93%	0.928	56%	0.558	S	S	*	*			trans	53	-0.9	142.1	0	0	0	0	0	121.9
86	A	50.2	Low	57.2	Low	58 Å²	58	93.8 Å²	93.8	48%	0.479	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-82.3	128.7	-177.5	0	0	0	0	0	110.7	L81 G84 L88	L81-A86 HydrophobicContact CD2-CB 3.91Å; L81-A86 WeakPolarHBondContact CD2-O 3.25Å; L81-A86 HydrophobicContact CG-CB 4.11Å; G84-A86 PolarHBondContact O-N 3.11Å; A86-L88 PolarHBondContact O-N 3.38Å; A86-L88 VanDerWaalsContact O-N 3.17Å
87	E	46	Very low	58.7	Low	175 Å²	175	89.2 Å²	89.2	82%	0.818	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-60.1	117	176.4	-63.8	-175.3	169.7	0	0	109.9
88	L	48.9	Very low	60.4	Low	127 Å²	127	88.1 Å²	88.1	67%	0.665	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-51.3	137.7	169	-75.7	159.5	0	0	0	109.2	L81 A86 K90	L81-L88 HydrophobicContact CD2-CD2 4.05Å; L81-L88 HydrophobicContact CD2-CG 4.24Å; A86-L88 PolarHBondContact O-N 3.38Å; A86-L88 VanDerWaalsContact O-N 3.17Å; L88-K90 PolarHBondContact O-N 2.8Å
89	P	44.8	Very low	62.3	Low	99 Å²	99	83.5 Å²	83.5	64%	0.643	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-49.9	128.7	173	-23.3	31.1	0	0	0	109.7	S91	P89-S91 PolarHBondContact O-N 3.17Å
90	K	50.9	Low	64.3	Low	200 Å²	200	77.4 Å²	77.4	87%	0.87	45%	0.449	S	S	*	.	S	Bend	trans	-56.1	-9.8	-171.4	-70.2	-176.5	178.8	178.3	0	114.9	L88	L88-K90 PolarHBondContact O-N 2.8Å
91	S	57.8	Low	66.3	Low	82 Å²	82	71.7 Å²	71.7	57%	0.573	42%	0.419	S	S	*	.	S	Bend	trans	-146.4	127.8	166	-54.2	0	0	0	0	109.1	P89	P89-S91 PolarHBondContact O-N 3.17Å
92	P	67.8	Low	68	Low	93 Å²	93	72.8 Å²	72.8	60%	0.604	42%	0.422	S	S	*	.			trans	-60.9	139.5	176.6	26.2	-33.3	0	0	0	109.7	L94	P92-L94 PolarHBondContact O-N 3.19Å
93	L	77.4	Confident	69.8	Low	34 Å²	34	67.2 Å²	67.2	18%	0.178	39%	0.393	C	S	.	.			trans	-61.9	131.1	171.4	-67.1	-172	0	0	0	109.4	Y15 Y70 I71 Q74 R75	Y15-L93 HydrophobicContact CD1-CD2 3.95Å; Y15-L93 HydrophobicContact CE1-CD2 3.54Å; Y15-L93 HydrophobicContact CE2-CD2 4.42Å; Y70-L93 HydrophobicContact CD1-CD1 4.2Å; Y70-L93 HydrophobicContact CE1-CD1 3.67Å; I71-L93 HydrophobicContact CG2-CB 3.97Å; Q74-L93 HydrophobicContact CB-CD1 4.04Å; Q74-L93 HydrophobicContact CG-CD1 4.38Å; R75-L93 WeakPolarHBondContact CD-O 3.43Å; R75-L93 WeakPolarHBondContact CG-O 3.35Å
94	L	81.6	Confident	71.7	Confident	16 Å²	16	58.4 Å²	58.4	8%	0.084	36%	0.355	C	S	.	.			trans	-107	146.4	177	-62.5	-175.5	0	0	0	109.5	Y15 I71 P92 E98 L99 Q102	Y15-L94 VanDerWaalsContact CE2-O 3.3Å; Y15-L94 WeakPolarHBondContact CE2-O 3.32Å; Y15-L94 PolarHBondContact OH-N 3.25Å; Y15-L94 PolarHBondContact OH-O 3.1Å; I71-L94 WeakPolarHBondContact CD1-O 3.33Å; P92-L94 PolarHBondContact O-N 3.19Å; L94-E98 HydrophobicContact CB-CB 3.94Å; L94-E98 HydrophobicContact CD1-CB 4.31Å; L94-L99 HydrophobicContact CB-CB 4.35Å; L94-Q102 HydrophobicContact CD1-CB 4.33Å
95	P	85.5	Confident	74	Confident	30 Å²	30	58 Å²	58	20%	0.195	34%	0.34	C	S	.	.			trans	-46.6	146.2	164.4	-26.7	32.9	0	0	0	110.7	G97 E98 L99	P95-G97 PolarHBondContact O-N 3.45Å; P95-G97 VanDerWaalsContact O-N 3.13Å; P95-E98 HydrophobicContact CB-CB 4.44Å; P95-E98 HydrophobicContact CB-CG 4.45Å; P95-E98 WeakPolarHBondContact CD-OE2 3.32Å; P95-E98 HydrophobicContact CG-CG 4.41Å; P95-E98 WeakPolarHBondContact O-CA 3.38Å; P95-E98 WeakPolarHBondContact O-CB 3.35Å; P95-E98 PolarHBondContact O-N 2.97Å; P95-L99 PolarHBondContact O-N 3.1Å
96	I	87.8	Confident	76	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-56.5	-36	-172.9	-65.4	-63.2	0	0	0	112.8	Y15 T18 F22 V59 D60 Y63 L66 N67 I71 L99 A100	Y15-I96 HydrophobicContact CD2-CD1 3.63Å; Y15-I96 HydrophobicContact CE2-CD1 3.85Å; T18-I96 HydrophobicContact CG2-CD1 4.25Å; T18-I96 HydrophobicContact CG2-CG2 4.21Å; F22-I96 HydrophobicContact CE2-CG2 3.93Å; F22-I96 HydrophobicContact CZ-CG2 4.08Å; V59-I96 HydrophobicContact CG1-CG2 3.81Å; D60-I96 PolarHBondContact OD1-N 3.23Å; Y63-I96 HydrophobicContact CD1-CD1 4.12Å; Y63-I96 HydrophobicContact CD1-CG1 3.75Å; Y63-I96 HydrophobicContact CG-CG1 4.13Å; L66-I96 HydrophobicContact CD2-CD1 4.32Å; L66-I96 HydrophobicContact CD2-CG1 4.45Å; N67-I96 WeakPolarHBondContact OD1-CG1 3.28Å; N67-I96 PolarHBondContact OD1-N 3.33Å; I71-I96 HydrophobicContact CD1-CD1 4.43Å; I71-I96 HydrophobicContact CD1-CG1 4.35Å; I96-L99 HydrophobicContact CD1-CD2 4.3Å; I96-L99 PolarHBondContact O-N 2.84Å; I96-A100 WeakPolarHBondContact O-CB 3.33Å; I96-A100 PolarHBondContact O-N 3.21Å
97	G	87.2	Confident	77.8	Confident	15 Å²	15	58.2 Å²	58.2	16%	0.155	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-43	174	0	0	0	0	0	113.2	D60 P95 A100 V101	D60-G97 PolarHBondContact OD1-N 2.91Å; P95-G97 PolarHBondContact O-N 3.45Å; P95-G97 VanDerWaalsContact O-N 3.13Å; G97-A100 PolarHBondContact O-N 3.3Å; G97-V101 VanDerWaalsContact O-CG2 3.3Å; G97-V101 WeakPolarHBondContact O-CG2 3.36Å; G97-V101 PolarHBondContact O-N 3.25Å
98	E	87	Confident	79.9	Confident	58 Å²	58	49.9 Å²	49.9	27%	0.271	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-40.2	174.6	-74.9	178.9	-155	0	0	111.3	R75 L94 P95 V101 Q102	R75-E98 IonicContact NH1-OE2 2.97Å; R75-E98 PolarHBondContact NH1-OE2 3.26Å; L94-E98 HydrophobicContact CB-CB 3.94Å; L94-E98 HydrophobicContact CD1-CB 4.31Å; P95-E98 HydrophobicContact CB-CB 4.44Å; P95-E98 HydrophobicContact CB-CG 4.45Å; P95-E98 WeakPolarHBondContact CD-OE2 3.32Å; P95-E98 HydrophobicContact CG-CG 4.41Å; P95-E98 WeakPolarHBondContact O-CA 3.38Å; P95-E98 WeakPolarHBondContact O-CB 3.35Å; P95-E98 PolarHBondContact O-N 2.97Å; E98-V101 PolarHBondContact O-N 3Å; E98-Q102 WeakPolarHBondContact O-CB 3.41Å; E98-Q102 PolarHBondContact O-N 3.32Å
99	L	88.7	Confident	81.8	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-50	175.4	176.6	68.6	0	0	0	111	Y15 K19 F22 L94 P95 I96 V101 Q102 T103	Y15-L99 HydrophobicContact CE1-CD2 4.24Å; Y15-L99 HydrophobicContact CE2-CD2 3.91Å; K19-L99 HydrophobicContact CB-CD2 3.99Å; K19-L99 HydrophobicContact CD-CD1 4.27Å; K19-L99 HydrophobicContact CG-CD1 4.22Å; K19-L99 HydrophobicContact CG-CD2 4.4Å; F22-L99 HydrophobicContact CD2-CD2 4.34Å; F22-L99 HydrophobicContact CD2-CG 4.47Å; L94-L99 HydrophobicContact CB-CB 4.35Å; P95-L99 PolarHBondContact O-N 3.1Å; I96-L99 HydrophobicContact CD1-CD2 4.3Å; I96-L99 PolarHBondContact O-N 2.84Å; L99-V101 VanDerWaalsContact C-N 3.31Å; L99-V101 PolarHBondContact O-N 3.17Å; L99-Q102 PolarHBondContact O-N 3.25Å; L99-T103 WeakPolarHBondContact O-CB 3.44Å; L99-T103 PolarHBondContact O-N 3.44Å; L99-T103 PolarHBondContact O-OG1 3.31Å
100	A	91	Very high	83.9	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-45.4	-179.6	0	0	0	0	0	111.8	F22 F52 A56 I96 G97 T103 W104	F22-A100 HydrophobicContact CD1-CB 4.37Å; F22-A100 HydrophobicContact CD2-CB 4.03Å; F22-A100 HydrophobicContact CE1-CB 4.09Å; F22-A100 HydrophobicContact CE2-CB 3.7Å; F22-A100 HydrophobicContact CG-CB 4.36Å; F22-A100 HydrophobicContact CZ-CB 3.74Å; F52-A100 HydrophobicContact CE1-CB 4.14Å; F52-A100 WeakPolarHBondContact CE1-O 3.47Å; F52-A100 HydrophobicContact CZ-CB 3.92Å; F52-A100 WeakPolarHBondContact CZ-O 3.48Å; A56-A100 HydrophobicContact CB-CB 3.61Å; I96-A100 WeakPolarHBondContact O-CB 3.33Å; I96-A100 PolarHBondContact O-N 3.21Å; G97-A100 PolarHBondContact O-N 3.3Å; A100-T103 PolarHBondContact O-N 3.05Å; A100-W104 PolarHBondContact O-N 3.4Å
101	V	90.9	Very high	85.9	Confident	14 Å²	14	36.7 Å²	36.7	9%	0.085	21%	0.209	C	C	.	.	H	α-helix	trans	-65.1	-42.7	177.9	170.5	0	0	0	0	111.8	W49 Y53 G97 E98 L99 W104 Q105 M148	W49-V101 HydrophobicContact CH2-CG1 4.44Å; W49-V101 HydrophobicContact CH2-CG2 4.25Å; Y53-V101 HydrophobicContact CD2-CG2 4.21Å; Y53-V101 HydrophobicContact CE2-CG2 4.08Å; G97-V101 VanDerWaalsContact O-CG2 3.3Å; G97-V101 WeakPolarHBondContact O-CG2 3.36Å; G97-V101 PolarHBondContact O-N 3.25Å; E98-V101 PolarHBondContact O-N 3Å; L99-V101 VanDerWaalsContact C-N 3.31Å; L99-V101 PolarHBondContact O-N 3.17Å; V101-W104 WeakPolarHBondContact O-CB 3.5Å; V101-W104 PolarHBondContact O-N 2.92Å; V101-Q105 PolarHBondContact O-N 2.87Å; V101-M148 VanDerWaalsContact CG1-CA 3.41Å; V101-M148 HydrophobicContact CG1-CB 3.96Å; V101-M148 HydrophobicContact CG1-CG 3.95Å; V101-M148 WeakPolarHBondContact CG1-O 3.37Å
102	Q	89	Confident	87.4	Confident	81 Å²	81	33.3 Å²	33.3	38%	0.379	18%	0.184	S	C	.	.	H	α-helix	trans	-63	-44.8	176.4	-172.5	-174.5	20.1	0	0	111.2	L94 E98 L99 W104 Q105 E106	L94-Q102 HydrophobicContact CD1-CB 4.33Å; E98-Q102 WeakPolarHBondContact O-CB 3.41Å; E98-Q102 PolarHBondContact O-N 3.32Å; L99-Q102 PolarHBondContact O-N 3.25Å; Q102-W104 VanDerWaalsContact C-N 3.31Å; Q102-W104 PolarHBondContact O-N 3.43Å; Q102-Q105 PolarHBondContact O-N 2.92Å; Q102-Q105 VanDerWaalsContact O-N 3.17Å; Q102-E106 WeakPolarHBondContact O-CB 3.43Å; Q102-E106 PolarHBondContact O-N 3.14Å
103	T	90.4	Very high	88.5	Confident	4 Å²	4	30 Å²	30	3%	0.025	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-43.5	175.5	-60.3	0	0	0	0	110.9	F22 E23 V26 L99 A100 Q105 E106 F107	F22-T103 HydrophobicContact CB-CG2 3.99Å; E23-T103 HydrophobicContact CB-CG2 4.34Å; E23-T103 HydrophobicContact CG-CG2 3.71Å; V26-T103 HydrophobicContact CB-CG2 4.36Å; V26-T103 HydrophobicContact CG2-CG2 4.09Å; L99-T103 WeakPolarHBondContact O-CB 3.44Å; L99-T103 PolarHBondContact O-N 3.44Å; L99-T103 PolarHBondContact O-OG1 3.31Å; A100-T103 PolarHBondContact O-N 3.05Å; T103-Q105 PolarHBondContact O-N 3.44Å; T103-E106 PolarHBondContact O-N 3.21Å; T103-F107 HydrophobicContact CG2-CD2 3.66Å; T103-F107 HydrophobicContact CG2-CE2 4.11Å; T103-F107 WeakPolarHBondContact O-CB 3.26Å; T103-F107 VanDerWaalsContact O-CD2 3.32Å; T103-F107 WeakPolarHBondContact O-CD2 3.4Å; T103-F107 PolarHBondContact O-N 3.5Å
104	W	92.6	Very high	89.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.4	-44.6	174.8	-175	-85.9	0	0	0	112.5	V26 V29 Y45 K48 W49 F52 A100 V101 Q102 L108 V109	V26-W104 HydrophobicContact CG2-CE3 3.99Å; V29-W104 HydrophobicContact CG1-CH2 4.05Å; V29-W104 HydrophobicContact CG1-CZ3 4.35Å; Y45-W104 HydrophobicContact CD2-CZ2 4.18Å; Y45-W104 AromaticContact CE2-CE2 3.98Å; Y45-W104 AromaticContact CE2-CZ2 3.85Å; Y45-W104 HydrophobicContact CE2-CZ2 3.85Å; Y45-W104 AromaticContact CE2-NE1 3.51Å; Y45-W104 AromaticContact CZ-NE1 3.83Å; Y45-W104 PolarHBondContact OH-NE1 3.35Å; K48-W104 HydrophobicContact CB-CH2 3.85Å; W49-W104 HydrophobicContact CB-CH2 4.36Å; W49-W104 HydrophobicContact CB-CZ2 3.75Å; W49-W104 AromaticContact CE3-CD1 3.44Å; W49-W104 VanDerWaalsContact CE3-CD1 3.44Å; W49-W104 AromaticContact CE3-CD2 3.64Å; W49-W104 HydrophobicContact CE3-CD2 3.64Å; W49-W104 AromaticContact CE3-CE2 3.42Å; W49-W104 VanDerWaalsContact CE3-CE2 3.42Å; W49-W104 HydrophobicContact CE3-CE3 4.41Å; W49-W104 AromaticContact CE3-CG 3.68Å; W49-W104 HydrophobicContact CE3-CG 3.68Å; W49-W104 HydrophobicContact CE3-CZ2 4.04Å; W49-W104 AromaticContact CE3-NE1 3.25Å; W49-W104 VanDerWaalsContact CE3-NE1 3.25Å; W49-W104 HydrophobicContact CZ3-CB 4.03Å; W49-W104 AromaticContact CZ3-CD1 3.37Å; W49-W104 AromaticContact CZ3-CD2 3.97Å; W49-W104 HydrophobicContact CZ3-CD2 3.97Å; W49-W104 AromaticContact CZ3-CG 3.52Å; W49-W104 HydrophobicContact CZ3-CG 3.52Å; W49-W104 AromaticContact CZ3-NE1 3.73Å; F52-W104 HydrophobicContact CB-CE3 3.93Å; F52-W104 HydrophobicContact CB-CH2 4.27Å; F52-W104 HydrophobicContact CB-CZ3 3.56Å; F52-W104 HydrophobicContact CD1-CB 4.34Å; F52-W104 AromaticContact CD1-CD2 3.93Å; F52-W104 HydrophobicContact CD1-CD2 3.93Å; F52-W104 AromaticContact CD1-CE3 3.29Å; F52-W104 HydrophobicContact CD1-CE3 3.29Å; F52-W104 HydrophobicContact CD1-CG 4.37Å; F52-W104 AromaticContact CD1-CZ3 3.88Å; F52-W104 HydrophobicContact CD1-CZ3 3.88Å; F52-W104 HydrophobicContact CD2-CE3 4.09Å; F52-W104 HydrophobicContact CD2-CZ3 4.19Å; F52-W104 HydrophobicContact CE1-CB 3.83Å; F52-W104 HydrophobicContact CE1-CD2 4.27Å; F52-W104 AromaticContact CE1-CE3 3.73Å; F52-W104 HydrophobicContact CE1-CE3 3.73Å; F52-W104 HydrophobicContact CE1-CG 4.34Å; F52-W104 HydrophobicContact CE2-CE3 4.44Å; F52-W104 HydrophobicContact CG-CD2 4.5Å; F52-W104 AromaticContact CG-CE3 3.49Å; F52-W104 HydrophobicContact CG-CE3 3.49Å; F52-W104 VanDerWaalsContact CG-CE3 3.49Å; F52-W104 AromaticContact CG-CZ3 3.6Å; F52-W104 HydrophobicContact CG-CZ3 3.6Å; F52-W104 HydrophobicContact CZ-CE3 4.27Å; A100-W104 PolarHBondContact O-N 3.4Å; V101-W104 WeakPolarHBondContact O-CB 3.5Å; V101-W104 PolarHBondContact O-N 2.92Å; Q102-W104 VanDerWaalsContact C-N 3.31Å; Q102-W104 PolarHBondContact O-N 3.43Å; W104-L108 HydrophobicContact CD2-CD1 4.23Å; W104-L108 HydrophobicContact CE3-CD1 4.18Å; W104-L108 HydrophobicContact CH2-CD1 3.67Å; W104-L108 HydrophobicContact CZ2-CD1 3.72Å; W104-L108 HydrophobicContact CZ2-CD2 3.86Å; W104-L108 HydrophobicContact CZ2-CG 4.44Å; W104-L108 HydrophobicContact CZ3-CD1 3.91Å; W104-L108 WeakPolarHBondContact O-CB 3.33Å; W104-L108 PolarHBondContact O-N 3.42Å; W104-L108 VanDerWaalsContact O-N 3.15Å; W104-V109 PolarHBondContact O-N 2.96Å; W104-V109 VanDerWaalsContact O-N 3.12Å
105	Q	90.4	Very high	89.7	Confident	37 Å²	37	35.1 Å²	35.1	17%	0.173	19%	0.193	C	C	.	.	I	π-helix	trans	-64	-45.4	179.9	-173.9	-177.3	11.8	0	0	112.4	V101 Q102 T103 T110 M148 F160	V101-Q105 PolarHBondContact O-N 2.87Å; Q102-Q105 PolarHBondContact O-N 2.92Å; Q102-Q105 VanDerWaalsContact O-N 3.17Å; T103-Q105 PolarHBondContact O-N 3.44Å; Q105-T110 WeakPolarHBondContact O-CB 3.32Å; Q105-T110 PolarHBondContact O-N 3.2Å; Q105-T110 PolarHBondContact O-OG1 2.92Å; Q105-M148 HydrophobicContact CB-SD 4.17Å; Q105-M148 HydrophobicContact CG-SD 4.2Å; Q105-F160 HydrophobicContact CG-CE2 4.28Å; Q105-F160 HydrophobicContact CG-CZ 4.19Å
106	E	89.5	Confident	90	Very high	108 Å²	108	33.7 Å²	33.7	51%	0.505	18%	0.184	S	C	.	.	I	π-helix	trans	-72	-47.7	-175.4	-175.7	172.5	-179	0	0	112.1	Q102 T103 P111	Q102-E106 WeakPolarHBondContact O-CB 3.43Å; Q102-E106 PolarHBondContact O-N 3.14Å; T103-E106 PolarHBondContact O-N 3.21Å; E106-P111 WeakPolarHBondContact O-CD 3.44Å
107	F	89.3	Confident	90.2	Very high	45 Å²	45	33.7 Å²	33.7	20%	0.197	18%	0.184	C	C	.	.	I	π-helix	trans	-93.5	-15.7	-169.5	-66.5	-74.6	0	0	0	114.7	E23 V26 H27 T103	E23-F107 HydrophobicContact CG-CD2 4.26Å; E23-F107 HydrophobicContact CG-CE2 3.71Å; E23-F107 HydrophobicContact CG-CZ 4.19Å; V26-F107 HydrophobicContact CG1-CB 3.71Å; H27-F107 AromaticContact CE1-CD1 3.41Å; H27-F107 VanDerWaalsContact CE1-CD1 3.41Å; H27-F107 WeakPolarHBondContact CE1-CD1 3.48Å; H27-F107 AromaticContact NE2-CD1 3.45Å; H27-F107 WeakPolarHBondContact NE2-CD1 3.49Å; H27-F107 AromaticContact NE2-CE1 3.75Å; T103-F107 HydrophobicContact CG2-CD2 3.66Å; T103-F107 HydrophobicContact CG2-CE2 4.11Å; T103-F107 WeakPolarHBondContact O-CB 3.26Å; T103-F107 VanDerWaalsContact O-CD2 3.32Å; T103-F107 WeakPolarHBondContact O-CD2 3.4Å; T103-F107 PolarHBondContact O-N 3.5Å
108	L	89.4	Confident	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.	I	π-helix	trans	-125.8	-51.8	-176.6	-174.8	161.5	0	0	0	112.6	V26 V29 I33 Y45 W104 P111 L112	V26-L108 HydrophobicContact CG1-CB 3.57Å; V26-L108 HydrophobicContact CG1-CD1 4.19Å; V29-L108 HydrophobicContact CB-CD1 3.96Å; V29-L108 HydrophobicContact CG1-CD1 3.55Å; I33-L108 HydrophobicContact CD1-CD1 4.2Å; I33-L108 HydrophobicContact CD1-CD2 4.47Å; Y45-L108 HydrophobicContact CD2-CD2 3.58Å; Y45-L108 HydrophobicContact CE2-CD2 3.52Å; W104-L108 HydrophobicContact CD2-CD1 4.23Å; W104-L108 HydrophobicContact CE3-CD1 4.18Å; W104-L108 HydrophobicContact CH2-CD1 3.67Å; W104-L108 HydrophobicContact CZ2-CD1 3.72Å; W104-L108 HydrophobicContact CZ2-CD2 3.86Å; W104-L108 HydrophobicContact CZ2-CG 4.44Å; W104-L108 HydrophobicContact CZ3-CD1 3.91Å; W104-L108 WeakPolarHBondContact O-CB 3.33Å; W104-L108 PolarHBondContact O-N 3.42Å; W104-L108 VanDerWaalsContact O-N 3.15Å; L108-P111 WeakPolarHBondContact O-CD 3.38Å; L108-L112 HydrophobicContact CD2-CD1 3.94Å; L108-L112 HydrophobicContact CG-CD1 4.15Å; L108-L112 WeakPolarHBondContact O-CB 3.46Å; L108-L112 VanDerWaalsContact O-CG 3.28Å; L108-L112 WeakPolarHBondContact O-CG 3.24Å; L108-L112 PolarHBondContact O-N 2.69Å
109	V	88.9	Confident	90.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-70.6	-48.3	-175	179.8	0	0	0	0	111	Y45 W104 L112 L113 F145 M148 F160	Y45-V109 HydrophobicContact CE2-CG2 4.01Å; W104-V109 PolarHBondContact O-N 2.96Å; W104-V109 VanDerWaalsContact O-N 3.12Å; V109-L112 CarbonylContact O-C 3.54Å; V109-L112 PolarHBondContact O-N 3.12Å; V109-L113 HydrophobicContact CG1-CD1 4.13Å; V109-L113 WeakPolarHBondContact O-CA 2.94Å; V109-L113 VanDerWaalsContact O-CB 3.3Å; V109-L113 WeakPolarHBondContact O-CB 3.46Å; V109-L113 PolarHBondContact O-N 2.56Å; V109-F145 HydrophobicContact CG1-CD1 4.25Å; V109-F145 HydrophobicContact CG1-CE1 3.78Å; V109-M148 HydrophobicContact CB-CE 4.49Å; V109-M148 HydrophobicContact CB-SD 4.46Å; V109-M148 HydrophobicContact CG1-CE 4.46Å; V109-M148 HydrophobicContact CG1-SD 4.36Å; V109-M148 HydrophobicContact CG2-CE 3.42Å; V109-M148 VanDerWaalsContact CG2-CE 3.42Å; V109-M148 HydrophobicContact CG2-SD 3.86Å; V109-F160 HydrophobicContact CG1-CE1 3.94Å; V109-F160 HydrophobicContact CG1-CZ 3.77Å
110	T	89.6	Confident	91	Very high	80 Å²	80	35 Å²	35	49%	0.491	19%	0.194	S	C	.	.	H	α-helix	trans	-58.9	-45.5	-177.5	-57	0	0	0	0	111.9	Q105 L113	Q105-T110 WeakPolarHBondContact O-CB 3.32Å; Q105-T110 PolarHBondContact O-N 3.2Å; Q105-T110 PolarHBondContact O-OG1 2.92Å; T110-L113 WeakPolarHBondContact O-CB 3.46Å
111	P	91.3	Very high	91.1	Very high	69 Å²	69	36.8 Å²	36.8	45%	0.448	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-33.8	175.3	-24.6	36.8	0	0	0	114.7	Y30 E106 L108	Y30-P111 HydrophobicContact CD2-CB 4.37Å; Y30-P111 HydrophobicContact CE2-CB 3.6Å; Y30-P111 HydrophobicContact CE2-CG 4.4Å; E106-P111 WeakPolarHBondContact O-CD 3.44Å; L108-P111 WeakPolarHBondContact O-CD 3.38Å
112	L	91	Very high	91.1	Very high	11 Å²	11	41.6 Å²	41.6	6%	0.058	23%	0.225	C	C	.	.	H	α-helix	trans	-89.1	-5.7	-178.9	-64	178.9	0	0	0	113.6	Y30 I33 I41 L108 V109 D114 S115 M116	Y30-L112 HydrophobicContact CD2-CD1 4.07Å; Y30-L112 HydrophobicContact CD2-CD2 4.06Å; Y30-L112 HydrophobicContact CD2-CG 3.86Å; Y30-L112 HydrophobicContact CE2-CD1 4.4Å; Y30-L112 HydrophobicContact CE2-CD2 3.57Å; Y30-L112 HydrophobicContact CE2-CG 3.72Å; I33-L112 HydrophobicContact CB-CD1 4.22Å; I33-L112 HydrophobicContact CD1-CD1 4.4Å; I33-L112 HydrophobicContact CG2-CD1 3.68Å; I41-L112 HydrophobicContact CD1-CD2 4.24Å; L108-L112 HydrophobicContact CD2-CD1 3.94Å; L108-L112 HydrophobicContact CG-CD1 4.15Å; L108-L112 WeakPolarHBondContact O-CB 3.46Å; L108-L112 VanDerWaalsContact O-CG 3.28Å; L108-L112 WeakPolarHBondContact O-CG 3.24Å; L108-L112 PolarHBondContact O-N 2.69Å; V109-L112 CarbonylContact O-C 3.54Å; V109-L112 PolarHBondContact O-N 3.12Å; L112-D114 PolarHBondContact O-N 3.49Å; L112-S115 PolarHBondContact O-N 3.02Å; L112-S115 VanDerWaalsContact O-N 3.14Å; L112-M116 HydrophobicContact CB-CG 4.19Å; L112-M116 HydrophobicContact CB-SD 3.95Å; L112-M116 WeakPolarHBondContact O-CG 3.32Å; L112-M116 PolarHBondContact O-N 3.41Å
113	L	91.2	Very high	91.3	Very high	24 Å²	24	40.7 Å²	40.7	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-56.9	-48.1	-166	-169.2	64.3	0	0	0	112.9	V109 T110 S115 M116 V117 F145 F160 V164	V109-L113 HydrophobicContact CG1-CD1 4.13Å; V109-L113 WeakPolarHBondContact O-CA 2.94Å; V109-L113 VanDerWaalsContact O-CB 3.3Å; V109-L113 WeakPolarHBondContact O-CB 3.46Å; V109-L113 PolarHBondContact O-N 2.56Å; T110-L113 WeakPolarHBondContact O-CB 3.46Å; L113-S115 VanDerWaalsContact C-N 3.33Å; L113-S115 PolarHBondContact O-N 2.78Å; L113-M116 PolarHBondContact O-N 2.65Å; L113-V117 HydrophobicContact CD1-CG2 4.13Å; L113-V117 HydrophobicContact CG-CG2 4.31Å; L113-V117 WeakPolarHBondContact O-CB 3.39Å; L113-V117 VanDerWaalsContact O-CG2 3.28Å; L113-V117 WeakPolarHBondContact O-CG2 3.25Å; L113-V117 PolarHBondContact O-N 2.97Å; L113-F145 HydrophobicContact CD1-CZ 4.32Å; L113-F160 HydrophobicContact CD1-CZ 4.43Å; L113-V164 HydrophobicContact CD1-CB 3.87Å; L113-V164 HydrophobicContact CD1-CG1 4.18Å; L113-V164 HydrophobicContact CD1-CG2 4.13Å; L113-V164 HydrophobicContact CD2-CB 3.87Å; L113-V164 HydrophobicContact CD2-CG1 3.6Å; L113-V164 HydrophobicContact CG-CB 4.28Å; L113-V164 HydrophobicContact CG-CG1 4.45Å
114	D	91.1	Very high	91.4	Very high	104 Å²	104	40.7 Å²	40.7	56%	0.556	22%	0.22	S	C	*	.	H	α-helix	trans	-66.9	-37	-177.1	-74	-35	0	0	0	111.9	L112 S118 K168	L112-D114 PolarHBondContact O-N 3.49Å; D114-S118 VanDerWaalsContact O-CB 3.23Å; D114-S118 WeakPolarHBondContact O-CB 3.4Å; D114-S118 PolarHBondContact O-N 3.48Å; D114-S118 PolarHBondContact O-OG 2.88Å; D114-K168 IonicContact OD1-NZ 3.97Å; D114-K168 PolarHBondContact OD1-NZ 2.86Å
115	S	91.3	Very high	91.3	Very high	52 Å²	52	44 Å²	44	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-66.8	-47.8	175.2	-175.3	0	0	0	0	111.1	L112 L113 S118 Q119	L112-S115 PolarHBondContact O-N 3.02Å; L112-S115 VanDerWaalsContact O-N 3.14Å; L113-S115 VanDerWaalsContact C-N 3.33Å; L113-S115 PolarHBondContact O-N 2.78Å; S115-S118 PolarHBondContact O-N 3.14Å; S115-Q119 WeakPolarHBondContact O-CG 3.23Å; S115-Q119 PolarHBondContact O-N 2.96Å
116	M	92.2	Very high	91.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-50.2	179.7	-69.9	177.2	67.5	0	0	111.6	I41 L42 Y45 L112 L113 S118 Q119 M120 V141 F145	I41-M116 HydrophobicContact CD1-CG 4.18Å; L42-M116 HydrophobicContact CD2-CB 3.91Å; L42-M116 HydrophobicContact CD2-CE 4.2Å; L42-M116 HydrophobicContact CD2-CG 4.09Å; Y45-M116 HydrophobicContact CD1-CE 3.38Å; Y45-M116 HydrophobicContact CD2-CE 3.67Å; Y45-M116 HydrophobicContact CD2-SD 3.89Å; Y45-M116 HydrophobicContact CE1-CE 3.52Å; Y45-M116 HydrophobicContact CE2-CE 3.8Å; Y45-M116 HydrophobicContact CE2-SD 4.12Å; Y45-M116 HydrophobicContact CG-CE 3.47Å; Y45-M116 VanDerWaalsContact CG-CE 3.47Å; Y45-M116 HydrophobicContact CG-SD 4.16Å; L112-M116 HydrophobicContact CB-CG 4.19Å; L112-M116 HydrophobicContact CB-SD 3.95Å; L112-M116 WeakPolarHBondContact O-CG 3.32Å; L112-M116 PolarHBondContact O-N 3.41Å; L113-M116 PolarHBondContact O-N 2.65Å; M116-S118 VanDerWaalsContact C-N 3.34Å; M116-S118 PolarHBondContact O-N 3.23Å; M116-Q119 PolarHBondContact O-N 3.22Å; M116-M120 WeakPolarHBondContact O-CG 3.33Å; M116-M120 PolarHBondContact O-N 3.11Å; M116-V141 HydrophobicContact CE-CG1 3.64Å; M116-F145 HydrophobicContact CE-CE1 4.12Å; M116-F145 HydrophobicContact CE-CZ 3.92Å
117	V	93.3	Very high	91.5	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-64.5	-41	-178.8	175.5	0	0	0	0	110.9	L113 Q119 M120 L121 F165 K168	L113-V117 HydrophobicContact CD1-CG2 4.13Å; L113-V117 HydrophobicContact CG-CG2 4.31Å; L113-V117 WeakPolarHBondContact O-CB 3.39Å; L113-V117 VanDerWaalsContact O-CG2 3.28Å; L113-V117 WeakPolarHBondContact O-CG2 3.25Å; L113-V117 PolarHBondContact O-N 2.97Å; V117-Q119 VanDerWaalsContact C-N 3.32Å; V117-Q119 PolarHBondContact O-N 2.98Å; V117-M120 PolarHBondContact O-N 3.47Å; V117-L121 HydrophobicContact CG1-CD1 4.06Å; V117-L121 HydrophobicContact CG1-CG 4.26Å; V117-L121 VanDerWaalsContact O-CG 3.29Å; V117-L121 WeakPolarHBondContact O-CG 3.3Å; V117-L121 PolarHBondContact O-N 3Å; V117-F165 HydrophobicContact CG1-CD2 4.35Å; V117-K168 HydrophobicContact CG1-CB 4.33Å; V117-K168 HydrophobicContact CG1-CD 3.73Å
118	S	92.8	Very high	91.6	Very high	74 Å²	74	39.4 Å²	39.4	52%	0.517	22%	0.217	S	C	.	.	H	α-helix	trans	-60.2	-43.1	176.7	-59.5	0	0	0	0	111.8	D114 S115 M116 L121 Q122	D114-S118 VanDerWaalsContact O-CB 3.23Å; D114-S118 WeakPolarHBondContact O-CB 3.4Å; D114-S118 PolarHBondContact O-N 3.48Å; D114-S118 PolarHBondContact O-OG 2.88Å; S115-S118 PolarHBondContact O-N 3.14Å; M116-S118 VanDerWaalsContact C-N 3.34Å; M116-S118 PolarHBondContact O-N 3.23Å; S118-L121 PolarHBondContact O-N 2.95Å; S118-Q122 WeakPolarHBondContact O-CB 3.47Å; S118-Q122 PolarHBondContact O-N 3.43Å
119	Q	91.9	Very high	91.6	Very high	31 Å²	31	44 Å²	44	15%	0.145	24%	0.241	C	C	.	.	H	α-helix	trans	-67.6	-40.4	176.2	-71.8	-169.4	27.1	0	0	112.8	P38 I41 L42 S115 M116 V117 L121 Q122 E123	P38-Q119 PolarHBondContact O-NE2 3.33Å; P38-Q119 PolarHBondContact O-OE1 3.21Å; P38-Q119 VanDerWaalsContact O-OE1 3.08Å; I41-Q119 HydrophobicContact CG2-CG 4.46Å; L42-Q119 HydrophobicContact CD1-CB 4.11Å; L42-Q119 HydrophobicContact CG-CB 4.39Å; S115-Q119 WeakPolarHBondContact O-CG 3.23Å; S115-Q119 PolarHBondContact O-N 2.96Å; M116-Q119 PolarHBondContact O-N 3.22Å; V117-Q119 VanDerWaalsContact C-N 3.32Å; V117-Q119 PolarHBondContact O-N 2.98Å; Q119-L121 VanDerWaalsContact C-N 3.31Å; Q119-L121 PolarHBondContact O-N 3.25Å; Q119-Q122 PolarHBondContact O-N 3.42Å; Q119-E123 WeakPolarHBondContact O-CB 3.39Å; Q119-E123 WeakPolarHBondContact O-CG 3.5Å; Q119-E123 PolarHBondContact O-N 3.33Å
120	M	93.5	Very high	91.5	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-43.1	175.6	-68.4	170.8	76.1	0	0	111.5	L42 M116 V117 E123 I124 L138 V141 I142 F145 F165	L42-M120 HydrophobicContact CD1-CG 3.72Å; L42-M120 HydrophobicContact CD2-CG 3.82Å; L42-M120 HydrophobicContact CD2-SD 4.42Å; L42-M120 HydrophobicContact CG-CG 4.45Å; M116-M120 WeakPolarHBondContact O-CG 3.33Å; M116-M120 PolarHBondContact O-N 3.11Å; V117-M120 PolarHBondContact O-N 3.47Å; M120-E123 PolarHBondContact O-N 3.15Å; M120-I124 WeakPolarHBondContact O-CD1 3.08Å; M120-I124 VanDerWaalsContact O-CG1 3.23Å; M120-I124 WeakPolarHBondContact O-CG1 3.39Å; M120-I124 PolarHBondContact O-N 3.18Å; M120-I124 VanDerWaalsContact O-N 3.11Å; M120-L138 HydrophobicContact CB-CD2 3.9Å; M120-L138 HydrophobicContact CE-CD2 4.4Å; M120-L138 HydrophobicContact CG-CD2 3.76Å; M120-V141 HydrophobicContact CE-CB 4.37Å; M120-V141 HydrophobicContact CE-CG1 4.03Å; M120-V141 HydrophobicContact SD-CG1 3.74Å; M120-I142 HydrophobicContact CE-CD1 4Å; M120-I142 HydrophobicContact CE-CG1 3.5Å; M120-I142 VanDerWaalsContact CE-CG1 3.5Å; M120-F145 HydrophobicContact CE-CE2 4.48Å; M120-F145 HydrophobicContact SD-CE2 4.1Å; M120-F165 HydrophobicContact CB-CD2 4.48Å; M120-F165 HydrophobicContact CB-CE2 3.85Å; M120-F165 HydrophobicContact CE-CD2 3.68Å; M120-F165 HydrophobicContact CE-CE2 3.47Å; M120-F165 VanDerWaalsContact CE-CE2 3.47Å; M120-F165 HydrophobicContact CE-CG 4.36Å; M120-F165 HydrophobicContact CE-CZ 3.99Å; M120-F165 HydrophobicContact SD-CD2 4.02Å; M120-F165 HydrophobicContact SD-CE2 4.11Å
121	L	93.4	Very high	91.5	Very high	37 Å²	37	48.7 Å²	48.7	19%	0.194	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-39.8	177.2	-66	176.9	0	0	0	111.9	V117 S118 Q119 I124 E125 F165 K168 H169 A172	V117-L121 HydrophobicContact CG1-CD1 4.06Å; V117-L121 HydrophobicContact CG1-CG 4.26Å; V117-L121 VanDerWaalsContact O-CG 3.29Å; V117-L121 WeakPolarHBondContact O-CG 3.3Å; V117-L121 PolarHBondContact O-N 3Å; S118-L121 PolarHBondContact O-N 2.95Å; Q119-L121 VanDerWaalsContact C-N 3.31Å; Q119-L121 PolarHBondContact O-N 3.25Å; L121-I124 PolarHBondContact O-N 3.22Å; L121-E125 PolarHBondContact O-N 3.11Å; L121-F165 HydrophobicContact CD2-CE2 4.44Å; L121-K168 HydrophobicContact CD1-CB 4.34Å; L121-H169 HydrophobicContact CD2-CB 3.88Å; L121-A172 HydrophobicContact CD1-CB 4.37Å; L121-A172 HydrophobicContact CD2-CB 4.15Å
122	Q	92.2	Very high	91.2	Very high	115 Å²	115	51 Å²	51	54%	0.537	29%	0.289	S	S	.	.	H	α-helix	trans	-64.2	-44.1	176.3	-172.9	175.9	22.6	0	0	112.1	S118 Q119 I124 E125 N126	S118-Q122 WeakPolarHBondContact O-CB 3.47Å; S118-Q122 PolarHBondContact O-N 3.43Å; Q119-Q122 PolarHBondContact O-N 3.42Å; Q122-I124 VanDerWaalsContact C-N 3.28Å; Q122-I124 PolarHBondContact O-N 3.09Å; Q122-E125 PolarHBondContact O-N 3.34Å; Q122-N126 WeakPolarHBondContact O-CB 3.29Å; Q122-N126 PolarHBondContact O-N 2.93Å; Q122-N126 PolarHBondContact O-ND2 3.02Å
123	E	91.5	Very high	90.9	Very high	63 Å²	63	51.3 Å²	51.3	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-59.6	-39.3	175	-76.2	-63.6	136.1	0	0	111.8	Q119 M120 N126 D127 L138	Q119-E123 WeakPolarHBondContact O-CB 3.39Å; Q119-E123 WeakPolarHBondContact O-CG 3.5Å; Q119-E123 PolarHBondContact O-N 3.33Å; M120-E123 PolarHBondContact O-N 3.15Å; E123-N126 WeakPolarHBondContact O-CB 3.34Å; E123-N126 PolarHBondContact O-N 3.08Å; E123-D127 PolarHBondContact O-N 3.33Å; E123-L138 HydrophobicContact CB-CD1 4.34Å; E123-L138 HydrophobicContact CB-CD2 4.38Å
124	I	92.6	Very high	90.9	Very high	3 Å²	3	53.7 Å²	53.7	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-69.2	-40.3	176.7	-65.4	163.7	0	0	0	111.5	M120 L121 Q122 N126 D127 R128 L138 F165 F211	M120-I124 WeakPolarHBondContact O-CD1 3.08Å; M120-I124 VanDerWaalsContact O-CG1 3.23Å; M120-I124 WeakPolarHBondContact O-CG1 3.39Å; M120-I124 PolarHBondContact O-N 3.18Å; M120-I124 VanDerWaalsContact O-N 3.11Å; L121-I124 PolarHBondContact O-N 3.22Å; Q122-I124 VanDerWaalsContact C-N 3.28Å; Q122-I124 PolarHBondContact O-N 3.09Å; I124-N126 VanDerWaalsContact C-N 3.34Å; I124-D127 PolarHBondContact O-N 3.29Å; I124-R128 WeakPolarHBondContact O-CG 3.44Å; I124-R128 PolarHBondContact O-N 3.49Å; I124-L138 HydrophobicContact CG1-CD1 4.09Å; I124-F165 HydrophobicContact CD1-CE2 4.46Å; I124-F165 HydrophobicContact CD1-CZ 3.97Å; I124-F211 HydrophobicContact CD1-CE2 3.76Å; I124-F211 HydrophobicContact CD1-CZ 3.91Å; I124-F211 HydrophobicContact CG1-CE2 4.25Å; I124-F211 HydrophobicContact CG1-CZ 3.96Å; I124-F211 HydrophobicContact CG2-CZ 4.49Å
125	E	92.2	Very high	90.8	Very high	69 Å²	69	50.5 Å²	50.5	32%	0.322	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-38.4	174.4	-172.4	167.6	-166.6	0	0	111.6	L121 Q122 R128 N129 Y176 R179	L121-E125 PolarHBondContact O-N 3.11Å; Q122-E125 PolarHBondContact O-N 3.34Å; E125-R128 WeakPolarHBondContact O-CB 3.3Å; E125-R128 PolarHBondContact O-N 3.35Å; E125-N129 PolarHBondContact O-N 3.46Å; E125-N129 VanDerWaalsContact O-N 3.11Å; E125-N129 PolarHBondContact O-ND2 2.87Å; E125-N129 VanDerWaalsContact O-ND2 3.14Å; E125-Y176 HydrophobicContact CG-CD2 4.11Å; E125-Y176 HydrophobicContact CG-CE2 4.15Å; E125-R179 IonicContact OE1-NH2 2.72Å; E125-R179 PolarHBondContact OE1-NH2 2.71Å
126	N	91.1	Very high	90.8	Very high	52 Å²	52	56.6 Å²	56.6	28%	0.278	31%	0.308	S	S	.	.	H	α-helix	trans	-61.2	-44.7	172.9	-73.3	-18.1	0	0	0	111.5	Q122 E123 I124 R128 N129 G130 Q131	Q122-N126 WeakPolarHBondContact O-CB 3.29Å; Q122-N126 PolarHBondContact O-N 2.93Å; Q122-N126 PolarHBondContact O-ND2 3.02Å; E123-N126 WeakPolarHBondContact O-CB 3.34Å; E123-N126 PolarHBondContact O-N 3.08Å; I124-N126 VanDerWaalsContact C-N 3.34Å; N126-R128 VanDerWaalsContact C-N 3.28Å; N126-R128 PolarHBondContact O-N 3.27Å; N126-N129 CarbonylContact O-C 3.32Å; N126-N129 WeakPolarHBondContact O-CA 3.37Å; N126-N129 PolarHBondContact O-N 2.84Å; N126-G130 PolarHBondContact O-N 3.37Å; N126-Q131 HydrophobicContact CB-CB 3.96Å; N126-Q131 HydrophobicContact CB-CG 4.35Å; N126-Q131 WeakPolarHBondContact O-CB 3.33Å; N126-Q131 PolarHBondContact O-N 3.34Å
127	D	91.6	Very high	90.9	Very high	21 Å²	21	57.2 Å²	57.2	11%	0.112	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-34.7	174.9	-166.7	67.7	0	0	0	112.5	E123 I124 N129 G130 Q131 A133 H135 R207	E123-D127 PolarHBondContact O-N 3.33Å; I124-D127 PolarHBondContact O-N 3.29Å; D127-N129 VanDerWaalsContact C-N 3.29Å; D127-N129 PolarHBondContact O-N 3.07Å; D127-G130 PolarHBondContact O-N 2.94Å; D127-Q131 WeakPolarHBondContact CA-O 3.39Å; D127-A133 HydrophobicContact CB-CB 3.66Å; D127-H135 VanDerWaalsContact CG-NE2 3.29Å; D127-H135 IonicContact OD1-CE1 3.58Å; D127-H135 PolarHBondContact OD1-CE1 3.49Å; D127-H135 IonicContact OD1-NE2 3.95Å; D127-H135 PolarHBondContact OD1-NE2 3.33Å; D127-H135 IonicContact OD2-NE2 2.97Å; D127-H135 PolarHBondContact OD2-NE2 2.8Å; D127-R207 PolarHBondContact O-NH2 3.47Å; D127-R207 VanDerWaalsContact OD2-CD 3.3Å; D127-R207 WeakPolarHBondContact OD2-CD 3.41Å; D127-R207 WeakPolarHBondContact OD2-CG 3.34Å; D127-R207 IonicContact OD2-CZ 3.52Å; D127-R207 IonicContact OD2-NE 2.67Å; D127-R207 PolarHBondContact OD2-NE 2.91Å; D127-R207 IonicContact OD2-NH2 2.66Å
128	R	90.7	Very high	90.9	Very high	22 Å²	22	57.4 Å²	57.4	8%	0.083	31%	0.313	C	S	.	.	H	α-helix	trans	-66.3	-32.8	173.5	-72.1	166.8	177.6	158.5	6.1	112.7	I124 E125 N126 G130 T173 Y176 E204	I124-R128 WeakPolarHBondContact O-CG 3.44Å; I124-R128 PolarHBondContact O-N 3.49Å; E125-R128 WeakPolarHBondContact O-CB 3.3Å; E125-R128 PolarHBondContact O-N 3.35Å; N126-R128 VanDerWaalsContact C-N 3.28Å; N126-R128 PolarHBondContact O-N 3.27Å; R128-G130 VanDerWaalsContact C-N 3.31Å; R128-T173 PolarHBondContact NH2-OG1 3.47Å; R128-Y176 HydrophobicContact CB-CE1 4.04Å; R128-Y176 HydrophobicContact CB-CE2 4.09Å; R128-Y176 WeakPolarHBondContact CB-OH 3.49Å; R128-Y176 HydrophobicContact CG-CE1 4.2Å; R128-E204 IonicContact CZ-OE1 3.86Å; R128-E204 IonicContact NE-OE1 3.74Å; R128-E204 IonicContact NE-OE2 2.72Å; R128-E204 PolarHBondContact NE-OE2 2.97Å; R128-E204 IonicContact NH2-OE1 3.38Å; R128-E204 PolarHBondContact NH2-OE1 3.43Å; R128-E204 IonicContact NH2-OE2 3.05Å
129	N	89.5	Confident	90.9	Very high	96 Å²	96	56 Å²	56	51%	0.513	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	8.6	178.7	-62	-32.2	0	0	0	113.4	E125 N126 D127 Y176	E125-N129 PolarHBondContact O-N 3.46Å; E125-N129 VanDerWaalsContact O-N 3.11Å; E125-N129 PolarHBondContact O-ND2 2.87Å; E125-N129 VanDerWaalsContact O-ND2 3.14Å; N126-N129 CarbonylContact O-C 3.32Å; N126-N129 WeakPolarHBondContact O-CA 3.37Å; N126-N129 PolarHBondContact O-N 2.84Å; D127-N129 VanDerWaalsContact C-N 3.29Å; D127-N129 PolarHBondContact O-N 3.07Å; N129-Y176 PolarHBondContact OD1-OH 3.25Å
130	G	87.7	Confident	91	Very high	64 Å²	64	55.3 Å²	55.3	66%	0.66	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	10.4	174.5	0	0	0	0	0	115.3	N126 D127 R128	N126-G130 PolarHBondContact O-N 3.37Å; D127-G130 PolarHBondContact O-N 2.94Å; R128-G130 VanDerWaalsContact C-N 3.31Å
131	Q	88.7	Confident	91	Very high	115 Å²	115	55.3 Å²	55.3	54%	0.537	31%	0.305	S	S	.	.			trans	-78.3	147.3	170.3	-61.6	-61.2	-45.5	0	0	110.3	N126 D127 A133	N126-Q131 HydrophobicContact CB-CB 3.96Å; N126-Q131 HydrophobicContact CB-CG 4.35Å; N126-Q131 WeakPolarHBondContact O-CB 3.33Å; N126-Q131 PolarHBondContact O-N 3.34Å; D127-Q131 WeakPolarHBondContact CA-O 3.39Å; Q131-A133 PolarHBondContact O-N 2.98Å
132	P	85.7	Confident	91	Very high	117 Å²	117	53.7 Å²	53.7	76%	0.76	30%	0.296	S	S	*	.			trans	-67.8	119.6	175.9	28.1	-33.1	0	0	0	110.1
133	A	85.9	Confident	91	Very high	17 Å²	17	52.1 Å²	52.1	14%	0.14	29%	0.288	C	S	.	.			trans	-104.3	145.1	172.2	0	0	0	0	0	111.8	D127 Q131 H135	D127-A133 HydrophobicContact CB-CB 3.66Å; Q131-A133 PolarHBondContact O-N 2.98Å; A133-H135 PolarHBondContact O-N 3.5Å; A133-H135 VanDerWaalsContact O-N 3.08Å
134	D	89.4	Confident	91	Very high	75 Å²	75	49.1 Å²	49.1	40%	0.401	27%	0.274	S	S	.	.			trans	-83.6	80.3	175.2	-173.4	1.8	0	0	0	111.2	K136 T137 L138	D134-K136 PolarHBondContact O-N 2.96Å; D134-K136 VanDerWaalsContact O-N 3.14Å; D134-K136 WeakPolarHBondContact OD1-CB 3.45Å; D134-K136 PolarHBondContact OD1-N 3.41Å; D134-T137 PolarHBondContact O-N 3.42Å; D134-T137 PolarHBondContact OD1-N 2.88Å; D134-T137 VanDerWaalsContact OD2-CB 3.25Å; D134-T137 WeakPolarHBondContact OD2-CB 3.3Å; D134-T137 PolarHBondContact OD2-OG1 3.06Å; D134-L138 PolarHBondContact O-N 3.49Å; D134-L138 VanDerWaalsContact O-N 3.12Å
135	H	90.3	Very high	90.9	Very high	37 Å²	37	49 Å²	49	17%	0.171	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-25.9	178.9	-54.8	127.7	0	0	0	112.9	D127 A133 S139 K210	D127-H135 VanDerWaalsContact CG-NE2 3.29Å; D127-H135 IonicContact OD1-CE1 3.58Å; D127-H135 PolarHBondContact OD1-CE1 3.49Å; D127-H135 IonicContact OD1-NE2 3.95Å; D127-H135 PolarHBondContact OD1-NE2 3.33Å; D127-H135 IonicContact OD2-NE2 2.97Å; D127-H135 PolarHBondContact OD2-NE2 2.8Å; A133-H135 PolarHBondContact O-N 3.5Å; A133-H135 VanDerWaalsContact O-N 3.08Å; H135-S139 VanDerWaalsContact O-CB 3.24Å; H135-S139 WeakPolarHBondContact O-CB 3.27Å; H135-S139 PolarHBondContact O-N 3.42Å; H135-K210 HydrophobicContact CB-CB 4.05Å; H135-K210 VanDerWaalsContact ND1-CD 3.33Å; H135-K210 WeakPolarHBondContact ND1-CD 3.38Å
136	K	91.6	Very high	90.8	Very high	179 Å²	179	45.8 Å²	45.8	78%	0.778	26%	0.259	S	S	*	.	H	α-helix	trans	-70.4	-46.1	178.4	-67	-176.7	179.6	179.8	0	111	D134 S139 G140	D134-K136 PolarHBondContact O-N 2.96Å; D134-K136 VanDerWaalsContact O-N 3.14Å; D134-K136 WeakPolarHBondContact OD1-CB 3.45Å; D134-K136 PolarHBondContact OD1-N 3.41Å; K136-S139 PolarHBondContact O-N 3.29Å; K136-G140 PolarHBondContact O-N 3.11Å
137	T	92.7	Very high	90.7	Very high	14 Å²	14	44.6 Å²	44.6	9%	0.086	25%	0.253	C	S	.	.	H	α-helix	trans	-63.3	-44.8	176.2	-67	0	0	0	0	110.6	L42 L46 D134 S139 G140 V141	L42-T137 HydrophobicContact CB-CG2 3.72Å; L46-T137 HydrophobicContact CD2-CG2 4.3Å; D134-T137 PolarHBondContact O-N 3.42Å; D134-T137 PolarHBondContact OD1-N 2.88Å; D134-T137 VanDerWaalsContact OD2-CB 3.25Å; D134-T137 WeakPolarHBondContact OD2-CB 3.3Å; D134-T137 PolarHBondContact OD2-OG1 3.06Å; T137-S139 PolarHBondContact O-N 2.94Å; T137-G140 PolarHBondContact O-N 2.98Å; T137-V141 HydrophobicContact CG2-CG2 4.32Å; T137-V141 VanDerWaalsContact O-CG2 3.27Å; T137-V141 WeakPolarHBondContact O-CG2 3.44Å; T137-V141 PolarHBondContact O-N 3.22Å
138	L	92.9	Very high	90.4	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-58	-48.5	176	-68.9	175.6	0	0	0	112.1	L42 M120 E123 I124 D134 G140 V141 I142 F211	L42-L138 HydrophobicContact CD1-CD2 4.23Å; M120-L138 HydrophobicContact CB-CD2 3.9Å; M120-L138 HydrophobicContact CE-CD2 4.4Å; M120-L138 HydrophobicContact CG-CD2 3.76Å; E123-L138 HydrophobicContact CB-CD1 4.34Å; E123-L138 HydrophobicContact CB-CD2 4.38Å; I124-L138 HydrophobicContact CG1-CD1 4.09Å; D134-L138 PolarHBondContact O-N 3.49Å; D134-L138 VanDerWaalsContact O-N 3.12Å; L138-G140 PolarHBondContact O-N 3.24Å; L138-V141 PolarHBondContact O-N 2.88Å; L138-I142 WeakPolarHBondContact O-CD1 3.27Å; L138-I142 VanDerWaalsContact O-CG1 3.3Å; L138-I142 WeakPolarHBondContact O-CG1 3.32Å; L138-I142 PolarHBondContact O-N 3.26Å; L138-F211 HydrophobicContact CB-CB 4.11Å; L138-F211 HydrophobicContact CB-CG 4.43Å
139	S	93.6	Very high	90.1	Very high	45 Å²	45	43.5 Å²	43.5	32%	0.315	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-44.1	177.9	-175.8	0	0	0	0	111.9	H135 K136 T137 I142 Q143	H135-S139 VanDerWaalsContact O-CB 3.24Å; H135-S139 WeakPolarHBondContact O-CB 3.27Å; H135-S139 PolarHBondContact O-N 3.42Å; K136-S139 PolarHBondContact O-N 3.29Å; T137-S139 PolarHBondContact O-N 2.94Å; S139-I142 PolarHBondContact O-N 2.86Å; S139-Q143 WeakPolarHBondContact O-CB 3.31Å; S139-Q143 PolarHBondContact O-N 3.05Å
140	G	93.6	Very high	89.6	Confident	17 Å²	17	41.5 Å²	41.5	18%	0.175	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-41.3	178	0	0	0	0	0	113.2	L46 K136 T137 L138 Q143 S144	L46-G140 VanDerWaalsContact CD1-C 3.48Å; K136-G140 PolarHBondContact O-N 3.11Å; T137-G140 PolarHBondContact O-N 2.98Å; L138-G140 PolarHBondContact O-N 3.24Å; G140-Q143 PolarHBondContact O-N 3.41Å; G140-S144 PolarHBondContact O-N 2.66Å
141	V	93.9	Very high	88.9	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-44.3	176.2	175.6	0	0	0	0	110.7	L42 Y45 L46 M116 M120 T137 L138 Q143 S144 F145	L42-V141 HydrophobicContact CB-CG2 4.35Å; L42-V141 HydrophobicContact CD2-CG2 4.35Å; Y45-V141 HydrophobicContact CD1-CG1 4.44Å; Y45-V141 HydrophobicContact CD1-CG2 3.93Å; Y45-V141 HydrophobicContact CE1-CG1 4.16Å; Y45-V141 HydrophobicContact CE1-CG2 4.23Å; L46-V141 HydrophobicContact CB-CG2 4.37Å; M116-V141 HydrophobicContact CE-CG1 3.64Å; M120-V141 HydrophobicContact CE-CB 4.37Å; M120-V141 HydrophobicContact CE-CG1 4.03Å; M120-V141 HydrophobicContact SD-CG1 3.74Å; T137-V141 HydrophobicContact CG2-CG2 4.32Å; T137-V141 VanDerWaalsContact O-CG2 3.27Å; T137-V141 WeakPolarHBondContact O-CG2 3.44Å; T137-V141 PolarHBondContact O-N 3.22Å; L138-V141 PolarHBondContact O-N 2.88Å; V141-Q143 VanDerWaalsContact C-N 3.32Å; V141-Q143 PolarHBondContact O-N 3.1Å; V141-S144 WeakPolarHBondContact O-CB 3.4Å; V141-S144 PolarHBondContact O-N 3.04Å; V141-S144 VanDerWaalsContact O-N 3.14Å; V141-S144 PolarHBondContact O-OG 2.84Å; V141-F145 HydrophobicContact CG1-CE1 4.23Å; V141-F145 HydrophobicContact CG1-CE2 3.92Å; V141-F145 HydrophobicContact CG1-CZ 3.71Å; V141-F145 PolarHBondContact O-N 2.61Å
142	I	93.1	Very high	88.2	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-44.1	176.2	-71.2	162.7	0	0	0	110.8	M120 L138 S139 S144 F145 I146 Y161 F165 F211 L212	M120-I142 HydrophobicContact CE-CD1 4Å; M120-I142 HydrophobicContact CE-CG1 3.5Å; M120-I142 VanDerWaalsContact CE-CG1 3.5Å; L138-I142 WeakPolarHBondContact O-CD1 3.27Å; L138-I142 VanDerWaalsContact O-CG1 3.3Å; L138-I142 WeakPolarHBondContact O-CG1 3.32Å; L138-I142 PolarHBondContact O-N 3.26Å; S139-I142 PolarHBondContact O-N 2.86Å; I142-S144 VanDerWaalsContact C-N 3.25Å; I142-S144 PolarHBondContact O-N 3.23Å; I142-F145 PolarHBondContact O-N 3.26Å; I142-F145 VanDerWaalsContact O-N 3.15Å; I142-I146 HydrophobicContact CG2-CD1 3.8Å; I142-I146 WeakPolarHBondContact O-CG1 3.29Å; I142-I146 PolarHBondContact O-N 3.44Å; I142-I146 VanDerWaalsContact O-N 3.13Å; I142-Y161 HydrophobicContact CG1-CE2 4.42Å; I142-Y161 HydrophobicContact CG2-CD2 3.82Å; I142-Y161 HydrophobicContact CG2-CE2 3.53Å; I142-F165 HydrophobicContact CD1-CE1 3.96Å; I142-F165 HydrophobicContact CD1-CZ 4.17Å; I142-F165 HydrophobicContact CG1-CD1 4.47Å; I142-F165 HydrophobicContact CG1-CE1 4.28Å; I142-F211 HydrophobicContact CD1-CB 4.37Å; I142-F211 HydrophobicContact CD1-CD2 3.68Å; I142-F211 WeakPolarHBondContact CD1-O 3.47Å; I142-L212 HydrophobicContact CD1-CD2 3.95Å
143	Q	91.7	Very high	87.7	Confident	82 Å²	82	38.9 Å²	38.9	38%	0.383	21%	0.214	S	C	.	.	H	α-helix	trans	-60.2	-38.2	176.7	-169.3	57.4	52	0	0	111.1	S139 G140 V141 F145 I146 D147	S139-Q143 WeakPolarHBondContact O-CB 3.31Å; S139-Q143 PolarHBondContact O-N 3.05Å; G140-Q143 PolarHBondContact O-N 3.41Å; V141-Q143 VanDerWaalsContact C-N 3.32Å; V141-Q143 PolarHBondContact O-N 3.1Å; Q143-F145 PolarHBondContact O-N 3.08Å; Q143-I146 WeakPolarHBondContact O-CB 3.3Å; Q143-I146 PolarHBondContact O-N 2.73Å; Q143-D147 PolarHBondContact NE2-OD1 3.45Å; Q143-D147 WeakPolarHBondContact O-CB 3.39Å; Q143-D147 PolarHBondContact O-N 3.04Å
144	S	92.3	Very high	86.9	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-44.6	174.3	82	0	0	0	0	112.8	Y45 G140 V141 I142 I146 D147 M148	Y45-S144 WeakPolarHBondContact CE1-OG 3.22Å; Y45-S144 PolarHBondContact OH-OG 2.82Å; G140-S144 PolarHBondContact O-N 2.66Å; V141-S144 WeakPolarHBondContact O-CB 3.4Å; V141-S144 PolarHBondContact O-N 3.04Å; V141-S144 VanDerWaalsContact O-N 3.14Å; V141-S144 PolarHBondContact O-OG 2.84Å; I142-S144 VanDerWaalsContact C-N 3.25Å; I142-S144 PolarHBondContact O-N 3.23Å; S144-I146 PolarHBondContact O-N 3.15Å; S144-D147 PolarHBondContact O-N 2.74Å; S144-M148 VanDerWaalsContact O-CG 3.31Å; S144-M148 WeakPolarHBondContact O-CG 3.19Å; S144-M148 PolarHBondContact O-N 2.95Å
145	F	91.6	Very high	86	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.7	-31.6	178.5	-62.7	-22	0	0	0	112.5	V109 L113 M116 M120 V141 I142 Q143 M148 F160 V164	V109-F145 HydrophobicContact CG1-CD1 4.25Å; V109-F145 HydrophobicContact CG1-CE1 3.78Å; L113-F145 HydrophobicContact CD1-CZ 4.32Å; M116-F145 HydrophobicContact CE-CE1 4.12Å; M116-F145 HydrophobicContact CE-CZ 3.92Å; M120-F145 HydrophobicContact CE-CE2 4.48Å; M120-F145 HydrophobicContact SD-CE2 4.1Å; V141-F145 HydrophobicContact CG1-CE1 4.23Å; V141-F145 HydrophobicContact CG1-CE2 3.92Å; V141-F145 HydrophobicContact CG1-CZ 3.71Å; V141-F145 PolarHBondContact O-N 2.61Å; I142-F145 PolarHBondContact O-N 3.26Å; I142-F145 VanDerWaalsContact O-N 3.15Å; Q143-F145 PolarHBondContact O-N 3.08Å; F145-M148 HydrophobicContact CD1-CE 4.05Å; F145-M148 HydrophobicContact CD1-SD 4.45Å; F145-F160 HydrophobicContact CB-CD1 3.97Å; F145-F160 HydrophobicContact CB-CE1 4.25Å; F145-F160 HydrophobicContact CD1-CD1 4.46Å; F145-F160 AromaticContact CD1-CE1 3.88Å; F145-F160 HydrophobicContact CD1-CE1 3.88Å; F145-F160 HydrophobicContact CG-CD1 4.39Å; F145-F160 HydrophobicContact CG-CE1 4.17Å; F145-V164 HydrophobicContact CD2-CG2 4.13Å; F145-V164 HydrophobicContact CE2-CG2 4.4Å
146	I	89.6	Confident	85.4	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.015	26%	0.261	C	S	.	.	H	α-helix	trans	-75.4	-41.7	176.7	-71.7	170.5	0	0	0	110.6	I142 Q143 S144 M148 N149 K157 Y158 Y161 P213	I142-I146 HydrophobicContact CG2-CD1 3.8Å; I142-I146 WeakPolarHBondContact O-CG1 3.29Å; I142-I146 PolarHBondContact O-N 3.44Å; I142-I146 VanDerWaalsContact O-N 3.13Å; Q143-I146 WeakPolarHBondContact O-CB 3.3Å; Q143-I146 PolarHBondContact O-N 2.73Å; S144-I146 PolarHBondContact O-N 3.15Å; I146-M148 VanDerWaalsContact C-N 3.3Å; I146-M148 PolarHBondContact O-N 3.14Å; I146-N149 PolarHBondContact O-N 2.82Å; I146-K157 HydrophobicContact CG2-CD 4.08Å; I146-K157 HydrophobicContact CG2-CG 3.89Å; I146-K157 WeakPolarHBondContact O-CG 3.39Å; I146-Y158 HydrophobicContact CD1-CD1 4.29Å; I146-Y158 HydrophobicContact CD1-CE1 4.07Å; I146-Y158 HydrophobicContact CG1-CD1 4.2Å; I146-Y158 HydrophobicContact CG1-CE1 4.35Å; I146-Y158 HydrophobicContact CG2-CE1 4.27Å; I146-Y161 HydrophobicContact CD1-CG 4.42Å; I146-Y161 HydrophobicContact CG1-CD2 4.34Å; I146-Y161 HydrophobicContact CG1-CG 3.98Å; I146-P213 HydrophobicContact CD1-CG 3.52Å
147	D	88	Confident	84.9	Confident	27 Å²	27	41 Å²	41	14%	0.144	23%	0.234	C	C	.	.	H	α-helix	trans	-69.4	-29.5	-179.2	-69	-21.3	0	0	0	112.2	W49 Q143 S144 N149 S150 K157	W49-D147 HydrophobicContact CZ2-CB 4.21Å; Q143-D147 PolarHBondContact NE2-OD1 3.45Å; Q143-D147 WeakPolarHBondContact O-CB 3.39Å; Q143-D147 PolarHBondContact O-N 3.04Å; S144-D147 PolarHBondContact O-N 2.74Å; D147-N149 PolarHBondContact O-N 2.8Å; D147-S150 VanDerWaalsContact O-CB 3.25Å; D147-S150 WeakPolarHBondContact O-CB 3.39Å; D147-S150 PolarHBondContact O-N 3.36Å; D147-S150 VanDerWaalsContact O-N 3.09Å; D147-S150 PolarHBondContact O-OG 2.82Å; D147-K157 IonicContact OD1-NZ 3.42Å
148	M	86.4	Confident	84.6	Confident	5 Å²	5	44 Å²	44	3%	0.025	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.2	176	-76.6	170	-148	0	0	114	Y45 W49 V101 Q105 V109 S144 F145 I146 F160	Y45-M148 WeakPolarHBondContact OH-CE 3.48Å; W49-M148 HydrophobicContact CE3-CE 4.49Å; W49-M148 HydrophobicContact CH2-CE 4.26Å; W49-M148 HydrophobicContact CH2-CG 3.9Å; W49-M148 HydrophobicContact CZ2-CG 4.45Å; W49-M148 HydrophobicContact CZ3-CE 4.25Å; W49-M148 HydrophobicContact CZ3-CG 4.49Å; V101-M148 VanDerWaalsContact CG1-CA 3.41Å; V101-M148 HydrophobicContact CG1-CB 3.96Å; V101-M148 HydrophobicContact CG1-CG 3.95Å; V101-M148 WeakPolarHBondContact CG1-O 3.37Å; Q105-M148 HydrophobicContact CB-SD 4.17Å; Q105-M148 HydrophobicContact CG-SD 4.2Å; V109-M148 HydrophobicContact CB-CE 4.49Å; V109-M148 HydrophobicContact CB-SD 4.46Å; V109-M148 HydrophobicContact CG1-CE 4.46Å; V109-M148 HydrophobicContact CG1-SD 4.36Å; V109-M148 HydrophobicContact CG2-CE 3.42Å; V109-M148 VanDerWaalsContact CG2-CE 3.42Å; V109-M148 HydrophobicContact CG2-SD 3.86Å; S144-M148 VanDerWaalsContact O-CG 3.31Å; S144-M148 WeakPolarHBondContact O-CG 3.19Å; S144-M148 PolarHBondContact O-N 2.95Å; F145-M148 HydrophobicContact CD1-CE 4.05Å; F145-M148 HydrophobicContact CD1-SD 4.45Å; I146-M148 VanDerWaalsContact C-N 3.3Å; I146-M148 PolarHBondContact O-N 3.14Å; M148-F160 HydrophobicContact SD-CD1 4.42Å; M148-F160 HydrophobicContact SD-CE1 4.03Å
149	N	83.6	Confident	84.2	Confident	15 Å²	15	52.3 Å²	52.3	8%	0.08	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	14	179.9	-87.8	8.5	0	0	0	113.3	I146 D147 S151 Y152 G156 K157 F160	I146-N149 PolarHBondContact O-N 2.82Å; D147-N149 PolarHBondContact O-N 2.8Å; N149-S151 PolarHBondContact O-N 3.43Å; N149-S151 VanDerWaalsContact O-N 3.1Å; N149-Y152 HydrophobicContact CB-CD2 4.01Å; N149-Y152 PolarHBondContact O-N 3.18Å; N149-G156 WeakPolarHBondContact CB-O 3.23Å; N149-G156 PolarHBondContact ND2-O 2.9Å; N149-K157 WeakPolarHBondContact CB-O 3.44Å; N149-K157 WeakPolarHBondContact O-CA 3.29Å; N149-F160 VanDerWaalsContact ND2-CB 3.34Å; N149-F160 WeakPolarHBondContact ND2-CB 3.35Å; N149-F160 PolarHBondContact ND2-N 3.35Å
150	S	79.2	Confident	83.8	Confident	54 Å²	54	51.3 Å²	51.3	38%	0.378	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-58.7	-25.5	-175.4	57	0	0	0	0	114.2	D147	D147-S150 VanDerWaalsContact O-CB 3.25Å; D147-S150 WeakPolarHBondContact O-CB 3.39Å; D147-S150 PolarHBondContact O-N 3.36Å; D147-S150 VanDerWaalsContact O-N 3.09Å; D147-S150 PolarHBondContact O-OG 2.82Å
151	S	73.7	Confident	83.7	Confident	54 Å²	54	50.5 Å²	50.5	38%	0.378	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-74.5	-18.2	177.7	56.8	0	0	0	0	114.3	N149 G153	N149-S151 PolarHBondContact O-N 3.43Å; N149-S151 VanDerWaalsContact O-N 3.1Å; S151-G153 PolarHBondContact O-N 3.38Å
152	Y	72.8	Confident	83.4	Confident	146 Å²	146	51.2 Å²	51.2	57%	0.573	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-85	19.3	-176.8	-63.8	-79.7	0	0	0	114.1	N149 G156	N149-Y152 HydrophobicContact CB-CD2 4.01Å; N149-Y152 PolarHBondContact O-N 3.18Å; Y152-G156 PolarHBondContact O-N 3.15Å
153	G	75.3	Confident	83.2	Confident	40 Å²	40	56.6 Å²	56.6	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	69.9	-178.7	-176.3	0	0	0	0	0	113.4	S151 V155 G156 K157	S151-G153 PolarHBondContact O-N 3.38Å; G153-V155 VanDerWaalsContact C-N 3.33Å; G153-V155 PolarHBondContact O-N 3.13Å; G153-G156 PolarHBondContact O-N 3.44Å; G153-K157 WeakPolarHBondContact O-CB 3.43Å; G153-K157 PolarHBondContact O-N 3.5Å
154	Q	70.7	Confident	83	Confident	154 Å²	154	53.3 Å²	53.3	72%	0.72	28%	0.278	S	S	*	.	H	α-helix	trans	-60.2	-38.6	-169.7	-67.4	-62.4	-31.5	0	0	113.7
155	V	70.4	Confident	83	Confident	137 Å²	137	53.3 Å²	53.3	83%	0.83	28%	0.278	S	S	*	.	H	α-helix	trans	-78.5	-39.4	179.7	-177.3	0	0	0	0	111.4	G153 K157	G153-V155 VanDerWaalsContact C-N 3.33Å; G153-V155 PolarHBondContact O-N 3.13Å; V155-K157 VanDerWaalsContact C-N 3.33Å; V155-K157 PolarHBondContact O-N 3.42Å
156	G	77.1	Confident	83	Confident	16 Å²	16	54 Å²	54	17%	0.165	28%	0.282	C	S	.	.	H	α-helix	trans	-70.9	-28.5	-178.9	0	0	0	0	0	113.6	N149 Y152 G153 Y158 R159	N149-G156 WeakPolarHBondContact CB-O 3.23Å; N149-G156 PolarHBondContact ND2-O 2.9Å; Y152-G156 PolarHBondContact O-N 3.15Å; G153-G156 PolarHBondContact O-N 3.44Å; G156-Y158 VanDerWaalsContact C-N 3.29Å; G156-Y158 PolarHBondContact O-N 2.94Å; G156-R159 VanDerWaalsContact O-CB 3.28Å; G156-R159 WeakPolarHBondContact O-CB 3.45Å; G156-R159 PolarHBondContact O-N 3.15Å
157	K	81.4	Confident	83.1	Confident	47 Å²	47	56.7 Å²	56.7	20%	0.204	30%	0.304	C	S	.	.	H	α-helix	trans	-54.9	-38.7	-178.6	-176.3	169.8	177	168.3	0	113.7	I146 D147 N149 G153 V155	I146-K157 HydrophobicContact CG2-CD 4.08Å; I146-K157 HydrophobicContact CG2-CG 3.89Å; I146-K157 WeakPolarHBondContact O-CG 3.39Å; D147-K157 IonicContact OD1-NZ 3.42Å; N149-K157 WeakPolarHBondContact CB-O 3.44Å; N149-K157 WeakPolarHBondContact O-CA 3.29Å; G153-K157 WeakPolarHBondContact O-CB 3.43Å; G153-K157 PolarHBondContact O-N 3.5Å; V155-K157 VanDerWaalsContact C-N 3.33Å; V155-K157 PolarHBondContact O-N 3.42Å
158	Y	84.9	Confident	83.3	Confident	77 Å²	77	59.3 Å²	59.3	30%	0.302	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.6	-179.2	-62.4	-77.7	0	0	0	114.1	I146 G156 F160 Y161 G162 P213	I146-Y158 HydrophobicContact CD1-CD1 4.29Å; I146-Y158 HydrophobicContact CD1-CE1 4.07Å; I146-Y158 HydrophobicContact CG1-CD1 4.2Å; I146-Y158 HydrophobicContact CG1-CE1 4.35Å; I146-Y158 HydrophobicContact CG2-CE1 4.27Å; G156-Y158 VanDerWaalsContact C-N 3.29Å; G156-Y158 PolarHBondContact O-N 2.94Å; Y158-F160 PolarHBondContact O-N 3.46Å; Y158-Y161 HydrophobicContact CD1-CD1 4.33Å; Y158-G162 PolarHBondContact O-N 2.81Å; Y158-P213 HydrophobicContact CE1-CB 4.33Å; Y158-P213 HydrophobicContact CE1-CG 4.3Å
159	R	85.5	Confident	83.7	Confident	178 Å²	178	59.1 Å²	59.1	67%	0.672	31%	0.313	S	S	*	.	H	α-helix	trans	-63.4	-44	-172.8	-173.2	179.7	-179.9	-171.1	-0.4	112.8	G156 N163	G156-R159 VanDerWaalsContact O-CB 3.28Å; G156-R159 WeakPolarHBondContact O-CB 3.45Å; G156-R159 PolarHBondContact O-N 3.15Å; R159-N163 WeakPolarHBondContact O-CB 3.29Å; R159-N163 VanDerWaalsContact O-CG 3.25Å; R159-N163 PolarHBondContact O-N 2.76Å; R159-N163 VanDerWaalsContact O-N 3.16Å; R159-N163 PolarHBondContact O-ND2 3.28Å
160	F	86	Confident	84.1	Confident	23 Å²	23	59.8 Å²	59.8	10%	0.101	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-55.7	179.9	-177	-108.8	0	0	0	110.5	Q105 V109 L113 F145 M148 N149 Y158 G162 N163 V164	Q105-F160 HydrophobicContact CG-CE2 4.28Å; Q105-F160 HydrophobicContact CG-CZ 4.19Å; V109-F160 HydrophobicContact CG1-CE1 3.94Å; V109-F160 HydrophobicContact CG1-CZ 3.77Å; L113-F160 HydrophobicContact CD1-CZ 4.43Å; F145-F160 HydrophobicContact CB-CD1 3.97Å; F145-F160 HydrophobicContact CB-CE1 4.25Å; F145-F160 HydrophobicContact CD1-CD1 4.46Å; F145-F160 AromaticContact CD1-CE1 3.88Å; F145-F160 HydrophobicContact CD1-CE1 3.88Å; F145-F160 HydrophobicContact CG-CD1 4.39Å; F145-F160 HydrophobicContact CG-CE1 4.17Å; M148-F160 HydrophobicContact SD-CD1 4.42Å; M148-F160 HydrophobicContact SD-CE1 4.03Å; N149-F160 VanDerWaalsContact ND2-CB 3.34Å; N149-F160 WeakPolarHBondContact ND2-CB 3.35Å; N149-F160 PolarHBondContact ND2-N 3.35Å; Y158-F160 PolarHBondContact O-N 3.46Å; F160-G162 VanDerWaalsContact C-N 3.26Å; F160-G162 PolarHBondContact O-N 3.46Å; F160-N163 PolarHBondContact O-N 3.19Å; F160-N163 VanDerWaalsContact O-N 3.12Å; F160-V164 HydrophobicContact CD1-CG2 4.25Å; F160-V164 HydrophobicContact CD2-CG1 3.85Å; F160-V164 HydrophobicContact CE1-CG1 4.27Å; F160-V164 HydrophobicContact CE1-CG2 4.11Å; F160-V164 HydrophobicContact CE2-CG1 3.56Å; F160-V164 HydrophobicContact CG-CG1 4.33Å; F160-V164 HydrophobicContact CZ-CG1 3.8Å; F160-V164 HydrophobicContact CZ-CG2 4.42Å; F160-V164 WeakPolarHBondContact O-CG1 3.34Å; F160-V164 VanDerWaalsContact O-CG2 3.24Å; F160-V164 WeakPolarHBondContact O-CG2 3.39Å; F160-V164 PolarHBondContact O-N 3.05Å
161	Y	90.4	Very high	84.8	Confident	1 Å²	1	62.5 Å²	62.5	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-48	-46.6	173	161.7	-99.1	0	0	0	113.1	I142 I146 Y158 N163 F165 E166 S216	I142-Y161 HydrophobicContact CG1-CE2 4.42Å; I142-Y161 HydrophobicContact CG2-CD2 3.82Å; I142-Y161 HydrophobicContact CG2-CE2 3.53Å; I146-Y161 HydrophobicContact CD1-CG 4.42Å; I146-Y161 HydrophobicContact CG1-CD2 4.34Å; I146-Y161 HydrophobicContact CG1-CG 3.98Å; Y158-Y161 HydrophobicContact CD1-CD1 4.33Å; Y161-N163 PolarHBondContact O-N 2.59Å; Y161-F165 HydrophobicContact CD2-CB 4.35Å; Y161-F165 HydrophobicContact CD2-CD1 4.14Å; Y161-F165 HydrophobicContact CE2-CB 4.47Å; Y161-F165 AromaticContact CE2-CD1 3.46Å; Y161-F165 HydrophobicContact CE2-CD1 3.46Å; Y161-F165 VanDerWaalsContact CE2-CD1 3.46Å; Y161-F165 HydrophobicContact CE2-CE1 4.14Å; Y161-F165 HydrophobicContact CE2-CG 4.36Å; Y161-F165 PolarHBondContact O-N 2.99Å; Y161-E166 HydrophobicContact CD1-CB 4.39Å; Y161-E166 HydrophobicContact CE1-CB 3.84Å; Y161-E166 HydrophobicContact CE1-CG 4.19Å; Y161-E166 PolarHBondContact O-N 3.45Å; Y161-S216 VanDerWaalsContact CE1-OG 3.29Å; Y161-S216 WeakPolarHBondContact CE1-OG 3.47Å; Y161-S216 VanDerWaalsContact OH-CB 3.29Å; Y161-S216 WeakPolarHBondContact OH-CB 3.47Å; Y161-S216 PolarHBondContact OH-OG 3.03Å
162	G	87.9	Confident	85.7	Confident	14 Å²	14	61.4 Å²	61.4	14%	0.144	32%	0.317	C	S	.	.	I	π-helix	trans	-59.3	-45.4	-179.7	0	0	0	0	0	112.9	Y158 F160 A167	Y158-G162 PolarHBondContact O-N 2.81Å; F160-G162 VanDerWaalsContact C-N 3.26Å; F160-G162 PolarHBondContact O-N 3.46Å; G162-A167 PolarHBondContact O-N 3.5Å; G162-A167 VanDerWaalsContact O-N 3.13Å
163	N	87.8	Confident	86.6	Confident	115 Å²	115	54.5 Å²	54.5	62%	0.615	29%	0.29	S	S	*	.	I	π-helix	trans	-76	-38	-177.4	-70.9	-13.6	0	0	0	113	R159 F160 Y161	R159-N163 WeakPolarHBondContact O-CB 3.29Å; R159-N163 VanDerWaalsContact O-CG 3.25Å; R159-N163 PolarHBondContact O-N 2.76Å; R159-N163 VanDerWaalsContact O-N 3.16Å; R159-N163 PolarHBondContact O-ND2 3.28Å; F160-N163 PolarHBondContact O-N 3.19Å; F160-N163 VanDerWaalsContact O-N 3.12Å; Y161-N163 PolarHBondContact O-N 2.59Å
164	V	89.4	Confident	87.4	Confident	13 Å²	13	56 Å²	56	8%	0.079	29%	0.285	C	S	.	.	I	π-helix	trans	-89.9	-33.8	-170.9	-56.8	0	0	0	0	113.5	L113 F145 F160	L113-V164 HydrophobicContact CD1-CB 3.87Å; L113-V164 HydrophobicContact CD1-CG1 4.18Å; L113-V164 HydrophobicContact CD1-CG2 4.13Å; L113-V164 HydrophobicContact CD2-CB 3.87Å; L113-V164 HydrophobicContact CD2-CG1 3.6Å; L113-V164 HydrophobicContact CG-CB 4.28Å; L113-V164 HydrophobicContact CG-CG1 4.45Å; F145-V164 HydrophobicContact CD2-CG2 4.13Å; F145-V164 HydrophobicContact CE2-CG2 4.4Å; F160-V164 HydrophobicContact CD1-CG2 4.25Å; F160-V164 HydrophobicContact CD2-CG1 3.85Å; F160-V164 HydrophobicContact CE1-CG1 4.27Å; F160-V164 HydrophobicContact CE1-CG2 4.11Å; F160-V164 HydrophobicContact CE2-CG1 3.56Å; F160-V164 HydrophobicContact CG-CG1 4.33Å; F160-V164 HydrophobicContact CZ-CG1 3.8Å; F160-V164 HydrophobicContact CZ-CG2 4.42Å; F160-V164 WeakPolarHBondContact O-CG1 3.34Å; F160-V164 VanDerWaalsContact O-CG2 3.24Å; F160-V164 WeakPolarHBondContact O-CG2 3.39Å; F160-V164 PolarHBondContact O-N 3.05Å
165	F	92.5	Very high	88.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	I	π-helix	trans	-123.1	-54	-172.3	177.6	-95.9	0	0	0	112.1	V117 M120 L121 I124 I142 Y161 A167 K168 H169 L212	V117-F165 HydrophobicContact CG1-CD2 4.35Å; M120-F165 HydrophobicContact CB-CD2 4.48Å; M120-F165 HydrophobicContact CB-CE2 3.85Å; M120-F165 HydrophobicContact CE-CD2 3.68Å; M120-F165 HydrophobicContact CE-CE2 3.47Å; M120-F165 VanDerWaalsContact CE-CE2 3.47Å; M120-F165 HydrophobicContact CE-CG 4.36Å; M120-F165 HydrophobicContact CE-CZ 3.99Å; M120-F165 HydrophobicContact SD-CD2 4.02Å; M120-F165 HydrophobicContact SD-CE2 4.11Å; L121-F165 HydrophobicContact CD2-CE2 4.44Å; I124-F165 HydrophobicContact CD1-CE2 4.46Å; I124-F165 HydrophobicContact CD1-CZ 3.97Å; I142-F165 HydrophobicContact CD1-CE1 3.96Å; I142-F165 HydrophobicContact CD1-CZ 4.17Å; I142-F165 HydrophobicContact CG1-CD1 4.47Å; I142-F165 HydrophobicContact CG1-CE1 4.28Å; Y161-F165 HydrophobicContact CD2-CB 4.35Å; Y161-F165 HydrophobicContact CD2-CD1 4.14Å; Y161-F165 HydrophobicContact CE2-CB 4.47Å; Y161-F165 AromaticContact CE2-CD1 3.46Å; Y161-F165 HydrophobicContact CE2-CD1 3.46Å; Y161-F165 VanDerWaalsContact CE2-CD1 3.46Å; Y161-F165 HydrophobicContact CE2-CE1 4.14Å; Y161-F165 HydrophobicContact CE2-CG 4.36Å; Y161-F165 PolarHBondContact O-N 2.99Å; F165-A167 PolarHBondContact O-N 3.17Å; F165-K168 PolarHBondContact O-N 3.31Å; F165-K168 VanDerWaalsContact O-N 3.17Å; F165-H169 HydrophobicContact CD1-CB 4.3Å; F165-H169 HydrophobicContact CE1-CB 3.91Å; F165-H169 AromaticContact CE1-CD2 3.9Å; F165-H169 AromaticContact CE1-CG 4Å; F165-H169 HydrophobicContact CE2-CB 4.3Å; F165-H169 HydrophobicContact CZ-CB 3.91Å; F165-H169 AromaticContact CZ-CG 3.86Å; F165-H169 VanDerWaalsContact O-CB 3.3Å; F165-H169 WeakPolarHBondContact O-CB 3.03Å; F165-H169 PolarHBondContact O-N 3.38Å; F165-L212 HydrophobicContact CE1-CD2 3.75Å; F165-L212 HydrophobicContact CZ-CD2 4.5Å
166	E	91.1	Very high	89.5	Confident	16 Å²	16	49 Å²	49	8%	0.075	24%	0.243	C	C	.	.	I	π-helix	trans	-58.5	-46.7	-170.2	-171.3	174	-149.4	0	0	112.5	Y161 K168 H169 I170 S216 R219	Y161-E166 HydrophobicContact CD1-CB 4.39Å; Y161-E166 HydrophobicContact CE1-CB 3.84Å; Y161-E166 HydrophobicContact CE1-CG 4.19Å; Y161-E166 PolarHBondContact O-N 3.45Å; E166-K168 PolarHBondContact O-N 3.13Å; E166-H169 PolarHBondContact O-N 3.45Å; E166-I170 HydrophobicContact CG-CD1 3.9Å; E166-I170 HydrophobicContact CG-CG1 4.47Å; E166-I170 WeakPolarHBondContact O-CB 3.39Å; E166-I170 VanDerWaalsContact O-CG1 3.31Å; E166-I170 WeakPolarHBondContact O-CG1 3.4Å; E166-I170 PolarHBondContact O-N 2.72Å; E166-S216 WeakPolarHBondContact OE1-CB 3.45Å; E166-S216 PolarHBondContact OE1-OG 3.49Å; E166-R219 IonicContact OE1-CZ 2.63Å; E166-R219 IonicContact OE1-NE 2.69Å; E166-R219 PolarHBondContact OE1-NE 3.16Å; E166-R219 IonicContact OE1-NH2 3.67Å; E166-R219 PolarHBondContact OE1-NH2 2.7Å; E166-R219 IonicContact OE2-CZ 3.81Å; E166-R219 IonicContact OE2-NE 3.7Å; E166-R219 IonicContact OE2-NH2 3.33Å; E166-R219 PolarHBondContact OE2-NH2 2.88Å
167	A	90.9	Very high	90.2	Very high	58 Å²	58	48.4 Å²	48.4	48%	0.479	24%	0.236	S	C	.	.	H	α-helix	trans	-60.9	-46.1	178.3	0	0	0	0	0	112.4	G162 F165 I170 E171	G162-A167 PolarHBondContact O-N 3.5Å; G162-A167 VanDerWaalsContact O-N 3.13Å; F165-A167 PolarHBondContact O-N 3.17Å; A167-I170 PolarHBondContact O-N 2.72Å; A167-E171 PolarHBondContact O-N 3.41Å; A167-E171 VanDerWaalsContact O-N 3.11Å
168	K	93.6	Very high	90.6	Very high	82 Å²	82	51.1 Å²	51.1	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-65.3	-39.6	177.9	-70	-177.2	176.5	-179.3	0	111.4	D114 V117 L121 F165 E166 E171 A172	D114-K168 IonicContact OD1-NZ 3.97Å; D114-K168 PolarHBondContact OD1-NZ 2.86Å; V117-K168 HydrophobicContact CG1-CB 4.33Å; V117-K168 HydrophobicContact CG1-CD 3.73Å; L121-K168 HydrophobicContact CD1-CB 4.34Å; F165-K168 PolarHBondContact O-N 3.31Å; F165-K168 VanDerWaalsContact O-N 3.17Å; E166-K168 PolarHBondContact O-N 3.13Å; K168-E171 PolarHBondContact O-N 3.31Å; K168-A172 WeakPolarHBondContact O-CB 3.37Å; K168-A172 PolarHBondContact O-N 2.81Å
169	H	93.2	Very high	90.8	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.009	26%	0.255	C	S	.	.	H	α-helix	trans	-68	-42.2	178.8	-179.5	41.3	0	0	0	112.5	L121 F165 E166 E171 T173 M220	L121-H169 HydrophobicContact CD2-CB 3.88Å; F165-H169 HydrophobicContact CD1-CB 4.3Å; F165-H169 HydrophobicContact CE1-CB 3.91Å; F165-H169 AromaticContact CE1-CD2 3.9Å; F165-H169 AromaticContact CE1-CG 4Å; F165-H169 HydrophobicContact CE2-CB 4.3Å; F165-H169 HydrophobicContact CZ-CB 3.91Å; F165-H169 AromaticContact CZ-CG 3.86Å; F165-H169 VanDerWaalsContact O-CB 3.3Å; F165-H169 WeakPolarHBondContact O-CB 3.03Å; F165-H169 PolarHBondContact O-N 3.38Å; E166-H169 PolarHBondContact O-N 3.45Å; H169-E171 VanDerWaalsContact C-N 3.33Å; H169-E171 PolarHBondContact O-N 3.05Å; H169-T173 PolarHBondContact CE1-OG1 2.82Å; H169-T173 WeakPolarHBondContact O-CB 3.48Å; H169-T173 PolarHBondContact O-N 3.22Å; H169-T173 PolarHBondContact O-OG1 2.98Å; H169-M220 WeakPolarHBondContact CD2-CE 3.48Å; H169-M220 VanDerWaalsContact NE2-CE 3.32Å; H169-M220 WeakPolarHBondContact NE2-CE 3Å
170	I	92.2	Very high	91	Very high	29 Å²	29	46.3 Å²	46.3	15%	0.149	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-47.7	173.1	-74.8	170.3	0	0	0	110.2	E166 A167 T173 K174 M220 V223	E166-I170 HydrophobicContact CG-CD1 3.9Å; E166-I170 HydrophobicContact CG-CG1 4.47Å; E166-I170 WeakPolarHBondContact O-CB 3.39Å; E166-I170 VanDerWaalsContact O-CG1 3.31Å; E166-I170 WeakPolarHBondContact O-CG1 3.4Å; E166-I170 PolarHBondContact O-N 2.72Å; A167-I170 PolarHBondContact O-N 2.72Å; I170-T173 PolarHBondContact O-N 2.92Å; I170-K174 HydrophobicContact CG2-CD 4.39Å; I170-K174 WeakPolarHBondContact O-CG 3.28Å; I170-K174 PolarHBondContact O-N 3.26Å; I170-M220 HydrophobicContact CG1-CE 3.81Å; I170-V223 HydrophobicContact CG2-CG1 4.21Å; I170-V223 HydrophobicContact CG2-CG2 3.88Å
171	E	93.3	Very high	91.1	Very high	111 Å²	111	45.3 Å²	45.3	52%	0.519	23%	0.227	S	C	.	.	H	α-helix	trans	-64.8	-47.1	-178.2	-166.8	57.9	-155.5	0	0	112.3	A167 K168 H169 T173 K174 E175	A167-E171 PolarHBondContact O-N 3.41Å; A167-E171 VanDerWaalsContact O-N 3.11Å; K168-E171 PolarHBondContact O-N 3.31Å; H169-E171 VanDerWaalsContact C-N 3.33Å; H169-E171 PolarHBondContact O-N 3.05Å; E171-T173 PolarHBondContact O-N 3.14Å; E171-K174 WeakPolarHBondContact O-CB 3.34Å; E171-K174 PolarHBondContact O-N 3.24Å; E171-K174 VanDerWaalsContact O-N 3.14Å; E171-E175 PolarHBondContact O-N 3Å
172	A	93.2	Very high	90.9	Very high	31 Å²	31	49.6 Å²	49.6	26%	0.256	25%	0.248	S	C	.	.	H	α-helix	trans	-59	-33.9	174.9	0	0	0	0	0	112.3	L121 K168 Y176	L121-A172 HydrophobicContact CD1-CB 4.37Å; L121-A172 HydrophobicContact CD2-CB 4.15Å; K168-A172 WeakPolarHBondContact O-CB 3.37Å; K168-A172 PolarHBondContact O-N 2.81Å; A172-Y176 VanDerWaalsContact O-CB 3.32Å; A172-Y176 WeakPolarHBondContact O-CB 3.33Å; A172-Y176 PolarHBondContact O-N 2.9Å
173	T	92.3	Very high	91	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-72	-39.9	177.6	-54.3	0	0	0	0	112	R128 H169 I170 E171 Y176 Y177 M220	R128-T173 PolarHBondContact NH2-OG1 3.47Å; H169-T173 PolarHBondContact CE1-OG1 2.82Å; H169-T173 WeakPolarHBondContact O-CB 3.48Å; H169-T173 PolarHBondContact O-N 3.22Å; H169-T173 PolarHBondContact O-OG1 2.98Å; I170-T173 PolarHBondContact O-N 2.92Å; E171-T173 PolarHBondContact O-N 3.14Å; T173-Y176 PolarHBondContact O-N 3.29Å; T173-Y177 HydrophobicContact CG2-CD2 3.56Å; T173-Y177 HydrophobicContact CG2-CE2 3.61Å; T173-Y177 WeakPolarHBondContact O-CD2 3.28Å; T173-Y177 PolarHBondContact O-N 2.96Å; T173-M220 HydrophobicContact CG2-SD 3.46Å; T173-M220 WeakPolarHBondContact CG2-SD 3.36Å
174	K	91.7	Very high	90.9	Very high	72 Å²	72	47.9 Å²	47.9	31%	0.313	24%	0.243	S	C	.	.	H	α-helix	trans	-59.6	-48.8	173.2	-70	177.1	178.9	175.8	0	111.4	I170 E171 Y176 Y177 K178 V223 V227	I170-K174 HydrophobicContact CG2-CD 4.39Å; I170-K174 WeakPolarHBondContact O-CG 3.28Å; I170-K174 PolarHBondContact O-N 3.26Å; E171-K174 WeakPolarHBondContact O-CB 3.34Å; E171-K174 PolarHBondContact O-N 3.24Å; E171-K174 VanDerWaalsContact O-N 3.14Å; K174-Y176 PolarHBondContact O-N 3.41Å; K174-Y177 PolarHBondContact O-N 3.3Å; K174-K178 VanDerWaalsContact O-CB 3.3Å; K174-K178 WeakPolarHBondContact O-CB 3.34Å; K174-K178 PolarHBondContact O-N 3.08Å; K174-V223 HydrophobicContact CD-CG1 4.11Å; K174-V223 HydrophobicContact CG-CG1 3.34Å; K174-V227 HydrophobicContact CB-CG2 4.02Å; K174-V227 HydrophobicContact CG-CG2 3.78Å
175	E	92.5	Very high	90.7	Very high	118 Å²	118	50.1 Å²	50.1	55%	0.551	25%	0.254	S	S	*	.	H	α-helix	trans	-63.3	-41.8	179.5	-173.2	177.2	-176.4	0	0	111.9	E171 K178 R179	E171-E175 PolarHBondContact O-N 3Å; E175-K178 PolarHBondContact O-N 2.94Å; E175-R179 WeakPolarHBondContact O-CG 3.3Å; E175-R179 PolarHBondContact O-N 3.02Å; E175-R179 VanDerWaalsContact O-N 3.11Å
176	Y	92.8	Very high	90.3	Very high	27 Å²	27	58.3 Å²	58.3	11%	0.106	29%	0.289	C	S	.	.	H	α-helix	trans	-58.2	-53.8	174.9	-178.8	-90.3	0	0	0	111.5	E125 R128 N129 A172 T173 K174 K178 R179 V180	E125-Y176 HydrophobicContact CG-CD2 4.11Å; E125-Y176 HydrophobicContact CG-CE2 4.15Å; R128-Y176 HydrophobicContact CB-CE1 4.04Å; R128-Y176 HydrophobicContact CB-CE2 4.09Å; R128-Y176 WeakPolarHBondContact CB-OH 3.49Å; R128-Y176 HydrophobicContact CG-CE1 4.2Å; N129-Y176 PolarHBondContact OD1-OH 3.25Å; A172-Y176 VanDerWaalsContact O-CB 3.32Å; A172-Y176 WeakPolarHBondContact O-CB 3.33Å; A172-Y176 PolarHBondContact O-N 2.9Å; T173-Y176 PolarHBondContact O-N 3.29Å; K174-Y176 PolarHBondContact O-N 3.41Å; Y176-K178 VanDerWaalsContact C-N 3.32Å; Y176-K178 PolarHBondContact O-N 2.7Å; Y176-R179 PolarHBondContact O-N 3.06Å; Y176-V180 HydrophobicContact CD1-CG2 4.05Å; Y176-V180 HydrophobicContact CE1-CG2 3.6Å; Y176-V180 WeakPolarHBondContact O-CG2 3.36Å; Y176-V180 PolarHBondContact O-N 3.07Å
177	Y	90.9	Very high	90.2	Very high	3 Å²	3	63.5 Å²	63.5	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-70.2	-27.8	-176.8	-80.5	-62.7	0	0	0	113.8	T173 K174 V180 S181 K200 E204 L228	T173-Y177 HydrophobicContact CG2-CD2 3.56Å; T173-Y177 HydrophobicContact CG2-CE2 3.61Å; T173-Y177 WeakPolarHBondContact O-CD2 3.28Å; T173-Y177 PolarHBondContact O-N 2.96Å; K174-Y177 PolarHBondContact O-N 3.3Å; Y177-V180 PolarHBondContact O-N 3.45Å; Y177-S181 WeakPolarHBondContact O-CB 3.34Å; Y177-S181 PolarHBondContact O-N 3.33Å; Y177-S181 PolarHBondContact O-OG 3.43Å; Y177-K200 HydrophobicContact CE1-CB 4.2Å; Y177-E204 HydrophobicContact CE2-CB 4.38Å; Y177-E204 HydrophobicContact CE2-CG 3.91Å; Y177-E204 WeakPolarHBondContact OH-CB 3.46Å; Y177-E204 PolarHBondContact OH-OE2 3.24Å; Y177-L228 HydrophobicContact CD1-CD1 3.94Å; Y177-L228 HydrophobicContact CD1-CD2 3.96Å; Y177-L228 HydrophobicContact CD1-CG 4.27Å; Y177-L228 HydrophobicContact CE1-CD1 4.34Å; Y177-L228 HydrophobicContact CG-CD1 4.33Å; Y177-L228 HydrophobicContact CG-CD2 4.33Å; Y177-L228 HydrophobicContact CG-CG 4.4Å
178	K	90.1	Very high	89.7	Confident	103 Å²	103	62.2 Å²	62.2	45%	0.448	31%	0.309	S	S	.	.	H	α-helix	trans	-63.8	-45	170.5	-174.8	179.1	179.9	-178.7	0	112	K174 E175 Y176 V180 S181 E182 V227	K174-K178 VanDerWaalsContact O-CB 3.3Å; K174-K178 WeakPolarHBondContact O-CB 3.34Å; K174-K178 PolarHBondContact O-N 3.08Å; E175-K178 PolarHBondContact O-N 2.94Å; Y176-K178 VanDerWaalsContact C-N 3.32Å; Y176-K178 PolarHBondContact O-N 2.7Å; K178-V180 VanDerWaalsContact C-N 3.32Å; K178-V180 PolarHBondContact O-N 3.2Å; K178-S181 PolarHBondContact O-N 3.39Å; K178-S181 PolarHBondContact O-OG 3.31Å; K178-E182 VanDerWaalsContact CE-OE1 3.26Å; K178-E182 WeakPolarHBondContact CE-OE1 3.33Å; K178-E182 WeakPolarHBondContact O-CB 3.27Å; K178-E182 WeakPolarHBondContact O-CG 3.41Å; K178-E182 PolarHBondContact O-N 3.23Å; K178-V227 HydrophobicContact CB-CG1 4.26Å
179	R	90.5	Very high	89.2	Confident	125 Å²	125	62.2 Å²	62.2	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-40.2	175.4	-69.5	-175.8	-64	168.9	6.2	111.5	E125 E175 Y176 A183	E125-R179 IonicContact OE1-NH2 2.72Å; E125-R179 PolarHBondContact OE1-NH2 2.71Å; E175-R179 WeakPolarHBondContact O-CG 3.3Å; E175-R179 PolarHBondContact O-N 3.02Å; E175-R179 VanDerWaalsContact O-N 3.11Å; Y176-R179 PolarHBondContact O-N 3.06Å; R179-A183 WeakPolarHBondContact O-CB 3.42Å; R179-A183 PolarHBondContact O-N 3.45Å
180	V	89.1	Confident	88.4	Confident	30 Å²	30	64.4 Å²	64.4	18%	0.182	33%	0.327	C	S	.	.	H	α-helix	trans	-65.9	-44.5	177.2	172.7	0	0	0	0	111.3	Y176 Y177 K178 A183 L184	Y176-V180 HydrophobicContact CD1-CG2 4.05Å; Y176-V180 HydrophobicContact CE1-CG2 3.6Å; Y176-V180 WeakPolarHBondContact O-CG2 3.36Å; Y176-V180 PolarHBondContact O-N 3.07Å; Y177-V180 PolarHBondContact O-N 3.45Å; K178-V180 VanDerWaalsContact C-N 3.32Å; K178-V180 PolarHBondContact O-N 3.2Å; V180-A183 PolarHBondContact O-N 3.24Å; V180-L184 HydrophobicContact CG1-CD1 3.81Å; V180-L184 HydrophobicContact CG1-CG 4.2Å; V180-L184 WeakPolarHBondContact O-CB 3.39Å; V180-L184 VanDerWaalsContact O-CG 3.28Å; V180-L184 WeakPolarHBondContact O-CG 3.16Å; V180-L184 PolarHBondContact O-N 3.33Å
181	S	87.5	Confident	87.7	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-46.7	179	62.3	0	0	0	0	111.6	Y177 K178 A183 L184 L185 Y193	Y177-S181 WeakPolarHBondContact O-CB 3.34Å; Y177-S181 PolarHBondContact O-N 3.33Å; Y177-S181 PolarHBondContact O-OG 3.43Å; K178-S181 PolarHBondContact O-N 3.39Å; K178-S181 PolarHBondContact O-OG 3.31Å; S181-A183 VanDerWaalsContact C-N 3.29Å; S181-A183 PolarHBondContact O-N 2.81Å; S181-L184 PolarHBondContact O-N 3.39Å; S181-L185 WeakPolarHBondContact O-CB 3.31Å; S181-L185 VanDerWaalsContact O-CG 3.32Å; S181-L185 WeakPolarHBondContact O-CG 3.48Å; S181-L185 PolarHBondContact O-N 3.16Å; S181-Y193 VanDerWaalsContact CB-OH 3.32Å; S181-Y193 WeakPolarHBondContact CB-OH 3.47Å
182	E	87.2	Confident	87.2	Confident	92 Å²	92	64.6 Å²	64.6	43%	0.43	33%	0.333	S	S	.	.	H	α-helix	trans	-61.3	-34.8	176.5	-72.1	175.9	-171.2	0	0	112.9	K178 K186	K178-E182 VanDerWaalsContact CE-OE1 3.26Å; K178-E182 WeakPolarHBondContact CE-OE1 3.33Å; K178-E182 WeakPolarHBondContact O-CB 3.27Å; K178-E182 WeakPolarHBondContact O-CG 3.41Å; K178-E182 PolarHBondContact O-N 3.23Å; E182-K186 WeakPolarHBondContact O-CG 3.2Å
183	A	89	Confident	86.7	Confident	55 Å²	55	63.1 Å²	63.1	46%	0.455	32%	0.32	S	S	.	.	H	α-helix	trans	-72.8	-44.1	176.3	0	0	0	0	0	112.1	R179 V180 S181 K186	R179-A183 WeakPolarHBondContact O-CB 3.42Å; R179-A183 PolarHBondContact O-N 3.45Å; V180-A183 PolarHBondContact O-N 3.24Å; S181-A183 VanDerWaalsContact C-N 3.29Å; S181-A183 PolarHBondContact O-N 2.81Å; A183-K186 PolarHBondContact O-N 3.37Å
184	L	87.1	Confident	86	Confident	38 Å²	38	63.4 Å²	63.4	20%	0.199	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-40.6	179.7	-71.9	177	0	0	0	111.9	V180 S181 K186 V187 C188 Y193 L196	V180-L184 HydrophobicContact CG1-CD1 3.81Å; V180-L184 HydrophobicContact CG1-CG 4.2Å; V180-L184 WeakPolarHBondContact O-CB 3.39Å; V180-L184 VanDerWaalsContact O-CG 3.28Å; V180-L184 WeakPolarHBondContact O-CG 3.16Å; V180-L184 PolarHBondContact O-N 3.33Å; S181-L184 PolarHBondContact O-N 3.39Å; L184-K186 PolarHBondContact O-N 3.08Å; L184-V187 PolarHBondContact O-N 2.74Å; L184-C188 WeakPolarHBondContact O-CB 3.24Å; L184-C188 PolarHBondContact O-N 2.88Å; L184-Y193 HydrophobicContact CB-CD2 3.81Å; L184-Y193 HydrophobicContact CB-CE2 4.07Å; L184-Y193 HydrophobicContact CD1-CD2 4.45Å; L184-Y193 HydrophobicContact CD1-CE2 4.43Å; L184-L196 HydrophobicContact CD1-CB 4.38Å; L184-L196 HydrophobicContact CD2-CD1 3.96Å
185	L	83.2	Confident	85.5	Confident	59 Å²	59	64.6 Å²	64.6	31%	0.309	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-21.2	179.8	-74.3	171.6	0	0	0	114.5	S181 V187 Y193 H232	S181-L185 WeakPolarHBondContact O-CB 3.31Å; S181-L185 VanDerWaalsContact O-CG 3.32Å; S181-L185 WeakPolarHBondContact O-CG 3.48Å; S181-L185 PolarHBondContact O-N 3.16Å; L185-V187 VanDerWaalsContact C-N 3.31Å; L185-Y193 HydrophobicContact CD2-CD1 4.25Å; L185-Y193 HydrophobicContact CD2-CD2 3.81Å; L185-Y193 HydrophobicContact CD2-CE2 4.1Å; L185-Y193 HydrophobicContact CD2-CG 3.9Å; L185-Y193 HydrophobicContact CG-CD2 3.97Å; L185-Y193 HydrophobicContact CG-CE2 3.91Å; L185-H232 WeakPolarHBondContact CD1-CE1 3.49Å; L185-H232 WeakPolarHBondContact CD1-ND1 3.42Å; L185-H232 WeakPolarHBondContact CD1-NE2 3.22Å
186	K	85.5	Confident	85.2	Confident	173 Å²	173	61.4 Å²	61.4	75%	0.752	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-20.5	175.2	-70	170.6	-173.6	172.6	0	112.8	E182 A183 L184	E182-K186 WeakPolarHBondContact O-CG 3.2Å; A183-K186 PolarHBondContact O-N 3.37Å; L184-K186 PolarHBondContact O-N 3.08Å
187	V	88	Confident	84.9	Confident	125 Å²	125	60.3 Å²	60.3	76%	0.758	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	-32.6	-169.4	-175.2	0	0	0	0	112.2	L184 L185	L184-V187 PolarHBondContact O-N 2.74Å; L185-V187 VanDerWaalsContact C-N 3.31Å
188	C	81.7	Confident	84.5	Confident	30 Å²	30	62 Å²	62	20%	0.203	32%	0.32	C	S	.	.	S	Bend	trans	-102.1	147.5	-173.1	-63	0	0	0	0	112	L184 E192	L184-C188 WeakPolarHBondContact O-CB 3.24Å; L184-C188 PolarHBondContact O-N 2.88Å; C188-E192 HydrophobicContact CB-CB 3.97Å
189	T	81.4	Confident	84.4	Confident	82 Å²	82	62.4 Å²	62.4	50%	0.503	32%	0.323	S	S	.	.			trans	-63.7	157	159.7	64.9	0	0	0	0	109.6	S191 E192 Y193	T189-S191 PolarHBondContact O-N 3.12Å; T189-E192 WeakPolarHBondContact CB-OE2 3.3Å; T189-E192 WeakPolarHBondContact CG2-OE2 3.46Å; T189-E192 PolarHBondContact N-OE2 2.83Å; T189-E192 PolarHBondContact O-N 3.12Å; T189-E192 VanDerWaalsContact O-N 3.11Å; T189-E192 VanDerWaalsContact OG1-CD 3.26Å; T189-E192 WeakPolarHBondContact OG1-CG 3.42Å; T189-E192 PolarHBondContact OG1-N 2.91Å; T189-E192 PolarHBondContact OG1-OE2 3.2Å; T189-Y193 WeakPolarHBondContact O-CB 3.34Å; T189-Y193 PolarHBondContact O-N 2.94Å
190	I	78.1	Confident	84.3	Confident	49 Å²	49	60 Å²	60	25%	0.251	32%	0.316	S	S	.	.	H	α-helix	trans	-63.5	-28.4	-179.6	-64.1	159.6	0	0	0	111.8	Y193 M194 L236 I239	I190-Y193 PolarHBondContact O-N 2.96Å; I190-M194 HydrophobicContact CG2-CE 3.97Å; I190-M194 VanDerWaalsContact O-CG 3.32Å; I190-M194 WeakPolarHBondContact O-CG 3.45Å; I190-M194 PolarHBondContact O-N 2.82Å; I190-L236 HydrophobicContact CG2-CD2 3.86Å; I190-I239 HydrophobicContact CB-CD1 3.22Å; I190-I239 HydrophobicContact CD1-CD1 3.33Å; I190-I239 HydrophobicContact CG1-CD1 3.84Å; I190-I239 HydrophobicContact CG2-CB 4.39Å; I190-I239 HydrophobicContact CG2-CD1 3.3Å; I190-I239 HydrophobicContact CG2-CG1 4.38Å
191	S	76.7	Confident	84.2	Confident	48 Å²	48	58.9 Å²	58.9	34%	0.336	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-43.7	173.4	-168	0	0	0	0	111.9	T189 M194 E195	T189-S191 PolarHBondContact O-N 3.12Å; S191-M194 PolarHBondContact O-N 3.44Å; S191-E195 PolarHBondContact O-N 2.85Å
192	E	83	Confident	84.2	Confident	95 Å²	95	61.8 Å²	61.8	44%	0.444	32%	0.323	S	S	.	.	H	α-helix	trans	-67	-40.6	175.6	-69.4	161.7	147.4	0	0	110.9	C188 T189 M194 E195 L196	C188-E192 HydrophobicContact CB-CB 3.97Å; T189-E192 WeakPolarHBondContact CB-OE2 3.3Å; T189-E192 WeakPolarHBondContact CG2-OE2 3.46Å; T189-E192 PolarHBondContact N-OE2 2.83Å; T189-E192 PolarHBondContact O-N 3.12Å; T189-E192 VanDerWaalsContact O-N 3.11Å; T189-E192 VanDerWaalsContact OG1-CD 3.26Å; T189-E192 WeakPolarHBondContact OG1-CG 3.42Å; T189-E192 PolarHBondContact OG1-N 2.91Å; T189-E192 PolarHBondContact OG1-OE2 3.2Å; E192-M194 VanDerWaalsContact C-N 3.29Å; E192-M194 PolarHBondContact O-N 3.19Å; E192-E195 PolarHBondContact O-N 2.99Å; E192-L196 VanDerWaalsContact O-CG 3.3Å; E192-L196 WeakPolarHBondContact O-CG 3.25Å; E192-L196 PolarHBondContact O-N 2.72Å
193	Y	83.5	Confident	84.3	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-55.5	-45.3	173.7	178	-97	0	0	0	111.2	S181 L184 L185 T189 I190 E195 L196 I197 L228 H232 L236	S181-Y193 VanDerWaalsContact CB-OH 3.32Å; S181-Y193 WeakPolarHBondContact CB-OH 3.47Å; L184-Y193 HydrophobicContact CB-CD2 3.81Å; L184-Y193 HydrophobicContact CB-CE2 4.07Å; L184-Y193 HydrophobicContact CD1-CD2 4.45Å; L184-Y193 HydrophobicContact CD1-CE2 4.43Å; L185-Y193 HydrophobicContact CD2-CD1 4.25Å; L185-Y193 HydrophobicContact CD2-CD2 3.81Å; L185-Y193 HydrophobicContact CD2-CE2 4.1Å; L185-Y193 HydrophobicContact CD2-CG 3.9Å; L185-Y193 HydrophobicContact CG-CD2 3.97Å; L185-Y193 HydrophobicContact CG-CE2 3.91Å; T189-Y193 WeakPolarHBondContact O-CB 3.34Å; T189-Y193 PolarHBondContact O-N 2.94Å; I190-Y193 PolarHBondContact O-N 2.96Å; Y193-E195 VanDerWaalsContact C-N 3.34Å; Y193-E195 PolarHBondContact O-N 3.27Å; Y193-L196 PolarHBondContact O-N 3.09Å; Y193-I197 HydrophobicContact CD1-CD1 4.45Å; Y193-I197 HydrophobicContact CD1-CG2 4.1Å; Y193-I197 HydrophobicContact CD2-CG2 4.25Å; Y193-I197 HydrophobicContact CE1-CD1 4.04Å; Y193-I197 HydrophobicContact CE1-CG2 3.6Å; Y193-I197 HydrophobicContact CE2-CG2 3.77Å; Y193-I197 HydrophobicContact CG-CG2 4.4Å; Y193-I197 VanDerWaalsContact CZ-CG2 3.4Å; Y193-I197 WeakPolarHBondContact O-CG2 3.42Å; Y193-I197 PolarHBondContact O-N 3.32Å; Y193-L228 PolarHBondContact OH-O 3.08Å; Y193-H232 AromaticContact CZ-CD2 3.91Å; Y193-H232 PolarHBondContact OH-CD2 3.41Å; Y193-L236 HydrophobicContact CD1-CD2 4.23Å; Y193-L236 HydrophobicContact CE1-CD2 4.46Å
194	M	77.4	Confident	84.4	Confident	7 Å²	7	57.5 Å²	57.5	3%	0.034	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-41	178.2	-77.7	-173.2	-165.6	0	0	113.1	I190 S191 E192 I197 I198 L236 I239 I243 F253	I190-M194 HydrophobicContact CG2-CE 3.97Å; I190-M194 VanDerWaalsContact O-CG 3.32Å; I190-M194 WeakPolarHBondContact O-CG 3.45Å; I190-M194 PolarHBondContact O-N 2.82Å; S191-M194 PolarHBondContact O-N 3.44Å; E192-M194 VanDerWaalsContact C-N 3.29Å; E192-M194 PolarHBondContact O-N 3.19Å; M194-I197 VanDerWaalsContact O-CG1 3.24Å; M194-I197 WeakPolarHBondContact O-CG1 3.4Å; M194-I198 WeakPolarHBondContact O-CD1 3.31Å; M194-I198 WeakPolarHBondContact O-CG1 3.34Å; M194-I198 PolarHBondContact O-N 3.3Å; M194-L236 HydrophobicContact CE-CB 3.86Å; M194-L236 HydrophobicContact CE-CD2 3.31Å; M194-L236 HydrophobicContact CE-CG 4.18Å; M194-L236 WeakPolarHBondContact CE-O 3.4Å; M194-L236 HydrophobicContact CG-CD2 3.52Å; M194-L236 HydrophobicContact SD-CD2 4.16Å; M194-I239 HydrophobicContact CE-CB 4Å; M194-I239 HydrophobicContact CE-CG2 3.98Å; M194-I243 HydrophobicContact CE-CD1 3.94Å; M194-I243 HydrophobicContact SD-CD1 3.13Å; M194-I243 WeakPolarHBondContact SD-CD1 3.22Å; M194-F253 HydrophobicContact CE-CE1 4.49Å; M194-F253 HydrophobicContact CE-CE2 4.37Å; M194-F253 HydrophobicContact CE-CZ 3.95Å; M194-F253 HydrophobicContact CG-CE2 4.13Å; M194-F253 HydrophobicContact SD-CD2 4.37Å; M194-F253 HydrophobicContact SD-CE2 3.92Å; M194-F253 HydrophobicContact SD-CZ 4.03Å
195	E	81	Confident	84.4	Confident	96 Å²	96	59.7 Å²	59.7	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-67.5	-42.9	177.8	-67.3	-176.2	178.6	0	0	111	S191 E192 Y193 I198 E199 K249	S191-E195 PolarHBondContact O-N 2.85Å; E192-E195 PolarHBondContact O-N 2.99Å; Y193-E195 VanDerWaalsContact C-N 3.34Å; Y193-E195 PolarHBondContact O-N 3.27Å; E195-I198 PolarHBondContact O-N 3.06Å; E195-E199 PolarHBondContact O-N 3.1Å; E195-K249 IonicContact OE1-NZ 3.81Å; E195-K249 PolarHBondContact OE1-NZ 3.24Å
196	L	85.9	Confident	84.8	Confident	52 Å²	52	61.7 Å²	61.7	27%	0.272	31%	0.307	S	S	.	.	H	α-helix	trans	-64.9	-41.7	179.2	-69	170.9	0	0	0	112.6	L184 E192 Y193 I198 E199 K200	L184-L196 HydrophobicContact CD1-CB 4.38Å; L184-L196 HydrophobicContact CD2-CD1 3.96Å; E192-L196 VanDerWaalsContact O-CG 3.3Å; E192-L196 WeakPolarHBondContact O-CG 3.25Å; E192-L196 PolarHBondContact O-N 2.72Å; Y193-L196 PolarHBondContact O-N 3.09Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 PolarHBondContact O-N 3.48Å; L196-E199 PolarHBondContact O-N 3.27Å; L196-K200 WeakPolarHBondContact O-CB 3.34Å; L196-K200 VanDerWaalsContact O-CG 3.26Å; L196-K200 WeakPolarHBondContact O-CG 3.45Å; L196-K200 PolarHBondContact O-N 3.05Å
197	I	85.8	Confident	85	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.015	28%	0.276	C	S	.	.	H	α-helix	trans	-66.5	-35	179.2	63.4	173.6	0	0	0	112.3	Y193 M194 E199 K200 I201 L228 V229	Y193-I197 HydrophobicContact CD1-CD1 4.45Å; Y193-I197 HydrophobicContact CD1-CG2 4.1Å; Y193-I197 HydrophobicContact CD2-CG2 4.25Å; Y193-I197 HydrophobicContact CE1-CD1 4.04Å; Y193-I197 HydrophobicContact CE1-CG2 3.6Å; Y193-I197 HydrophobicContact CE2-CG2 3.77Å; Y193-I197 HydrophobicContact CG-CG2 4.4Å; Y193-I197 VanDerWaalsContact CZ-CG2 3.4Å; Y193-I197 WeakPolarHBondContact O-CG2 3.42Å; Y193-I197 PolarHBondContact O-N 3.32Å; M194-I197 VanDerWaalsContact O-CG1 3.24Å; M194-I197 WeakPolarHBondContact O-CG1 3.4Å; I197-E199 VanDerWaalsContact C-N 3.33Å; I197-K200 PolarHBondContact O-N 2.97Å; I197-I201 WeakPolarHBondContact O-CB 3.28Å; I197-I201 VanDerWaalsContact O-CG1 3.23Å; I197-I201 WeakPolarHBondContact O-CG1 3.5Å; I197-I201 PolarHBondContact O-N 3.3Å; I197-L228 HydrophobicContact CB-CB 4.4Å; I197-L228 HydrophobicContact CB-CD1 4.49Å; I197-L228 HydrophobicContact CG2-CB 4.27Å; I197-L228 HydrophobicContact CG2-CD2 4.22Å; I197-V229 HydrophobicContact CD1-CG2 4.43Å
198	I	82.5	Confident	85.2	Confident	40 Å²	40	48.9 Å²	48.9	21%	0.205	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-44.5	177.9	-69.6	168.7	0	0	0	109.6	M194 E195 L196 E202 F256	M194-I198 WeakPolarHBondContact O-CD1 3.31Å; M194-I198 WeakPolarHBondContact O-CG1 3.34Å; M194-I198 PolarHBondContact O-N 3.3Å; E195-I198 PolarHBondContact O-N 3.06Å; L196-I198 VanDerWaalsContact C-N 3.33Å; L196-I198 PolarHBondContact O-N 3.48Å; I198-E202 WeakPolarHBondContact O-CB 3.48Å; I198-E202 PolarHBondContact O-N 3.37Å; I198-E202 VanDerWaalsContact O-N 3.14Å; I198-F256 HydrophobicContact CG1-CE2 4.48Å; I198-F256 HydrophobicContact CG2-CE2 4.31Å
199	E	87.4	Confident	85.7	Confident	110 Å²	110	52.6 Å²	52.6	51%	0.514	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-47.8	174.7	-172.9	179.1	-169	0	0	111.2	E195 L196 I197 I201 E202 D203	E195-E199 PolarHBondContact O-N 3.1Å; L196-E199 PolarHBondContact O-N 3.27Å; I197-E199 VanDerWaalsContact C-N 3.33Å; E199-I201 PolarHBondContact O-N 3.17Å; E199-E202 PolarHBondContact O-N 2.84Å; E199-D203 WeakPolarHBondContact O-CB 3.3Å; E199-D203 PolarHBondContact O-N 3.17Å
200	K	88.5	Confident	86.1	Confident	74 Å²	74	54 Å²	54	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-62.5	-38.5	-179.8	-69.5	-63.5	176.2	-160.6	0	113.8	Y177 L196 I197 E204	Y177-K200 HydrophobicContact CE1-CB 4.2Å; L196-K200 WeakPolarHBondContact O-CB 3.34Å; L196-K200 VanDerWaalsContact O-CG 3.26Å; L196-K200 WeakPolarHBondContact O-CG 3.45Å; L196-K200 PolarHBondContact O-N 3.05Å; I197-K200 PolarHBondContact O-N 2.97Å; K200-E204 WeakPolarHBondContact O-CB 3.34Å; K200-E204 PolarHBondContact O-N 3.06Å
201	I	87.2	Confident	86.7	Confident	7 Å²	7	51.9 Å²	51.9	4%	0.036	24%	0.243	C	C	.	.	H	α-helix	trans	-66.4	-42.7	176.1	-70.1	165.6	0	0	0	110.3	I197 E199 E204 R205 Q225 L228 F256	I197-I201 WeakPolarHBondContact O-CB 3.28Å; I197-I201 VanDerWaalsContact O-CG1 3.23Å; I197-I201 WeakPolarHBondContact O-CG1 3.5Å; I197-I201 PolarHBondContact O-N 3.3Å; E199-I201 PolarHBondContact O-N 3.17Å; I201-E204 PolarHBondContact O-N 3.46Å; I201-R205 WeakPolarHBondContact O-CB 3.21Å; I201-R205 PolarHBondContact O-N 2.89Å; I201-Q225 HydrophobicContact CD1-CG 4.15Å; I201-Q225 HydrophobicContact CG2-CG 4.26Å; I201-L228 HydrophobicContact CD1-CD1 4.09Å; I201-L228 HydrophobicContact CG1-CD1 3.57Å; I201-F256 HydrophobicContact CG2-CE1 4.14Å
202	E	87.4	Confident	87.4	Confident	63 Å²	63	50.3 Å²	50.3	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-68.7	-38.1	179.7	-179.3	58.8	-168.1	0	0	112.1	I198 E199 R205 K206	I198-E202 WeakPolarHBondContact O-CB 3.48Å; I198-E202 PolarHBondContact O-N 3.37Å; I198-E202 VanDerWaalsContact O-N 3.14Å; E199-E202 PolarHBondContact O-N 2.84Å; E202-R205 PolarHBondContact O-N 2.93Å; E202-R205 IonicContact OE1-CZ 3.14Å; E202-R205 IonicContact OE1-NE 3.52Å; E202-R205 IonicContact OE1-NH2 2.82Å; E202-R205 PolarHBondContact OE1-NH2 3.24Å; E202-R205 IonicContact OE2-CZ 2.69Å; E202-R205 IonicContact OE2-NE 3.52Å; E202-R205 PolarHBondContact OE2-NE 3.46Å; E202-R205 IonicContact OE2-NH2 3.51Å; E202-K206 WeakPolarHBondContact O-CG 3.41Å; E202-K206 PolarHBondContact O-N 3.4Å; E202-K206 WeakPolarHBondContact OE1-CE 3.37Å; E202-K206 IonicContact OE1-NZ 2.74Å
203	D	90.1	Very high	87.6	Confident	55 Å²	55	46.9 Å²	46.9	29%	0.294	22%	0.217	S	C	.	.	H	α-helix	trans	-62.3	-43.4	172.4	-75.8	-13.8	0	0	0	111.7	E199 K206 R207	E199-D203 WeakPolarHBondContact O-CB 3.3Å; E199-D203 PolarHBondContact O-N 3.17Å; D203-K206 PolarHBondContact O-N 2.85Å; D203-R207 VanDerWaalsContact O-CB 3.25Å; D203-R207 WeakPolarHBondContact O-CB 3.32Å; D203-R207 PolarHBondContact O-N 3.3Å
204	E	90.4	Very high	87.8	Confident	2 Å²	2	55 Å²	55	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-37.3	177.9	-166.7	61.6	-173.2	0	0	112.4	R128 Y177 K200 I201 R207 S208 M220	R128-E204 IonicContact CZ-OE1 3.86Å; R128-E204 IonicContact NE-OE1 3.74Å; R128-E204 IonicContact NE-OE2 2.72Å; R128-E204 PolarHBondContact NE-OE2 2.97Å; R128-E204 IonicContact NH2-OE1 3.38Å; R128-E204 PolarHBondContact NH2-OE1 3.43Å; R128-E204 IonicContact NH2-OE2 3.05Å; Y177-E204 HydrophobicContact CE2-CB 4.38Å; Y177-E204 HydrophobicContact CE2-CG 3.91Å; Y177-E204 WeakPolarHBondContact OH-CB 3.46Å; Y177-E204 PolarHBondContact OH-OE2 3.24Å; K200-E204 WeakPolarHBondContact O-CB 3.34Å; K200-E204 PolarHBondContact O-N 3.06Å; I201-E204 PolarHBondContact O-N 3.46Å; E204-R207 PolarHBondContact O-N 3.42Å; E204-R207 WeakPolarHBondContact OE2-CD 3.46Å; E204-R207 IonicContact OE2-CZ 3.49Å; E204-R207 IonicContact OE2-NE 3.92Å; E204-R207 IonicContact OE2-NH1 3.8Å; E204-R207 PolarHBondContact OE2-NH1 2.77Å; E204-S208 VanDerWaalsContact O-CB 3.26Å; E204-S208 WeakPolarHBondContact O-CB 3.37Å; E204-S208 PolarHBondContact O-N 3.39Å; E204-S208 PolarHBondContact O-OG 3.44Å; E204-M220 HydrophobicContact CG-CG 4.31Å
205	R	88.5	Confident	88.2	Confident	84 Å²	84	59.1 Å²	59.1	32%	0.317	27%	0.274	S	S	.	.	H	α-helix	trans	-60.2	-51.6	173.1	-172.1	-170.2	69	73.5	2.3	110.3	I201 E202 R207 S208 E209	I201-R205 WeakPolarHBondContact O-CB 3.21Å; I201-R205 PolarHBondContact O-N 2.89Å; E202-R205 PolarHBondContact O-N 2.93Å; E202-R205 IonicContact OE1-CZ 3.14Å; E202-R205 IonicContact OE1-NE 3.52Å; E202-R205 IonicContact OE1-NH2 2.82Å; E202-R205 PolarHBondContact OE1-NH2 3.24Å; E202-R205 IonicContact OE2-CZ 2.69Å; E202-R205 IonicContact OE2-NE 3.52Å; E202-R205 PolarHBondContact OE2-NE 3.46Å; E202-R205 IonicContact OE2-NH2 3.51Å; R205-R207 VanDerWaalsContact C-N 3.31Å; R205-R207 PolarHBondContact O-N 3.49Å; R205-S208 PolarHBondContact O-N 2.95Å; R205-E209 IonicContact CZ-OE1 2.88Å; R205-E209 IonicContact CZ-OE2 3.85Å; R205-E209 IonicContact NH1-OE1 3.66Å; R205-E209 PolarHBondContact NH1-OE1 3.48Å; R205-E209 IonicContact NH1-OE2 2.8Å; R205-E209 PolarHBondContact NH1-OE2 3.04Å; R205-E209 WeakPolarHBondContact O-CG 3.44Å; R205-E209 PolarHBondContact O-N 3.3Å; R205-E209 VanDerWaalsContact O-N 3.08Å
206	K	90.2	Very high	88.5	Confident	100 Å²	100	54.7 Å²	54.7	44%	0.435	25%	0.254	S	S	.	.	H	α-helix	trans	-62	-37	177.5	-72.1	172.9	-174.8	163.1	0	112.5	E202 D203 K210	E202-K206 WeakPolarHBondContact O-CG 3.41Å; E202-K206 PolarHBondContact O-N 3.4Å; E202-K206 WeakPolarHBondContact OE1-CE 3.37Å; E202-K206 IonicContact OE1-NZ 2.74Å; D203-K206 PolarHBondContact O-N 2.85Å; K206-K210 WeakPolarHBondContact O-CG 3.24Å
207	R	91.1	Very high	88.7	Confident	30 Å²	30	52.6 Å²	52.6	11%	0.113	24%	0.243	C	C	.	.	H	α-helix	trans	-64.8	-51.4	176.3	173.9	-179.5	-64.6	115.5	3.8	110.6	D127 D203 E204 R205 E209 K210 F211	D127-R207 PolarHBondContact O-NH2 3.47Å; D127-R207 VanDerWaalsContact OD2-CD 3.3Å; D127-R207 WeakPolarHBondContact OD2-CD 3.41Å; D127-R207 WeakPolarHBondContact OD2-CG 3.34Å; D127-R207 IonicContact OD2-CZ 3.52Å; D127-R207 IonicContact OD2-NE 2.67Å; D127-R207 PolarHBondContact OD2-NE 2.91Å; D127-R207 IonicContact OD2-NH2 2.66Å; D203-R207 VanDerWaalsContact O-CB 3.25Å; D203-R207 WeakPolarHBondContact O-CB 3.32Å; D203-R207 PolarHBondContact O-N 3.3Å; E204-R207 PolarHBondContact O-N 3.42Å; E204-R207 WeakPolarHBondContact OE2-CD 3.46Å; E204-R207 IonicContact OE2-CZ 3.49Å; E204-R207 IonicContact OE2-NE 3.92Å; E204-R207 IonicContact OE2-NH1 3.8Å; E204-R207 PolarHBondContact OE2-NH1 2.77Å; R205-R207 VanDerWaalsContact C-N 3.31Å; R205-R207 PolarHBondContact O-N 3.49Å; R207-E209 VanDerWaalsContact C-N 3.29Å; R207-E209 PolarHBondContact O-N 3.03Å; R207-K210 WeakPolarHBondContact O-CB 3.46Å; R207-K210 PolarHBondContact O-N 3.36Å; R207-K210 VanDerWaalsContact O-N 3.1Å; R207-F211 HydrophobicContact CG-CE1 3.73Å; R207-F211 HydrophobicContact CG-CZ 4.31Å; R207-F211 VanDerWaalsContact O-CD1 3.3Å; R207-F211 WeakPolarHBondContact O-CD1 3.47Å; R207-F211 WeakPolarHBondContact O-CE1 3.44Å
208	S	91.2	Very high	88.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-55.6	-43.3	179.3	-65	0	0	0	0	111.8	E204 R205 K210 F211 L212	E204-S208 VanDerWaalsContact O-CB 3.26Å; E204-S208 WeakPolarHBondContact O-CB 3.37Å; E204-S208 PolarHBondContact O-N 3.39Å; E204-S208 PolarHBondContact O-OG 3.44Å; R205-S208 PolarHBondContact O-N 2.95Å; S208-K210 PolarHBondContact O-N 2.95Å; S208-K210 VanDerWaalsContact O-N 3.1Å; S208-F211 PolarHBondContact O-N 3.17Å; S208-L212 VanDerWaalsContact O-CB 3.32Å; S208-L212 WeakPolarHBondContact O-CB 3.29Å; S208-L212 PolarHBondContact O-N 3.15Å
209	E	91.7	Very high	88.9	Confident	107 Å²	107	60.9 Å²	60.9	50%	0.5	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-19.3	-179.7	-76.5	174.4	176	0	0	114.5	R205 R207	R205-E209 IonicContact CZ-OE1 2.88Å; R205-E209 IonicContact CZ-OE2 3.85Å; R205-E209 IonicContact NH1-OE1 3.66Å; R205-E209 PolarHBondContact NH1-OE1 3.48Å; R205-E209 IonicContact NH1-OE2 2.8Å; R205-E209 PolarHBondContact NH1-OE2 3.04Å; R205-E209 WeakPolarHBondContact O-CG 3.44Å; R205-E209 PolarHBondContact O-N 3.3Å; R205-E209 VanDerWaalsContact O-N 3.08Å; R207-E209 VanDerWaalsContact C-N 3.29Å; R207-E209 PolarHBondContact O-N 3.03Å
210	K	90.7	Very high	89	Confident	112 Å²	112	55.8 Å²	55.8	49%	0.487	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-26.3	179.7	-61.9	176.6	-171.2	174.8	0	113.4	H135 K206 R207 S208	H135-K210 HydrophobicContact CB-CB 4.05Å; H135-K210 VanDerWaalsContact ND1-CD 3.33Å; H135-K210 WeakPolarHBondContact ND1-CD 3.38Å; K206-K210 WeakPolarHBondContact O-CG 3.24Å; R207-K210 WeakPolarHBondContact O-CB 3.46Å; R207-K210 PolarHBondContact O-N 3.36Å; R207-K210 VanDerWaalsContact O-N 3.1Å; S208-K210 PolarHBondContact O-N 2.95Å; S208-K210 VanDerWaalsContact O-N 3.1Å
211	F	91	Very high	88.9	Confident	5 Å²	5	53.1 Å²	53.1	2%	0.022	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-138.7	-18.7	-172.2	61.4	-94.1	0	0	0	115.5	I124 L138 I142 R207 S208	I124-F211 HydrophobicContact CD1-CE2 3.76Å; I124-F211 HydrophobicContact CD1-CZ 3.91Å; I124-F211 HydrophobicContact CG1-CE2 4.25Å; I124-F211 HydrophobicContact CG1-CZ 3.96Å; I124-F211 HydrophobicContact CG2-CZ 4.49Å; L138-F211 HydrophobicContact CB-CB 4.11Å; L138-F211 HydrophobicContact CB-CG 4.43Å; I142-F211 HydrophobicContact CD1-CB 4.37Å; I142-F211 HydrophobicContact CD1-CD2 3.68Å; I142-F211 WeakPolarHBondContact CD1-O 3.47Å; R207-F211 HydrophobicContact CG-CE1 3.73Å; R207-F211 HydrophobicContact CG-CZ 4.31Å; R207-F211 VanDerWaalsContact O-CD1 3.3Å; R207-F211 WeakPolarHBondContact O-CD1 3.47Å; R207-F211 WeakPolarHBondContact O-CE1 3.44Å; S208-F211 PolarHBondContact O-N 3.17Å
212	L	90.6	Very high	88.8	Confident	14 Å²	14	56.6 Å²	56.6	7%	0.073	26%	0.262	C	S	.	.	S	Bend	trans	-95	151.9	179.8	-60.6	-178.9	0	0	0	112.5	I142 F165 S208	I142-L212 HydrophobicContact CD1-CD2 3.95Å; F165-L212 HydrophobicContact CE1-CD2 3.75Å; F165-L212 HydrophobicContact CZ-CD2 4.5Å; S208-L212 VanDerWaalsContact O-CB 3.32Å; S208-L212 WeakPolarHBondContact O-CB 3.29Å; S208-L212 PolarHBondContact O-N 3.15Å
213	P	88	Confident	88.9	Confident	24 Å²	24	54.2 Å²	54.2	16%	0.156	25%	0.252	C	S	.	.			trans	-60.2	153.4	165.2	-21.4	33	0	0	0	112.2	I146 Y158 D215 S216 C217	I146-P213 HydrophobicContact CD1-CG 3.52Å; Y158-P213 HydrophobicContact CE1-CB 4.33Å; Y158-P213 HydrophobicContact CE1-CG 4.3Å; P213-D215 VanDerWaalsContact C-N 3.29Å; P213-D215 PolarHBondContact O-N 2.89Å; P213-S216 PolarHBondContact O-N 3.35Å; P213-S216 VanDerWaalsContact O-N 3.08Å; P213-C217 PolarHBondContact O-N 3.49Å; P213-C217 PolarHBondContact O-SG 3.05Å
214	K	87.5	Confident	88.7	Confident	169 Å²	169	51.7 Å²	51.7	74%	0.735	24%	0.238	S	C	*	.	H	α-helix	trans	-54.2	-41.5	-177.7	-171.4	176.8	-177.9	178.9	0	113.5	C217 N218	K214-C217 WeakPolarHBondContact O-CB 3.48Å; K214-C217 PolarHBondContact O-N 3.44Å; K214-N218 PolarHBondContact O-N 3.47Å; K214-N218 VanDerWaalsContact O-N 3.11Å; K214-N218 PolarHBondContact O-ND2 3.15Å
215	D	86	Confident	88.4	Confident	95 Å²	95	52.5 Å²	52.5	51%	0.508	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-40.1	180	-64.8	-27.5	0	0	0	112	P213 C217 N218 R219	P213-D215 VanDerWaalsContact C-N 3.29Å; P213-D215 PolarHBondContact O-N 2.89Å; D215-C217 VanDerWaalsContact C-N 3.35Å; D215-N218 PolarHBondContact O-N 3.44Å; D215-R219 PolarHBondContact O-N 3.46Å; D215-R219 VanDerWaalsContact O-N 3.07Å
216	S	87.9	Confident	88.2	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-66.9	-35.3	173.5	-65.2	0	0	0	0	112.3	Y161 E166 P213 N218 R219 M220	Y161-S216 VanDerWaalsContact CE1-OG 3.29Å; Y161-S216 WeakPolarHBondContact CE1-OG 3.47Å; Y161-S216 VanDerWaalsContact OH-CB 3.29Å; Y161-S216 WeakPolarHBondContact OH-CB 3.47Å; Y161-S216 PolarHBondContact OH-OG 3.03Å; E166-S216 WeakPolarHBondContact OE1-CB 3.45Å; E166-S216 PolarHBondContact OE1-OG 3.49Å; P213-S216 PolarHBondContact O-N 3.35Å; P213-S216 VanDerWaalsContact O-N 3.08Å; S216-N218 VanDerWaalsContact C-N 3.34Å; S216-N218 PolarHBondContact O-N 3.38Å; S216-R219 PolarHBondContact O-N 2.94Å; S216-M220 WeakPolarHBondContact O-CB 3.35Å; S216-M220 PolarHBondContact O-N 2.76Å
217	C	88.5	Confident	88.1	Confident	7 Å²	7	47.2 Å²	47.2	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-60	-45.5	173.5	-63.1	0	0	0	0	111.2	P213 K214 D215 M220 A221	P213-C217 PolarHBondContact O-N 3.49Å; P213-C217 PolarHBondContact O-SG 3.05Å; K214-C217 WeakPolarHBondContact O-CB 3.48Å; K214-C217 PolarHBondContact O-N 3.44Å; D215-C217 VanDerWaalsContact C-N 3.35Å; C217-M220 PolarHBondContact O-N 3.14Å; C217-A221 WeakPolarHBondContact O-CB 3.47Å; C217-A221 PolarHBondContact O-N 3.07Å
218	N	86.4	Confident	87.7	Confident	98 Å²	98	45.9 Å²	45.9	52%	0.524	22%	0.219	S	C	.	.	H	α-helix	trans	-63.1	-42.9	177.7	-67.4	-30.9	0	0	0	111.6	K214 D215 S216 A221 K222	K214-N218 PolarHBondContact O-N 3.47Å; K214-N218 VanDerWaalsContact O-N 3.11Å; K214-N218 PolarHBondContact O-ND2 3.15Å; D215-N218 PolarHBondContact O-N 3.44Å; S216-N218 VanDerWaalsContact C-N 3.34Å; S216-N218 PolarHBondContact O-N 3.38Å; N218-A221 PolarHBondContact O-N 2.94Å; N218-K222 PolarHBondContact O-N 2.95Å
219	R	87.6	Confident	87.1	Confident	120 Å²	120	46 Å²	46	45%	0.453	22%	0.22	S	C	.	.	H	α-helix	trans	-62.1	-43.9	175	-73.4	-165.7	-81.2	-129	1.5	111.7	E166 D215 S216 K222 V223	E166-R219 IonicContact OE1-CZ 2.63Å; E166-R219 IonicContact OE1-NE 2.69Å; E166-R219 PolarHBondContact OE1-NE 3.16Å; E166-R219 IonicContact OE1-NH2 3.67Å; E166-R219 PolarHBondContact OE1-NH2 2.7Å; E166-R219 IonicContact OE2-CZ 3.81Å; E166-R219 IonicContact OE2-NE 3.7Å; E166-R219 IonicContact OE2-NH2 3.33Å; E166-R219 PolarHBondContact OE2-NH2 2.88Å; D215-R219 PolarHBondContact O-N 3.46Å; D215-R219 VanDerWaalsContact O-N 3.07Å; S216-R219 PolarHBondContact O-N 2.94Å; R219-K222 PolarHBondContact O-N 3.45Å; R219-V223 VanDerWaalsContact O-CG2 3.3Å; R219-V223 WeakPolarHBondContact O-CG2 3.37Å; R219-V223 PolarHBondContact O-N 2.93Å
220	M	88.6	Confident	86.2	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-43.7	178.6	-168.5	57.7	65.4	0	0	111.9	H169 I170 T173 E204 S216 C217 K222 V223 C224	H169-M220 WeakPolarHBondContact CD2-CE 3.48Å; H169-M220 VanDerWaalsContact NE2-CE 3.32Å; H169-M220 WeakPolarHBondContact NE2-CE 3Å; I170-M220 HydrophobicContact CG1-CE 3.81Å; T173-M220 HydrophobicContact CG2-SD 3.46Å; T173-M220 WeakPolarHBondContact CG2-SD 3.36Å; E204-M220 HydrophobicContact CG-CG 4.31Å; S216-M220 WeakPolarHBondContact O-CB 3.35Å; S216-M220 PolarHBondContact O-N 2.76Å; C217-M220 PolarHBondContact O-N 3.14Å; M220-K222 VanDerWaalsContact C-N 3.34Å; M220-K222 PolarHBondContact O-N 3.01Å; M220-V223 PolarHBondContact O-N 3.13Å; M220-C224 PolarHBondContact O-N 3.13Å; M220-C224 PolarHBondContact O-SG 3.41Å
221	A	86.1	Confident	85.2	Confident	19 Å²	19	47.7 Å²	47.7	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-43.8	176.2	0	0	0	0	0	111.8	C217 N218 C224 Q225	C217-A221 WeakPolarHBondContact O-CB 3.47Å; C217-A221 PolarHBondContact O-N 3.07Å; N218-A221 PolarHBondContact O-N 2.94Å; A221-C224 PolarHBondContact O-N 2.84Å; A221-Q225 VanDerWaalsContact O-CG 3.24Å; A221-Q225 WeakPolarHBondContact O-CG 3.41Å; A221-Q225 PolarHBondContact O-N 3.17Å
222	K	86.2	Confident	84.3	Confident	79 Å²	79	49 Å²	49	34%	0.343	23%	0.232	S	C	.	.	H	α-helix	trans	-61.3	-45.9	175.4	-176.5	168.7	-176.2	156.7	0	111.7	N218 R219 M220 C224 Q225 E226 N262	N218-K222 PolarHBondContact O-N 2.95Å; R219-K222 PolarHBondContact O-N 3.45Å; M220-K222 VanDerWaalsContact C-N 3.34Å; M220-K222 PolarHBondContact O-N 3.01Å; K222-C224 VanDerWaalsContact C-N 3.35Å; K222-C224 PolarHBondContact O-N 2.88Å; K222-Q225 WeakPolarHBondContact O-CB 3.41Å; K222-Q225 PolarHBondContact O-N 3.02Å; K222-E226 WeakPolarHBondContact CE-OE1 3.45Å; K222-E226 HydrophobicContact CG-CG 4.46Å; K222-E226 WeakPolarHBondContact O-CG 3.35Å; K222-E226 PolarHBondContact O-N 3.34Å; K222-N262 PolarHBondContact NZ-OXT 3.06Å
223	V	87.7	Confident	83.4	Confident	14 Å²	14	51.5 Å²	51.5	9%	0.085	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-44	178	168.1	0	0	0	0	111.7	I170 K174 R219 M220 Q225 E226 V227	I170-V223 HydrophobicContact CG2-CG1 4.21Å; I170-V223 HydrophobicContact CG2-CG2 3.88Å; K174-V223 HydrophobicContact CD-CG1 4.11Å; K174-V223 HydrophobicContact CG-CG1 3.34Å; R219-V223 VanDerWaalsContact O-CG2 3.3Å; R219-V223 WeakPolarHBondContact O-CG2 3.37Å; R219-V223 PolarHBondContact O-N 2.93Å; M220-V223 PolarHBondContact O-N 3.13Å; V223-Q225 VanDerWaalsContact C-N 3.34Å; V223-Q225 PolarHBondContact O-N 3.29Å; V223-E226 PolarHBondContact O-N 2.91Å; V223-V227 WeakPolarHBondContact O-CG2 3.37Å; V223-V227 PolarHBondContact O-N 2.97Å
224	C	87	Confident	82.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-65.4	-39.9	178.4	-64.2	0	0	0	0	111.7	M220 A221 K222 L228	M220-C224 PolarHBondContact O-N 3.13Å; M220-C224 PolarHBondContact O-SG 3.41Å; A221-C224 PolarHBondContact O-N 2.84Å; K222-C224 VanDerWaalsContact C-N 3.35Å; K222-C224 PolarHBondContact O-N 2.88Å; C224-L228 VanDerWaalsContact O-CB 3.28Å; C224-L228 WeakPolarHBondContact O-CB 3.4Å; C224-L228 WeakPolarHBondContact O-CG 3.5Å; C224-L228 PolarHBondContact O-N 2.98Å
225	Q	84.8	Confident	81.7	Confident	20 Å²	20	51 Å²	51	9%	0.093	25%	0.249	C	C	.	.	H	α-helix	trans	-62.5	-45.6	174.1	-72.2	168.5	13.2	0	0	111.4	I201 A221 K222 V223 V229 F256 A260	I201-Q225 HydrophobicContact CD1-CG 4.15Å; I201-Q225 HydrophobicContact CG2-CG 4.26Å; A221-Q225 VanDerWaalsContact O-CG 3.24Å; A221-Q225 WeakPolarHBondContact O-CG 3.41Å; A221-Q225 PolarHBondContact O-N 3.17Å; K222-Q225 WeakPolarHBondContact O-CB 3.41Å; K222-Q225 PolarHBondContact O-N 3.02Å; V223-Q225 VanDerWaalsContact C-N 3.34Å; V223-Q225 PolarHBondContact O-N 3.29Å; Q225-V229 WeakPolarHBondContact O-CB 3.47Å; Q225-V229 VanDerWaalsContact O-CG2 3.24Å; Q225-V229 WeakPolarHBondContact O-CG2 3.42Å; Q225-V229 PolarHBondContact O-N 2.83Å; Q225-F256 HydrophobicContact CG-CD1 4.14Å; Q225-A260 HydrophobicContact CB-CB 4.34Å
226	E	84.4	Confident	81	Confident	54 Å²	54	46.5 Å²	46.5	25%	0.252	23%	0.225	S	C	.	.	I	π-helix	trans	-58.4	-52	176.4	-74.4	174.5	-171	0	0	111.2	K222 V223 R230	K222-E226 WeakPolarHBondContact CE-OE1 3.45Å; K222-E226 HydrophobicContact CG-CG 4.46Å; K222-E226 WeakPolarHBondContact O-CG 3.35Å; K222-E226 PolarHBondContact O-N 3.34Å; V223-E226 PolarHBondContact O-N 2.91Å; E226-R230 WeakPolarHBondContact O-CA 3.3Å; E226-R230 WeakPolarHBondContact O-CB 3.37Å; E226-R230 PolarHBondContact O-N 3.43Å
227	V	86.1	Confident	80.1	Confident	18 Å²	18	49.7 Å²	49.7	11%	0.109	24%	0.241	C	C	.	.	I	π-helix	trans	-66.3	-42.5	-176.5	174.1	0	0	0	0	112.6	K174 K178 V223	K174-V227 HydrophobicContact CB-CG2 4.02Å; K174-V227 HydrophobicContact CG-CG2 3.78Å; K178-V227 HydrophobicContact CB-CG1 4.26Å; V223-V227 WeakPolarHBondContact O-CG2 3.37Å; V223-V227 PolarHBondContact O-N 2.97Å
228	L	82.9	Confident	79.2	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	27%	0.272	C	S	.	.	I	π-helix	trans	-80.3	-26.5	-174.5	-67.9	169.9	0	0	0	113.5	Y177 Y193 I197 I201 C224	Y177-L228 HydrophobicContact CD1-CD1 3.94Å; Y177-L228 HydrophobicContact CD1-CD2 3.96Å; Y177-L228 HydrophobicContact CD1-CG 4.27Å; Y177-L228 HydrophobicContact CE1-CD1 4.34Å; Y177-L228 HydrophobicContact CG-CD1 4.33Å; Y177-L228 HydrophobicContact CG-CD2 4.33Å; Y177-L228 HydrophobicContact CG-CG 4.4Å; Y193-L228 PolarHBondContact OH-O 3.08Å; I197-L228 HydrophobicContact CB-CB 4.4Å; I197-L228 HydrophobicContact CB-CD1 4.49Å; I197-L228 HydrophobicContact CG2-CB 4.27Å; I197-L228 HydrophobicContact CG2-CD2 4.22Å; I201-L228 HydrophobicContact CD1-CD1 4.09Å; I201-L228 HydrophobicContact CG1-CD1 3.57Å; C224-L228 VanDerWaalsContact O-CB 3.28Å; C224-L228 WeakPolarHBondContact O-CB 3.4Å; C224-L228 WeakPolarHBondContact O-CG 3.5Å; C224-L228 PolarHBondContact O-N 2.98Å
229	V	78.4	Confident	78.4	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	25%	0.253	C	S	.	.	I	π-helix	trans	-102.7	-45.9	-175.5	-176.9	0	0	0	0	112.1	I197 Q225 D231 H232 Y233 L236 I257 A260	I197-V229 HydrophobicContact CD1-CG2 4.43Å; Q225-V229 WeakPolarHBondContact O-CB 3.47Å; Q225-V229 VanDerWaalsContact O-CG2 3.24Å; Q225-V229 WeakPolarHBondContact O-CG2 3.42Å; Q225-V229 PolarHBondContact O-N 2.83Å; V229-D231 PolarHBondContact O-N 3.07Å; V229-H232 CarbonylContact O-C 3.46Å; V229-H232 PolarHBondContact O-N 3.04Å; V229-Y233 WeakPolarHBondContact O-CA 3.32Å; V229-Y233 PolarHBondContact O-N 2.88Å; V229-L236 HydrophobicContact CG1-CD1 4.1Å; V229-I257 HydrophobicContact CG1-CG1 4.25Å; V229-A260 HydrophobicContact CB-CB 4.48Å
230	R	73.3	Confident	77.3	Confident	161 Å²	161	49.1 Å²	49.1	61%	0.608	24%	0.241	S	C	*	.	I	π-helix	trans	-66.8	-40.4	-169.3	-169.9	-180	176.4	174.8	-0.9	112.2	E226 H232 Y233	E226-R230 WeakPolarHBondContact O-CA 3.3Å; E226-R230 WeakPolarHBondContact O-CB 3.37Å; E226-R230 PolarHBondContact O-N 3.43Å; R230-H232 PolarHBondContact O-N 3.45Å; R230-H232 VanDerWaalsContact O-N 3.16Å; R230-Y233 PolarHBondContact O-N 2.92Å
231	D	71	Confident	76.3	Confident	94 Å²	94	53.1 Å²	53.1	50%	0.503	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.6	-177.8	-72.8	2.3	0	0	0	112.7	V229	V229-D231 PolarHBondContact O-N 3.07Å
232	H	70.8	Confident	75.3	Confident	33 Å²	33	60.1 Å²	60.1	15%	0.153	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	13.8	-178	-54.9	-52	0	0	0	113	L185 Y193 V229 R230 D234 S235 L236	L185-H232 WeakPolarHBondContact CD1-CE1 3.49Å; L185-H232 WeakPolarHBondContact CD1-ND1 3.42Å; L185-H232 WeakPolarHBondContact CD1-NE2 3.22Å; Y193-H232 AromaticContact CZ-CD2 3.91Å; Y193-H232 PolarHBondContact OH-CD2 3.41Å; V229-H232 CarbonylContact O-C 3.46Å; V229-H232 PolarHBondContact O-N 3.04Å; R230-H232 PolarHBondContact O-N 3.45Å; R230-H232 VanDerWaalsContact O-N 3.16Å; H232-D234 VanDerWaalsContact C-N 3.3Å; H232-D234 PolarHBondContact O-N 3.38Å; H232-S235 PolarHBondContact O-N 3.34Å; H232-S235 VanDerWaalsContact O-N 3.13Å; H232-L236 HydrophobicContact CB-CD1 4.27Å; H232-L236 HydrophobicContact CB-CG 4.26Å; H232-L236 WeakPolarHBondContact O-CB 3.36Å; H232-L236 WeakPolarHBondContact O-CG 3.45Å; H232-L236 PolarHBondContact O-N 3.35Å
233	Y	72.4	Confident	74.1	Confident	65 Å²	65	58 Å²	58	26%	0.255	29%	0.286	S	S	.	.	H	α-helix	trans	-53.7	-45.7	-171.7	-179.7	-109	0	0	0	112.8	V229 R230 S235 L236 L237 I257 F261	V229-Y233 WeakPolarHBondContact O-CA 3.32Å; V229-Y233 PolarHBondContact O-N 2.88Å; R230-Y233 PolarHBondContact O-N 2.92Å; Y233-S235 PolarHBondContact O-N 3.19Å; Y233-L236 WeakPolarHBondContact O-CB 3.22Å; Y233-L236 PolarHBondContact O-N 2.66Å; Y233-L237 HydrophobicContact CD1-CD1 3.99Å; Y233-L237 HydrophobicContact CD1-CG 4.35Å; Y233-L237 HydrophobicContact CE1-CD1 3.45Å; Y233-L237 VanDerWaalsContact CE1-CD1 3.45Å; Y233-L237 HydrophobicContact CE1-CD2 4.42Å; Y233-L237 HydrophobicContact CE1-CG 4Å; Y233-L237 HydrophobicContact CE2-CD2 4.09Å; Y233-L237 HydrophobicContact CE2-CG 4.23Å; Y233-L237 WeakPolarHBondContact O-CG 3.5Å; Y233-L237 PolarHBondContact O-N 3.37Å; Y233-I257 HydrophobicContact CE2-CD1 4.32Å; Y233-I257 HydrophobicContact CE2-CG2 3.92Å; Y233-F261 AromaticContact CD1-CZ 3.89Å; Y233-F261 HydrophobicContact CD1-CZ 3.89Å; Y233-F261 HydrophobicContact CD2-CD2 4.41Å; Y233-F261 AromaticContact CD2-CE2 3.24Å; Y233-F261 HydrophobicContact CD2-CE2 3.24Å; Y233-F261 AromaticContact CD2-CZ 3.32Å; Y233-F261 HydrophobicContact CD2-CZ 3.32Å; Y233-F261 HydrophobicContact CE1-CZ 4.12Å; Y233-F261 HydrophobicContact CE2-CD2 4.12Å; Y233-F261 AromaticContact CE2-CE2 3.31Å; Y233-F261 HydrophobicContact CE2-CE2 3.31Å; Y233-F261 AromaticContact CE2-CZ 3.61Å; Y233-F261 HydrophobicContact CE2-CZ 3.61Å; Y233-F261 HydrophobicContact CG-CE1 4.49Å; Y233-F261 AromaticContact CG-CE2 3.91Å; Y233-F261 HydrophobicContact CG-CE2 3.91Å; Y233-F261 AromaticContact CG-CZ 3.45Å; Y233-F261 HydrophobicContact CG-CZ 3.45Å; Y233-F261 VanDerWaalsContact CG-CZ 3.45Å; Y233-F261 AromaticContact CZ-CZ 3.99Å
234	D	70.8	Confident	72.6	Confident	125 Å²	125	61 Å²	61	67%	0.668	31%	0.305	S	S	*	.	H	α-helix	trans	-63.5	-44.8	-178.6	-63.2	-32.6	0	0	0	111.8	H232 L236 L237	H232-D234 VanDerWaalsContact C-N 3.3Å; H232-D234 PolarHBondContact O-N 3.38Å; D234-L236 VanDerWaalsContact C-N 3.3Å; D234-L236 PolarHBondContact O-N 2.93Å; D234-L237 PolarHBondContact O-N 2.97Å
235	S	69.2	Low	71.4	Confident	57 Å²	57	65.7 Å²	65.7	40%	0.399	34%	0.344	S	S	.	.	H	α-helix	trans	-67.3	-31.3	176.5	-54.2	0	0	0	0	112.7	H232 Y233	H232-S235 PolarHBondContact O-N 3.34Å; H232-S235 VanDerWaalsContact O-N 3.13Å; Y233-S235 PolarHBondContact O-N 3.19Å
236	L	69.8	Low	70.5	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	36%	0.355	C	S	.	.	H	α-helix	trans	-70.6	-40.4	176.7	-68.8	172	0	0	0	111.2	I190 Y193 M194 V229 H232 Y233 D234 E238 I239 I240 F253	I190-L236 HydrophobicContact CG2-CD2 3.86Å; Y193-L236 HydrophobicContact CD1-CD2 4.23Å; Y193-L236 HydrophobicContact CE1-CD2 4.46Å; M194-L236 HydrophobicContact CE-CB 3.86Å; M194-L236 HydrophobicContact CE-CD2 3.31Å; M194-L236 HydrophobicContact CE-CG 4.18Å; M194-L236 WeakPolarHBondContact CE-O 3.4Å; M194-L236 HydrophobicContact CG-CD2 3.52Å; M194-L236 HydrophobicContact SD-CD2 4.16Å; V229-L236 HydrophobicContact CG1-CD1 4.1Å; H232-L236 HydrophobicContact CB-CD1 4.27Å; H232-L236 HydrophobicContact CB-CG 4.26Å; H232-L236 WeakPolarHBondContact O-CB 3.36Å; H232-L236 WeakPolarHBondContact O-CG 3.45Å; H232-L236 PolarHBondContact O-N 3.35Å; Y233-L236 WeakPolarHBondContact O-CB 3.22Å; Y233-L236 PolarHBondContact O-N 2.66Å; D234-L236 VanDerWaalsContact C-N 3.3Å; D234-L236 PolarHBondContact O-N 2.93Å; L236-E238 VanDerWaalsContact C-N 3.29Å; L236-E238 PolarHBondContact O-N 3.4Å; L236-I239 PolarHBondContact O-N 3.49Å; L236-I239 VanDerWaalsContact O-N 3.12Å; L236-I240 WeakPolarHBondContact O-CG1 3.45Å; L236-I240 PolarHBondContact O-N 3.46Å; L236-F253 HydrophobicContact CB-CZ 4.15Å; L236-F253 HydrophobicContact CD1-CZ 4.42Å
237	L	70.2	Confident	69.5	Low	69 Å²	69	73.3 Å²	73.3	36%	0.361	38%	0.382	S	S	.	.	H	α-helix	trans	-58.5	-37.3	179.1	-76.4	-178.3	0	0	0	113.1	Y233 D234 I239 I240 P241	Y233-L237 HydrophobicContact CD1-CD1 3.99Å; Y233-L237 HydrophobicContact CD1-CG 4.35Å; Y233-L237 HydrophobicContact CE1-CD1 3.45Å; Y233-L237 VanDerWaalsContact CE1-CD1 3.45Å; Y233-L237 HydrophobicContact CE1-CD2 4.42Å; Y233-L237 HydrophobicContact CE1-CG 4Å; Y233-L237 HydrophobicContact CE2-CD2 4.09Å; Y233-L237 HydrophobicContact CE2-CG 4.23Å; Y233-L237 WeakPolarHBondContact O-CG 3.5Å; Y233-L237 PolarHBondContact O-N 3.37Å; D234-L237 PolarHBondContact O-N 2.97Å; L237-I239 PolarHBondContact O-N 3.22Å; L237-I240 HydrophobicContact CD2-CD1 3.61Å; L237-I240 PolarHBondContact O-N 2.85Å; L237-P241 WeakPolarHBondContact O-CD 3.29Å
238	E	70	Confident	68.6	Low	150 Å²	150	77.7 Å²	77.7	70%	0.701	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.8	179.7	-68.4	-171.4	166.1	0	0	113.4	L236	L236-E238 VanDerWaalsContact C-N 3.29Å; L236-E238 PolarHBondContact O-N 3.4Å
239	I	68.3	Low	67.7	Low	23 Å²	23	81.5 Å²	81.5	12%	0.118	42%	0.421	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-15.7	-171.5	-68.8	174.5	0	0	0	112.3	I190 M194 L236 L237 P241 K242 I243	I190-I239 HydrophobicContact CB-CD1 3.22Å; I190-I239 HydrophobicContact CD1-CD1 3.33Å; I190-I239 HydrophobicContact CG1-CD1 3.84Å; I190-I239 HydrophobicContact CG2-CB 4.39Å; I190-I239 HydrophobicContact CG2-CD1 3.3Å; I190-I239 HydrophobicContact CG2-CG1 4.38Å; M194-I239 HydrophobicContact CE-CB 4Å; M194-I239 HydrophobicContact CE-CG2 3.98Å; L236-I239 PolarHBondContact O-N 3.49Å; L236-I239 VanDerWaalsContact O-N 3.12Å; L237-I239 PolarHBondContact O-N 3.22Å; I239-P241 VanDerWaalsContact C-N 3.26Å; I239-K242 WeakPolarHBondContact O-CA 3.43Å; I239-K242 WeakPolarHBondContact O-CB 3.34Å; I239-K242 PolarHBondContact O-N 2.86Å; I239-I243 HydrophobicContact CG2-CD1 3.6Å; I239-I243 HydrophobicContact CG2-CG1 3.99Å; I239-I243 PolarHBondContact O-N 3.47Å
240	I	65.8	Low	67.1	Low	41 Å²	41	85.8 Å²	85.8	21%	0.21	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-43.8	171.2	-64.6	177.5	0	0	0	112.2	L236 L237 K242 I243 T244 F253 I257	L236-I240 WeakPolarHBondContact O-CG1 3.45Å; L236-I240 PolarHBondContact O-N 3.46Å; L237-I240 HydrophobicContact CD2-CD1 3.61Å; L237-I240 PolarHBondContact O-N 2.85Å; I240-K242 PolarHBondContact O-N 2.89Å; I240-I243 PolarHBondContact O-N 3.34Å; I240-T244 WeakPolarHBondContact O-CG2 3.4Å; I240-F253 HydrophobicContact CD1-CD1 4.43Å; I240-F253 HydrophobicContact CD1-CE1 3.72Å; I240-F253 HydrophobicContact CG1-CD1 4.3Å; I240-F253 HydrophobicContact CG1-CE1 3.65Å; I240-I257 HydrophobicContact CD1-CD1 4.1Å
241	P	67	Low	66.9	Low	85 Å²	85	80.3 Å²	80.3	55%	0.552	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-27.8	177.1	-23	35.1	0	0	0	113.8	L237 I239 T244	L237-P241 WeakPolarHBondContact O-CD 3.29Å; I239-P241 VanDerWaalsContact C-N 3.26Å; P241-T244 WeakPolarHBondContact O-CG2 2.82Å; P241-T244 PolarHBondContact O-OG1 3.25Å
242	K	64.9	Low	66.8	Low	166 Å²	166	81.2 Å²	81.2	72%	0.722	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-25.9	-176.6	-64	178.1	-179.5	171.3	0	113.4	I239 I240 T244	I239-K242 WeakPolarHBondContact O-CA 3.43Å; I239-K242 WeakPolarHBondContact O-CB 3.34Å; I239-K242 PolarHBondContact O-N 2.86Å; I240-K242 PolarHBondContact O-N 2.89Å; K242-T244 VanDerWaalsContact C-N 3.25Å; K242-T244 PolarHBondContact O-N 3.43Å
243	I	60.7	Low	66.6	Low	35 Å²	35	80.5 Å²	80.5	18%	0.179	43%	0.429	C	S	.	.	S	Bend	trans	-83.4	-2.4	179	-66	166.7	0	0	0	112.1	M194 I239 I240 A245 D246	M194-I243 HydrophobicContact CE-CD1 3.94Å; M194-I243 HydrophobicContact SD-CD1 3.13Å; M194-I243 WeakPolarHBondContact SD-CD1 3.22Å; I239-I243 HydrophobicContact CG2-CD1 3.6Å; I239-I243 HydrophobicContact CG2-CG1 3.99Å; I239-I243 PolarHBondContact O-N 3.47Å; I240-I243 PolarHBondContact O-N 3.34Å; I243-A245 PolarHBondContact O-N 2.87Å; I243-D246 PolarHBondContact O-N 3.01Å
244	T	56.6	Low	66.5	Low	76 Å²	76	81.5 Å²	81.5	47%	0.466	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-1.3	-176.4	52.1	0	0	0	0	116.5	I240 P241 K242	I240-T244 WeakPolarHBondContact O-CG2 3.4Å; P241-T244 WeakPolarHBondContact O-CG2 2.82Å; P241-T244 PolarHBondContact O-OG1 3.25Å; K242-T244 VanDerWaalsContact C-N 3.25Å; K242-T244 PolarHBondContact O-N 3.43Å
245	A	62	Low	66.4	Low	101 Å²	101	82.6 Å²	82.6	84%	0.835	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-17.8	174.3	0	0	0	0	0	114.4	I243	I243-A245 PolarHBondContact O-N 2.87Å
246	D	65.1	Low	66.3	Low	62 Å²	62	81.4 Å²	81.4	33%	0.332	42%	0.42	S	S	.	.			trans	-118.9	96.4	178.9	-170	-24.4	0	0	0	110.7	I243 N248 K249 K250	I243-D246 PolarHBondContact O-N 3.01Å; D246-N248 PolarHBondContact O-N 3.33Å; D246-N248 WeakPolarHBondContact OD1-CB 3.32Å; D246-N248 PolarHBondContact OD1-N 3.12Å; D246-N248 VanDerWaalsContact OD1-N 3.17Å; D246-K249 HydrophobicContact CB-CB 4.22Å; D246-K249 HydrophobicContact CB-CD 4.05Å; D246-K249 HydrophobicContact CB-CG 4.2Å; D246-K249 PolarHBondContact O-N 3.23Å; D246-K249 PolarHBondContact OD1-N 3.38Å; D246-K249 VanDerWaalsContact OD2-CD 3.25Å; D246-K249 WeakPolarHBondContact OD2-CD 3.37Å; D246-K249 WeakPolarHBondContact OD2-CE 3.46Å; D246-K249 WeakPolarHBondContact OD2-CG 3.45Å; D246-K249 IonicContact OD2-NZ 2.99Å; D246-K250 PolarHBondContact O-N 3.4Å
247	E	63.7	Low	66.2	Low	172 Å²	172	82 Å²	82	80%	0.804	42%	0.424	S	S	*	.	H	α-helix	trans	-58.6	-30.9	-177.5	-67.4	-166.3	149.2	0	0	113	G251	E247-G251 PolarHBondContact O-N 3.04Å; E247-G251 VanDerWaalsContact O-N 3.17Å
248	N	67.7	Low	66.2	Low	110 Å²	110	84.9 Å²	84.9	59%	0.588	43%	0.433	S	S	*	.	H	α-helix	trans	-72.1	-39.7	-177.9	-164.2	0.6	0	0	0	111.3	D246 K252	D246-N248 PolarHBondContact O-N 3.33Å; D246-N248 WeakPolarHBondContact OD1-CB 3.32Å; D246-N248 PolarHBondContact OD1-N 3.12Å; D246-N248 VanDerWaalsContact OD1-N 3.17Å; N248-K252 PolarHBondContact O-N 3.43Å
249	K	64.6	Low	66	Low	82 Å²	82	79.3 Å²	79.3	36%	0.357	41%	0.41	S	S	.	.	H	α-helix	trans	-67.5	-41.3	175.7	-69.5	-179.1	-176	178.1	0	111.7	E195 D246 G251 K252 F253	E195-K249 IonicContact OE1-NZ 3.81Å; E195-K249 PolarHBondContact OE1-NZ 3.24Å; D246-K249 HydrophobicContact CB-CB 4.22Å; D246-K249 HydrophobicContact CB-CD 4.05Å; D246-K249 HydrophobicContact CB-CG 4.2Å; D246-K249 PolarHBondContact O-N 3.23Å; D246-K249 PolarHBondContact OD1-N 3.38Å; D246-K249 VanDerWaalsContact OD2-CD 3.25Å; D246-K249 WeakPolarHBondContact OD2-CD 3.37Å; D246-K249 WeakPolarHBondContact OD2-CE 3.46Å; D246-K249 WeakPolarHBondContact OD2-CG 3.45Å; D246-K249 IonicContact OD2-NZ 2.99Å; K249-G251 PolarHBondContact O-N 3.4Å; K249-K252 PolarHBondContact O-N 3.44Å; K249-F253 WeakPolarHBondContact O-CB 3.45Å; K249-F253 PolarHBondContact O-N 2.85Å
250	K	65.6	Low	65.7	Low	93 Å²	93	78.7 Å²	78.7	40%	0.404	41%	0.409	S	S	.	.	H	α-helix	trans	-60.2	-43.3	177.7	-173.1	-179.8	179.3	-177.2	0	112.5	D246 F253 M254	D246-K250 PolarHBondContact O-N 3.4Å; K250-F253 PolarHBondContact O-N 2.8Å; K250-M254 HydrophobicContact CG-CG 4.45Å; K250-M254 WeakPolarHBondContact O-CB 3.45Å; K250-M254 WeakPolarHBondContact O-CG 3.47Å; K250-M254 PolarHBondContact O-N 2.65Å
251	G	69.5	Low	65.6	Low	46 Å²	46	81.3 Å²	81.3	47%	0.474	42%	0.419	S	S	.	.	H	α-helix	trans	-61.5	-48.1	179.6	0	0	0	0	0	112.7	E247 K249 Y255	E247-G251 PolarHBondContact O-N 3.04Å; E247-G251 VanDerWaalsContact O-N 3.17Å; K249-G251 PolarHBondContact O-N 3.4Å; G251-Y255 WeakPolarHBondContact O-CB 3.45Å; G251-Y255 PolarHBondContact O-N 3.15Å
252	K	67.7	Low	65	Low	112 Å²	112	84.8 Å²	84.8	49%	0.487	43%	0.433	S	S	.	.	H	α-helix	trans	-61.3	-46.4	175.8	-68.9	-178.8	-177.5	-179.4	0	111.3	N248 K249 Y255 F256	N248-K252 PolarHBondContact O-N 3.43Å; K249-K252 PolarHBondContact O-N 3.44Å; K252-Y255 WeakPolarHBondContact O-CB 3.39Å; K252-Y255 PolarHBondContact O-N 3.46Å; K252-F256 HydrophobicContact CB-CD2 4.44Å; K252-F256 HydrophobicContact CB-CE2 4.22Å; K252-F256 WeakPolarHBondContact O-CD2 3.19Å; K252-F256 PolarHBondContact O-N 2.93Å
253	F	67.3	Low	65	Low	19 Å²	19	80.7 Å²	80.7	8%	0.083	42%	0.418	C	S	.	.	H	α-helix	trans	-63	-45	-178.9	-172.7	-105	0	0	0	112.8	M194 L236 I240 K249 K250 Y255 F256 I257	M194-F253 HydrophobicContact CE-CE1 4.49Å; M194-F253 HydrophobicContact CE-CE2 4.37Å; M194-F253 HydrophobicContact CE-CZ 3.95Å; M194-F253 HydrophobicContact CG-CE2 4.13Å; M194-F253 HydrophobicContact SD-CD2 4.37Å; M194-F253 HydrophobicContact SD-CE2 3.92Å; M194-F253 HydrophobicContact SD-CZ 4.03Å; L236-F253 HydrophobicContact CB-CZ 4.15Å; L236-F253 HydrophobicContact CD1-CZ 4.42Å; I240-F253 HydrophobicContact CD1-CD1 4.43Å; I240-F253 HydrophobicContact CD1-CE1 3.72Å; I240-F253 HydrophobicContact CG1-CD1 4.3Å; I240-F253 HydrophobicContact CG1-CE1 3.65Å; K249-F253 WeakPolarHBondContact O-CB 3.45Å; K249-F253 PolarHBondContact O-N 2.85Å; K250-F253 PolarHBondContact O-N 2.8Å; F253-Y255 VanDerWaalsContact C-N 3.29Å; F253-Y255 PolarHBondContact O-N 3.1Å; F253-F256 PolarHBondContact O-N 2.93Å; F253-I257 HydrophobicContact CD1-CD1 3.79Å; F253-I257 HydrophobicContact CD1-CG1 4.44Å; F253-I257 HydrophobicContact CE1-CD1 3.16Å; F253-I257 HydrophobicContact CE1-CG1 4.04Å; F253-I257 HydrophobicContact CE2-CD1 4.48Å; F253-I257 HydrophobicContact CZ-CD1 3.57Å; F253-I257 HydrophobicContact CZ-CG1 4.13Å; F253-I257 PolarHBondContact O-N 3.17Å
254	M	69.1	Low	65.2	Low	85 Å²	85	83.1 Å²	83.1	42%	0.419	43%	0.431	S	S	.	.	H	α-helix	trans	-62.1	-36.5	174.5	-77.3	-125.8	76.1	0	0	112.4	K250 K258	K250-M254 HydrophobicContact CG-CG 4.45Å; K250-M254 WeakPolarHBondContact O-CB 3.45Å; K250-M254 WeakPolarHBondContact O-CG 3.47Å; K250-M254 PolarHBondContact O-N 2.65Å; M254-K258 WeakPolarHBondContact O-CB 3.22Å; M254-K258 VanDerWaalsContact O-CG 3.3Å; M254-K258 WeakPolarHBondContact O-CG 3.34Å; M254-K258 PolarHBondContact O-N 3.17Å
255	Y	70.5	Confident	65.7	Low	149 Å²	149	83.5 Å²	83.5	58%	0.584	43%	0.429	S	S	*	.	H	α-helix	trans	-63.2	-47.1	173.6	178.5	-96.5	0	0	0	111.1	G251 K252 F253 K258 C259	G251-Y255 WeakPolarHBondContact O-CB 3.45Å; G251-Y255 PolarHBondContact O-N 3.15Å; K252-Y255 WeakPolarHBondContact O-CB 3.39Å; K252-Y255 PolarHBondContact O-N 3.46Å; F253-Y255 VanDerWaalsContact C-N 3.29Å; F253-Y255 PolarHBondContact O-N 3.1Å; Y255-K258 PolarHBondContact O-N 3.46Å; Y255-C259 PolarHBondContact O-N 2.99Å; Y255-C259 PolarHBondContact O-SG 3.31Å; Y255-C259 VanDerWaalsContact O-SG 3.33Å
256	F	66.4	Low	65.9	Low	32 Å²	32	82.5 Å²	82.5	14%	0.14	41%	0.405	C	S	.	.	H	α-helix	trans	-64.2	-41.8	178.9	-73.2	-62.8	0	0	0	113.3	I198 I201 Q225 K252 F253 K258 C259 A260	I198-F256 HydrophobicContact CG1-CE2 4.48Å; I198-F256 HydrophobicContact CG2-CE2 4.31Å; I201-F256 HydrophobicContact CG2-CE1 4.14Å; Q225-F256 HydrophobicContact CG-CD1 4.14Å; K252-F256 HydrophobicContact CB-CD2 4.44Å; K252-F256 HydrophobicContact CB-CE2 4.22Å; K252-F256 WeakPolarHBondContact O-CD2 3.19Å; K252-F256 PolarHBondContact O-N 2.93Å; F253-F256 PolarHBondContact O-N 2.93Å; F256-K258 VanDerWaalsContact C-N 3.34Å; F256-K258 PolarHBondContact O-N 3.03Å; F256-C259 PolarHBondContact O-N 3.11Å; F256-A260 PolarHBondContact O-N 3.19Å
257	I	67.3	Low	66	Low	15 Å²	15	83.8 Å²	83.8	8%	0.077	41%	0.409	C	S	.	.	H	α-helix	trans	-59.1	-48	172	-72.3	179.7	0	0	0	110	V229 Y233 I240 F253 C259 A260 F261	V229-I257 HydrophobicContact CG1-CG1 4.25Å; Y233-I257 HydrophobicContact CE2-CD1 4.32Å; Y233-I257 HydrophobicContact CE2-CG2 3.92Å; I240-I257 HydrophobicContact CD1-CD1 4.1Å; F253-I257 HydrophobicContact CD1-CD1 3.79Å; F253-I257 HydrophobicContact CD1-CG1 4.44Å; F253-I257 HydrophobicContact CE1-CD1 3.16Å; F253-I257 HydrophobicContact CE1-CG1 4.04Å; F253-I257 HydrophobicContact CE2-CD1 4.48Å; F253-I257 HydrophobicContact CZ-CD1 3.57Å; F253-I257 HydrophobicContact CZ-CG1 4.13Å; F253-I257 PolarHBondContact O-N 3.17Å; I257-C259 PolarHBondContact O-N 3.3Å; I257-A260 PolarHBondContact O-N 3.4Å; I257-A260 VanDerWaalsContact O-N 3.17Å; I257-F261 HydrophobicContact CG2-CD2 3.96Å; I257-F261 HydrophobicContact CG2-CE2 4.3Å; I257-F261 WeakPolarHBondContact O-CD2 3.38Å; I257-F261 PolarHBondContact O-N 2.7Å
258	K	70.6	Confident	66.1	Low	128 Å²	128	77.9 Å²	77.9	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-59.7	-34.6	178.4	-77.4	179.9	179.1	-175	0	112.6	M254 Y255 F256 N262	M254-K258 WeakPolarHBondContact O-CB 3.22Å; M254-K258 VanDerWaalsContact O-CG 3.3Å; M254-K258 WeakPolarHBondContact O-CG 3.34Å; M254-K258 PolarHBondContact O-N 3.17Å; Y255-K258 PolarHBondContact O-N 3.46Å; F256-K258 VanDerWaalsContact C-N 3.34Å; F256-K258 PolarHBondContact O-N 3.03Å; K258-N262 WeakPolarHBondContact O-CB 3.18Å; K258-N262 PolarHBondContact O-N 3.42Å; K258-N262 PolarHBondContact O-ND2 2.82Å
259	C	65	Low	66	Low	33 Å²	33	75.6 Å²	75.6	22%	0.223	37%	0.368	C	S	.	.	H	α-helix	trans	-75.6	-32	177.2	-68.4	0	0	0	0	113.4	Y255 F256 I257	Y255-C259 PolarHBondContact O-N 2.99Å; Y255-C259 PolarHBondContact O-SG 3.31Å; Y255-C259 VanDerWaalsContact O-SG 3.33Å; F256-C259 PolarHBondContact O-N 3.11Å; I257-C259 PolarHBondContact O-N 3.3Å
260	A	62.4	Low	66.1	Low	11 Å²	11	75.1 Å²	75.1	9%	0.091	37%	0.369	C	S	.	.	H	α-helix	trans	-73.3	-27	178.5	0	0	0	0	0	113.3	Q225 V229 F256 I257	Q225-A260 HydrophobicContact CB-CB 4.34Å; V229-A260 HydrophobicContact CB-CB 4.48Å; F256-A260 PolarHBondContact O-N 3.19Å; I257-A260 PolarHBondContact O-N 3.4Å; I257-A260 VanDerWaalsContact O-N 3.17Å
261	F	63.7	Low	66.2	Low	95 Å²	95	73.6 Å²	73.6	42%	0.417	37%	0.366	S	S	.	.			trans	-106.1	0.6	-176.1	-71.8	-86	0	0	0	115	Y233 I257	Y233-F261 AromaticContact CD1-CZ 3.89Å; Y233-F261 HydrophobicContact CD1-CZ 3.89Å; Y233-F261 HydrophobicContact CD2-CD2 4.41Å; Y233-F261 AromaticContact CD2-CE2 3.24Å; Y233-F261 HydrophobicContact CD2-CE2 3.24Å; Y233-F261 AromaticContact CD2-CZ 3.32Å; Y233-F261 HydrophobicContact CD2-CZ 3.32Å; Y233-F261 HydrophobicContact CE1-CZ 4.12Å; Y233-F261 HydrophobicContact CE2-CD2 4.12Å; Y233-F261 AromaticContact CE2-CE2 3.31Å; Y233-F261 HydrophobicContact CE2-CE2 3.31Å; Y233-F261 AromaticContact CE2-CZ 3.61Å; Y233-F261 HydrophobicContact CE2-CZ 3.61Å; Y233-F261 HydrophobicContact CG-CE1 4.49Å; Y233-F261 AromaticContact CG-CE2 3.91Å; Y233-F261 HydrophobicContact CG-CE2 3.91Å; Y233-F261 AromaticContact CG-CZ 3.45Å; Y233-F261 HydrophobicContact CG-CZ 3.45Å; Y233-F261 VanDerWaalsContact CG-CZ 3.45Å; Y233-F261 AromaticContact CZ-CZ 3.99Å; I257-F261 HydrophobicContact CG2-CD2 3.96Å; I257-F261 HydrophobicContact CG2-CE2 4.3Å; I257-F261 WeakPolarHBondContact O-CD2 3.38Å; I257-F261 PolarHBondContact O-N 2.7Å
262	N	54.8	Low	65.9	Low	158 Å²	158	76.1 Å²	76.1	85%	0.845	36%	0.357	S	S	*	.			trans	-113.6	0	172.6	-70.6	-54.1	0	0	0	111.5	K222 K258	K222-N262 PolarHBondContact NZ-OXT 3.06Å; K258-N262 WeakPolarHBondContact O-CB 3.18Å; K258-N262 PolarHBondContact O-N 3.42Å; K258-N262 PolarHBondContact O-ND2 2.82Å

Retrieved 262 of 262 residues in 520 ms (Link to these results)

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