A0A077Z1C4_TRITR Loading...

Trimeric intracellular cation channel type B

AlphaFold DB , UniProt , Accession A0A077Z1C4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 306 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.8	Very low	78.3	Confident	240 Å²	240	115.5 Å²	115.5	100%	1.182	58%	0.581	S	S	*	*				0	109.5	0	-91	176.7	-174.8	0	0	106.8	F3	M1-F3 PolarHBondContact O-N 3.43Å
2	E	57.8	Low	79.2	Confident	195 Å²	195	106 Å²	106	91%	0.911	53%	0.534	S	S	*	.			trans	-64.4	120.9	166.8	-71.6	-180	160.4	0	0	107.4	N4	E2-N4 PolarHBondContact O-N 2.75Å
3	F	69.3	Low	80	Confident	156 Å²	156	105.7 Å²	105.7	68%	0.684	53%	0.529	S	S	*	.			trans	-72.8	101.5	178.9	-168.5	-90.5	0	0	0	107.4	M1 P5 L8	M1-F3 PolarHBondContact O-N 3.43Å; F3-P5 WeakPolarHBondContact O-CD 3.46Å; F3-L8 HydrophobicContact CE1-CB 4.05Å; F3-L8 HydrophobicContact CE1-CD2 3.67Å; F3-L8 HydrophobicContact CE1-CG 4.28Å; F3-L8 HydrophobicContact CZ-CB 4.23Å; F3-L8 HydrophobicContact CZ-CD1 3.96Å; F3-L8 HydrophobicContact CZ-CD2 3.76Å; F3-L8 HydrophobicContact CZ-CG 4.19Å
4	N	80.9	Confident	80.7	Confident	85 Å²	85	105.1 Å²	105.1	46%	0.455	53%	0.527	S	S	.	.			trans	-75.6	108.8	180	-175.1	-9.7	0	0	0	109.2	E2 Q6 A7 L8	E2-N4 PolarHBondContact O-N 2.75Å; N4-Q6 PolarHBondContact O-N 3.13Å; N4-Q6 WeakPolarHBondContact OD1-CB 3.46Å; N4-Q6 PolarHBondContact OD1-N 3.45Å; N4-A7 HydrophobicContact CB-CB 3.99Å; N4-A7 PolarHBondContact O-N 3.37Å; N4-L8 PolarHBondContact O-N 3.13Å
5	P	82.8	Confident	81.2	Confident	83 Å²	83	100.4 Å²	100.4	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-28.6	-178	27	-34.9	0	0	0	112.3	F3 L8 L9	F3-P5 WeakPolarHBondContact O-CD 3.46Å; P5-L8 PolarHBondContact O-N 3.36Å; P5-L9 WeakPolarHBondContact O-CG 3.26Å; P5-L9 PolarHBondContact O-N 3.35Å; P5-L9 VanDerWaalsContact O-N 3.07Å
6	Q	85.1	Confident	81.6	Confident	129 Å²	129	95.4 Å²	95.4	60%	0.603	48%	0.483	S	S	*	.	H	α-helix	trans	-68	-43.9	176.9	-66.8	173.5	-16.9	0	0	111.1	N4 L8 L9 E10	N4-Q6 PolarHBondContact O-N 3.13Å; N4-Q6 WeakPolarHBondContact OD1-CB 3.46Å; N4-Q6 PolarHBondContact OD1-N 3.45Å; Q6-L8 VanDerWaalsContact C-N 3.27Å; Q6-L8 PolarHBondContact O-N 2.85Å; Q6-L9 PolarHBondContact O-N 3.16Å; Q6-L9 VanDerWaalsContact O-N 3.11Å; Q6-E10 WeakPolarHBondContact O-CG 3.29Å; Q6-E10 PolarHBondContact O-N 3.26Å
7	A	87	Confident	82	Confident	39 Å²	39	95.8 Å²	95.8	32%	0.322	49%	0.486	S	S	.	.	H	α-helix	trans	-61.1	-37.9	175.8	0	0	0	0	0	111.5	N4 M11	N4-A7 HydrophobicContact CB-CB 3.99Å; N4-A7 PolarHBondContact O-N 3.37Å; A7-M11 WeakPolarHBondContact O-CB 3.48Å; A7-M11 WeakPolarHBondContact O-CG 3.39Å; A7-M11 PolarHBondContact O-N 3.04Å
8	L	87	Confident	82.4	Confident	40 Å²	40	93.9 Å²	93.9	21%	0.209	48%	0.478	C	S	.	.	H	α-helix	trans	-61.8	-46.5	173.8	-177.3	70.1	0	0	0	111.5	F3 N4 P5 Q6 M11 S12 L229 F232	F3-L8 HydrophobicContact CE1-CB 4.05Å; F3-L8 HydrophobicContact CE1-CD2 3.67Å; F3-L8 HydrophobicContact CE1-CG 4.28Å; F3-L8 HydrophobicContact CZ-CB 4.23Å; F3-L8 HydrophobicContact CZ-CD1 3.96Å; F3-L8 HydrophobicContact CZ-CD2 3.76Å; F3-L8 HydrophobicContact CZ-CG 4.19Å; N4-L8 PolarHBondContact O-N 3.13Å; P5-L8 PolarHBondContact O-N 3.36Å; Q6-L8 VanDerWaalsContact C-N 3.27Å; Q6-L8 PolarHBondContact O-N 2.85Å; L8-M11 PolarHBondContact O-N 2.89Å; L8-S12 VanDerWaalsContact O-CB 3.31Å; L8-S12 WeakPolarHBondContact O-CB 3.2Å; L8-S12 PolarHBondContact O-N 2.95Å; L8-L229 HydrophobicContact CD2-CD1 3.67Å; L8-L229 HydrophobicContact CG-CD1 4.02Å; L8-F232 HydrophobicContact CD1-CD1 3.96Å; L8-F232 HydrophobicContact CD1-CE1 3.39Å; L8-F232 HydrophobicContact CD1-CZ 4.07Å
9	L	88.2	Confident	82.7	Confident	82 Å²	82	98.5 Å²	98.5	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-43.7	-180	-71.1	171.9	0	0	0	111.7	P5 Q6 S12 H13 P226	P5-L9 WeakPolarHBondContact O-CG 3.26Å; P5-L9 PolarHBondContact O-N 3.35Å; P5-L9 VanDerWaalsContact O-N 3.07Å; Q6-L9 PolarHBondContact O-N 3.16Å; Q6-L9 VanDerWaalsContact O-N 3.11Å; L9-S12 WeakPolarHBondContact CA-OG 3.35Å; L9-S12 PolarHBondContact O-N 3.37Å; L9-S12 PolarHBondContact O-OG 3.16Å; L9-H13 WeakPolarHBondContact O-CB 3.49Å; L9-H13 PolarHBondContact O-N 3.35Å; L9-P226 HydrophobicContact CD2-CG 4.08Å
10	E	89.1	Confident	82.9	Confident	127 Å²	127	95 Å²	95	59%	0.593	48%	0.477	S	S	*	.	H	α-helix	trans	-60.2	-48	174.8	-72	173.5	-174.8	0	0	111.8	Q6 S12 H13 I14	Q6-E10 WeakPolarHBondContact O-CG 3.29Å; Q6-E10 PolarHBondContact O-N 3.26Å; E10-S12 VanDerWaalsContact C-N 3.28Å; E10-S12 PolarHBondContact O-N 3.5Å; E10-H13 WeakPolarHBondContact O-CB 3.27Å; E10-H13 PolarHBondContact O-N 3.11Å; E10-I14 VanDerWaalsContact O-CG1 3.3Å; E10-I14 WeakPolarHBondContact O-CG1 3.3Å; E10-I14 PolarHBondContact O-N 3.02Å
11	M	87.5	Confident	83.2	Confident	94 Å²	94	94.9 Å²	94.9	46%	0.463	47%	0.471	S	S	.	.	H	α-helix	trans	-61.3	-39.4	176.5	-73	-58.7	-61.7	0	0	111.9	A7 L8 H13 I14 I15	A7-M11 WeakPolarHBondContact O-CB 3.48Å; A7-M11 WeakPolarHBondContact O-CG 3.39Å; A7-M11 PolarHBondContact O-N 3.04Å; L8-M11 PolarHBondContact O-N 2.89Å; M11-H13 VanDerWaalsContact C-N 3.34Å; M11-I14 PolarHBondContact O-N 2.72Å; M11-I14 HydrophobicContact SD-CD1 4.39Å; M11-I15 HydrophobicContact CE-CD1 4.48Å; M11-I15 WeakPolarHBondContact O-CG1 3.39Å; M11-I15 PolarHBondContact O-N 2.96Å
12	S	88.8	Confident	85.3	Confident	2 Å²	2	85.7 Å²	85.7	1%	0.014	43%	0.43	C	S	.	.	H	α-helix	trans	-63.4	-42.3	177.2	78.8	0	0	0	0	111.6	L8 L9 E10 I15 A16 D228	L8-S12 VanDerWaalsContact O-CB 3.31Å; L8-S12 WeakPolarHBondContact O-CB 3.2Å; L8-S12 PolarHBondContact O-N 2.95Å; L9-S12 WeakPolarHBondContact CA-OG 3.35Å; L9-S12 PolarHBondContact O-N 3.37Å; L9-S12 PolarHBondContact O-OG 3.16Å; E10-S12 VanDerWaalsContact C-N 3.28Å; E10-S12 PolarHBondContact O-N 3.5Å; S12-I15 PolarHBondContact O-N 2.94Å; S12-A16 VanDerWaalsContact O-CB 3.29Å; S12-A16 WeakPolarHBondContact O-CB 3.44Å; S12-A16 PolarHBondContact O-N 3.29Å; S12-D228 WeakPolarHBondContact CB-O 3.32Å
13	H	90.2	Very high	86.9	Confident	102 Å²	102	84.8 Å²	84.8	47%	0.472	42%	0.419	S	S	.	.	H	α-helix	trans	-64.3	-43.7	177.5	-173.2	66.8	0	0	0	111.9	L9 E10 M11 I15 N17 D228	L9-H13 WeakPolarHBondContact O-CB 3.49Å; L9-H13 PolarHBondContact O-N 3.35Å; E10-H13 WeakPolarHBondContact O-CB 3.27Å; E10-H13 PolarHBondContact O-N 3.11Å; M11-H13 VanDerWaalsContact C-N 3.34Å; H13-I15 PolarHBondContact O-N 3.29Å; H13-N17 PolarHBondContact CE1-ND2 3.38Å; H13-N17 PolarHBondContact ND1-ND2 2.99Å; H13-N17 VanDerWaalsContact ND1-ND2 3.2Å; H13-N17 WeakPolarHBondContact O-CB 3.48Å; H13-N17 PolarHBondContact O-N 3.43Å; H13-N17 VanDerWaalsContact O-N 3.08Å; H13-N17 PolarHBondContact O-ND2 3.19Å; H13-D228 IonicContact CE1-OD2 2.65Å; H13-D228 IonicContact CG-OD2 3.78Å; H13-D228 IonicContact ND1-OD2 3.19Å; H13-D228 PolarHBondContact ND1-OD2 3.18Å
14	I	89.7	Confident	88	Confident	98 Å²	98	79 Å²	79	50%	0.503	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-45.5	177.2	-68.3	164.7	0	0	0	110.8	E10 M11 L18	E10-I14 VanDerWaalsContact O-CG1 3.3Å; E10-I14 WeakPolarHBondContact O-CG1 3.3Å; E10-I14 PolarHBondContact O-N 3.02Å; M11-I14 PolarHBondContact O-N 2.72Å; M11-I14 HydrophobicContact SD-CD1 4.39Å; I14-L18 PolarHBondContact O-N 2.84Å; I14-L18 VanDerWaalsContact O-N 3.16Å
15	I	88.1	Confident	88.6	Confident	34 Å²	34	75.5 Å²	75.5	17%	0.174	38%	0.375	C	S	.	.	H	α-helix	trans	-71.7	-39.2	-177.2	-74.7	164.5	0	0	0	111.8	M11 S12 H13 N17 L18 Y231 F232 V235	M11-I15 HydrophobicContact CE-CD1 4.48Å; M11-I15 WeakPolarHBondContact O-CG1 3.39Å; M11-I15 PolarHBondContact O-N 2.96Å; S12-I15 PolarHBondContact O-N 2.94Å; H13-I15 PolarHBondContact O-N 3.29Å; I15-N17 VanDerWaalsContact C-N 3.33Å; I15-N17 PolarHBondContact O-N 3.42Å; I15-L18 WeakPolarHBondContact O-CB 3.2Å; I15-L18 PolarHBondContact O-N 3.42Å; I15-Y231 HydrophobicContact CG2-CD1 4.27Å; I15-Y231 HydrophobicContact CG2-CE1 4.12Å; I15-F232 HydrophobicContact CB-CD2 4.26Å; I15-F232 HydrophobicContact CD1-CD2 3.38Å; I15-F232 HydrophobicContact CD1-CE2 3.36Å; I15-F232 HydrophobicContact CG1-CD2 4.38Å; I15-F232 HydrophobicContact CG2-CD2 4.42Å; I15-V235 HydrophobicContact CG2-CB 4.48Å; I15-V235 HydrophobicContact CG2-CG1 4.34Å; I15-V235 HydrophobicContact CG2-CG2 4.31Å
16	A	87.7	Confident	89.1	Confident	21 Å²	21	74.5 Å²	74.5	17%	0.174	37%	0.365	C	S	.	.	H	α-helix	trans	-65.7	-35.9	177.5	0	0	0	0	0	112.5	S12 D228 Y231	S12-A16 VanDerWaalsContact O-CB 3.29Å; S12-A16 WeakPolarHBondContact O-CB 3.44Å; S12-A16 PolarHBondContact O-N 3.29Å; A16-D228 HydrophobicContact CB-CB 3.84Å; A16-Y231 HydrophobicContact CB-CD1 4.12Å
17	N	88.5	Confident	89.4	Confident	101 Å²	101	68.6 Å²	68.6	54%	0.54	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	11.3	-178.8	-66.9	-76.1	0	0	0	113.8	H13 I15 K19	H13-N17 PolarHBondContact CE1-ND2 3.38Å; H13-N17 PolarHBondContact ND1-ND2 2.99Å; H13-N17 VanDerWaalsContact ND1-ND2 3.2Å; H13-N17 WeakPolarHBondContact O-CB 3.48Å; H13-N17 PolarHBondContact O-N 3.43Å; H13-N17 VanDerWaalsContact O-N 3.08Å; H13-N17 PolarHBondContact O-ND2 3.19Å; I15-N17 VanDerWaalsContact C-N 3.33Å; I15-N17 PolarHBondContact O-N 3.42Å; N17-K19 PolarHBondContact O-N 3.39Å
18	L	88.2	Confident	89.6	Confident	63 Å²	63	66.7 Å²	66.7	33%	0.33	32%	0.322	S	S	.	.			trans	-68.5	125.5	-178.4	-164.1	66.5	0	0	0	110.9	I14 I15 L20 F24	I14-L18 PolarHBondContact O-N 2.84Å; I14-L18 VanDerWaalsContact O-N 3.16Å; I15-L18 WeakPolarHBondContact O-CB 3.2Å; I15-L18 PolarHBondContact O-N 3.42Å; L18-L20 PolarHBondContact O-N 3.19Å; L18-L20 VanDerWaalsContact O-N 3.12Å; L18-F24 HydrophobicContact CD2-CD2 4.21Å; L18-F24 HydrophobicContact CD2-CE1 4.13Å; L18-F24 HydrophobicContact CD2-CE2 3.2Å; L18-F24 HydrophobicContact CD2-CZ 3.17Å; L18-F24 HydrophobicContact CG-CE2 3.79Å; L18-F24 HydrophobicContact CG-CZ 4.24Å
19	K	88.5	Confident	89.9	Confident	181 Å²	181	65.2 Å²	65.2	79%	0.787	31%	0.314	S	S	*	.			trans	-67.6	112.2	172.2	-68.6	-175.9	179.7	178.3	0	109.4	N17	N17-K19 PolarHBondContact O-N 3.39Å
20	L	87.1	Confident	90.1	Very high	28 Å²	28	62.4 Å²	62.4	15%	0.147	30%	0.299	C	S	.	.			trans	-69.8	-39.9	-178.9	-59	176.2	0	0	0	112.5	L18 P22 Y23 F24 D25 N129	L18-L20 PolarHBondContact O-N 3.19Å; L18-L20 VanDerWaalsContact O-N 3.12Å; L20-P22 CarbonylContact O-C 3.51Å; L20-Y23 PolarHBondContact O-N 3.02Å; L20-F24 HydrophobicContact CB-CB 4.12Å; L20-F24 HydrophobicContact CD2-CB 4.08Å; L20-F24 HydrophobicContact CD2-CD2 4.32Å; L20-F24 HydrophobicContact CD2-CG 4.09Å; L20-F24 WeakPolarHBondContact O-CB 3.25Å; L20-F24 PolarHBondContact O-N 2.85Å; L20-D25 PolarHBondContact O-N 2.95Å; L20-N129 HydrophobicContact CD1-CB 3.44Å; L20-N129 VanDerWaalsContact CD1-CB 3.44Å; L20-N129 HydrophobicContact CD2-CB 4.27Å; L20-N129 HydrophobicContact CG-CB 4.43Å
21	Y	89.6	Confident	90	Very high	92 Å²	92	56.5 Å²	56.5	36%	0.361	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	136	177.1	-176	-91.3	0	0	0	110.4	H87 L90	Y21-H87 AromaticContact CD2-CE1 3.77Å; Y21-L90 HydrophobicContact CD2-CD2 4.25Å; Y21-L90 HydrophobicContact CE2-CD2 3.65Å
22	P	89.9	Confident	90.1	Very high	48 Å²	48	52.2 Å²	52.2	31%	0.312	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	cis	-92.1	-17.3	-0.4	33.9	-34.3	0	0	0	114.3	L20 L26 L90	L20-P22 CarbonylContact O-C 3.51Å; P22-L26 WeakPolarHBondContact O-CB 3.42Å; P22-L26 PolarHBondContact O-N 3.07Å; P22-L90 HydrophobicContact CB-CD2 4.21Å
23	Y	92.7	Very high	90.1	Very high	176 Å²	176	52.1 Å²	52.1	69%	0.69	25%	0.25	S	C	*	.	H	α-helix	trans	-69.4	-45.2	-163.1	-57.5	-72.4	0	0	0	115	L20 L26 A27	L20-Y23 PolarHBondContact O-N 3.02Å; Y23-L26 WeakPolarHBondContact O-CB 3.27Å; Y23-A27 PolarHBondContact O-N 2.98Å; Y23-A27 VanDerWaalsContact O-N 3.07Å
24	F	92.3	Very high	90.1	Very high	35 Å²	35	47.4 Å²	47.4	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-73.7	-35.3	-179.5	-68	-89.2	0	0	0	111.3	L18 L20 A27 H28 A122 V125 Q126	L18-F24 HydrophobicContact CD2-CD2 4.21Å; L18-F24 HydrophobicContact CD2-CE1 4.13Å; L18-F24 HydrophobicContact CD2-CE2 3.2Å; L18-F24 HydrophobicContact CD2-CZ 3.17Å; L18-F24 HydrophobicContact CG-CE2 3.79Å; L18-F24 HydrophobicContact CG-CZ 4.24Å; L20-F24 HydrophobicContact CB-CB 4.12Å; L20-F24 HydrophobicContact CD2-CB 4.08Å; L20-F24 HydrophobicContact CD2-CD2 4.32Å; L20-F24 HydrophobicContact CD2-CG 4.09Å; L20-F24 WeakPolarHBondContact O-CB 3.25Å; L20-F24 PolarHBondContact O-N 2.85Å; F24-A27 PolarHBondContact O-N 3.41Å; F24-H28 PolarHBondContact O-N 3.47Å; F24-A122 HydrophobicContact CD1-CB 3.91Å; F24-A122 WeakPolarHBondContact CD1-O 3.38Å; F24-A122 HydrophobicContact CE1-CB 4.05Å; F24-V125 HydrophobicContact CD1-CB 3.81Å; F24-V125 HydrophobicContact CD1-CG1 4.09Å; F24-V125 HydrophobicContact CD1-CG2 4.39Å; F24-V125 HydrophobicContact CE1-CB 3.77Å; F24-V125 HydrophobicContact CE1-CG1 3.94Å; F24-V125 HydrophobicContact CE1-CG2 3.9Å; F24-Q126 HydrophobicContact CB-CB 4.27Å; F24-Q126 HydrophobicContact CB-CG 4.26Å
25	D	92.3	Very high	89.9	Confident	11 Å²	11	43.4 Å²	43.4	6%	0.059	21%	0.209	C	C	.	.	H	α-helix	trans	-70.2	-38.6	174.3	-73.2	-17.9	0	0	0	111.8	L20 A27 H28 Y29 H87 Q126	L20-D25 PolarHBondContact O-N 2.95Å; D25-A27 VanDerWaalsContact C-N 3.32Å; D25-A27 PolarHBondContact O-N 2.82Å; D25-H28 WeakPolarHBondContact O-CB 3.45Å; D25-H28 PolarHBondContact O-N 3.43Å; D25-Y29 HydrophobicContact CB-CD2 4.47Å; D25-Y29 HydrophobicContact CB-CE2 3.84Å; D25-Y29 WeakPolarHBondContact O-CD2 3.31Å; D25-Y29 PolarHBondContact O-N 2.93Å; D25-H87 IonicContact OD2-CE1 3.78Å; D25-H87 PolarHBondContact OD2-CE1 2.98Å; D25-H87 IonicContact OD2-ND1 3Å; D25-H87 PolarHBondContact OD2-ND1 3.5Å; D25-Q126 WeakPolarHBondContact OD1-CG 3.49Å; D25-Q126 PolarHBondContact OD1-NE2 3.48Å
26	L	94.5	Very high	89.8	Confident	61 Å²	61	41.9 Å²	41.9	32%	0.319	20%	0.202	S	C	.	.	H	α-helix	trans	-55.5	-48.9	170.3	176.8	71.6	0	0	0	110.7	P22 Y23 H28 Y29 I30 L90 V94	P22-L26 WeakPolarHBondContact O-CB 3.42Å; P22-L26 PolarHBondContact O-N 3.07Å; Y23-L26 WeakPolarHBondContact O-CB 3.27Å; L26-H28 VanDerWaalsContact C-N 3.33Å; L26-H28 PolarHBondContact O-N 2.88Å; L26-Y29 PolarHBondContact O-N 3.28Å; L26-I30 HydrophobicContact CD1-CD1 4.19Å; L26-I30 HydrophobicContact CD1-CG1 4.49Å; L26-I30 HydrophobicContact CG-CD1 3.88Å; L26-I30 WeakPolarHBondContact O-CB 3.46Å; L26-I30 VanDerWaalsContact O-CG1 3.24Å; L26-I30 WeakPolarHBondContact O-CG1 3.21Å; L26-I30 PolarHBondContact O-N 3.47Å; L26-L90 HydrophobicContact CD1-CD1 4.06Å; L26-V94 HydrophobicContact CD1-CG2 3.38Å
27	A	91.7	Very high	89.9	Confident	5 Å²	5	41.4 Å²	41.4	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-43.2	177	0	0	0	0	0	112	Y23 F24 D25 I30 M31 V119 A122 K123	Y23-A27 PolarHBondContact O-N 2.98Å; Y23-A27 VanDerWaalsContact O-N 3.07Å; F24-A27 PolarHBondContact O-N 3.41Å; D25-A27 VanDerWaalsContact C-N 3.32Å; D25-A27 PolarHBondContact O-N 2.82Å; A27-I30 PolarHBondContact O-N 2.92Å; A27-M31 WeakPolarHBondContact O-CG 3.4Å; A27-M31 PolarHBondContact O-N 3.42Å; A27-V119 HydrophobicContact CB-CG1 3.89Å; A27-A122 HydrophobicContact CB-CB 3.7Å; A27-K123 HydrophobicContact CB-CB 4.49Å
28	H	90.2	Very high	89.8	Confident	0 Å²	0	38 Å²	38	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58	-52.5	173.7	169.6	67.3	0	0	0	111.9	F24 D25 L26 I30 M31 M32 C63 Q126 K130 Y161	F24-H28 PolarHBondContact O-N 3.47Å; D25-H28 WeakPolarHBondContact O-CB 3.45Å; D25-H28 PolarHBondContact O-N 3.43Å; L26-H28 VanDerWaalsContact C-N 3.33Å; L26-H28 PolarHBondContact O-N 2.88Å; H28-I30 VanDerWaalsContact C-N 3.31Å; H28-I30 PolarHBondContact O-N 3.25Å; H28-M31 PolarHBondContact O-N 2.82Å; H28-M32 WeakPolarHBondContact CE1-CG 3.37Å; H28-M32 WeakPolarHBondContact O-CG 3.21Å; H28-M32 PolarHBondContact O-N 3.05Å; H28-C63 PolarHBondContact NE2-O 2.96Å; H28-Q126 HydrophobicContact CB-CB 4.49Å; H28-Q126 HydrophobicContact CB-CG 3.99Å; H28-K130 PolarHBondContact CD2-NZ 3.36Å; H28-K130 PolarHBondContact CE1-NZ 2.79Å; H28-K130 VanDerWaalsContact CG-NZ 3.31Å; H28-K130 PolarHBondContact ND1-NZ 3.23Å; H28-K130 PolarHBondContact NE2-NZ 3.23Å; H28-Y161 AromaticContact CE1-CE1 3.5Å; H28-Y161 AromaticContact CE1-CZ 3.65Å; H28-Y161 PolarHBondContact CE1-OH 3.29Å; H28-Y161 AromaticContact ND1-CE1 3.38Å; H28-Y161 WeakPolarHBondContact ND1-CE1 3.34Å; H28-Y161 AromaticContact ND1-CZ 3.71Å; H28-Y161 PolarHBondContact ND1-OH 2.9Å
29	Y	92.8	Very high	89.5	Confident	8 Å²	8	36.9 Å²	36.9	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-62.7	-37.6	-179.5	-58.9	-38.2	0	0	0	112.6	D25 L26 M32 T33 C63 F64 H87 L90 A91	D25-Y29 HydrophobicContact CB-CD2 4.47Å; D25-Y29 HydrophobicContact CB-CE2 3.84Å; D25-Y29 WeakPolarHBondContact O-CD2 3.31Å; D25-Y29 PolarHBondContact O-N 2.93Å; L26-Y29 PolarHBondContact O-N 3.28Å; Y29-M32 PolarHBondContact O-N 3.32Å; Y29-T33 WeakPolarHBondContact O-CB 3.48Å; Y29-T33 PolarHBondContact O-N 3.17Å; Y29-T33 PolarHBondContact O-OG1 3.31Å; Y29-C63 HydrophobicContact CD1-CB 3.73Å; Y29-C63 HydrophobicContact CE1-CB 4.08Å; Y29-F64 HydrophobicContact CE1-CE1 4.12Å; Y29-F64 HydrophobicContact CE1-CZ 4.29Å; Y29-H87 WeakPolarHBondContact OH-CB 3.35Å; Y29-H87 PolarHBondContact OH-ND1 2.8Å; Y29-L90 HydrophobicContact CD2-CB 4.4Å; Y29-L90 HydrophobicContact CD2-CD2 4.08Å; Y29-L90 HydrophobicContact CD2-CG 3.94Å; Y29-L90 HydrophobicContact CE2-CB 4.24Å; Y29-L90 HydrophobicContact CE2-CD2 3.91Å; Y29-L90 HydrophobicContact CE2-CG 4.08Å; Y29-A91 HydrophobicContact CD1-CB 3.94Å; Y29-A91 HydrophobicContact CD2-CB 4.08Å; Y29-A91 HydrophobicContact CE1-CB 4.21Å; Y29-A91 HydrophobicContact CE2-CB 4.33Å; Y29-A91 HydrophobicContact CG-CB 3.9Å
30	I	92	Very high	89.4	Confident	23 Å²	23	29.7 Å²	29.7	12%	0.118	14%	0.141	C	C	.	.	H	α-helix	trans	-57.7	-52.8	174.4	-77.3	168.4	0	0	0	109.6	L26 A27 H28 M32 T33 I34 V94 I110 V119	L26-I30 HydrophobicContact CD1-CD1 4.19Å; L26-I30 HydrophobicContact CD1-CG1 4.49Å; L26-I30 HydrophobicContact CG-CD1 3.88Å; L26-I30 WeakPolarHBondContact O-CB 3.46Å; L26-I30 VanDerWaalsContact O-CG1 3.24Å; L26-I30 WeakPolarHBondContact O-CG1 3.21Å; L26-I30 PolarHBondContact O-N 3.47Å; A27-I30 PolarHBondContact O-N 2.92Å; H28-I30 VanDerWaalsContact C-N 3.31Å; H28-I30 PolarHBondContact O-N 3.25Å; I30-M32 VanDerWaalsContact C-N 3.29Å; I30-M32 PolarHBondContact O-N 2.91Å; I30-T33 PolarHBondContact O-N 2.95Å; I30-I34 HydrophobicContact CG2-CD1 3.79Å; I30-I34 WeakPolarHBondContact O-CB 3.45Å; I30-I34 VanDerWaalsContact O-CG1 3.28Å; I30-I34 WeakPolarHBondContact O-CG1 3.49Å; I30-I34 PolarHBondContact O-N 2.84Å; I30-V94 HydrophobicContact CB-CG1 4.28Å; I30-V94 HydrophobicContact CG1-CG1 3.68Å; I30-V94 HydrophobicContact CG1-CG2 4.39Å; I30-I110 HydrophobicContact CD1-CD1 4.27Å; I30-I110 HydrophobicContact CG1-CD1 4.28Å; I30-I110 HydrophobicContact CG2-CB 4.48Å; I30-I110 HydrophobicContact CG2-CD1 3.51Å; I30-I110 HydrophobicContact CG2-CG1 4.1Å; I30-I110 HydrophobicContact CG2-CG2 3.73Å; I30-V119 HydrophobicContact CB-CG1 4.27Å; I30-V119 HydrophobicContact CG2-CG1 3.91Å
31	M	88.9	Confident	89.3	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-64.5	-35.7	-178.1	-64.3	-42.2	-71.2	0	0	112.1	A27 H28 A35 V119 K123 I165	A27-M31 WeakPolarHBondContact O-CG 3.4Å; A27-M31 PolarHBondContact O-N 3.42Å; H28-M31 PolarHBondContact O-N 2.82Å; M31-A35 WeakPolarHBondContact O-CB 3.33Å; M31-A35 PolarHBondContact O-N 2.87Å; M31-V119 HydrophobicContact CG-CG1 3.81Å; M31-V119 HydrophobicContact SD-CB 4.26Å; M31-V119 HydrophobicContact SD-CG1 3.48Å; M31-V119 WeakPolarHBondContact SD-CG1 3.28Å; M31-K123 HydrophobicContact CB-CG 4.28Å; M31-K123 HydrophobicContact CG-CB 4.18Å; M31-K123 HydrophobicContact CG-CG 4.13Å; M31-I165 HydrophobicContact CB-CD1 4.25Å; M31-I165 HydrophobicContact CE-CD1 3.17Å; M31-I165 HydrophobicContact CE-CG1 3.49Å; M31-I165 VanDerWaalsContact CE-CG1 3.49Å; M31-I165 HydrophobicContact CE-CG2 4.28Å; M31-I165 HydrophobicContact CG-CD1 4.31Å
32	M	88	Confident	89	Confident	4 Å²	4	33.1 Å²	33.1	2%	0.02	19%	0.185	C	C	.	.	H	α-helix	trans	-70.8	-42.8	180	-67.4	-46.6	99.8	0	0	112.2	H28 Y29 I30 I34 A35 V36 M62 S160 Y161	H28-M32 WeakPolarHBondContact CE1-CG 3.37Å; H28-M32 WeakPolarHBondContact O-CG 3.21Å; H28-M32 PolarHBondContact O-N 3.05Å; Y29-M32 PolarHBondContact O-N 3.32Å; I30-M32 VanDerWaalsContact C-N 3.29Å; I30-M32 PolarHBondContact O-N 2.91Å; M32-I34 VanDerWaalsContact C-N 3.35Å; M32-A35 WeakPolarHBondContact O-CB 3.41Å; M32-A35 PolarHBondContact O-N 3.45Å; M32-V36 PolarHBondContact O-N 3.32Å; M32-M62 HydrophobicContact CB-CB 4.34Å; M32-S160 PolarHBondContact SD-OG 2.89Å; M32-Y161 HydrophobicContact CE-CD1 3.53Å; M32-Y161 HydrophobicContact CE-CE1 3.71Å; M32-Y161 HydrophobicContact SD-CD1 4.05Å; M32-Y161 HydrophobicContact SD-CE1 4.07Å
33	T	90	Very high	88.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-40.8	176.9	-55.7	0	0	0	0	111.5	Y29 I30 A35 V36 R37 W95 I98 F99	Y29-T33 WeakPolarHBondContact O-CB 3.48Å; Y29-T33 PolarHBondContact O-N 3.17Å; Y29-T33 PolarHBondContact O-OG1 3.31Å; I30-T33 PolarHBondContact O-N 2.95Å; T33-A35 VanDerWaalsContact C-N 3.32Å; T33-A35 PolarHBondContact O-N 2.92Å; T33-V36 PolarHBondContact O-N 2.82Å; T33-R37 WeakPolarHBondContact O-CB 3.35Å; T33-R37 PolarHBondContact O-N 2.86Å; T33-W95 HydrophobicContact CG2-CB 4.25Å; T33-I98 HydrophobicContact CG2-CB 3.57Å; T33-I98 HydrophobicContact CG2-CG1 3.86Å; T33-I98 HydrophobicContact CG2-CG2 3.69Å; T33-F99 HydrophobicContact CG2-CD2 3.85Å; T33-F99 HydrophobicContact CG2-CE2 3.65Å
34	I	90.5	Very high	88.6	Confident	4 Å²	4	24.3 Å²	24.3	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-43	173.4	-75.4	177.4	0	0	0	110.6	I30 M32 V36 R37 E38 I98 Y107 I110	I30-I34 HydrophobicContact CG2-CD1 3.79Å; I30-I34 WeakPolarHBondContact O-CB 3.45Å; I30-I34 VanDerWaalsContact O-CG1 3.28Å; I30-I34 WeakPolarHBondContact O-CG1 3.49Å; I30-I34 PolarHBondContact O-N 2.84Å; M32-I34 VanDerWaalsContact C-N 3.35Å; I34-V36 VanDerWaalsContact C-N 3.33Å; I34-V36 PolarHBondContact O-N 3.27Å; I34-R37 PolarHBondContact O-N 3.29Å; I34-R37 VanDerWaalsContact O-N 3.16Å; I34-E38 HydrophobicContact CG2-CG 4.09Å; I34-E38 WeakPolarHBondContact CG2-OE1 3.43Å; I34-E38 WeakPolarHBondContact O-CB 3.27Å; I34-E38 VanDerWaalsContact O-CG 3.3Å; I34-E38 WeakPolarHBondContact O-CG 3.47Å; I34-E38 PolarHBondContact O-N 3.38Å; I34-I98 HydrophobicContact CD1-CD1 4.15Å; I34-I98 HydrophobicContact CG1-CD1 3.96Å; I34-I98 HydrophobicContact CG1-CG1 4.44Å; I34-I98 HydrophobicContact CG1-CG2 4.05Å; I34-Y107 HydrophobicContact CG1-CD2 4.21Å; I34-Y107 HydrophobicContact CG1-CE2 4.44Å; I34-Y107 HydrophobicContact CG2-CE2 4.32Å; I34-I110 HydrophobicContact CD1-CB 3.84Å; I34-I110 HydrophobicContact CD1-CD1 4.19Å; I34-I110 HydrophobicContact CD1-CG2 3.26Å
35	A	85.1	Confident	88.6	Confident	13 Å²	13	24.7 Å²	24.7	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-43	177.1	0	0	0	0	0	112.1	M31 M32 T33 E38 D39	M31-A35 WeakPolarHBondContact O-CB 3.33Å; M31-A35 PolarHBondContact O-N 2.87Å; M32-A35 WeakPolarHBondContact O-CB 3.41Å; M32-A35 PolarHBondContact O-N 3.45Å; T33-A35 VanDerWaalsContact C-N 3.32Å; T33-A35 PolarHBondContact O-N 2.92Å; A35-E38 PolarHBondContact O-N 3Å; A35-D39 WeakPolarHBondContact O-CB 3.45Å; A35-D39 PolarHBondContact O-N 2.95Å
36	V	86.2	Confident	88.6	Confident	2 Å²	2	29 Å²	29	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-45	174.4	172.1	0	0	0	0	111.4	M32 T33 I34 D39 L40 S58 M62 F99 R187	M32-V36 PolarHBondContact O-N 3.32Å; T33-V36 PolarHBondContact O-N 2.82Å; I34-V36 VanDerWaalsContact C-N 3.33Å; I34-V36 PolarHBondContact O-N 3.27Å; V36-D39 PolarHBondContact O-N 3.43Å; V36-L40 HydrophobicContact CG1-CD1 4.48Å; V36-L40 PolarHBondContact O-N 3.48Å; V36-S58 VanDerWaalsContact CG1-OG 3.23Å; V36-S58 WeakPolarHBondContact CG1-OG 3.42Å; V36-M62 HydrophobicContact CG2-CB 3.89Å; V36-M62 HydrophobicContact CG2-CG 3.56Å; V36-F99 HydrophobicContact CG1-CZ 4.16Å; V36-R187 PolarHBondContact O-NH1 3.27Å
37	R	88.9	Confident	88.5	Confident	12 Å²	12	28 Å²	28	5%	0.045	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-45	-179.8	-173.9	174.1	170.1	-177.7	-11	112.1	T33 I34 D39 L40 S44 I98 F99 D104	T33-R37 WeakPolarHBondContact O-CB 3.35Å; T33-R37 PolarHBondContact O-N 2.86Å; I34-R37 PolarHBondContact O-N 3.29Å; I34-R37 VanDerWaalsContact O-N 3.16Å; R37-D39 VanDerWaalsContact C-N 3.33Å; R37-L40 PolarHBondContact O-N 3.08Å; R37-S44 WeakPolarHBondContact CG-OG 3.42Å; R37-S44 PolarHBondContact NE-OG 3.44Å; R37-S44 WeakPolarHBondContact O-CB 3.13Å; R37-I98 PolarHBondContact NH1-O 3.42Å; R37-F99 HydrophobicContact CB-CE1 3.81Å; R37-F99 HydrophobicContact CB-CE2 4.05Å; R37-F99 HydrophobicContact CB-CZ 3.47Å; R37-F99 VanDerWaalsContact CB-CZ 3.47Å; R37-F99 HydrophobicContact CG-CD1 4.3Å; R37-F99 HydrophobicContact CG-CE1 3.72Å; R37-F99 HydrophobicContact CG-CZ 3.93Å; R37-D104 IonicContact CZ-OD1 3.3Å; R37-D104 VanDerWaalsContact CZ-OD1 3.3Å; R37-D104 IonicContact CZ-OD2 3.57Å; R37-D104 IonicContact NH1-OD1 2.62Å; R37-D104 PolarHBondContact NH1-OD1 3.36Å; R37-D104 IonicContact NH1-OD2 3.63Å; R37-D104 IonicContact NH2-OD1 3.11Å; R37-D104 PolarHBondContact NH2-OD1 3.38Å; R37-D104 VanDerWaalsContact NH2-OD1 3.11Å; R37-D104 IonicContact NH2-OD2 2.69Å; R37-D104 PolarHBondContact NH2-OD2 2.99Å
38	E	86.6	Confident	88.6	Confident	30 Å²	30	27.7 Å²	27.7	14%	0.14	18%	0.176	C	C	.	.	H	α-helix	trans	-70.2	-31.2	-179.8	-68.4	180	-158.5	0	0	112.4	I34 A35 L40 A41 Y107 K111 F164	I34-E38 HydrophobicContact CG2-CG 4.09Å; I34-E38 WeakPolarHBondContact CG2-OE1 3.43Å; I34-E38 WeakPolarHBondContact O-CB 3.27Å; I34-E38 VanDerWaalsContact O-CG 3.3Å; I34-E38 WeakPolarHBondContact O-CG 3.47Å; I34-E38 PolarHBondContact O-N 3.38Å; A35-E38 PolarHBondContact O-N 3Å; E38-L40 VanDerWaalsContact C-N 3.28Å; E38-L40 PolarHBondContact O-N 3.36Å; E38-A41 WeakPolarHBondContact O-CA 3.42Å; E38-A41 PolarHBondContact O-N 3.42Å; E38-Y107 HydrophobicContact CG-CE2 4.47Å; E38-K111 WeakPolarHBondContact OE1-CE 3.37Å; E38-K111 IonicContact OE1-NZ 2.68Å; E38-K111 PolarHBondContact OE1-NZ 2.89Å; E38-K111 IonicContact OE2-NZ 3.61Å; E38-K111 PolarHBondContact OE2-NZ 3.47Å; E38-F164 HydrophobicContact CB-CD1 3.7Å; E38-F164 HydrophobicContact CB-CE1 3.37Å; E38-F164 HydrophobicContact CB-CZ 4.09Å; E38-F164 HydrophobicContact CG-CD1 4.49Å; E38-F164 HydrophobicContact CG-CE1 4.27Å; E38-F164 WeakPolarHBondContact OE2-CD1 3.35Å; E38-F164 WeakPolarHBondContact OE2-CE1 3.47Å
39	D	82.6	Confident	88.8	Confident	39 Å²	39	36.1 Å²	36.1	21%	0.209	21%	0.207	C	C	.	.	H	α-helix	trans	-65	-32.3	173.9	-166.8	56.5	0	0	0	112.6	A35 V36 R37 A41 R180 Q184 R187	A35-D39 WeakPolarHBondContact O-CB 3.45Å; A35-D39 PolarHBondContact O-N 2.95Å; V36-D39 PolarHBondContact O-N 3.43Å; R37-D39 VanDerWaalsContact C-N 3.33Å; D39-A41 PolarHBondContact O-N 3.03Å; D39-R180 VanDerWaalsContact CG-NH2 3.28Å; D39-R180 IonicContact OD1-CZ 3.41Å; D39-R180 IonicContact OD1-NE 3.54Å; D39-R180 IonicContact OD1-NH2 2.85Å; D39-R180 PolarHBondContact OD1-NH2 3.24Å; D39-Q184 PolarHBondContact OD1-NE2 2.7Å; D39-Q184 PolarHBondContact OD2-NE2 2.96Å; D39-R187 IonicContact OD2-CZ 3.72Å; D39-R187 IonicContact OD2-NH1 3.32Å; D39-R187 IonicContact OD2-NH2 3.37Å; D39-R187 PolarHBondContact OD2-NH2 2.83Å
40	L	85.4	Confident	89	Confident	29 Å²	29	43 Å²	43	15%	0.152	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-6.1	171.6	-69.9	162	0	0	0	113.4	V36 R37 E38 G43 S44 F47 F99	V36-L40 HydrophobicContact CG1-CD1 4.48Å; V36-L40 PolarHBondContact O-N 3.48Å; R37-L40 PolarHBondContact O-N 3.08Å; E38-L40 VanDerWaalsContact C-N 3.28Å; E38-L40 PolarHBondContact O-N 3.36Å; L40-G43 PolarHBondContact O-N 3.46Å; L40-G43 VanDerWaalsContact O-N 3.16Å; L40-S44 PolarHBondContact O-N 2.82Å; L40-F47 HydrophobicContact CD1-CB 4.47Å; L40-F47 HydrophobicContact CD1-CD1 3.74Å; L40-F47 HydrophobicContact CD1-CE1 4.42Å; L40-F47 HydrophobicContact CD1-CG 4.35Å; L40-F47 HydrophobicContact CD2-CB 4.14Å; L40-F47 HydrophobicContact CD2-CD1 3.75Å; L40-F47 HydrophobicContact CD2-CD2 4.27Å; L40-F47 HydrophobicContact CD2-CE1 4.24Å; L40-F47 HydrophobicContact CD2-CG 3.77Å; L40-F47 HydrophobicContact CG-CD1 4.42Å; L40-F99 HydrophobicContact CD1-CE1 4.25Å; L40-F99 HydrophobicContact CD1-CZ 4.42Å
41	A	85.1	Confident	89	Confident	66 Å²	66	45.9 Å²	45.9	55%	0.545	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	49.2	-134.4	178.4	0	0	0	0	0	113.2	E38 D39 G43 S44	E38-A41 WeakPolarHBondContact O-CA 3.42Å; E38-A41 PolarHBondContact O-N 3.42Å; D39-A41 PolarHBondContact O-N 3.03Å; A41-G43 PolarHBondContact O-N 3.42Å; A41-S44 WeakPolarHBondContact O-CB 3.28Å; A41-S44 PolarHBondContact O-N 2.92Å
42	S	83	Confident	89.3	Confident	127 Å²	127	48.5 Å²	48.5	89%	0.888	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-64.1	-23.2	-178.7	52.6	0	0	0	0	113.6	S44	S42-S44 VanDerWaalsContact C-N 3.31Å; S42-S44 PolarHBondContact O-N 2.98Å
43	G	86.3	Confident	89.6	Confident	30 Å²	30	54.9 Å²	54.9	31%	0.309	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-83.3	0	179.6	0	0	0	0	0	114.5	L40 A41 I45 T46 F47	L40-G43 PolarHBondContact O-N 3.46Å; L40-G43 VanDerWaalsContact O-N 3.16Å; A41-G43 PolarHBondContact O-N 3.42Å; G43-I45 PolarHBondContact O-N 3.28Å; G43-T46 PolarHBondContact O-N 2.98Å; G43-F47 VanDerWaalsContact O-CB 3.31Å; G43-F47 WeakPolarHBondContact O-CB 3.42Å; G43-F47 PolarHBondContact O-N 3.39Å
44	S	88.4	Confident	89.7	Confident	9 Å²	9	56.3 Å²	56.3	6%	0.063	31%	0.311	C	S	.	.	H	α-helix	trans	-58	-45.6	-167	79.6	0	0	0	0	114.5	R37 L40 A41 S42 S48	R37-S44 WeakPolarHBondContact CG-OG 3.42Å; R37-S44 PolarHBondContact NE-OG 3.44Å; R37-S44 WeakPolarHBondContact O-CB 3.13Å; L40-S44 PolarHBondContact O-N 2.82Å; A41-S44 WeakPolarHBondContact O-CB 3.28Å; A41-S44 PolarHBondContact O-N 2.92Å; S42-S44 VanDerWaalsContact C-N 3.31Å; S42-S44 PolarHBondContact O-N 2.98Å; S44-S48 WeakPolarHBondContact O-CB 3.4Å; S44-S48 PolarHBondContact O-N 2.84Å; S44-S48 PolarHBondContact O-OG 2.99Å
45	I	92.5	Very high	89.8	Confident	42 Å²	42	56.1 Å²	56.1	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-75.8	-38.8	-177.9	-60.8	-55.3	0	0	0	111.2	G43 F47 S48 R49 F99	G43-I45 PolarHBondContact O-N 3.28Å; I45-F47 VanDerWaalsContact C-N 3.33Å; I45-S48 PolarHBondContact O-OG 3.31Å; I45-S48 VanDerWaalsContact O-OG 3.1Å; I45-R49 WeakPolarHBondContact O-CB 3.24Å; I45-R49 VanDerWaalsContact O-CG 3.28Å; I45-R49 WeakPolarHBondContact O-CG 3.4Å; I45-R49 PolarHBondContact O-N 3.4Å; I45-R49 VanDerWaalsContact O-N 3.1Å; I45-F99 HydrophobicContact CD1-CD1 4.44Å; I45-F99 WeakPolarHBondContact CD1-O 3.13Å
46	T	92.9	Very high	90.3	Very high	102 Å²	102	59 Å²	59	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-63.4	-43.7	176.1	-54.1	0	0	0	0	110.5	G43 K50	G43-T46 PolarHBondContact O-N 2.98Å; T46-K50 WeakPolarHBondContact O-CB 3.37Å; T46-K50 PolarHBondContact O-N 2.58Å
47	F	92.1	Very high	90.6	Very high	39 Å²	39	62.5 Å²	62.5	17%	0.171	34%	0.336	C	S	.	.	H	α-helix	trans	-63.9	-49.8	176.6	-178.8	-90.9	0	0	0	111.9	L40 G43 I45 R49 K50 H51 C55 R187	L40-F47 HydrophobicContact CD1-CB 4.47Å; L40-F47 HydrophobicContact CD1-CD1 3.74Å; L40-F47 HydrophobicContact CD1-CE1 4.42Å; L40-F47 HydrophobicContact CD1-CG 4.35Å; L40-F47 HydrophobicContact CD2-CB 4.14Å; L40-F47 HydrophobicContact CD2-CD1 3.75Å; L40-F47 HydrophobicContact CD2-CD2 4.27Å; L40-F47 HydrophobicContact CD2-CE1 4.24Å; L40-F47 HydrophobicContact CD2-CG 3.77Å; L40-F47 HydrophobicContact CG-CD1 4.42Å; G43-F47 VanDerWaalsContact O-CB 3.31Å; G43-F47 WeakPolarHBondContact O-CB 3.42Å; G43-F47 PolarHBondContact O-N 3.39Å; I45-F47 VanDerWaalsContact C-N 3.33Å; F47-R49 VanDerWaalsContact C-N 3.27Å; F47-R49 PolarHBondContact O-N 3.29Å; F47-K50 PolarHBondContact O-N 3.06Å; F47-H51 HydrophobicContact CE1-CB 4.46Å; F47-H51 HydrophobicContact CE2-CB 4.38Å; F47-H51 AromaticContact CE2-CD2 3.98Å; F47-H51 HydrophobicContact CZ-CB 4.19Å; F47-H51 PolarHBondContact O-N 3.13Å; F47-C55 HydrophobicContact CD1-CB 4.25Å; F47-C55 HydrophobicContact CE1-CB 4.07Å; F47-R187 HydrophobicContact CE1-CB 4.33Å; F47-R187 HydrophobicContact CE1-CG 3.9Å; F47-R187 HydrophobicContact CE2-CB 4.32Å; F47-R187 HydrophobicContact CZ-CB 3.7Å; F47-R187 HydrophobicContact CZ-CG 3.71Å
48	S	94	Very high	90.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-39	-178.2	69.5	0	0	0	0	111.8	S44 I45 H51 P52 F99 Y100	S44-S48 WeakPolarHBondContact O-CB 3.4Å; S44-S48 PolarHBondContact O-N 2.84Å; S44-S48 PolarHBondContact O-OG 2.99Å; I45-S48 PolarHBondContact O-OG 3.31Å; I45-S48 VanDerWaalsContact O-OG 3.1Å; S48-H51 CarbonylContact O-C 3.52Å; S48-P52 WeakPolarHBondContact O-CA 3.28Å; S48-P52 WeakPolarHBondContact O-CB 3.29Å; S48-P52 VanDerWaalsContact O-N 3.08Å; S48-F99 VanDerWaalsContact CB-CD1 3.46Å; S48-Y100 PolarHBondContact O-OH 3.47Å
49	R	94.2	Very high	90.8	Very high	176 Å²	176	60.5 Å²	60.5	66%	0.664	33%	0.327	S	S	*	.	H	α-helix	trans	-71.7	-36.4	177.4	-69.4	174.7	179.5	-178.4	-0	113.6	I45 F47 Y100	I45-R49 WeakPolarHBondContact O-CB 3.24Å; I45-R49 VanDerWaalsContact O-CG 3.28Å; I45-R49 WeakPolarHBondContact O-CG 3.4Å; I45-R49 PolarHBondContact O-N 3.4Å; I45-R49 VanDerWaalsContact O-N 3.1Å; F47-R49 VanDerWaalsContact C-N 3.27Å; F47-R49 PolarHBondContact O-N 3.29Å; R49-Y100 HydrophobicContact CG-CE1 4.06Å
50	K	95.4	Very high	91.2	Very high	152 Å²	152	58.7 Å²	58.7	66%	0.661	32%	0.318	S	S	*	.	H	α-helix	trans	-77.1	-34.5	179.3	-168.1	179.3	176.8	-178.4	0	112.3	T46 F47	T46-K50 WeakPolarHBondContact O-CB 3.37Å; T46-K50 PolarHBondContact O-N 2.58Å; F47-K50 PolarHBondContact O-N 3.06Å
51	H	94	Very high	91.3	Very high	84 Å²	84	58 Å²	58	39%	0.389	31%	0.314	S	S	.	.	S	Bend	trans	-133.3	63.3	-175.7	-57.2	-66.4	0	0	0	111.5	F47 S48 L53 S54 C55	F47-H51 HydrophobicContact CE1-CB 4.46Å; F47-H51 HydrophobicContact CE2-CB 4.38Å; F47-H51 AromaticContact CE2-CD2 3.98Å; F47-H51 HydrophobicContact CZ-CB 4.19Å; F47-H51 PolarHBondContact O-N 3.13Å; S48-H51 CarbonylContact O-C 3.52Å; H51-L53 VanDerWaalsContact C-N 3.34Å; H51-L53 PolarHBondContact O-N 2.96Å; H51-S54 PolarHBondContact O-N 3.31Å; H51-C55 PolarHBondContact O-N 3.36Å
52	P	95.1	Very high	91.3	Very high	58 Å²	58	55 Å²	55	38%	0.377	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-39.4	-172.3	23.5	-33.9	0	0	0	112.9	S48 C55 W56 W95	S48-P52 WeakPolarHBondContact O-CA 3.28Å; S48-P52 WeakPolarHBondContact O-CB 3.29Å; S48-P52 VanDerWaalsContact O-N 3.08Å; P52-C55 PolarHBondContact O-N 2.89Å; P52-W56 WeakPolarHBondContact O-CB 3.48Å; P52-W56 PolarHBondContact O-N 3.36Å; P52-W95 WeakPolarHBondContact O-CZ2 3.49Å
53	L	94	Very high	91.6	Very high	139 Å²	139	49 Å²	49	73%	0.728	25%	0.247	S	C	*	.	H	α-helix	trans	-67.4	-39.1	178.3	-65.8	-179.6	0	0	0	112.7	H51 W56 L57	H51-L53 VanDerWaalsContact C-N 3.34Å; H51-L53 PolarHBondContact O-N 2.96Å; L53-W56 PolarHBondContact O-N 3.46Å; L53-L57 VanDerWaalsContact O-CB 3.25Å; L53-L57 WeakPolarHBondContact O-CB 3.35Å; L53-L57 PolarHBondContact O-N 2.98Å
54	S	91.8	Very high	91.8	Very high	29 Å²	29	48.2 Å²	48.2	20%	0.203	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-45.8	175.4	176.3	0	0	0	0	110.1	H51 W56 L57 S58 V186	H51-S54 PolarHBondContact O-N 3.31Å; S54-W56 PolarHBondContact O-N 3.17Å; S54-L57 PolarHBondContact O-N 2.96Å; S54-S58 VanDerWaalsContact O-CB 3.32Å; S54-S58 WeakPolarHBondContact O-CB 3.31Å; S54-S58 PolarHBondContact O-N 3.42Å; S54-V186 PolarHBondContact OG-O 3.39Å
55	C	92.7	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.1	-42	176.9	-178.6	0	0	0	0	112.9	F47 H51 P52 S59 W95 F99	F47-C55 HydrophobicContact CD1-CB 4.25Å; F47-C55 HydrophobicContact CE1-CB 4.07Å; H51-C55 PolarHBondContact O-N 3.36Å; P52-C55 PolarHBondContact O-N 2.89Å; C55-S59 WeakPolarHBondContact O-CB 3.25Å; C55-S59 PolarHBondContact O-N 2.93Å; C55-S59 PolarHBondContact O-OG 3.4Å; C55-W95 HydrophobicContact CB-CZ2 4.45Å; C55-W95 PolarHBondContact SG-NE1 3.41Å; C55-F99 VanDerWaalsContact SG-CZ 3.52Å
56	W	95.9	Very high	91.3	Very high	74 Å²	74	46 Å²	46	28%	0.28	22%	0.223	S	C	.	.	H	α-helix	trans	-62.3	-50.8	174.6	177.2	82.3	0	0	0	111	P52 L53 S54 S58 S59 M60 V88 S92 W95	P52-W56 WeakPolarHBondContact O-CB 3.48Å; P52-W56 PolarHBondContact O-N 3.36Å; L53-W56 PolarHBondContact O-N 3.46Å; S54-W56 PolarHBondContact O-N 3.17Å; W56-S58 VanDerWaalsContact C-N 3.34Å; W56-S58 PolarHBondContact O-N 3.41Å; W56-S59 CarbonylContact O-C 3.48Å; W56-S59 WeakPolarHBondContact O-CA 3.16Å; W56-S59 WeakPolarHBondContact O-CB 3.46Å; W56-S59 PolarHBondContact O-N 3.19Å; W56-S59 VanDerWaalsContact O-N 3.12Å; W56-M60 HydrophobicContact CD2-CG 3.82Å; W56-M60 VanDerWaalsContact CE2-CG 3.47Å; W56-M60 HydrophobicContact CE3-CG 4.19Å; W56-M60 HydrophobicContact CG-CG 4.41Å; W56-M60 HydrophobicContact CH2-CG 3.95Å; W56-M60 HydrophobicContact CZ2-CG 3.56Å; W56-M60 HydrophobicContact CZ2-SD 4.14Å; W56-M60 HydrophobicContact CZ3-CG 4.24Å; W56-M60 WeakPolarHBondContact O-CG 3.15Å; W56-M60 PolarHBondContact O-N 2.84Å; W56-V88 HydrophobicContact CZ2-CG1 4.33Å; W56-S92 PolarHBondContact NE1-OG 3.41Å; W56-W95 HydrophobicContact CB-CD2 4.17Å; W56-W95 HydrophobicContact CB-CE3 4.39Å; W56-W95 HydrophobicContact CB-CH2 3.84Å; W56-W95 HydrophobicContact CB-CZ2 3.62Å; W56-W95 HydrophobicContact CB-CZ3 4.23Å; W56-W95 AromaticContact CD1-CD2 3.76Å; W56-W95 AromaticContact CD1-CE3 3.53Å; W56-W95 AromaticContact CD1-CZ3 3.82Å; W56-W95 HydrophobicContact CG-CD2 4.39Å; W56-W95 HydrophobicContact CG-CE3 4.35Å; W56-W95 HydrophobicContact CG-CH2 4.45Å; W56-W95 HydrophobicContact CG-CZ3 4.37Å
57	L	92.4	Very high	91	Very high	75 Å²	75	42.5 Å²	42.5	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-43.3	-178.6	-179.3	60.5	0	0	0	111.5	L53 S54 S59 M60 M61 V186	L53-L57 VanDerWaalsContact O-CB 3.25Å; L53-L57 WeakPolarHBondContact O-CB 3.35Å; L53-L57 PolarHBondContact O-N 2.98Å; S54-L57 PolarHBondContact O-N 2.96Å; L57-S59 VanDerWaalsContact C-N 3.32Å; L57-S59 PolarHBondContact O-N 3.35Å; L57-M60 PolarHBondContact O-N 3.47Å; L57-M61 HydrophobicContact CD1-CG 4.48Å; L57-M61 HydrophobicContact CG-CE 4.44Å; L57-M61 WeakPolarHBondContact O-CG 3.37Å; L57-M61 PolarHBondContact O-N 2.83Å; L57-V186 HydrophobicContact CB-CG1 4.46Å; L57-V186 HydrophobicContact CD2-CG1 3.85Å; L57-V186 HydrophobicContact CG-CG1 4.16Å
58	S	88.5	Confident	90.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-42.4	175.6	117.7	0	0	0	0	111.1	V36 S54 W56 M60 M61 M62 E183 R187	V36-S58 VanDerWaalsContact CG1-OG 3.23Å; V36-S58 WeakPolarHBondContact CG1-OG 3.42Å; S54-S58 VanDerWaalsContact O-CB 3.32Å; S54-S58 WeakPolarHBondContact O-CB 3.31Å; S54-S58 PolarHBondContact O-N 3.42Å; W56-S58 VanDerWaalsContact C-N 3.34Å; W56-S58 PolarHBondContact O-N 3.41Å; S58-M60 PolarHBondContact O-N 3.4Å; S58-M61 PolarHBondContact O-N 3.47Å; S58-M62 PolarHBondContact O-N 3.44Å; S58-E183 WeakPolarHBondContact CB-OE1 3.43Å; S58-E183 VanDerWaalsContact O-CG 3.32Å; S58-E183 WeakPolarHBondContact O-CG 3.16Å; S58-E183 PolarHBondContact OG-OE1 2.93Å; S58-R187 WeakPolarHBondContact OG-CD 3.24Å
59	S	90.9	Very high	90.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.7	-42.1	174.1	-56.2	0	0	0	0	112.6	C55 W56 L57 M62 C63	C55-S59 WeakPolarHBondContact O-CB 3.25Å; C55-S59 PolarHBondContact O-N 2.93Å; C55-S59 PolarHBondContact O-OG 3.4Å; W56-S59 CarbonylContact O-C 3.48Å; W56-S59 WeakPolarHBondContact O-CA 3.16Å; W56-S59 WeakPolarHBondContact O-CB 3.46Å; W56-S59 PolarHBondContact O-N 3.19Å; W56-S59 VanDerWaalsContact O-N 3.12Å; L57-S59 VanDerWaalsContact C-N 3.32Å; L57-S59 PolarHBondContact O-N 3.35Å; S59-M62 PolarHBondContact O-N 2.95Å; S59-C63 WeakPolarHBondContact O-CB 3.27Å; S59-C63 PolarHBondContact O-N 2.88Å; S59-C63 PolarHBondContact O-SG 3.36Å
60	M	90.7	Very high	89.8	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-64.5	-43.1	176.5	-67.1	-50.9	110	0	0	111.6	W56 L57 S58 M62 C63 F64 A91 W95	W56-M60 HydrophobicContact CD2-CG 3.82Å; W56-M60 VanDerWaalsContact CE2-CG 3.47Å; W56-M60 HydrophobicContact CE3-CG 4.19Å; W56-M60 HydrophobicContact CG-CG 4.41Å; W56-M60 HydrophobicContact CH2-CG 3.95Å; W56-M60 HydrophobicContact CZ2-CG 3.56Å; W56-M60 HydrophobicContact CZ2-SD 4.14Å; W56-M60 HydrophobicContact CZ3-CG 4.24Å; W56-M60 WeakPolarHBondContact O-CG 3.15Å; W56-M60 PolarHBondContact O-N 2.84Å; L57-M60 PolarHBondContact O-N 3.47Å; S58-M60 PolarHBondContact O-N 3.4Å; M60-M62 VanDerWaalsContact C-N 3.3Å; M60-M62 PolarHBondContact O-N 3.34Å; M60-C63 PolarHBondContact O-N 3.14Å; M60-F64 HydrophobicContact CB-CD2 4.46Å; M60-F64 WeakPolarHBondContact O-CD2 3.38Å; M60-F64 PolarHBondContact O-N 3.2Å; M60-F64 HydrophobicContact SD-CE2 4.06Å; M60-A91 HydrophobicContact CE-CB 3.92Å; M60-A91 HydrophobicContact SD-CB 3.82Å; M60-W95 HydrophobicContact CE-CB 4.13Å
61	M	87.1	Confident	89.4	Confident	13 Å²	13	28 Å²	28	6%	0.064	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-40	175.2	-72.5	-170.6	-57.8	0	0	111.8	L57 S58 F64 A65 F68 F182 E183 V186	L57-M61 HydrophobicContact CD1-CG 4.48Å; L57-M61 HydrophobicContact CG-CE 4.44Å; L57-M61 WeakPolarHBondContact O-CG 3.37Å; L57-M61 PolarHBondContact O-N 2.83Å; S58-M61 PolarHBondContact O-N 3.47Å; M61-F64 CarbonylContact O-C 3.14Å; M61-A65 WeakPolarHBondContact O-CA 3.39Å; M61-A65 VanDerWaalsContact O-CB 3.25Å; M61-A65 WeakPolarHBondContact O-CB 3.42Å; M61-A65 PolarHBondContact O-N 3.2Å; M61-F68 HydrophobicContact CG-CE2 4.47Å; M61-F182 HydrophobicContact SD-CD1 3.86Å; M61-F182 HydrophobicContact SD-CE1 3.95Å; M61-E183 HydrophobicContact CE-CB 3.91Å; M61-E183 HydrophobicContact CE-CG 3.95Å; M61-V186 HydrophobicContact CE-CB 3.54Å; M61-V186 HydrophobicContact CE-CG1 3.84Å; M61-V186 HydrophobicContact CE-CG2 3.38Å; M61-V186 HydrophobicContact SD-CG2 4.04Å
62	M	86.1	Confident	89.1	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-45.8	174.1	-77	-64.1	-71.2	0	0	112.1	M32 V36 S58 S59 M60 F64 A65 S160 R180 E183	M32-M62 HydrophobicContact CB-CB 4.34Å; V36-M62 HydrophobicContact CG2-CB 3.89Å; V36-M62 HydrophobicContact CG2-CG 3.56Å; S58-M62 PolarHBondContact O-N 3.44Å; S59-M62 PolarHBondContact O-N 2.95Å; M60-M62 VanDerWaalsContact C-N 3.3Å; M60-M62 PolarHBondContact O-N 3.34Å; M62-F64 VanDerWaalsContact C-N 3.28Å; M62-F64 PolarHBondContact O-N 2.86Å; M62-A65 WeakPolarHBondContact O-CB 3.5Å; M62-A65 PolarHBondContact O-N 3.01Å; M62-S160 WeakPolarHBondContact CE-O 3.44Å; M62-S160 PolarHBondContact O-OG 3.12Å; M62-R180 HydrophobicContact SD-CB 4.36Å; M62-E183 HydrophobicContact CG-CB 4.38Å; M62-E183 HydrophobicContact CG-CG 3.8Å; M62-E183 HydrophobicContact SD-CB 4.49Å; M62-E183 HydrophobicContact SD-CG 4.47Å
63	C	89.3	Confident	88.6	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.007	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-38.5	178.1	-75.2	0	0	0	0	112.7	H28 Y29 S59 M60 A91	H28-C63 PolarHBondContact NE2-O 2.96Å; Y29-C63 HydrophobicContact CD1-CB 3.73Å; Y29-C63 HydrophobicContact CE1-CB 4.08Å; S59-C63 WeakPolarHBondContact O-CB 3.27Å; S59-C63 PolarHBondContact O-N 2.88Å; S59-C63 PolarHBondContact O-SG 3.36Å; M60-C63 PolarHBondContact O-N 3.14Å; C63-A91 HydrophobicContact CB-CB 4.4Å
64	F	90.2	Very high	88.3	Confident	13 Å²	13	26.4 Å²	26.4	6%	0.057	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	13.7	-177.3	-57.2	-68.1	0	0	0	113.8	Y29 M60 M61 M62 G66 S67 F68 P81 H87 V88 A91	Y29-F64 HydrophobicContact CE1-CE1 4.12Å; Y29-F64 HydrophobicContact CE1-CZ 4.29Å; M60-F64 HydrophobicContact CB-CD2 4.46Å; M60-F64 WeakPolarHBondContact O-CD2 3.38Å; M60-F64 PolarHBondContact O-N 3.2Å; M60-F64 HydrophobicContact SD-CE2 4.06Å; M61-F64 CarbonylContact O-C 3.14Å; M62-F64 VanDerWaalsContact C-N 3.28Å; M62-F64 PolarHBondContact O-N 2.86Å; F64-G66 VanDerWaalsContact C-N 3.31Å; F64-G66 PolarHBondContact O-N 2.74Å; F64-S67 PolarHBondContact O-N 3.28Å; F64-F68 HydrophobicContact CB-CD2 3.78Å; F64-F68 HydrophobicContact CB-CE2 3.7Å; F64-F68 WeakPolarHBondContact O-CD2 3.45Å; F64-F68 PolarHBondContact O-N 3.29Å; F64-P81 HydrophobicContact CB-CB 3.97Å; F64-P81 HydrophobicContact CB-CG 4.49Å; F64-P81 HydrophobicContact CD1-CB 4.06Å; F64-P81 HydrophobicContact CG-CB 4.07Å; F64-H87 HydrophobicContact CE1-CB 3.99Å; F64-H87 HydrophobicContact CZ-CB 4.1Å; F64-V88 HydrophobicContact CE2-CG2 4.19Å; F64-V88 HydrophobicContact CZ-CG2 4.14Å; F64-A91 HydrophobicContact CE2-CB 4.31Å; F64-A91 HydrophobicContact CZ-CB 4.22Å
65	A	85.5	Confident	88.1	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-51	-46.8	-172.5	0	0	0	0	0	113.5	M61 M62 S67 F68 L69 M179	M61-A65 WeakPolarHBondContact O-CA 3.39Å; M61-A65 VanDerWaalsContact O-CB 3.25Å; M61-A65 WeakPolarHBondContact O-CB 3.42Å; M61-A65 PolarHBondContact O-N 3.2Å; M62-A65 WeakPolarHBondContact O-CB 3.5Å; M62-A65 PolarHBondContact O-N 3.01Å; A65-S67 VanDerWaalsContact C-N 3.32Å; A65-S67 PolarHBondContact O-N 3.05Å; A65-F68 PolarHBondContact O-N 2.95Å; A65-L69 WeakPolarHBondContact O-CB 3.49Å; A65-L69 PolarHBondContact O-N 3.3Å; A65-M179 HydrophobicContact CB-CB 3.87Å; A65-M179 HydrophobicContact CB-CG 3.49Å; A65-M179 VanDerWaalsContact CB-CG 3.49Å
66	G	83.6	Confident	88	Confident	3 Å²	3	30.9 Å²	30.9	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-63.1	-37.3	179.6	0	0	0	0	0	112.9	F64 A70	F64-G66 VanDerWaalsContact C-N 3.31Å; F64-G66 PolarHBondContact O-N 2.74Å; G66-A70 WeakPolarHBondContact O-CB 3.5Å; G66-A70 PolarHBondContact O-N 3.37Å
67	S	87.2	Confident	87.8	Confident	29 Å²	29	30.8 Å²	30.8	20%	0.203	18%	0.18	C	C	.	.	H	α-helix	trans	-73.1	-45.6	177.1	-59	0	0	0	0	111.4	F64 A65 L69 A70 N71	F64-S67 PolarHBondContact O-N 3.28Å; A65-S67 VanDerWaalsContact C-N 3.32Å; A65-S67 PolarHBondContact O-N 3.05Å; S67-L69 VanDerWaalsContact C-N 3.31Å; S67-L69 PolarHBondContact O-N 3.47Å; S67-A70 PolarHBondContact O-N 2.93Å; S67-N71 VanDerWaalsContact O-CB 3.31Å; S67-N71 WeakPolarHBondContact O-CB 3.39Å; S67-N71 PolarHBondContact O-N 3.42Å; S67-N71 PolarHBondContact O-OD1 3.1Å; S67-N71 VanDerWaalsContact O-OD1 3.12Å
68	F	86.6	Confident	87.6	Confident	28 Å²	28	30.8 Å²	30.8	12%	0.123	18%	0.18	C	C	.	.	H	α-helix	trans	-56.6	-46.8	176.3	-82.6	-61.7	0	0	0	111.7	M61 F64 A65 F72 L78 P81 L82 M179	M61-F68 HydrophobicContact CG-CE2 4.47Å; F64-F68 HydrophobicContact CB-CD2 3.78Å; F64-F68 HydrophobicContact CB-CE2 3.7Å; F64-F68 WeakPolarHBondContact O-CD2 3.45Å; F64-F68 PolarHBondContact O-N 3.29Å; A65-F68 PolarHBondContact O-N 2.95Å; F68-F72 VanDerWaalsContact O-CB 3.29Å; F68-F72 WeakPolarHBondContact O-CB 3.31Å; F68-F72 PolarHBondContact O-N 3.48Å; F68-L78 HydrophobicContact CD1-CB 4.02Å; F68-L78 WeakPolarHBondContact CD1-O 3.17Å; F68-L78 HydrophobicContact CE1-CB 4.27Å; F68-L78 WeakPolarHBondContact CE1-O 3.32Å; F68-L78 VanDerWaalsContact O-CD2 3.28Å; F68-L78 WeakPolarHBondContact O-CD2 3.44Å; F68-P81 HydrophobicContact CD1-CG 4.13Å; F68-P81 HydrophobicContact CE1-CG 4.02Å; F68-P81 HydrophobicContact CE2-CG 4.48Å; F68-P81 HydrophobicContact CG-CG 4.41Å; F68-P81 HydrophobicContact CZ-CG 4.19Å; F68-L82 HydrophobicContact CZ-CD1 4.32Å; F68-L82 HydrophobicContact CZ-CG 4.26Å; F68-M179 HydrophobicContact CB-CE 3.14Å; F68-M179 HydrophobicContact CD2-CE 3.71Å; F68-M179 HydrophobicContact CG-CE 3.66Å
69	L	83.1	Confident	87.5	Confident	19 Å²	19	36 Å²	36	10%	0.099	21%	0.205	C	C	.	.	H	α-helix	trans	-72	-40.9	-179.6	-178	63.6	0	0	0	112.7	A65 S67 N71 F72 L73 A155 I159	A65-L69 WeakPolarHBondContact O-CB 3.49Å; A65-L69 PolarHBondContact O-N 3.3Å; S67-L69 VanDerWaalsContact C-N 3.31Å; S67-L69 PolarHBondContact O-N 3.47Å; L69-N71 VanDerWaalsContact C-N 3.27Å; L69-N71 PolarHBondContact O-N 3.22Å; L69-F72 HydrophobicContact CD1-CD1 4.16Å; L69-F72 WeakPolarHBondContact O-CB 3.43Å; L69-F72 PolarHBondContact O-N 3.05Å; L69-L73 HydrophobicContact CD1-CD1 4.02Å; L69-L73 HydrophobicContact CD1-CG 3.96Å; L69-L73 HydrophobicContact CD2-CD1 4.39Å; L69-L73 HydrophobicContact CG-CD1 3.82Å; L69-L73 HydrophobicContact CG-CG 4.21Å; L69-L73 WeakPolarHBondContact O-CB 3.05Å; L69-L73 VanDerWaalsContact O-CG 3.28Å; L69-L73 WeakPolarHBondContact O-CG 3.46Å; L69-L73 PolarHBondContact O-N 3.33Å; L69-A155 HydrophobicContact CD2-CB 4.04Å; L69-A155 HydrophobicContact CG-CB 4.38Å; L69-I159 HydrophobicContact CD2-CB 3.92Å; L69-I159 HydrophobicContact CD2-CD1 3.02Å; L69-I159 HydrophobicContact CD2-CG1 3.97Å; L69-I159 HydrophobicContact CD2-CG2 3.72Å; L69-I159 HydrophobicContact CG-CD1 4.48Å
70	A	85.2	Confident	87.5	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-57.4	-46	174.8	0	0	0	0	0	110.6	G66 S67 L73 L74 I152	G66-A70 WeakPolarHBondContact O-CB 3.5Å; G66-A70 PolarHBondContact O-N 3.37Å; S67-A70 PolarHBondContact O-N 2.93Å; A70-L73 PolarHBondContact O-N 3.01Å; A70-L74 WeakPolarHBondContact O-CB 3.34Å; A70-L74 VanDerWaalsContact O-CG 3.24Å; A70-L74 WeakPolarHBondContact O-CG 3.42Å; A70-L74 PolarHBondContact O-N 3.32Å; A70-I152 HydrophobicContact CB-CG2 3.93Å
71	N	88.2	Confident	87.2	Confident	12 Å²	12	38.8 Å²	38.8	6%	0.064	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-41.9	177.8	-64.2	4	0	0	0	111.5	S67 L69 L73 L74 G75 E76 S77 L78 P81	S67-N71 VanDerWaalsContact O-CB 3.31Å; S67-N71 WeakPolarHBondContact O-CB 3.39Å; S67-N71 PolarHBondContact O-N 3.42Å; S67-N71 PolarHBondContact O-OD1 3.1Å; S67-N71 VanDerWaalsContact O-OD1 3.12Å; L69-N71 VanDerWaalsContact C-N 3.27Å; L69-N71 PolarHBondContact O-N 3.22Å; N71-L73 PolarHBondContact O-N 3.16Å; N71-L74 CarbonylContact O-C 3.51Å; N71-L74 PolarHBondContact O-N 3.03Å; N71-G75 CarbonylContact O-C 3.58Å; N71-G75 PolarHBondContact O-N 3.17Å; N71-E76 HydrophobicContact CB-CB 4.04Å; N71-E76 PolarHBondContact O-N 3.33Å; N71-S77 PolarHBondContact ND2-O 3.21Å; N71-L78 HydrophobicContact CB-CD2 4.2Å; N71-P81 WeakPolarHBondContact ND2-CD 3.38Å
72	F	86.8	Confident	87.3	Confident	142 Å²	142	40.6 Å²	40.6	62%	0.623	23%	0.229	S	C	*	.	H	α-helix	trans	-57.2	-47.8	175.4	-179.3	-103	0	0	0	111.9	F68 L69 L74 G75 L78	F68-F72 VanDerWaalsContact O-CB 3.29Å; F68-F72 WeakPolarHBondContact O-CB 3.31Å; F68-F72 PolarHBondContact O-N 3.48Å; L69-F72 HydrophobicContact CD1-CD1 4.16Å; L69-F72 WeakPolarHBondContact O-CB 3.43Å; L69-F72 PolarHBondContact O-N 3.05Å; F72-L74 VanDerWaalsContact C-N 3.32Å; F72-L74 PolarHBondContact O-N 3.28Å; F72-G75 PolarHBondContact O-N 3.12Å; F72-L78 HydrophobicContact CB-CD2 3.81Å
73	L	85.2	Confident	87.5	Confident	81 Å²	81	49.5 Å²	49.5	42%	0.424	26%	0.263	S	S	.	.	H	α-helix	trans	-70	-28.9	-179.3	-69.1	169.8	0	0	0	113	L69 A70 N71 L151 I152 A155	L69-L73 HydrophobicContact CD1-CD1 4.02Å; L69-L73 HydrophobicContact CD1-CG 3.96Å; L69-L73 HydrophobicContact CD2-CD1 4.39Å; L69-L73 HydrophobicContact CG-CD1 3.82Å; L69-L73 HydrophobicContact CG-CG 4.21Å; L69-L73 WeakPolarHBondContact O-CB 3.05Å; L69-L73 VanDerWaalsContact O-CG 3.28Å; L69-L73 WeakPolarHBondContact O-CG 3.46Å; L69-L73 PolarHBondContact O-N 3.33Å; A70-L73 PolarHBondContact O-N 3.01Å; N71-L73 PolarHBondContact O-N 3.16Å; L73-L151 HydrophobicContact CD1-CD2 3.77Å; L73-I152 HydrophobicContact CB-CD1 3.44Å; L73-I152 VanDerWaalsContact CB-CD1 3.44Å; L73-I152 HydrophobicContact CD1-CD1 3.78Å; L73-I152 HydrophobicContact CG-CD1 4.27Å; L73-A155 HydrophobicContact CD1-CB 4.05Å
74	L	87.3	Confident	87.6	Confident	25 Å²	25	54.5 Å²	54.5	13%	0.131	29%	0.286	C	S	.	.	H	α-helix	trans	-86.7	-6.2	175.7	-67.1	171.9	0	0	0	113.3	A70 N71 F72 E76 V138 L141 Y142 I152	A70-L74 WeakPolarHBondContact O-CB 3.34Å; A70-L74 VanDerWaalsContact O-CG 3.24Å; A70-L74 WeakPolarHBondContact O-CG 3.42Å; A70-L74 PolarHBondContact O-N 3.32Å; N71-L74 CarbonylContact O-C 3.51Å; N71-L74 PolarHBondContact O-N 3.03Å; F72-L74 VanDerWaalsContact C-N 3.32Å; F72-L74 PolarHBondContact O-N 3.28Å; L74-E76 HydrophobicContact CB-CG 4.03Å; L74-E76 PolarHBondContact O-N 3.24Å; L74-V138 HydrophobicContact CD1-CG2 3.94Å; L74-V138 HydrophobicContact CD2-CG2 3.95Å; L74-V138 HydrophobicContact CG-CG2 4.48Å; L74-L141 HydrophobicContact CD1-CD1 4.17Å; L74-Y142 HydrophobicContact CD2-CD2 4.42Å; L74-Y142 HydrophobicContact CD2-CE2 4.04Å; L74-I152 HydrophobicContact CD1-CG2 4.36Å; L74-I152 HydrophobicContact CD2-CD1 4.24Å; L74-I152 HydrophobicContact CD2-CG1 4.14Å; L74-I152 HydrophobicContact CG-CD1 4.03Å; L74-I152 HydrophobicContact CG-CG1 4.35Å
75	G	88.2	Confident	87.7	Confident	72 Å²	72	60.2 Å²	60.2	74%	0.742	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	19.4	-172.5	0	0	0	0	0	113.7	N71 F72	N71-G75 CarbonylContact O-C 3.58Å; N71-G75 PolarHBondContact O-N 3.17Å; F72-G75 PolarHBondContact O-N 3.12Å
76	E	90.2	Very high	88.2	Confident	51 Å²	51	66.2 Å²	66.2	24%	0.238	34%	0.34	C	S	.	.			trans	-82.2	163.3	174	-67.1	-177.4	179.7	0	0	111.1	N71 L74 L78 I80 H137 L141	N71-E76 HydrophobicContact CB-CB 4.04Å; N71-E76 PolarHBondContact O-N 3.33Å; L74-E76 HydrophobicContact CB-CG 4.03Å; L74-E76 PolarHBondContact O-N 3.24Å; E76-L78 PolarHBondContact O-N 3.31Å; E76-I80 HydrophobicContact CB-CD1 3.97Å; E76-H137 IonicContact OE1-CD2 2.6Å; E76-H137 IonicContact OE1-CE1 4Å; E76-H137 IonicContact OE1-NE2 3.59Å; E76-H137 PolarHBondContact OE1-NE2 3.29Å; E76-H137 IonicContact OE2-NE2 2.98Å; E76-H137 PolarHBondContact OE2-NE2 3.11Å; E76-L141 WeakPolarHBondContact OE1-CD1 3.24Å
77	S	91.5	Very high	88.7	Confident	72 Å²	72	68.1 Å²	68.1	50%	0.503	35%	0.348	S	S	.	.			trans	-62.3	126.2	178.3	-175.7	0	0	0	0	111.6	N71 M79 I80	N71-S77 PolarHBondContact ND2-O 3.21Å; S77-M79 PolarHBondContact O-N 2.93Å; S77-M79 VanDerWaalsContact O-N 3.1Å; S77-M79 PolarHBondContact OG-N 3.19Å; S77-I80 WeakPolarHBondContact O-CD1 3.19Å; S77-I80 VanDerWaalsContact O-CG1 3.27Å; S77-I80 WeakPolarHBondContact O-CG1 3.44Å; S77-I80 PolarHBondContact O-N 3.19Å
78	L	87.5	Confident	89.1	Confident	75 Å²	75	67.8 Å²	67.8	39%	0.393	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-17	172.9	-59.5	-175.2	0	0	0	112.5	F68 N71 F72 E76 I80 P81	F68-L78 HydrophobicContact CD1-CB 4.02Å; F68-L78 WeakPolarHBondContact CD1-O 3.17Å; F68-L78 HydrophobicContact CE1-CB 4.27Å; F68-L78 WeakPolarHBondContact CE1-O 3.32Å; F68-L78 VanDerWaalsContact O-CD2 3.28Å; F68-L78 WeakPolarHBondContact O-CD2 3.44Å; N71-L78 HydrophobicContact CB-CD2 4.2Å; F72-L78 HydrophobicContact CB-CD2 3.81Å; E76-L78 PolarHBondContact O-N 3.31Å; L78-I80 VanDerWaalsContact C-N 3.33Å; L78-I80 PolarHBondContact O-N 3.04Å; L78-P81 VanDerWaalsContact O-CD 3.29Å; L78-P81 WeakPolarHBondContact O-CD 3.08Å; L78-P81 WeakPolarHBondContact O-CG 3.47Å
79	M	87.5	Confident	89.6	Confident	108 Å²	108	71.6 Å²	71.6	53%	0.532	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-10.5	-178.6	-60.2	-56.7	-67.2	0	0	113.7	S77 L82 R83	S77-M79 PolarHBondContact O-N 2.93Å; S77-M79 VanDerWaalsContact O-N 3.1Å; S77-M79 PolarHBondContact OG-N 3.19Å; M79-L82 HydrophobicContact CE-CB 4.35Å; M79-L82 HydrophobicContact CE-CD1 3.61Å; M79-L82 PolarHBondContact O-N 2.88Å; M79-L82 HydrophobicContact SD-CD1 3.93Å; M79-R83 PolarHBondContact O-N 3.11Å; M79-R83 VanDerWaalsContact O-N 3.15Å
80	I	90.1	Very high	90.2	Very high	56 Å²	56	72 Å²	72	29%	0.287	37%	0.368	S	S	.	.	H	α-helix	trans	-53.2	-50.8	179.7	-63.9	165.4	0	0	0	112.8	E76 S77 L78 L82 R83 H84	E76-I80 HydrophobicContact CB-CD1 3.97Å; S77-I80 WeakPolarHBondContact O-CD1 3.19Å; S77-I80 VanDerWaalsContact O-CG1 3.27Å; S77-I80 WeakPolarHBondContact O-CG1 3.44Å; S77-I80 PolarHBondContact O-N 3.19Å; L78-I80 VanDerWaalsContact C-N 3.33Å; L78-I80 PolarHBondContact O-N 3.04Å; I80-L82 PolarHBondContact O-N 3.25Å; I80-R83 WeakPolarHBondContact O-CB 3.48Å; I80-R83 PolarHBondContact O-N 3.35Å; I80-R83 VanDerWaalsContact O-N 3.12Å; I80-H84 PolarHBondContact O-CD2 2.95Å
81	P	85.2	Confident	90.7	Very high	6 Å²	6	71.9 Å²	71.9	4%	0.039	37%	0.366	C	S	.	.	H	α-helix	trans	-58.7	-31.7	176.6	21	-34.3	0	0	0	113.6	F64 F68 N71 L78 R83 H84	F64-P81 HydrophobicContact CB-CB 3.97Å; F64-P81 HydrophobicContact CB-CG 4.49Å; F64-P81 HydrophobicContact CD1-CB 4.06Å; F64-P81 HydrophobicContact CG-CB 4.07Å; F68-P81 HydrophobicContact CD1-CG 4.13Å; F68-P81 HydrophobicContact CE1-CG 4.02Å; F68-P81 HydrophobicContact CE2-CG 4.48Å; F68-P81 HydrophobicContact CG-CG 4.41Å; F68-P81 HydrophobicContact CZ-CG 4.19Å; N71-P81 WeakPolarHBondContact ND2-CD 3.38Å; L78-P81 VanDerWaalsContact O-CD 3.29Å; L78-P81 WeakPolarHBondContact O-CD 3.08Å; L78-P81 WeakPolarHBondContact O-CG 3.47Å; P81-R83 VanDerWaalsContact C-N 3.35Å; P81-H84 PolarHBondContact O-N 2.86Å
82	L	88.9	Confident	91.2	Very high	50 Å²	50	72.6 Å²	72.6	26%	0.262	37%	0.373	S	S	.	.	H	α-helix	trans	-77.4	-18.6	-179.9	-64.5	176.4	0	0	0	113.3	F68 M79 I80 H84 V88	F68-L82 HydrophobicContact CZ-CD1 4.32Å; F68-L82 HydrophobicContact CZ-CG 4.26Å; M79-L82 HydrophobicContact CE-CB 4.35Å; M79-L82 HydrophobicContact CE-CD1 3.61Å; M79-L82 PolarHBondContact O-N 2.88Å; M79-L82 HydrophobicContact SD-CD1 3.93Å; I80-L82 PolarHBondContact O-N 3.25Å; L82-H84 PolarHBondContact O-N 3.42Å; L82-V88 HydrophobicContact CD2-CG2 4.09Å
83	R	90.4	Very high	91.7	Very high	193 Å²	193	69.3 Å²	69.3	73%	0.728	36%	0.364	S	S	*	.	H	α-helix	trans	-67.3	-22.5	173.4	-68.8	177.5	65.2	172.5	0.2	112.7	M79 I80 P81 H85	M79-R83 PolarHBondContact O-N 3.11Å; M79-R83 VanDerWaalsContact O-N 3.15Å; I80-R83 WeakPolarHBondContact O-CB 3.48Å; I80-R83 PolarHBondContact O-N 3.35Å; I80-R83 VanDerWaalsContact O-N 3.12Å; P81-R83 VanDerWaalsContact C-N 3.35Å; R83-H85 PolarHBondContact O-CD2 3.39Å; R83-H85 VanDerWaalsContact O-CD2 3.27Å; R83-H85 PolarHBondContact O-N 3.07Å
84	H	90.8	Very high	92.3	Very high	105 Å²	105	65.7 Å²	65.7	49%	0.486	35%	0.345	S	S	.	.			trans	-83.4	79.3	178.8	-68.1	-74.7	0	0	0	110.7	I80 P81 L82 E86 H87 V88	I80-H84 PolarHBondContact O-CD2 2.95Å; P81-H84 PolarHBondContact O-N 2.86Å; L82-H84 PolarHBondContact O-N 3.42Å; H84-E86 PolarHBondContact O-N 2.66Å; H84-H87 HydrophobicContact CB-CB 4.31Å; H84-H87 PolarHBondContact O-N 2.93Å; H84-H87 VanDerWaalsContact O-N 3.08Å; H84-V88 PolarHBondContact O-N 3.36Å; H84-V88 VanDerWaalsContact O-N 3.11Å
85	H	93.4	Very high	92.7	Very high	133 Å²	133	65.8 Å²	65.8	62%	0.616	34%	0.344	S	S	*	.	H	α-helix	trans	-56.7	-36.9	-172.9	-63.3	178.6	0	0	0	113	R83 H87 V88 I89	R83-H85 PolarHBondContact O-CD2 3.39Å; R83-H85 VanDerWaalsContact O-CD2 3.27Å; R83-H85 PolarHBondContact O-N 3.07Å; H85-H87 VanDerWaalsContact C-N 3.33Å; H85-H87 PolarHBondContact O-N 3.26Å; H85-V88 PolarHBondContact O-N 2.91Å; H85-I89 HydrophobicContact CB-CD1 4.46Å; H85-I89 WeakPolarHBondContact O-CB 3.48Å; H85-I89 WeakPolarHBondContact O-CD1 3.32Å; H85-I89 WeakPolarHBondContact O-CG1 3.27Å; H85-I89 PolarHBondContact O-N 3.26Å
86	E	94.8	Very high	93.1	Very high	126 Å²	126	68.8 Å²	68.8	59%	0.589	33%	0.334	S	S	*	.	H	α-helix	trans	-57	-46.2	177.4	-61.5	180	172.8	0	0	112	H84 L90	H84-E86 PolarHBondContact O-N 2.66Å; E86-L90 WeakPolarHBondContact O-CB 3.35Å; E86-L90 PolarHBondContact O-N 2.89Å
87	H	94.1	Very high	93.4	Very high	43 Å²	43	70 Å²	70	20%	0.199	34%	0.342	C	S	.	.	H	α-helix	trans	-69.9	-39.6	178.3	-69.3	-88.4	0	0	0	112	Y21 D25 Y29 F64 H84 H85 L90 A91	Y21-H87 AromaticContact CD2-CE1 3.77Å; D25-H87 IonicContact OD2-CE1 3.78Å; D25-H87 PolarHBondContact OD2-CE1 2.98Å; D25-H87 IonicContact OD2-ND1 3Å; D25-H87 PolarHBondContact OD2-ND1 3.5Å; Y29-H87 WeakPolarHBondContact OH-CB 3.35Å; Y29-H87 PolarHBondContact OH-ND1 2.8Å; F64-H87 HydrophobicContact CE1-CB 3.99Å; F64-H87 HydrophobicContact CZ-CB 4.1Å; H84-H87 HydrophobicContact CB-CB 4.31Å; H84-H87 PolarHBondContact O-N 2.93Å; H84-H87 VanDerWaalsContact O-N 3.08Å; H85-H87 VanDerWaalsContact C-N 3.33Å; H85-H87 PolarHBondContact O-N 3.26Å; H87-L90 PolarHBondContact O-N 3.31Å; H87-A91 VanDerWaalsContact O-CB 3.24Å; H87-A91 WeakPolarHBondContact O-CB 3.39Å; H87-A91 PolarHBondContact O-N 3.31Å
88	V	95.7	Very high	93.6	Very high	22 Å²	22	66.7 Å²	66.7	13%	0.133	32%	0.318	C	S	.	.	H	α-helix	trans	-65.7	-42.5	177.3	177.2	0	0	0	0	111	W56 F64 L82 H84 H85 S92	W56-V88 HydrophobicContact CZ2-CG1 4.33Å; F64-V88 HydrophobicContact CE2-CG2 4.19Å; F64-V88 HydrophobicContact CZ-CG2 4.14Å; L82-V88 HydrophobicContact CD2-CG2 4.09Å; H84-V88 PolarHBondContact O-N 3.36Å; H84-V88 VanDerWaalsContact O-N 3.11Å; H85-V88 PolarHBondContact O-N 2.91Å; V88-S92 VanDerWaalsContact O-CB 3.26Å; V88-S92 WeakPolarHBondContact O-CB 3.34Å; V88-S92 PolarHBondContact O-N 2.9Å; V88-S92 PolarHBondContact O-OG 2.84Å
89	I	97	Very high	94	Very high	109 Å²	109	63.3 Å²	63.3	56%	0.559	30%	0.3	S	S	*	.	H	α-helix	trans	-63.7	-49.1	176	-69.4	164.9	0	0	0	109.7	H85 A91 S92 V93	H85-I89 HydrophobicContact CB-CD1 4.46Å; H85-I89 WeakPolarHBondContact O-CB 3.48Å; H85-I89 WeakPolarHBondContact O-CD1 3.32Å; H85-I89 WeakPolarHBondContact O-CG1 3.27Å; H85-I89 PolarHBondContact O-N 3.26Å; I89-A91 PolarHBondContact O-N 2.86Å; I89-S92 WeakPolarHBondContact O-CB 3.11Å; I89-S92 PolarHBondContact O-N 3.2Å; I89-S92 VanDerWaalsContact O-N 3.12Å; I89-V93 HydrophobicContact CG2-CG2 4.41Å; I89-V93 WeakPolarHBondContact O-CG2 3.22Å; I89-V93 PolarHBondContact O-N 3.42Å
90	L	96.8	Very high	94.4	Very high	28 Å²	28	60.7 Å²	60.7	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-59.9	-47.4	179.2	-175.8	59.9	0	0	0	111.6	Y21 P22 L26 Y29 E86 H87 S92 V93 V94	Y21-L90 HydrophobicContact CD2-CD2 4.25Å; Y21-L90 HydrophobicContact CE2-CD2 3.65Å; P22-L90 HydrophobicContact CB-CD2 4.21Å; L26-L90 HydrophobicContact CD1-CD1 4.06Å; Y29-L90 HydrophobicContact CD2-CB 4.4Å; Y29-L90 HydrophobicContact CD2-CD2 4.08Å; Y29-L90 HydrophobicContact CD2-CG 3.94Å; Y29-L90 HydrophobicContact CE2-CB 4.24Å; Y29-L90 HydrophobicContact CE2-CD2 3.91Å; Y29-L90 HydrophobicContact CE2-CG 4.08Å; E86-L90 WeakPolarHBondContact O-CB 3.35Å; E86-L90 PolarHBondContact O-N 2.89Å; H87-L90 PolarHBondContact O-N 3.31Å; L90-S92 VanDerWaalsContact C-N 3.28Å; L90-S92 PolarHBondContact O-N 2.83Å; L90-V93 PolarHBondContact O-N 3.36Å; L90-V94 VanDerWaalsContact O-CG2 3.29Å; L90-V94 WeakPolarHBondContact O-CG2 3.33Å; L90-V94 PolarHBondContact O-N 2.89Å
91	A	96.3	Very high	94.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-37.7	175.7	0	0	0	0	0	111.9	Y29 M60 C63 F64 H87 I89 V94 W95	Y29-A91 HydrophobicContact CD1-CB 3.94Å; Y29-A91 HydrophobicContact CD2-CB 4.08Å; Y29-A91 HydrophobicContact CE1-CB 4.21Å; Y29-A91 HydrophobicContact CE2-CB 4.33Å; Y29-A91 HydrophobicContact CG-CB 3.9Å; M60-A91 HydrophobicContact CE-CB 3.92Å; M60-A91 HydrophobicContact SD-CB 3.82Å; C63-A91 HydrophobicContact CB-CB 4.4Å; F64-A91 HydrophobicContact CE2-CB 4.31Å; F64-A91 HydrophobicContact CZ-CB 4.22Å; H87-A91 VanDerWaalsContact O-CB 3.24Å; H87-A91 WeakPolarHBondContact O-CB 3.39Å; H87-A91 PolarHBondContact O-N 3.31Å; I89-A91 PolarHBondContact O-N 2.86Å; A91-V94 PolarHBondContact O-N 3.29Å; A91-W95 WeakPolarHBondContact O-CB 3.42Å; A91-W95 PolarHBondContact O-N 2.97Å
92	S	97.4	Very high	94.9	Very high	28 Å²	28	62.7 Å²	62.7	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-68.6	-40.4	177.6	-61.4	0	0	0	0	112.5	W56 V88 I89 L90 W95 Y96	W56-S92 PolarHBondContact NE1-OG 3.41Å; V88-S92 VanDerWaalsContact O-CB 3.26Å; V88-S92 WeakPolarHBondContact O-CB 3.34Å; V88-S92 PolarHBondContact O-N 2.9Å; V88-S92 PolarHBondContact O-OG 2.84Å; I89-S92 WeakPolarHBondContact O-CB 3.11Å; I89-S92 PolarHBondContact O-N 3.2Å; I89-S92 VanDerWaalsContact O-N 3.12Å; L90-S92 VanDerWaalsContact C-N 3.28Å; L90-S92 PolarHBondContact O-N 2.83Å; S92-W95 PolarHBondContact O-N 3.46Å; S92-Y96 WeakPolarHBondContact O-CB 3.1Å; S92-Y96 PolarHBondContact O-N 2.85Å
93	V	97.7	Very high	95.1	Very high	73 Å²	73	68.9 Å²	68.9	44%	0.442	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-46	174.1	170.7	0	0	0	0	110.2	I89 L90 W95 Y96 L97	I89-V93 HydrophobicContact CG2-CG2 4.41Å; I89-V93 WeakPolarHBondContact O-CG2 3.22Å; I89-V93 PolarHBondContact O-N 3.42Å; L90-V93 PolarHBondContact O-N 3.36Å; V93-W95 PolarHBondContact O-N 3.2Å; V93-Y96 PolarHBondContact O-N 3.14Å; V93-L97 HydrophobicContact CG1-CD1 4.05Å; V93-L97 HydrophobicContact CG1-CG 4.42Å; V93-L97 WeakPolarHBondContact O-CG 3.28Å; V93-L97 PolarHBondContact O-N 3.35Å
94	V	96.9	Very high	95.1	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.024	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-47.9	175.6	172.8	0	0	0	0	111	L26 I30 L90 A91 Y96 L97 I98	L26-V94 HydrophobicContact CD1-CG2 3.38Å; I30-V94 HydrophobicContact CB-CG1 4.28Å; I30-V94 HydrophobicContact CG1-CG1 3.68Å; I30-V94 HydrophobicContact CG1-CG2 4.39Å; L90-V94 VanDerWaalsContact O-CG2 3.29Å; L90-V94 WeakPolarHBondContact O-CG2 3.33Å; L90-V94 PolarHBondContact O-N 2.89Å; A91-V94 PolarHBondContact O-N 3.29Å; V94-Y96 VanDerWaalsContact C-N 3.27Å; V94-Y96 PolarHBondContact O-N 3.23Å; V94-L97 PolarHBondContact O-N 2.65Å; V94-I98 HydrophobicContact CG1-CG1 4.15Å; V94-I98 VanDerWaalsContact O-CG1 3.27Å; V94-I98 WeakPolarHBondContact O-CG1 3.28Å; V94-I98 PolarHBondContact O-N 3.4Å
95	W	96.2	Very high	95.3	Very high	28 Å²	28	60.7 Å²	60.7	11%	0.106	30%	0.3	C	S	.	.	H	α-helix	trans	-52	-49	174.2	167.7	76.8	0	0	0	111.8	T33 P52 C55 W56 M60 A91 S92 V93 L97 I98 F99 Y100	T33-W95 HydrophobicContact CG2-CB 4.25Å; P52-W95 WeakPolarHBondContact O-CZ2 3.49Å; C55-W95 HydrophobicContact CB-CZ2 4.45Å; C55-W95 PolarHBondContact SG-NE1 3.41Å; W56-W95 HydrophobicContact CB-CD2 4.17Å; W56-W95 HydrophobicContact CB-CE3 4.39Å; W56-W95 HydrophobicContact CB-CH2 3.84Å; W56-W95 HydrophobicContact CB-CZ2 3.62Å; W56-W95 HydrophobicContact CB-CZ3 4.23Å; W56-W95 AromaticContact CD1-CD2 3.76Å; W56-W95 AromaticContact CD1-CE3 3.53Å; W56-W95 AromaticContact CD1-CZ3 3.82Å; W56-W95 HydrophobicContact CG-CD2 4.39Å; W56-W95 HydrophobicContact CG-CE3 4.35Å; W56-W95 HydrophobicContact CG-CH2 4.45Å; W56-W95 HydrophobicContact CG-CZ3 4.37Å; M60-W95 HydrophobicContact CE-CB 4.13Å; A91-W95 WeakPolarHBondContact O-CB 3.42Å; A91-W95 PolarHBondContact O-N 2.97Å; S92-W95 PolarHBondContact O-N 3.46Å; V93-W95 PolarHBondContact O-N 3.2Å; W95-L97 PolarHBondContact O-N 3.07Å; W95-I98 PolarHBondContact O-N 2.87Å; W95-F99 AromaticContact CD1-CD2 3.5Å; W95-F99 VanDerWaalsContact CD1-CD2 3.5Å; W95-F99 AromaticContact CD1-CE2 3.73Å; W95-F99 HydrophobicContact CG-CD2 4.39Å; W95-F99 AromaticContact NE1-CD2 3.61Å; W95-F99 AromaticContact NE1-CE2 3.91Å; W95-F99 WeakPolarHBondContact O-CD2 3.35Å; W95-F99 PolarHBondContact O-N 3.48Å; W95-Y100 AromaticContact CH2-CE2 3.68Å; W95-Y100 HydrophobicContact CH2-CE2 3.68Å; W95-Y100 AromaticContact CZ2-CE2 3.63Å; W95-Y100 HydrophobicContact CZ2-CE2 3.63Å; W95-Y100 HydrophobicContact CZ3-CE2 4.16Å
96	Y	97.3	Very high	95.2	Very high	135 Å²	135	55.7 Å²	55.7	53%	0.529	28%	0.28	S	S	.	.	H	α-helix	trans	-61.5	-47.3	-180	-174.8	-93.7	0	0	0	111.9	S92 V93 V94 I98 F99 Y100	S92-Y96 WeakPolarHBondContact O-CB 3.1Å; S92-Y96 PolarHBondContact O-N 2.85Å; V93-Y96 PolarHBondContact O-N 3.14Å; V94-Y96 VanDerWaalsContact C-N 3.27Å; V94-Y96 PolarHBondContact O-N 3.23Å; Y96-I98 PolarHBondContact O-N 2.8Å; Y96-F99 PolarHBondContact O-N 3.29Å; Y96-Y100 AromaticContact CD2-CD2 3.73Å; Y96-Y100 HydrophobicContact CD2-CD2 3.73Å; Y96-Y100 HydrophobicContact CD2-CE2 4.44Å; Y96-Y100 HydrophobicContact CD2-CG 4.3Å; Y96-Y100 HydrophobicContact CE2-CD2 4.08Å; Y96-Y100 HydrophobicContact CE2-CG 4.22Å; Y96-Y100 HydrophobicContact CG-CD2 4.3Å; Y96-Y100 WeakPolarHBondContact O-CA 3.19Å; Y96-Y100 WeakPolarHBondContact O-CB 3.07Å; Y96-Y100 PolarHBondContact O-N 2.85Å
97	L	96.9	Very high	95.1	Very high	77 Å²	77	51.7 Å²	51.7	40%	0.403	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-41.5	179.7	-70.1	175.8	0	0	0	112.6	V93 V94 W95 S101 C106	V93-L97 HydrophobicContact CG1-CD1 4.05Å; V93-L97 HydrophobicContact CG1-CG 4.42Å; V93-L97 WeakPolarHBondContact O-CG 3.28Å; V93-L97 PolarHBondContact O-N 3.35Å; V94-L97 PolarHBondContact O-N 2.65Å; W95-L97 PolarHBondContact O-N 3.07Å; L97-S101 WeakPolarHBondContact O-CB 3.41Å; L97-S101 PolarHBondContact O-N 2.87Å; L97-S101 PolarHBondContact O-OG 3.31Å; L97-C106 HydrophobicContact CB-CB 4.38Å
98	I	94.7	Very high	95.1	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-69.1	-36.5	179.7	-63.7	-63	0	0	0	111.7	T33 I34 R37 V94 W95 Y96 Y107 I110	T33-I98 HydrophobicContact CG2-CB 3.57Å; T33-I98 HydrophobicContact CG2-CG1 3.86Å; T33-I98 HydrophobicContact CG2-CG2 3.69Å; I34-I98 HydrophobicContact CD1-CD1 4.15Å; I34-I98 HydrophobicContact CG1-CD1 3.96Å; I34-I98 HydrophobicContact CG1-CG1 4.44Å; I34-I98 HydrophobicContact CG1-CG2 4.05Å; R37-I98 PolarHBondContact NH1-O 3.42Å; V94-I98 HydrophobicContact CG1-CG1 4.15Å; V94-I98 VanDerWaalsContact O-CG1 3.27Å; V94-I98 WeakPolarHBondContact O-CG1 3.28Å; V94-I98 PolarHBondContact O-N 3.4Å; W95-I98 PolarHBondContact O-N 2.87Å; Y96-I98 PolarHBondContact O-N 2.8Å; I98-Y107 HydrophobicContact CG2-CD2 4.33Å; I98-I110 HydrophobicContact CD1-CD1 3.34Å
99	F	95.3	Very high	94.9	Very high	4 Å²	4	61.7 Å²	61.7	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-94.3	-26.4	-176.3	-82.2	-86.9	0	0	0	114.7	T33 V36 R37 L40 I45 S48 C55 W95 Y96	T33-F99 HydrophobicContact CG2-CD2 3.85Å; T33-F99 HydrophobicContact CG2-CE2 3.65Å; V36-F99 HydrophobicContact CG1-CZ 4.16Å; R37-F99 HydrophobicContact CB-CE1 3.81Å; R37-F99 HydrophobicContact CB-CE2 4.05Å; R37-F99 HydrophobicContact CB-CZ 3.47Å; R37-F99 VanDerWaalsContact CB-CZ 3.47Å; R37-F99 HydrophobicContact CG-CD1 4.3Å; R37-F99 HydrophobicContact CG-CE1 3.72Å; R37-F99 HydrophobicContact CG-CZ 3.93Å; L40-F99 HydrophobicContact CD1-CE1 4.25Å; L40-F99 HydrophobicContact CD1-CZ 4.42Å; I45-F99 HydrophobicContact CD1-CD1 4.44Å; I45-F99 WeakPolarHBondContact CD1-O 3.13Å; S48-F99 VanDerWaalsContact CB-CD1 3.46Å; C55-F99 VanDerWaalsContact SG-CZ 3.52Å; W95-F99 AromaticContact CD1-CD2 3.5Å; W95-F99 VanDerWaalsContact CD1-CD2 3.5Å; W95-F99 AromaticContact CD1-CE2 3.73Å; W95-F99 HydrophobicContact CG-CD2 4.39Å; W95-F99 AromaticContact NE1-CD2 3.61Å; W95-F99 AromaticContact NE1-CE2 3.91Å; W95-F99 WeakPolarHBondContact O-CD2 3.35Å; W95-F99 PolarHBondContact O-N 3.48Å; Y96-F99 PolarHBondContact O-N 3.29Å
100	Y	95.6	Very high	94.6	Very high	52 Å²	52	56.9 Å²	56.9	20%	0.204	27%	0.274	C	S	.	.	H	α-helix	trans	-128.1	5.4	-168.3	-53.7	-80.2	0	0	0	114.6	S48 R49 W95 Y96	S48-Y100 PolarHBondContact O-OH 3.47Å; R49-Y100 HydrophobicContact CG-CE1 4.06Å; W95-Y100 AromaticContact CH2-CE2 3.68Å; W95-Y100 HydrophobicContact CH2-CE2 3.68Å; W95-Y100 AromaticContact CZ2-CE2 3.63Å; W95-Y100 HydrophobicContact CZ2-CE2 3.63Å; W95-Y100 HydrophobicContact CZ3-CE2 4.16Å; Y96-Y100 AromaticContact CD2-CD2 3.73Å; Y96-Y100 HydrophobicContact CD2-CD2 3.73Å; Y96-Y100 HydrophobicContact CD2-CE2 4.44Å; Y96-Y100 HydrophobicContact CD2-CG 4.3Å; Y96-Y100 HydrophobicContact CE2-CD2 4.08Å; Y96-Y100 HydrophobicContact CE2-CG 4.22Å; Y96-Y100 HydrophobicContact CG-CD2 4.3Å; Y96-Y100 WeakPolarHBondContact O-CA 3.19Å; Y96-Y100 WeakPolarHBondContact O-CB 3.07Å; Y96-Y100 PolarHBondContact O-N 2.85Å
101	S	94.5	Very high	94.2	Very high	14 Å²	14	58.3 Å²	58.3	10%	0.098	28%	0.28	C	S	.	.			trans	-57.5	137.4	172.4	52.3	0	0	0	0	111.3	L97 F103 D104 C106	L97-S101 WeakPolarHBondContact O-CB 3.41Å; L97-S101 PolarHBondContact O-N 2.87Å; L97-S101 PolarHBondContact O-OG 3.31Å; S101-F103 PolarHBondContact O-N 3.5Å; S101-D104 PolarHBondContact O-N 2.96Å; S101-D104 VanDerWaalsContact O-N 3.09Å; S101-C106 PolarHBondContact OG-N 3.11Å
102	P	92.5	Very high	93.8	Very high	91 Å²	91	64.6 Å²	64.6	59%	0.591	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-60.4	141.3	178.5	26.6	-34.6	0	0	0	109.7	D104 I105	P102-D104 PolarHBondContact O-N 2.98Å; P102-I105 WeakPolarHBondContact O-CD1 3.49Å; P102-I105 VanDerWaalsContact O-CG1 3.25Å; P102-I105 WeakPolarHBondContact O-CG1 3.16Å; P102-I105 PolarHBondContact O-N 3.12Å
103	F	91.8	Very high	93.2	Very high	179 Å²	179	68.6 Å²	68.6	79%	0.785	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	53.8	15.9	-175.6	-50	-77.6	0	0	0	115.3	S101 I105 R108	S101-F103 PolarHBondContact O-N 3.5Å; F103-I105 HydrophobicContact CB-CD1 4.3Å; F103-I105 HydrophobicContact CB-CG1 4.04Å; F103-I105 HydrophobicContact CD2-CD1 4.31Å; F103-I105 PolarHBondContact O-N 3.21Å; F103-R108 PolarHBondContact O-NE 2.94Å
104	D	91.4	Very high	92.8	Very high	33 Å²	33	68 Å²	68	18%	0.176	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	60.8	28.4	-179.9	-154.8	22	0	0	0	113.7	R37 S101 P102 C106 Y107 R108	R37-D104 IonicContact CZ-OD1 3.3Å; R37-D104 VanDerWaalsContact CZ-OD1 3.3Å; R37-D104 IonicContact CZ-OD2 3.57Å; R37-D104 IonicContact NH1-OD1 2.62Å; R37-D104 PolarHBondContact NH1-OD1 3.36Å; R37-D104 IonicContact NH1-OD2 3.63Å; R37-D104 IonicContact NH2-OD1 3.11Å; R37-D104 PolarHBondContact NH2-OD1 3.38Å; R37-D104 VanDerWaalsContact NH2-OD1 3.11Å; R37-D104 IonicContact NH2-OD2 2.69Å; R37-D104 PolarHBondContact NH2-OD2 2.99Å; S101-D104 PolarHBondContact O-N 2.96Å; S101-D104 VanDerWaalsContact O-N 3.09Å; P102-D104 PolarHBondContact O-N 2.98Å; D104-C106 PolarHBondContact O-N 3.49Å; D104-Y107 PolarHBondContact O-N 3.13Å; D104-Y107 WeakPolarHBondContact OD1-CB 3.48Å; D104-Y107 WeakPolarHBondContact OD2-CD1 3.46Å; D104-R108 WeakPolarHBondContact O-CB 3.25Å; D104-R108 VanDerWaalsContact O-CG 3.27Å; D104-R108 WeakPolarHBondContact O-CG 3.23Å; D104-R108 PolarHBondContact O-N 3.16Å
105	I	94.1	Very high	92.6	Very high	94 Å²	94	69.8 Å²	69.8	48%	0.482	33%	0.33	S	S	.	.	H	α-helix	trans	-59.1	-46.8	-171.1	-68.4	162	0	0	0	111.1	P102 F103 Y107 R108 M109	P102-I105 WeakPolarHBondContact O-CD1 3.49Å; P102-I105 VanDerWaalsContact O-CG1 3.25Å; P102-I105 WeakPolarHBondContact O-CG1 3.16Å; P102-I105 PolarHBondContact O-N 3.12Å; F103-I105 HydrophobicContact CB-CD1 4.3Å; F103-I105 HydrophobicContact CB-CG1 4.04Å; F103-I105 HydrophobicContact CD2-CD1 4.31Å; F103-I105 PolarHBondContact O-N 3.21Å; I105-Y107 PolarHBondContact O-N 3.29Å; I105-R108 PolarHBondContact O-N 3.44Å; I105-M109 WeakPolarHBondContact O-CB 3.2Å; I105-M109 PolarHBondContact O-N 2.72Å
106	C	92.8	Very high	92.1	Very high	27 Å²	27	69.8 Å²	69.8	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-46.2	-176.1	-63.7	0	0	0	0	111.3	L97 S101 D104 M109 I110	L97-C106 HydrophobicContact CB-CB 4.38Å; S101-C106 PolarHBondContact OG-N 3.11Å; D104-C106 PolarHBondContact O-N 3.49Å; C106-M109 PolarHBondContact O-N 3.29Å; C106-I110 WeakPolarHBondContact O-CD1 3.32Å; C106-I110 WeakPolarHBondContact O-CG1 3.24Å; C106-I110 PolarHBondContact O-N 2.87Å
107	Y	92.5	Very high	91.7	Very high	43 Å²	43	64.8 Å²	64.8	17%	0.169	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-45.9	178	177	-106.8	0	0	0	111.9	I34 E38 I98 D104 I105 M109 I110 K111	I34-Y107 HydrophobicContact CG1-CD2 4.21Å; I34-Y107 HydrophobicContact CG1-CE2 4.44Å; I34-Y107 HydrophobicContact CG2-CE2 4.32Å; E38-Y107 HydrophobicContact CG-CE2 4.47Å; I98-Y107 HydrophobicContact CG2-CD2 4.33Å; D104-Y107 PolarHBondContact O-N 3.13Å; D104-Y107 WeakPolarHBondContact OD1-CB 3.48Å; D104-Y107 WeakPolarHBondContact OD2-CD1 3.46Å; I105-Y107 PolarHBondContact O-N 3.29Å; Y107-M109 VanDerWaalsContact C-N 3.34Å; Y107-M109 PolarHBondContact O-N 3.21Å; Y107-I110 PolarHBondContact O-N 3.39Å; Y107-K111 HydrophobicContact CD1-CG 4.46Å; Y107-K111 HydrophobicContact CE1-CG 4.16Å; Y107-K111 HydrophobicContact CE2-CG 4.24Å; Y107-K111 VanDerWaalsContact CZ-CE 3.42Å; Y107-K111 WeakPolarHBondContact O-CB 3.3Å; Y107-K111 WeakPolarHBondContact O-CG 3.34Å; Y107-K111 PolarHBondContact O-N 3.46Å; Y107-K111 WeakPolarHBondContact OH-CE 3.2Å
108	R	92.8	Very high	91.4	Very high	169 Å²	169	66.5 Å²	66.5	64%	0.638	32%	0.322	S	S	*	.	H	α-helix	trans	-61.6	-41.7	177.1	-71.2	177.4	-173.4	-154.9	3.8	112.1	F103 D104 I105 K111 F112	F103-R108 PolarHBondContact O-NE 2.94Å; D104-R108 WeakPolarHBondContact O-CB 3.25Å; D104-R108 VanDerWaalsContact O-CG 3.27Å; D104-R108 WeakPolarHBondContact O-CG 3.23Å; D104-R108 PolarHBondContact O-N 3.16Å; I105-R108 PolarHBondContact O-N 3.44Å; R108-K111 PolarHBondContact O-N 3.28Å; R108-F112 PolarHBondContact O-N 3.41Å; R108-F112 VanDerWaalsContact O-N 3.11Å
109	M	92.4	Very high	91.2	Very high	105 Å²	105	67.4 Å²	67.4	52%	0.517	33%	0.327	S	S	.	.	H	α-helix	trans	-61.6	-45.4	177.2	-178.3	-176.5	70.4	0	0	111.4	I105 C106 Y107 K111 F112 V115	I105-M109 WeakPolarHBondContact O-CB 3.2Å; I105-M109 PolarHBondContact O-N 2.72Å; C106-M109 PolarHBondContact O-N 3.29Å; Y107-M109 VanDerWaalsContact C-N 3.34Å; Y107-M109 PolarHBondContact O-N 3.21Å; M109-K111 VanDerWaalsContact C-N 3.3Å; M109-K111 PolarHBondContact O-N 2.95Å; M109-F112 WeakPolarHBondContact O-CB 3.12Å; M109-F112 PolarHBondContact O-N 3.27Å; M109-F112 VanDerWaalsContact O-N 3.15Å; M109-V115 WeakPolarHBondContact O-CB 3.13Å
110	I	90.7	Very high	90.8	Very high	9 Å²	9	67.3 Å²	67.3	5%	0.046	33%	0.327	C	S	.	.	H	α-helix	trans	-71	-29.6	179.4	-64.7	154.1	0	0	0	111.6	I30 I34 I98 C106 Y107 F112 K116	I30-I110 HydrophobicContact CD1-CD1 4.27Å; I30-I110 HydrophobicContact CG1-CD1 4.28Å; I30-I110 HydrophobicContact CG2-CB 4.48Å; I30-I110 HydrophobicContact CG2-CD1 3.51Å; I30-I110 HydrophobicContact CG2-CG1 4.1Å; I30-I110 HydrophobicContact CG2-CG2 3.73Å; I34-I110 HydrophobicContact CD1-CB 3.84Å; I34-I110 HydrophobicContact CD1-CD1 4.19Å; I34-I110 HydrophobicContact CD1-CG2 3.26Å; I98-I110 HydrophobicContact CD1-CD1 3.34Å; C106-I110 WeakPolarHBondContact O-CD1 3.32Å; C106-I110 WeakPolarHBondContact O-CG1 3.24Å; C106-I110 PolarHBondContact O-N 2.87Å; Y107-I110 PolarHBondContact O-N 3.39Å; I110-F112 PolarHBondContact O-N 3.25Å; I110-K116 WeakPolarHBondContact O-CA 2.98Å; I110-K116 VanDerWaalsContact O-CB 3.23Å; I110-K116 WeakPolarHBondContact O-CB 3.25Å; I110-K116 PolarHBondContact O-N 3.38Å
111	K	87.8	Confident	90.4	Very high	58 Å²	58	67.1 Å²	67.1	25%	0.252	33%	0.328	S	S	.	.	H	α-helix	trans	-69.4	-20	172.1	-77.3	-70	-159.3	171.8	0	113.3	E38 Y107 R108 M109 F113	E38-K111 WeakPolarHBondContact OE1-CE 3.37Å; E38-K111 IonicContact OE1-NZ 2.68Å; E38-K111 PolarHBondContact OE1-NZ 2.89Å; E38-K111 IonicContact OE2-NZ 3.61Å; E38-K111 PolarHBondContact OE2-NZ 3.47Å; Y107-K111 HydrophobicContact CD1-CG 4.46Å; Y107-K111 HydrophobicContact CE1-CG 4.16Å; Y107-K111 HydrophobicContact CE2-CG 4.24Å; Y107-K111 VanDerWaalsContact CZ-CE 3.42Å; Y107-K111 WeakPolarHBondContact O-CB 3.3Å; Y107-K111 WeakPolarHBondContact O-CG 3.34Å; Y107-K111 PolarHBondContact O-N 3.46Å; Y107-K111 WeakPolarHBondContact OH-CE 3.2Å; R108-K111 PolarHBondContact O-N 3.28Å; M109-K111 VanDerWaalsContact C-N 3.3Å; M109-K111 PolarHBondContact O-N 2.95Å; K111-F113 PolarHBondContact O-N 3.25Å
112	F	88.8	Confident	90.2	Very high	132 Å²	132	67.5 Å²	67.5	58%	0.579	33%	0.332	S	S	*	.	S	Bend	trans	-61.5	124	174.5	-170.4	-123.9	0	0	0	109.7	R108 M109 I110 P114 V115 K116	R108-F112 PolarHBondContact O-N 3.41Å; R108-F112 VanDerWaalsContact O-N 3.11Å; M109-F112 WeakPolarHBondContact O-CB 3.12Å; M109-F112 PolarHBondContact O-N 3.27Å; M109-F112 VanDerWaalsContact O-N 3.15Å; I110-F112 PolarHBondContact O-N 3.25Å; F112-P114 HydrophobicContact CD1-CG 3.36Å; F112-P114 HydrophobicContact CE1-CG 3.17Å; F112-P114 HydrophobicContact CG-CG 4.26Å; F112-P114 HydrophobicContact CZ-CG 3.96Å; F112-V115 HydrophobicContact CD1-CG2 4.22Å; F112-V115 PolarHBondContact O-N 3.21Å; F112-K116 PolarHBondContact O-N 2.77Å
113	F	85.3	Confident	90	Very high	112 Å²	112	63.3 Å²	63.3	49%	0.491	31%	0.305	S	S	.	.	H	α-helix	trans	-47.4	-50.5	-167.1	-178.3	-101.2	0	0	0	115.4	K111 V115 K116 L117 V246	K111-F113 PolarHBondContact O-N 3.25Å; F113-V115 VanDerWaalsContact C-N 3.34Å; F113-V115 PolarHBondContact O-N 3.01Å; F113-K116 WeakPolarHBondContact O-CB 3.32Å; F113-K116 PolarHBondContact O-N 3.32Å; F113-L117 WeakPolarHBondContact O-CB 3.4Å; F113-L117 PolarHBondContact O-N 2.67Å; F113-V246 HydrophobicContact CE2-CG1 3.81Å; F113-V246 HydrophobicContact CZ-CG1 4.27Å
114	P	89.7	Confident	89.7	Confident	59 Å²	59	54.8 Å²	54.8	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-65.9	-35.2	-179.5	25.5	-34.7	0	0	0	112.9	F112 L117 L118	F112-P114 HydrophobicContact CD1-CG 3.36Å; F112-P114 HydrophobicContact CE1-CG 3.17Å; F112-P114 HydrophobicContact CG-CG 4.26Å; F112-P114 HydrophobicContact CZ-CG 3.96Å; P114-L117 PolarHBondContact O-N 3.2Å; P114-L118 WeakPolarHBondContact O-CG 3.26Å; P114-L118 PolarHBondContact O-N 2.82Å; P114-L118 VanDerWaalsContact O-N 3.15Å
115	V	90.8	Very high	89.7	Confident	43 Å²	43	54 Å²	54	26%	0.261	26%	0.264	S	S	.	.	H	α-helix	trans	-69.2	-45.8	175.7	-179.7	0	0	0	0	109.9	M109 F112 F113 L117 L118 V119	M109-V115 WeakPolarHBondContact O-CB 3.13Å; F112-V115 HydrophobicContact CD1-CG2 4.22Å; F112-V115 PolarHBondContact O-N 3.21Å; F113-V115 VanDerWaalsContact C-N 3.34Å; F113-V115 PolarHBondContact O-N 3.01Å; V115-L117 PolarHBondContact O-N 3.28Å; V115-L118 PolarHBondContact O-N 2.9Å; V115-V119 HydrophobicContact CG1-CG2 4.19Å; V115-V119 VanDerWaalsContact O-CG2 3.31Å; V115-V119 WeakPolarHBondContact O-CG2 3.48Å; V115-V119 PolarHBondContact O-N 3.08Å
116	K	87.6	Confident	89.5	Confident	27 Å²	27	50 Å²	50	12%	0.117	24%	0.243	C	C	.	.	H	α-helix	trans	-53.8	-44.1	175	-168.2	-178.7	174.9	-172	0	111	I110 F112 F113 T120 I165	I110-K116 WeakPolarHBondContact O-CA 2.98Å; I110-K116 VanDerWaalsContact O-CB 3.23Å; I110-K116 WeakPolarHBondContact O-CB 3.25Å; I110-K116 PolarHBondContact O-N 3.38Å; F112-K116 PolarHBondContact O-N 2.77Å; F113-K116 WeakPolarHBondContact O-CB 3.32Å; F113-K116 PolarHBondContact O-N 3.32Å; K116-T120 WeakPolarHBondContact O-CB 3.3Å; K116-T120 PolarHBondContact O-N 3.5Å; K116-T120 PolarHBondContact O-OG1 2.84Å; K116-I165 PolarHBondContact NZ-O 3.24Å
117	L	87.2	Confident	89.3	Confident	31 Å²	31	49.4 Å²	49.4	16%	0.162	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-51.7	179.9	-164.8	66.8	0	0	0	111.3	F113 P114 V115 T120 M121 L243 V246	F113-L117 WeakPolarHBondContact O-CB 3.4Å; F113-L117 PolarHBondContact O-N 2.67Å; P114-L117 PolarHBondContact O-N 3.2Å; V115-L117 PolarHBondContact O-N 3.28Å; L117-T120 PolarHBondContact O-N 2.92Å; L117-M121 HydrophobicContact CG-CE 4.36Å; L117-M121 WeakPolarHBondContact O-CG 3.5Å; L117-M121 PolarHBondContact O-N 3.1Å; L117-L243 HydrophobicContact CD1-CD1 3.65Å; L117-L243 HydrophobicContact CD2-CD1 4.09Å; L117-L243 HydrophobicContact CG-CD1 4.04Å; L117-V246 HydrophobicContact CD1-CB 4.27Å; L117-V246 HydrophobicContact CD1-CG1 3.77Å
118	L	90.5	Very high	89.2	Confident	113 Å²	113	47.3 Å²	47.3	59%	0.592	23%	0.229	S	C	*	.	H	α-helix	trans	-60.6	-48.2	179.5	-69.2	174	0	0	0	112.3	P114 V115 T120 M121 A122	P114-L118 WeakPolarHBondContact O-CG 3.26Å; P114-L118 PolarHBondContact O-N 2.82Å; P114-L118 VanDerWaalsContact O-N 3.15Å; V115-L118 PolarHBondContact O-N 2.9Å; L118-T120 VanDerWaalsContact C-N 3.3Å; L118-T120 PolarHBondContact O-N 2.75Å; L118-M121 HydrophobicContact CD2-CE 3.74Å; L118-M121 PolarHBondContact O-N 3.39Å; L118-A122 PolarHBondContact O-N 3.45Å
119	V	90.8	Very high	89.1	Confident	21 Å²	21	41 Å²	41	13%	0.127	21%	0.208	C	C	.	.	H	α-helix	trans	-62.7	-40.7	179.5	177.7	0	0	0	0	110.6	A27 I30 M31 V115 A122 K123	A27-V119 HydrophobicContact CB-CG1 3.89Å; I30-V119 HydrophobicContact CB-CG1 4.27Å; I30-V119 HydrophobicContact CG2-CG1 3.91Å; M31-V119 HydrophobicContact CG-CG1 3.81Å; M31-V119 HydrophobicContact SD-CB 4.26Å; M31-V119 HydrophobicContact SD-CG1 3.48Å; M31-V119 WeakPolarHBondContact SD-CG1 3.28Å; V115-V119 HydrophobicContact CG1-CG2 4.19Å; V115-V119 VanDerWaalsContact O-CG2 3.31Å; V115-V119 WeakPolarHBondContact O-CG2 3.48Å; V115-V119 PolarHBondContact O-N 3.08Å; V119-A122 PolarHBondContact O-N 2.61Å; V119-K123 VanDerWaalsContact O-CB 3.27Å; V119-K123 WeakPolarHBondContact O-CB 3.2Å; V119-K123 PolarHBondContact O-N 3.19Å
120	T	86.7	Confident	89	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-65.7	-42.4	178.5	-57.9	0	0	0	0	111.3	K116 L117 L118 K123 E124 K242	K116-T120 WeakPolarHBondContact O-CB 3.3Å; K116-T120 PolarHBondContact O-N 3.5Å; K116-T120 PolarHBondContact O-OG1 2.84Å; L117-T120 PolarHBondContact O-N 2.92Å; L118-T120 VanDerWaalsContact C-N 3.3Å; L118-T120 PolarHBondContact O-N 2.75Å; T120-K123 PolarHBondContact O-N 3.08Å; T120-E124 WeakPolarHBondContact O-CG 3.36Å; T120-E124 PolarHBondContact O-N 2.96Å; T120-E124 VanDerWaalsContact O-N 3.07Å; T120-K242 HydrophobicContact CG2-CD 3.54Å; T120-K242 HydrophobicContact CG2-CG 3.38Å
121	M	87.2	Confident	89	Confident	48 Å²	48	36.8 Å²	36.8	24%	0.236	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-47.6	175.6	-71	-170	-65.4	0	0	112.1	L117 L118 K123 E124 V125 V239 L243	L117-M121 HydrophobicContact CG-CE 4.36Å; L117-M121 WeakPolarHBondContact O-CG 3.5Å; L117-M121 PolarHBondContact O-N 3.1Å; L118-M121 HydrophobicContact CD2-CE 3.74Å; L118-M121 PolarHBondContact O-N 3.39Å; M121-K123 VanDerWaalsContact C-N 3.26Å; M121-K123 PolarHBondContact O-N 2.83Å; M121-E124 WeakPolarHBondContact O-CB 3.29Å; M121-E124 PolarHBondContact O-N 3.41Å; M121-V125 PolarHBondContact O-N 3.15Å; M121-V239 HydrophobicContact CB-CG1 4.4Å; M121-V239 HydrophobicContact CG-CG1 4.05Å; M121-V239 HydrophobicContact SD-CG1 4.06Å; M121-L243 HydrophobicContact SD-CD1 4.02Å
122	A	90.4	Very high	89.2	Confident	22 Å²	22	36 Å²	36	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-57.6	-42.7	175.5	0	0	0	0	0	111.2	F24 A27 L118 V119 E124 V125 Q126	F24-A122 HydrophobicContact CD1-CB 3.91Å; F24-A122 WeakPolarHBondContact CD1-O 3.38Å; F24-A122 HydrophobicContact CE1-CB 4.05Å; A27-A122 HydrophobicContact CB-CB 3.7Å; L118-A122 PolarHBondContact O-N 3.45Å; V119-A122 PolarHBondContact O-N 2.61Å; A122-E124 PolarHBondContact O-N 3.21Å; A122-V125 WeakPolarHBondContact O-CB 3.37Å; A122-V125 PolarHBondContact O-N 2.75Å; A122-V125 VanDerWaalsContact O-N 3.16Å; A122-Q126 PolarHBondContact O-N 2.96Å; A122-Q126 VanDerWaalsContact O-N 3.08Å
123	K	87.9	Confident	89.3	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-63.1	-26.4	176.1	175.5	-90.4	155.4	-137.7	0	113.1	A27 M31 V119 T120 M121 R127 Y161	A27-K123 HydrophobicContact CB-CB 4.49Å; M31-K123 HydrophobicContact CB-CG 4.28Å; M31-K123 HydrophobicContact CG-CB 4.18Å; M31-K123 HydrophobicContact CG-CG 4.13Å; V119-K123 VanDerWaalsContact O-CB 3.27Å; V119-K123 WeakPolarHBondContact O-CB 3.2Å; V119-K123 PolarHBondContact O-N 3.19Å; T120-K123 PolarHBondContact O-N 3.08Å; M121-K123 VanDerWaalsContact C-N 3.26Å; M121-K123 PolarHBondContact O-N 2.83Å; K123-R127 VanDerWaalsContact NZ-NE 3.1Å; K123-R127 PolarHBondContact O-N 3.4Å; K123-Y161 HydrophobicContact CD-CE1 4.5Å
124	E	86.6	Confident	89.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-74.6	-34.6	173.7	-68.2	-49.7	138.9	0	0	113.4	T120 M121 A122 Q126 R127 T128 F238 V239 K242	T120-E124 WeakPolarHBondContact O-CG 3.36Å; T120-E124 PolarHBondContact O-N 2.96Å; T120-E124 VanDerWaalsContact O-N 3.07Å; M121-E124 WeakPolarHBondContact O-CB 3.29Å; M121-E124 PolarHBondContact O-N 3.41Å; A122-E124 PolarHBondContact O-N 3.21Å; E124-Q126 VanDerWaalsContact C-N 3.32Å; E124-R127 WeakPolarHBondContact O-CB 3.43Å; E124-R127 PolarHBondContact O-N 3.38Å; E124-R127 IonicContact OE1-CZ 2.86Å; E124-R127 IonicContact OE1-NH1 3.47Å; E124-R127 PolarHBondContact OE1-NH1 2.91Å; E124-R127 IonicContact OE1-NH2 3.44Å; E124-R127 WeakPolarHBondContact OE2-CD 3.28Å; E124-R127 IonicContact OE2-CZ 3.61Å; E124-R127 VanDerWaalsContact OE2-CZ 3.29Å; E124-R127 IonicContact OE2-NE 3.78Å; E124-R127 IonicContact OE2-NH1 3.29Å; E124-R127 PolarHBondContact OE2-NH1 2.88Å; E124-T128 PolarHBondContact O-N 3.32Å; E124-T128 VanDerWaalsContact O-N 3.15Å; E124-T128 PolarHBondContact O-OG1 3.45Å; E124-T128 VanDerWaalsContact O-OG1 3.11Å; E124-F238 HydrophobicContact CB-CB 4.22Å; E124-V239 HydrophobicContact CB-CG2 3.98Å; E124-K242 HydrophobicContact CG-CB 3.67Å; E124-K242 HydrophobicContact CG-CG 3.75Å
125	V	90.7	Very high	89.6	Confident	18 Å²	18	24 Å²	24	11%	0.109	13%	0.13	C	C	.	.	H	α-helix	trans	-61.3	-46.3	169.3	-175.1	0	0	0	0	109.8	F24 M121 A122 R127 T128 N129 Y231 V235 V239	F24-V125 HydrophobicContact CD1-CB 3.81Å; F24-V125 HydrophobicContact CD1-CG1 4.09Å; F24-V125 HydrophobicContact CD1-CG2 4.39Å; F24-V125 HydrophobicContact CE1-CB 3.77Å; F24-V125 HydrophobicContact CE1-CG1 3.94Å; F24-V125 HydrophobicContact CE1-CG2 3.9Å; M121-V125 PolarHBondContact O-N 3.15Å; A122-V125 WeakPolarHBondContact O-CB 3.37Å; A122-V125 PolarHBondContact O-N 2.75Å; A122-V125 VanDerWaalsContact O-N 3.16Å; V125-R127 VanDerWaalsContact C-N 3.33Å; V125-R127 PolarHBondContact O-N 3.2Å; V125-T128 PolarHBondContact O-N 2.97Å; V125-N129 PolarHBondContact O-N 3.04Å; V125-N129 VanDerWaalsContact O-N 3.12Å; V125-Y231 PolarHBondContact O-OH 2.93Å; V125-V235 HydrophobicContact CB-CG1 4.36Å; V125-V235 HydrophobicContact CG1-CG1 4.31Å; V125-V235 HydrophobicContact CG1-CG2 4.47Å; V125-V235 HydrophobicContact CG2-CG1 3.82Å; V125-V239 HydrophobicContact CG2-CG2 4.27Å
126	Q	89.7	Confident	89.6	Confident	10 Å²	10	23.4 Å²	23.4	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-59	-43.3	177.6	-154.5	-71.7	-20.6	0	0	111.8	F24 D25 H28 A122 E124 T128 N129 K130	F24-Q126 HydrophobicContact CB-CB 4.27Å; F24-Q126 HydrophobicContact CB-CG 4.26Å; D25-Q126 WeakPolarHBondContact OD1-CG 3.49Å; D25-Q126 PolarHBondContact OD1-NE2 3.48Å; H28-Q126 HydrophobicContact CB-CB 4.49Å; H28-Q126 HydrophobicContact CB-CG 3.99Å; A122-Q126 PolarHBondContact O-N 2.96Å; A122-Q126 VanDerWaalsContact O-N 3.08Å; E124-Q126 VanDerWaalsContact C-N 3.32Å; Q126-T128 PolarHBondContact O-N 2.82Å; Q126-N129 PolarHBondContact O-N 3.39Å; Q126-K130 VanDerWaalsContact CD-NZ 3.28Å; Q126-K130 VanDerWaalsContact NE2-CE 3.27Å; Q126-K130 VanDerWaalsContact NE2-NZ 3.15Å; Q126-K130 PolarHBondContact O-N 3.16Å; Q126-K130 VanDerWaalsContact OE1-CE 3.27Å
127	R	88.6	Confident	89.8	Confident	13 Å²	13	25.3 Å²	25.3	5%	0.049	14%	0.135	C	C	.	.	H	α-helix	trans	-55.8	-49.6	175.4	172.7	-175	-77.6	160.2	-7.1	111.5	K123 E124 V125 N129 K130 V131	K123-R127 VanDerWaalsContact NZ-NE 3.1Å; K123-R127 PolarHBondContact O-N 3.4Å; E124-R127 WeakPolarHBondContact O-CB 3.43Å; E124-R127 PolarHBondContact O-N 3.38Å; E124-R127 IonicContact OE1-CZ 2.86Å; E124-R127 IonicContact OE1-NH1 3.47Å; E124-R127 PolarHBondContact OE1-NH1 2.91Å; E124-R127 IonicContact OE1-NH2 3.44Å; E124-R127 WeakPolarHBondContact OE2-CD 3.28Å; E124-R127 IonicContact OE2-CZ 3.61Å; E124-R127 VanDerWaalsContact OE2-CZ 3.29Å; E124-R127 IonicContact OE2-NE 3.78Å; E124-R127 IonicContact OE2-NH1 3.29Å; E124-R127 PolarHBondContact OE2-NH1 2.88Å; V125-R127 VanDerWaalsContact C-N 3.33Å; V125-R127 PolarHBondContact O-N 3.2Å; R127-N129 VanDerWaalsContact C-N 3.26Å; R127-N129 PolarHBondContact O-N 3.48Å; R127-K130 WeakPolarHBondContact O-CB 3.28Å; R127-K130 PolarHBondContact O-N 3.37Å; R127-K130 VanDerWaalsContact O-N 3.11Å; R127-V131 WeakPolarHBondContact O-CG2 3.2Å; R127-V131 PolarHBondContact O-N 3.08Å
128	T	90.4	Very high	89.9	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.3	-42.6	-179.3	-54	0	0	0	0	110.9	E124 V125 Q126 K130 V131 Y132 F214 Y231 V234 V235 F238	E124-T128 PolarHBondContact O-N 3.32Å; E124-T128 VanDerWaalsContact O-N 3.15Å; E124-T128 PolarHBondContact O-OG1 3.45Å; E124-T128 VanDerWaalsContact O-OG1 3.11Å; V125-T128 PolarHBondContact O-N 2.97Å; Q126-T128 PolarHBondContact O-N 2.82Å; T128-K130 PolarHBondContact O-N 3.11Å; T128-V131 PolarHBondContact O-N 3.2Å; T128-Y132 WeakPolarHBondContact O-CB 3.45Å; T128-Y132 PolarHBondContact O-N 3.15Å; T128-F214 HydrophobicContact CG2-CE2 4.24Å; T128-F214 HydrophobicContact CG2-CZ 3.86Å; T128-Y231 HydrophobicContact CG2-CD2 4.24Å; T128-Y231 HydrophobicContact CG2-CE2 3.74Å; T128-V234 HydrophobicContact CG2-CB 4.05Å; T128-V234 HydrophobicContact CG2-CG1 3.53Å; T128-V235 HydrophobicContact CG2-CG2 3.65Å; T128-F238 WeakPolarHBondContact OG1-CD2 3.29Å
129	N	90.8	Very high	90	Very high	35 Å²	35	19.6 Å²	19.6	19%	0.187	11%	0.105	C	C	.	.	H	α-helix	trans	-65.1	-37	176.8	-136.8	-66.1	0	0	0	112.6	L20 V125 Q126 R127 Y132 S133 Y231	L20-N129 HydrophobicContact CD1-CB 3.44Å; L20-N129 VanDerWaalsContact CD1-CB 3.44Å; L20-N129 HydrophobicContact CD2-CB 4.27Å; L20-N129 HydrophobicContact CG-CB 4.43Å; V125-N129 PolarHBondContact O-N 3.04Å; V125-N129 VanDerWaalsContact O-N 3.12Å; Q126-N129 PolarHBondContact O-N 3.39Å; R127-N129 VanDerWaalsContact C-N 3.26Å; R127-N129 PolarHBondContact O-N 3.48Å; N129-Y132 PolarHBondContact O-N 2.97Å; N129-S133 WeakPolarHBondContact O-CB 3.43Å; N129-S133 PolarHBondContact O-N 3.12Å; N129-Y231 WeakPolarHBondContact CA-OH 3.36Å; N129-Y231 WeakPolarHBondContact CB-OH 3.4Å; N129-Y231 VanDerWaalsContact CG-OH 3.29Å; N129-Y231 PolarHBondContact N-OH 2.67Å; N129-Y231 PolarHBondContact ND2-OH 3.07Å
130	K	90.1	Very high	90	Very high	26 Å²	26	26.7 Å²	26.7	11%	0.113	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-42.3	172.5	-84.5	-177.6	174.9	129.5	0	113	H28 Q126 R127 T128 G134 K156 Y161	H28-K130 PolarHBondContact CD2-NZ 3.36Å; H28-K130 PolarHBondContact CE1-NZ 2.79Å; H28-K130 VanDerWaalsContact CG-NZ 3.31Å; H28-K130 PolarHBondContact ND1-NZ 3.23Å; H28-K130 PolarHBondContact NE2-NZ 3.23Å; Q126-K130 VanDerWaalsContact CD-NZ 3.28Å; Q126-K130 VanDerWaalsContact NE2-CE 3.27Å; Q126-K130 VanDerWaalsContact NE2-NZ 3.15Å; Q126-K130 PolarHBondContact O-N 3.16Å; Q126-K130 VanDerWaalsContact OE1-CE 3.27Å; R127-K130 WeakPolarHBondContact O-CB 3.28Å; R127-K130 PolarHBondContact O-N 3.37Å; R127-K130 VanDerWaalsContact O-N 3.11Å; T128-K130 PolarHBondContact O-N 3.11Å; K130-G134 PolarHBondContact O-N 3.24Å; K130-K156 HydrophobicContact CB-CG 4.33Å; K130-K156 WeakPolarHBondContact O-CD 3.49Å; K130-Y161 VanDerWaalsContact CD-OH 3.24Å; K130-Y161 WeakPolarHBondContact CD-OH 3.4Å; K130-Y161 PolarHBondContact NZ-OH 3.37Å
131	V	91.1	Very high	90.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.4	-53.6	174.9	176.2	0	0	0	0	109.5	R127 T128 S133 G134 V135 C207 A210 S211 F214	R127-V131 WeakPolarHBondContact O-CG2 3.2Å; R127-V131 PolarHBondContact O-N 3.08Å; T128-V131 PolarHBondContact O-N 3.2Å; V131-S133 PolarHBondContact O-N 3.29Å; V131-G134 PolarHBondContact O-N 3.44Å; V131-G134 VanDerWaalsContact O-N 3.11Å; V131-V135 WeakPolarHBondContact O-CG2 3.39Å; V131-V135 PolarHBondContact O-N 2.97Å; V131-C207 HydrophobicContact CG2-CB 3.99Å; V131-A210 HydrophobicContact CG1-CB 4.21Å; V131-S211 WeakPolarHBondContact CG1-OG 3.35Å; V131-F214 HydrophobicContact CB-CE2 4.49Å; V131-F214 HydrophobicContact CG1-CD2 4.11Å; V131-F214 HydrophobicContact CG1-CE2 4.18Å
132	Y	91.9	Very high	90.2	Very high	43 Å²	43	33.5 Å²	33.5	17%	0.169	16%	0.163	C	C	.	.	H	α-helix	trans	-57.1	-50.1	179.3	176.4	-112.4	0	0	0	112.2	T128 N129 G134 V135 V136 F214 K218 H227	T128-Y132 WeakPolarHBondContact O-CB 3.45Å; T128-Y132 PolarHBondContact O-N 3.15Å; N129-Y132 PolarHBondContact O-N 2.97Å; Y132-G134 VanDerWaalsContact C-N 3.26Å; Y132-G134 PolarHBondContact O-N 2.6Å; Y132-V135 PolarHBondContact O-N 3.11Å; Y132-V136 HydrophobicContact CD1-CG2 4.46Å; Y132-V136 HydrophobicContact CD2-CG2 4Å; Y132-V136 HydrophobicContact CE1-CG2 4.05Å; Y132-V136 HydrophobicContact CE2-CG2 3.51Å; Y132-V136 HydrophobicContact CG-CG2 4.44Å; Y132-V136 WeakPolarHBondContact O-CG2 3.45Å; Y132-V136 PolarHBondContact O-N 2.94Å; Y132-F214 HydrophobicContact CD2-CB 4.33Å; Y132-F214 AromaticContact CD2-CD1 3.77Å; Y132-F214 HydrophobicContact CD2-CD1 3.77Å; Y132-F214 HydrophobicContact CD2-CD2 4.24Å; Y132-F214 HydrophobicContact CD2-CE1 4.08Å; Y132-F214 AromaticContact CD2-CG 3.87Å; Y132-F214 HydrophobicContact CD2-CG 3.87Å; Y132-F214 HydrophobicContact CD2-CZ 4.45Å; Y132-F214 HydrophobicContact CE2-CD1 4.42Å; Y132-K218 WeakPolarHBondContact OH-CE 3.4Å; Y132-K218 PolarHBondContact OH-NZ 2.83Å; Y132-K218 VanDerWaalsContact OH-NZ 3.12Å; Y132-H227 AromaticContact CD2-CE1 3.76Å; Y132-H227 AromaticContact CE1-CE1 3.97Å; Y132-H227 AromaticContact CE1-NE2 3.7Å; Y132-H227 AromaticContact CE2-CE1 3.11Å; Y132-H227 WeakPolarHBondContact CE2-CE1 3.32Å; Y132-H227 AromaticContact CE2-ND1 3.97Å; Y132-H227 AromaticContact CE2-NE2 3.69Å; Y132-H227 AromaticContact CZ-CE1 3.22Å; Y132-H227 AromaticContact CZ-NE2 3.27Å; Y132-H227 VanDerWaalsContact CZ-NE2 3.27Å; Y132-H227 PolarHBondContact OH-CE1 3.36Å; Y132-H227 PolarHBondContact OH-NE2 2.87Å
133	S	90.6	Very high	90.1	Very high	49 Å²	49	35 Å²	35	34%	0.343	17%	0.171	S	C	.	.	H	α-helix	trans	-57.9	-38	176.4	174	0	0	0	0	112.2	N129 V131 H137 K156	N129-S133 WeakPolarHBondContact O-CB 3.43Å; N129-S133 PolarHBondContact O-N 3.12Å; V131-S133 PolarHBondContact O-N 3.29Å; S133-H137 VanDerWaalsContact O-CB 3.24Å; S133-H137 WeakPolarHBondContact O-CB 3.49Å; S133-H137 PolarHBondContact O-N 3.47Å; S133-K156 PolarHBondContact OG-NZ 2.86Å
134	G	89.6	Confident	90	Very high	1 Å²	1	41 Å²	41	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-47.5	176.3	0	0	0	0	0	112.3	K130 V131 Y132 H137 V138	K130-G134 PolarHBondContact O-N 3.24Å; V131-G134 PolarHBondContact O-N 3.44Å; V131-G134 VanDerWaalsContact O-N 3.11Å; Y132-G134 VanDerWaalsContact C-N 3.26Å; Y132-G134 PolarHBondContact O-N 2.6Å; G134-H137 PolarHBondContact O-N 2.82Å; G134-V138 PolarHBondContact O-N 2.98Å; G134-V138 VanDerWaalsContact O-N 3.16Å
135	V	92.2	Very high	90.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.1	-49.8	176.1	170.5	0	0	0	0	110.7	V131 Y132 H137 V138 M139 F214 I215	V131-V135 WeakPolarHBondContact O-CG2 3.39Å; V131-V135 PolarHBondContact O-N 2.97Å; Y132-V135 PolarHBondContact O-N 3.11Å; V135-H137 PolarHBondContact O-N 3.48Å; V135-V138 PolarHBondContact O-N 2.93Å; V135-M139 HydrophobicContact CG1-CE 3.69Å; V135-M139 VanDerWaalsContact O-CB 3.25Å; V135-M139 WeakPolarHBondContact O-CB 3.4Å; V135-M139 PolarHBondContact O-N 3.42Å; V135-F214 HydrophobicContact CG1-CB 4.23Å; V135-I215 HydrophobicContact CG1-CD1 4.49Å; V135-I215 HydrophobicContact CG1-CG1 3.61Å
136	V	92.1	Very high	90	Very high	30 Å²	30	48 Å²	48	18%	0.182	24%	0.236	C	C	.	.	H	α-helix	trans	-64.9	-39.4	-178.8	173.1	0	0	0	0	112.2	Y132 M139 K140 K218	Y132-V136 HydrophobicContact CD1-CG2 4.46Å; Y132-V136 HydrophobicContact CD2-CG2 4Å; Y132-V136 HydrophobicContact CE1-CG2 4.05Å; Y132-V136 HydrophobicContact CE2-CG2 3.51Å; Y132-V136 HydrophobicContact CG-CG2 4.44Å; Y132-V136 WeakPolarHBondContact O-CG2 3.45Å; Y132-V136 PolarHBondContact O-N 2.94Å; V136-M139 PolarHBondContact O-N 3.47Å; V136-K140 WeakPolarHBondContact O-CG 3.4Å; V136-K140 PolarHBondContact O-N 2.95Å; V136-K218 HydrophobicContact CG2-CD 4.22Å
137	H	90.5	Very high	89.9	Confident	67 Å²	67	53.9 Å²	53.9	31%	0.31	27%	0.267	S	S	.	.	H	α-helix	trans	-59	-51	176.9	-176.1	66.9	0	0	0	111.3	E76 S133 G134 V135 M139 K140 L141	E76-H137 IonicContact OE1-CD2 2.6Å; E76-H137 IonicContact OE1-CE1 4Å; E76-H137 IonicContact OE1-NE2 3.59Å; E76-H137 PolarHBondContact OE1-NE2 3.29Å; E76-H137 IonicContact OE2-NE2 2.98Å; E76-H137 PolarHBondContact OE2-NE2 3.11Å; S133-H137 VanDerWaalsContact O-CB 3.24Å; S133-H137 WeakPolarHBondContact O-CB 3.49Å; S133-H137 PolarHBondContact O-N 3.47Å; G134-H137 PolarHBondContact O-N 2.82Å; V135-H137 PolarHBondContact O-N 3.48Å; H137-M139 VanDerWaalsContact C-N 3.33Å; H137-M139 PolarHBondContact O-N 3.02Å; H137-K140 PolarHBondContact O-N 3.2Å; H137-L141 WeakPolarHBondContact NE2-CD1 3.48Å; H137-L141 PolarHBondContact O-N 2.82Å
138	V	90.1	Very high	89.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.9	-32.3	179.6	176.4	0	0	0	0	112.3	L74 G134 V135 K140 L141 Y142 V148 M149 I152	L74-V138 HydrophobicContact CD1-CG2 3.94Å; L74-V138 HydrophobicContact CD2-CG2 3.95Å; L74-V138 HydrophobicContact CG-CG2 4.48Å; G134-V138 PolarHBondContact O-N 2.98Å; G134-V138 VanDerWaalsContact O-N 3.16Å; V135-V138 PolarHBondContact O-N 2.93Å; V138-K140 PolarHBondContact O-N 3.24Å; V138-L141 PolarHBondContact O-N 2.98Å; V138-L141 VanDerWaalsContact O-N 3.1Å; V138-Y142 HydrophobicContact CG1-CD2 4.29Å; V138-Y142 PolarHBondContact O-N 3.45Å; V138-V148 HydrophobicContact CG1-CB 4.36Å; V138-V148 HydrophobicContact CG1-CG1 3.86Å; V138-M149 HydrophobicContact CB-CG 4.43Å; V138-M149 HydrophobicContact CG1-CB 4.43Å; V138-M149 HydrophobicContact CG1-CG 3.89Å; V138-I152 HydrophobicContact CG2-CB 3.53Å; V138-I152 HydrophobicContact CG2-CG1 3.78Å; V138-I152 HydrophobicContact CG2-CG2 3.38Å
139	M	91.6	Very high	89.8	Confident	24 Å²	24	55.6 Å²	55.6	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-29.2	176.3	-167.4	178.8	-54.6	0	0	112.6	V135 V136 H137 P143 M149 K218 K219	V135-M139 HydrophobicContact CG1-CE 3.69Å; V135-M139 VanDerWaalsContact O-CB 3.25Å; V135-M139 WeakPolarHBondContact O-CB 3.4Å; V135-M139 PolarHBondContact O-N 3.42Å; V136-M139 PolarHBondContact O-N 3.47Å; H137-M139 VanDerWaalsContact C-N 3.33Å; H137-M139 PolarHBondContact O-N 3.02Å; M139-P143 VanDerWaalsContact O-CA 3.23Å; M139-P143 WeakPolarHBondContact O-CA 3.17Å; M139-P143 WeakPolarHBondContact O-CB 3.49Å; M139-M149 HydrophobicContact CB-CE 4.34Å; M139-M149 HydrophobicContact CB-SD 4.2Å; M139-M149 HydrophobicContact CE-SD 4.12Å; M139-M149 HydrophobicContact CG-CE 4.05Å; M139-M149 HydrophobicContact CG-SD 4.15Å; M139-K218 HydrophobicContact CE-CB 3.86Å; M139-K218 HydrophobicContact CE-CD 3.97Å; M139-K218 HydrophobicContact CE-CG 4.44Å; M139-K218 HydrophobicContact SD-CB 3.79Å; M139-K218 HydrophobicContact SD-CD 3.81Å; M139-K218 HydrophobicContact SD-CG 4.46Å; M139-K219 HydrophobicContact SD-CG 4.3Å
140	K	91.5	Very high	89.7	Confident	170 Å²	170	55.5 Å²	55.5	74%	0.739	28%	0.279	S	S	*	.	H	α-helix	trans	-75.1	-37.5	173.1	-66.8	174.9	-178.4	-177.7	0	112.5	V136 H137 V138	V136-K140 WeakPolarHBondContact O-CG 3.4Å; V136-K140 PolarHBondContact O-N 2.95Å; H137-K140 PolarHBondContact O-N 3.2Å; V138-K140 PolarHBondContact O-N 3.24Å
141	L	89.9	Confident	89.5	Confident	80 Å²	80	58.3 Å²	58.3	42%	0.419	30%	0.295	S	S	.	.	H	α-helix	trans	-76.8	-45.2	-179.4	-72.4	157.8	0	0	0	112.5	L74 E76 H137 V138	L74-L141 HydrophobicContact CD1-CD1 4.17Å; E76-L141 WeakPolarHBondContact OE1-CD1 3.24Å; H137-L141 WeakPolarHBondContact NE2-CD1 3.48Å; H137-L141 PolarHBondContact O-N 2.82Å; V138-L141 PolarHBondContact O-N 2.98Å; V138-L141 VanDerWaalsContact O-N 3.1Å
142	Y	89.2	Confident	89.2	Confident	113 Å²	113	58.4 Å²	58.4	44%	0.443	30%	0.296	S	S	.	.			trans	-132.6	73.3	-174.8	-59.3	-69.2	0	0	0	110.8	L74 V138 N144 S145 V148 M149	L74-Y142 HydrophobicContact CD2-CD2 4.42Å; L74-Y142 HydrophobicContact CD2-CE2 4.04Å; V138-Y142 HydrophobicContact CG1-CD2 4.29Å; V138-Y142 PolarHBondContact O-N 3.45Å; Y142-N144 PolarHBondContact O-N 3.03Å; Y142-S145 PolarHBondContact O-N 2.89Å; Y142-S145 VanDerWaalsContact O-N 3.16Å; Y142-V148 HydrophobicContact CD2-CG1 4.44Å; Y142-M149 WeakPolarHBondContact O-CE 3.43Å
143	P	86.7	Confident	89	Confident	54 Å²	54	56.3 Å²	56.3	35%	0.351	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17	-171.8	23.3	-34.5	0	0	0	115.3	M139 M149 K219	M139-P143 VanDerWaalsContact O-CA 3.23Å; M139-P143 WeakPolarHBondContact O-CA 3.17Å; M139-P143 WeakPolarHBondContact O-CB 3.49Å; P143-M149 VanDerWaalsContact C-CE 3.45Å; P143-M149 VanDerWaalsContact O-CE 3.25Å; P143-M149 WeakPolarHBondContact O-CE 3.4Å; P143-K219 WeakPolarHBondContact O-CE 3.44Å; P143-K219 PolarHBondContact O-NZ 3.26Å
144	N	87.2	Confident	88.7	Confident	129 Å²	129	54.8 Å²	54.8	69%	0.69	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.6	-0.8	-177.8	-60.9	-33.7	0	0	0	113.3	Y142 Y146	Y142-N144 PolarHBondContact O-N 3.03Å; N144-Y146 PolarHBondContact O-N 3.42Å
145	S	88.1	Confident	88.3	Confident	46 Å²	46	55 Å²	55	32%	0.322	28%	0.278	S	S	.	.			trans	-100.5	74.4	-173.6	-58.5	0	0	0	0	111.7	Y142 L147 V148 M149	Y142-S145 PolarHBondContact O-N 2.89Å; Y142-S145 VanDerWaalsContact O-N 3.16Å; S145-L147 VanDerWaalsContact C-N 3.32Å; S145-L147 PolarHBondContact O-N 2.97Å; S145-V148 PolarHBondContact O-N 3.16Å; S145-V148 VanDerWaalsContact O-N 3.12Å; S145-M149 WeakPolarHBondContact O-CG 3.39Å; S145-M149 PolarHBondContact O-N 3.38Å; S145-M149 VanDerWaalsContact O-N 3.1Å
146	Y	89.1	Confident	87.8	Confident	117 Å²	117	56.5 Å²	56.5	46%	0.459	28%	0.284	S	S	.	.	H	α-helix	trans	-56.2	-41.2	-175.7	-59.1	-69.8	0	0	0	113.8	N144 V148 M149 V150 I215 K219	N144-Y146 PolarHBondContact O-N 3.42Å; Y146-V148 VanDerWaalsContact C-N 3.32Å; Y146-V148 PolarHBondContact O-N 3.3Å; Y146-M149 HydrophobicContact CD1-SD 4.38Å; Y146-M149 WeakPolarHBondContact O-CB 2.87Å; Y146-M149 PolarHBondContact O-N 3.36Å; Y146-V150 WeakPolarHBondContact O-CG2 3.46Å; Y146-V150 PolarHBondContact O-N 3.41Å; Y146-I215 HydrophobicContact CD1-CG2 3.62Å; Y146-I215 HydrophobicContact CE1-CG2 4.16Å; Y146-K219 HydrophobicContact CE1-CB 4.04Å; Y146-K219 HydrophobicContact CE1-CD 4.24Å; Y146-K219 HydrophobicContact CE1-CG 3.95Å
147	L	87.6	Confident	86.7	Confident	134 Å²	134	55.1 Å²	55.1	70%	0.702	28%	0.276	S	S	*	.	H	α-helix	trans	-62.4	-41.6	179	-170.8	154.6	0	0	0	111.5	S145 M149 V150 L151	S145-L147 VanDerWaalsContact C-N 3.32Å; S145-L147 PolarHBondContact O-N 2.97Å; L147-M149 VanDerWaalsContact C-N 3.32Å; L147-M149 PolarHBondContact O-N 2.98Å; L147-V150 PolarHBondContact O-N 3.25Å; L147-L151 WeakPolarHBondContact O-CB 2.96Å; L147-L151 PolarHBondContact O-N 2.69Å
148	V	86.7	Confident	85.4	Confident	50 Å²	50	52 Å²	52	30%	0.303	26%	0.261	S	S	.	.	H	α-helix	trans	-65.4	-38.9	177.8	-174.5	0	0	0	0	110.3	V138 Y142 S145 Y146 L151 I152	V138-V148 HydrophobicContact CG1-CB 4.36Å; V138-V148 HydrophobicContact CG1-CG1 3.86Å; Y142-V148 HydrophobicContact CD2-CG1 4.44Å; S145-V148 PolarHBondContact O-N 3.16Å; S145-V148 VanDerWaalsContact O-N 3.12Å; Y146-V148 VanDerWaalsContact C-N 3.32Å; Y146-V148 PolarHBondContact O-N 3.3Å; V148-L151 PolarHBondContact O-N 3.21Å; V148-I152 HydrophobicContact CG1-CG1 4.23Å; V148-I152 VanDerWaalsContact O-CG1 3.32Å; V148-I152 WeakPolarHBondContact O-CG1 3.46Å; V148-I152 PolarHBondContact O-N 2.88Å
149	M	89.7	Confident	83.8	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-46	175	-61.6	175.3	-159	0	0	111.9	V138 M139 Y142 P143 S145 Y146 L147 G153 I215	V138-M149 HydrophobicContact CB-CG 4.43Å; V138-M149 HydrophobicContact CG1-CB 4.43Å; V138-M149 HydrophobicContact CG1-CG 3.89Å; M139-M149 HydrophobicContact CB-CE 4.34Å; M139-M149 HydrophobicContact CB-SD 4.2Å; M139-M149 HydrophobicContact CE-SD 4.12Å; M139-M149 HydrophobicContact CG-CE 4.05Å; M139-M149 HydrophobicContact CG-SD 4.15Å; Y142-M149 WeakPolarHBondContact O-CE 3.43Å; P143-M149 VanDerWaalsContact C-CE 3.45Å; P143-M149 VanDerWaalsContact O-CE 3.25Å; P143-M149 WeakPolarHBondContact O-CE 3.4Å; S145-M149 WeakPolarHBondContact O-CG 3.39Å; S145-M149 PolarHBondContact O-N 3.38Å; S145-M149 VanDerWaalsContact O-N 3.1Å; Y146-M149 HydrophobicContact CD1-SD 4.38Å; Y146-M149 WeakPolarHBondContact O-CB 2.87Å; Y146-M149 PolarHBondContact O-N 3.36Å; L147-M149 VanDerWaalsContact C-N 3.32Å; L147-M149 PolarHBondContact O-N 2.98Å; M149-G153 PolarHBondContact O-N 3.13Å; M149-I215 HydrophobicContact CB-CD1 3.49Å; M149-I215 VanDerWaalsContact CB-CD1 3.49Å; M149-I215 HydrophobicContact CB-CG1 3.96Å; M149-I215 HydrophobicContact SD-CD1 4.44Å; M149-I215 HydrophobicContact SD-CG1 4.14Å; M149-I215 HydrophobicContact SD-CG2 4.36Å
150	V	88	Confident	81.8	Confident	32 Å²	32	52.2 Å²	52.2	19%	0.194	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-46.3	177	175.4	0	0	0	0	110.3	Y146 L147 I152 T154 I208 I212 I215	Y146-V150 WeakPolarHBondContact O-CG2 3.46Å; Y146-V150 PolarHBondContact O-N 3.41Å; L147-V150 PolarHBondContact O-N 3.25Å; V150-I152 PolarHBondContact O-N 2.89Å; V150-T154 WeakPolarHBondContact O-CB 3.24Å; V150-T154 PolarHBondContact O-N 3.25Å; V150-T154 PolarHBondContact O-OG1 3.28Å; V150-I208 HydrophobicContact CG1-CG2 4.03Å; V150-I212 HydrophobicContact CG1-CG1 4.4Å; V150-I212 HydrophobicContact CG2-CG1 3.85Å; V150-I215 HydrophobicContact CB-CD1 4.37Å; V150-I215 HydrophobicContact CG2-CD1 3.4Å; V150-I215 VanDerWaalsContact CG2-CD1 3.4Å
151	L	86.4	Confident	80	Confident	85 Å²	85	45.2 Å²	45.2	45%	0.445	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-45.4	-176.6	-172.9	132.5	0	0	0	111.8	L73 L147 V148 A155	L73-L151 HydrophobicContact CD1-CD2 3.77Å; L147-L151 WeakPolarHBondContact O-CB 2.96Å; L147-L151 PolarHBondContact O-N 2.69Å; V148-L151 PolarHBondContact O-N 3.21Å; L151-A155 VanDerWaalsContact O-CB 3.25Å; L151-A155 WeakPolarHBondContact O-CB 3.09Å; L151-A155 PolarHBondContact O-N 3.35Å
152	I	85.6	Confident	77.6	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-76.1	-38.5	-179.6	-60.5	-67.4	0	0	0	112.3	A70 L73 L74 V138 V148 V150 T154 A155 K156	A70-I152 HydrophobicContact CB-CG2 3.93Å; L73-I152 HydrophobicContact CB-CD1 3.44Å; L73-I152 VanDerWaalsContact CB-CD1 3.44Å; L73-I152 HydrophobicContact CD1-CD1 3.78Å; L73-I152 HydrophobicContact CG-CD1 4.27Å; L74-I152 HydrophobicContact CD1-CG2 4.36Å; L74-I152 HydrophobicContact CD2-CD1 4.24Å; L74-I152 HydrophobicContact CD2-CG1 4.14Å; L74-I152 HydrophobicContact CG-CD1 4.03Å; L74-I152 HydrophobicContact CG-CG1 4.35Å; V138-I152 HydrophobicContact CG2-CB 3.53Å; V138-I152 HydrophobicContact CG2-CG1 3.78Å; V138-I152 HydrophobicContact CG2-CG2 3.38Å; V148-I152 HydrophobicContact CG1-CG1 4.23Å; V148-I152 VanDerWaalsContact O-CG1 3.32Å; V148-I152 WeakPolarHBondContact O-CG1 3.46Å; V148-I152 PolarHBondContact O-N 2.88Å; V150-I152 PolarHBondContact O-N 2.89Å; I152-T154 VanDerWaalsContact C-N 3.3Å; I152-T154 PolarHBondContact O-N 3.47Å; I152-A155 PolarHBondContact O-N 3.16Å; I152-K156 WeakPolarHBondContact O-CB 3.38Å; I152-K156 PolarHBondContact O-N 3.43Å
153	G	86.3	Confident	75.4	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.3	-46.5	172.2	0	0	0	0	0	111.4	M149 G157	M149-G153 PolarHBondContact O-N 3.13Å; G153-G157 PolarHBondContact O-N 3.45Å; G153-G157 VanDerWaalsContact O-N 3.08Å
154	T	84.2	Confident	73.3	Confident	17 Å²	17	39 Å²	39	10%	0.104	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-45.4	174.4	-58.9	0	0	0	0	111.4	V150 I152 G157 N158 T204 I208 S211	V150-T154 WeakPolarHBondContact O-CB 3.24Å; V150-T154 PolarHBondContact O-N 3.25Å; V150-T154 PolarHBondContact O-OG1 3.28Å; I152-T154 VanDerWaalsContact C-N 3.3Å; I152-T154 PolarHBondContact O-N 3.47Å; T154-G157 PolarHBondContact O-N 2.95Å; T154-N158 WeakPolarHBondContact CG2-ND2 3.28Å; T154-N158 VanDerWaalsContact O-CB 3.26Å; T154-N158 WeakPolarHBondContact O-CB 3.48Å; T154-N158 PolarHBondContact O-N 3.37Å; T154-N158 PolarHBondContact O-ND2 3.24Å; T154-T204 HydrophobicContact CG2-CG2 4.48Å; T154-I208 HydrophobicContact CG2-CD1 4.32Å; T154-I208 HydrophobicContact CG2-CG1 3.51Å; T154-I208 WeakPolarHBondContact OG1-CA 3.4Å; T154-I208 WeakPolarHBondContact OG1-CG1 3.48Å; T154-S211 PolarHBondContact N-OG 3.44Å
155	A	81.8	Confident	71.1	Confident	5 Å²	5	34.2 Å²	34.2	4%	0.041	18%	0.177	C	C	.	.	H	α-helix	trans	-63.1	-45.1	-178.8	0	0	0	0	0	112.3	L69 L73 L151 I152 G157 I159	L69-A155 HydrophobicContact CD2-CB 4.04Å; L69-A155 HydrophobicContact CG-CB 4.38Å; L73-A155 HydrophobicContact CD1-CB 4.05Å; L151-A155 VanDerWaalsContact O-CB 3.25Å; L151-A155 WeakPolarHBondContact O-CB 3.09Å; L151-A155 PolarHBondContact O-N 3.35Å; I152-A155 PolarHBondContact O-N 3.16Å; A155-G157 VanDerWaalsContact C-N 3.28Å; A155-G157 PolarHBondContact O-N 3.5Å; A155-I159 HydrophobicContact CB-CD1 4.17Å; A155-I159 PolarHBondContact O-N 3.15Å
156	K	82.8	Confident	69.1	Low	32 Å²	32	35 Å²	35	14%	0.139	18%	0.177	C	C	.	.	H	α-helix	trans	-66.2	-32.7	178.2	-160.1	171.4	-177.2	178.7	0	111.9	K130 S133 I152	K130-K156 HydrophobicContact CB-CG 4.33Å; K130-K156 WeakPolarHBondContact O-CD 3.49Å; S133-K156 PolarHBondContact OG-NZ 2.86Å; I152-K156 WeakPolarHBondContact O-CB 3.38Å; I152-K156 PolarHBondContact O-N 3.43Å
157	G	68.7	Low	66.9	Low	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-85.4	-27.2	179.8	0	0	0	0	0	116.9	G153 T154 A155 Y161	G153-G157 PolarHBondContact O-N 3.45Å; G153-G157 VanDerWaalsContact O-N 3.08Å; T154-G157 PolarHBondContact O-N 2.95Å; A155-G157 VanDerWaalsContact C-N 3.28Å; A155-G157 PolarHBondContact O-N 3.5Å; G157-Y161 WeakPolarHBondContact O-CD2 3.35Å; G157-Y161 WeakPolarHBondContact O-CE2 3.17Å
158	N	62.8	Low	64.6	Low	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-106.1	-39.4	-172.2	-84.9	-52.1	0	0	0	116.1	T154 S160 Y161 A203 T204 C207	T154-N158 WeakPolarHBondContact CG2-ND2 3.28Å; T154-N158 VanDerWaalsContact O-CB 3.26Å; T154-N158 WeakPolarHBondContact O-CB 3.48Å; T154-N158 PolarHBondContact O-N 3.37Å; T154-N158 PolarHBondContact O-ND2 3.24Å; N158-S160 PolarHBondContact O-N 3.36Å; N158-Y161 WeakPolarHBondContact O-CB 3.23Å; N158-Y161 WeakPolarHBondContact O-CD2 3.34Å; N158-Y161 PolarHBondContact O-N 2.91Å; N158-A203 PolarHBondContact OD1-O 3.26Å; N158-T204 VanDerWaalsContact CG-CA 3.48Å; N158-T204 VanDerWaalsContact ND2-CA 3.3Å; N158-T204 WeakPolarHBondContact ND2-CA 3.29Å; N158-T204 PolarHBondContact ND2-O 3.43Å; N158-T204 WeakPolarHBondContact OD1-CA 3.35Å; N158-T204 PolarHBondContact OD1-N 3.11Å; N158-C207 WeakPolarHBondContact ND2-CB 3.35Å; N158-C207 PolarHBondContact OD1-SG 3.08Å
159	I	56.6	Low	62.1	Low	24 Å²	24	38.5 Å²	38.5	12%	0.123	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-3.8	-153.8	-71.8	171.4	0	0	0	113.4	L69 A155 M179	L69-I159 HydrophobicContact CD2-CB 3.92Å; L69-I159 HydrophobicContact CD2-CD1 3.02Å; L69-I159 HydrophobicContact CD2-CG1 3.97Å; L69-I159 HydrophobicContact CD2-CG2 3.72Å; L69-I159 HydrophobicContact CG-CD1 4.48Å; A155-I159 HydrophobicContact CB-CD1 4.17Å; A155-I159 PolarHBondContact O-N 3.15Å; I159-M179 HydrophobicContact CG2-CB 3.65Å
160	S	49.9	Very low	59.3	Low	5 Å²	5	42.5 Å²	42.5	4%	0.035	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.4	166.7	-164.5	0	0	0	0	112.9	M32 M62 N158	M32-S160 PolarHBondContact SD-OG 2.89Å; M62-S160 WeakPolarHBondContact CE-O 3.44Å; M62-S160 PolarHBondContact O-OG 3.12Å; N158-S160 PolarHBondContact O-N 3.36Å
161	Y	52	Low	56.6	Low	24 Å²	24	47.9 Å²	47.9	9%	0.094	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.6	-13.1	-148	-55.1	-72.2	0	0	0	118.7	H28 M32 K123 K130 G157 N158 L163	H28-Y161 AromaticContact CE1-CE1 3.5Å; H28-Y161 AromaticContact CE1-CZ 3.65Å; H28-Y161 PolarHBondContact CE1-OH 3.29Å; H28-Y161 AromaticContact ND1-CE1 3.38Å; H28-Y161 WeakPolarHBondContact ND1-CE1 3.34Å; H28-Y161 AromaticContact ND1-CZ 3.71Å; H28-Y161 PolarHBondContact ND1-OH 2.9Å; M32-Y161 HydrophobicContact CE-CD1 3.53Å; M32-Y161 HydrophobicContact CE-CE1 3.71Å; M32-Y161 HydrophobicContact SD-CD1 4.05Å; M32-Y161 HydrophobicContact SD-CE1 4.07Å; K123-Y161 HydrophobicContact CD-CE1 4.5Å; K130-Y161 VanDerWaalsContact CD-OH 3.24Å; K130-Y161 WeakPolarHBondContact CD-OH 3.4Å; K130-Y161 PolarHBondContact NZ-OH 3.37Å; G157-Y161 WeakPolarHBondContact O-CD2 3.35Å; G157-Y161 WeakPolarHBondContact O-CE2 3.17Å; N158-Y161 WeakPolarHBondContact O-CB 3.23Å; N158-Y161 WeakPolarHBondContact O-CD2 3.34Å; N158-Y161 PolarHBondContact O-N 2.91Å; Y161-L163 PolarHBondContact O-N 3.28Å
162	V	41	Very low	53.8	Low	6 Å²	6	51.9 Å²	51.9	4%	0.036	26%	0.262	C	S	.	.	S	Bend	trans	-79.2	120.4	-165.3	178.5	0	0	0	0	111.6	E196 S201 A203	V162-E196 HydrophobicContact CB-CG 3.86Å; V162-E196 HydrophobicContact CG1-CG 3.63Å; V162-E196 HydrophobicContact CG2-CG 4.19Å; V162-E196 WeakPolarHBondContact CG2-OE1 3.09Å; V162-S201 VanDerWaalsContact CG1-CB 3.45Å; V162-S201 WeakPolarHBondContact CG1-OG 3.21Å; V162-S201 WeakPolarHBondContact CG2-OG 3.28Å; V162-A203 HydrophobicContact CG2-CB 4.49Å
163	L	41.6	Very low	51	Low	81 Å²	81	54.6 Å²	54.6	42%	0.424	29%	0.291	S	S	.	.	S	Bend	trans	68.8	59.2	161.7	-67.8	165.6	0	0	0	119.1	Y161	Y161-L163 PolarHBondContact O-N 3.28Å
164	F	43	Very low	48.5	Very low	28 Å²	28	56.3 Å²	56.3	12%	0.123	31%	0.305	C	S	.	.	S	Bend	trans	-135.2	-27	151.5	-141.6	-84.2	0	0	0	117	E38 D166 R167	E38-F164 HydrophobicContact CB-CD1 3.7Å; E38-F164 HydrophobicContact CB-CE1 3.37Å; E38-F164 HydrophobicContact CB-CZ 4.09Å; E38-F164 HydrophobicContact CG-CD1 4.49Å; E38-F164 HydrophobicContact CG-CE1 4.27Å; E38-F164 WeakPolarHBondContact OE2-CD1 3.35Å; E38-F164 WeakPolarHBondContact OE2-CE1 3.47Å; F164-D166 PolarHBondContact O-N 2.95Å; F164-R167 HydrophobicContact CD1-CB 4.22Å; F164-R167 HydrophobicContact CD2-CB 4.46Å; F164-R167 HydrophobicContact CE1-CB 4.23Å; F164-R167 VanDerWaalsContact CE2-CD 3.48Å; F164-R167 HydrophobicContact CE2-CG 4.44Å; F164-R167 HydrophobicContact CG-CB 4.34Å; F164-R167 HydrophobicContact CZ-CB 4.48Å; F164-R167 HydrophobicContact CZ-CG 4.32Å; F164-R167 WeakPolarHBondContact O-CB 3.47Å; F164-R167 PolarHBondContact O-N 2.92Å
165	I	41.5	Very low	46.1	Very low	29 Å²	29	55.9 Å²	55.9	15%	0.149	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-63.4	-30.6	177.9	-64.9	164.5	0	0	0	112	M31 K116 R167	M31-I165 HydrophobicContact CB-CD1 4.25Å; M31-I165 HydrophobicContact CE-CD1 3.17Å; M31-I165 HydrophobicContact CE-CG1 3.49Å; M31-I165 VanDerWaalsContact CE-CG1 3.49Å; M31-I165 HydrophobicContact CE-CG2 4.28Å; M31-I165 HydrophobicContact CG-CD1 4.31Å; K116-I165 PolarHBondContact NZ-O 3.24Å; I165-R167 VanDerWaalsContact C-N 3.3Å
166	D	45.5	Very low	44.1	Very low	62 Å²	62	56 Å²	56	33%	0.332	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-82.4	-7.4	179.6	-61.3	0	0	0	0	112	F164 M168 K242 S245	F164-D166 PolarHBondContact O-N 2.95Å; D166-M168 PolarHBondContact O-N 3.42Å; D166-K242 IonicContact OD1-NZ 3.19Å; D166-K242 PolarHBondContact OD1-NZ 3.31Å; D166-K242 IonicContact OD2-NZ 2.75Å; D166-K242 PolarHBondContact OD2-NZ 3.4Å; D166-S245 PolarHBondContact OD1-OG 2.89Å; D166-S245 PolarHBondContact OD2-OG 3.22Å; D166-S245 VanDerWaalsContact OD2-OG 3.13Å
167	R	42.9	Very low	42.9	Very low	174 Å²	174	54.6 Å²	54.6	66%	0.657	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-72.9	11.9	179.3	-164	154.8	172.8	-174.4	-0.7	114.3	F164 I165 S169	F164-R167 HydrophobicContact CD1-CB 4.22Å; F164-R167 HydrophobicContact CD2-CB 4.46Å; F164-R167 HydrophobicContact CE1-CB 4.23Å; F164-R167 VanDerWaalsContact CE2-CD 3.48Å; F164-R167 HydrophobicContact CE2-CG 4.44Å; F164-R167 HydrophobicContact CG-CB 4.34Å; F164-R167 HydrophobicContact CZ-CB 4.48Å; F164-R167 HydrophobicContact CZ-CG 4.32Å; F164-R167 WeakPolarHBondContact O-CB 3.47Å; F164-R167 PolarHBondContact O-N 2.92Å; I165-R167 VanDerWaalsContact C-N 3.3Å; R167-S169 VanDerWaalsContact C-N 3.27Å; R167-S169 PolarHBondContact O-N 2.99Å
168	M	39.1	Very low	42.4	Very low	145 Å²	145	59.1 Å²	59.1	71%	0.714	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-81.6	1.9	173.4	-158.1	69.4	-173.6	0	0	113.4	D166	D166-M168 PolarHBondContact O-N 3.42Å
169	S	34.5	Very low	42.6	Very low	57 Å²	57	60.1 Å²	60.1	40%	0.399	33%	0.327	S	S	.	.	S	Bend	trans	-140.9	93.5	171	-164.1	0	0	0	0	111.2	R167 N249	R167-S169 VanDerWaalsContact C-N 3.27Å; R167-S169 PolarHBondContact O-N 2.99Å; S169-N249 WeakPolarHBondContact CB-ND2 3.48Å; S169-N249 PolarHBondContact OG-ND2 3.15Å
170	S	31.5	Very low	43.1	Very low	83 Å²	83	59.9 Å²	59.9	58%	0.58	33%	0.325	S	S	*	.			trans	46.4	108.6	149.5	-141.2	0	0	0	0	118.9
171	I	30.2	Very low	44.1	Very low	146 Å²	146	60.4 Å²	60.4	75%	0.749	33%	0.328	S	S	*	.			trans	74.2	143.2	149.6	-46.4	160	0	0	0	115
172	E	27.5	Very low	45	Very low	169 Å²	169	64.5 Å²	64.5	79%	0.79	35%	0.346	S	S	*	.			trans	76.8	124.3	-172.6	-49.8	177.8	-149.4	0	0	113.4
173	G	28.7	Very low	46.6	Very low	59 Å²	59	64.3 Å²	64.3	61%	0.608	35%	0.345	S	S	*	.			cis	127.1	97.3	22.7	0	0	0	0	0	107.2
174	A	32.7	Very low	48.3	Very low	36 Å²	36	61.1 Å²	61.1	30%	0.298	33%	0.328	S	S	.	.			trans	62	100.6	158.3	0	0	0	0	0	121.7	S194	A174-S194 VanDerWaalsContact CA-CB 3.49Å; A174-S194 WeakPolarHBondContact CA-OG 3.35Å; A174-S194 WeakPolarHBondContact CB-OG 3.46Å
175	G	33.3	Very low	50	Low	8 Å²	8	63.9 Å²	63.9	8%	0.082	34%	0.344	C	S	.	.			trans	-178.9	75.2	155.3	0	0	0	0	0	112.3
176	A	41.3	Very low	51.6	Low	8 Å²	8	64.9 Å²	64.9	7%	0.066	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-82.4	125.9	166	0	0	0	0	0	108.7	R180 S194 E196	A176-R180 HydrophobicContact CB-CB 4.27Å; A176-R180 HydrophobicContact CB-CG 4.31Å; A176-S194 WeakPolarHBondContact CA-O 3.34Å; A176-S194 VanDerWaalsContact CB-O 3.23Å; A176-S194 WeakPolarHBondContact CB-O 3.42Å; A176-S194 PolarHBondContact N-O 2.66Å; A176-E196 PolarHBondContact O-N 2.82Å; A176-E196 VanDerWaalsContact O-N 3.08Å
177	G	55.8	Low	53.1	Low	2 Å²	2	62.8 Å²	62.8	2%	0.021	34%	0.338	C	S	.	.			trans	-61.9	154.4	168.3	0	0	0	0	0	111	M179 R180 T181 E196	G177-M179 PolarHBondContact O-N 3.25Å; G177-M179 VanDerWaalsContact O-N 3.13Å; G177-R180 WeakPolarHBondContact O-CA 3.34Å; G177-R180 WeakPolarHBondContact O-CB 3.36Å; G177-R180 PolarHBondContact O-N 2.99Å; G177-T181 PolarHBondContact O-N 3.07Å; G177-E196 WeakPolarHBondContact CA-OE2 3.47Å
178	I	59.9	Low	54.6	Low	95 Å²	95	57.9 Å²	57.9	49%	0.487	34%	0.341	S	S	.	.	H	α-helix	trans	-50.7	-42.1	-178.7	-64.7	165.9	0	0	0	111.5	R180 T181 F182 V197	I178-R180 VanDerWaalsContact C-N 3.34Å; I178-R180 PolarHBondContact O-N 3.08Å; I178-T181 PolarHBondContact O-N 3.14Å; I178-F182 PolarHBondContact O-N 3.33Å; I178-V197 HydrophobicContact CD1-CG2 4.39Å
179	M	65.9	Low	56	Low	21 Å²	21	54.4 Å²	54.4	10%	0.103	33%	0.328	C	S	.	.	H	α-helix	trans	-69.5	-30.7	179.4	-172.3	58.1	111.4	0	0	113.1	A65 F68 I159 G177 F182 E183	A65-M179 HydrophobicContact CB-CB 3.87Å; A65-M179 HydrophobicContact CB-CG 3.49Å; A65-M179 VanDerWaalsContact CB-CG 3.49Å; F68-M179 HydrophobicContact CB-CE 3.14Å; F68-M179 HydrophobicContact CD2-CE 3.71Å; F68-M179 HydrophobicContact CG-CE 3.66Å; I159-M179 HydrophobicContact CG2-CB 3.65Å; G177-M179 PolarHBondContact O-N 3.25Å; G177-M179 VanDerWaalsContact O-N 3.13Å; M179-F182 PolarHBondContact O-N 3.29Å; M179-F182 HydrophobicContact SD-CB 4.19Å; M179-F182 HydrophobicContact SD-CD1 4.16Å; M179-E183 WeakPolarHBondContact O-CB 3.42Å; M179-E183 PolarHBondContact O-N 2.95Å
180	R	68	Low	57.4	Low	20 Å²	20	59.5 Å²	59.5	8%	0.075	34%	0.339	C	S	.	.	H	α-helix	trans	-66.1	-41.1	175.2	-174.5	179.3	-178.3	142.2	2.5	111	D39 M62 A176 G177 I178 F182 E183 Q184	D39-R180 VanDerWaalsContact CG-NH2 3.28Å; D39-R180 IonicContact OD1-CZ 3.41Å; D39-R180 IonicContact OD1-NE 3.54Å; D39-R180 IonicContact OD1-NH2 2.85Å; D39-R180 PolarHBondContact OD1-NH2 3.24Å; M62-R180 HydrophobicContact SD-CB 4.36Å; A176-R180 HydrophobicContact CB-CB 4.27Å; A176-R180 HydrophobicContact CB-CG 4.31Å; G177-R180 WeakPolarHBondContact O-CA 3.34Å; G177-R180 WeakPolarHBondContact O-CB 3.36Å; G177-R180 PolarHBondContact O-N 2.99Å; I178-R180 VanDerWaalsContact C-N 3.34Å; I178-R180 PolarHBondContact O-N 3.08Å; R180-F182 VanDerWaalsContact C-N 3.3Å; R180-F182 PolarHBondContact O-N 3.47Å; R180-E183 PolarHBondContact O-N 3.34Å; R180-Q184 WeakPolarHBondContact O-CB 3.19Å; R180-Q184 WeakPolarHBondContact O-CG 3.27Å; R180-Q184 PolarHBondContact O-N 3.01Å
181	T	69.6	Low	58.9	Low	15 Å²	15	58.1 Å²	58.1	9%	0.092	33%	0.329	C	S	.	.	H	α-helix	trans	-61.1	-42.5	174.3	-51.2	0	0	0	0	111	G177 I178 E183 Q184 L185 W190	G177-T181 PolarHBondContact O-N 3.07Å; I178-T181 PolarHBondContact O-N 3.14Å; T181-E183 VanDerWaalsContact C-N 3.33Å; T181-E183 PolarHBondContact O-N 3.05Å; T181-Q184 PolarHBondContact O-N 2.96Å; T181-L185 PolarHBondContact O-N 2.89Å; T181-W190 HydrophobicContact CG2-CE3 4.18Å; T181-W190 HydrophobicContact CG2-CH2 4.04Å; T181-W190 HydrophobicContact CG2-CZ3 3.71Å
182	F	71.5	Confident	60	Low	111 Å²	111	53.5 Å²	53.5	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-66.3	-35.6	175.7	-165.9	-99.6	0	0	0	112.6	M61 I178 M179 R180 L185 V186	M61-F182 HydrophobicContact SD-CD1 3.86Å; M61-F182 HydrophobicContact SD-CE1 3.95Å; I178-F182 PolarHBondContact O-N 3.33Å; M179-F182 PolarHBondContact O-N 3.29Å; M179-F182 HydrophobicContact SD-CB 4.19Å; M179-F182 HydrophobicContact SD-CD1 4.16Å; R180-F182 VanDerWaalsContact C-N 3.3Å; R180-F182 PolarHBondContact O-N 3.47Å; F182-L185 HydrophobicContact CD2-CD2 4.42Å; F182-L185 HydrophobicContact CE2-CD2 4.49Å; F182-L185 WeakPolarHBondContact O-CB 3.33Å; F182-L185 PolarHBondContact O-N 3.42Å; F182-V186 PolarHBondContact O-N 3.41Å
183	E	74.1	Confident	61.4	Low	2 Å²	2	50.2 Å²	50.2	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-73.2	-36.8	178	176.7	-91.5	168.8	0	0	113.3	S58 M61 M62 M179 R180 T181 L185 V186 R187	S58-E183 WeakPolarHBondContact CB-OE1 3.43Å; S58-E183 VanDerWaalsContact O-CG 3.32Å; S58-E183 WeakPolarHBondContact O-CG 3.16Å; S58-E183 PolarHBondContact OG-OE1 2.93Å; M61-E183 HydrophobicContact CE-CB 3.91Å; M61-E183 HydrophobicContact CE-CG 3.95Å; M62-E183 HydrophobicContact CG-CB 4.38Å; M62-E183 HydrophobicContact CG-CG 3.8Å; M62-E183 HydrophobicContact SD-CB 4.49Å; M62-E183 HydrophobicContact SD-CG 4.47Å; M179-E183 WeakPolarHBondContact O-CB 3.42Å; M179-E183 PolarHBondContact O-N 2.95Å; R180-E183 PolarHBondContact O-N 3.34Å; T181-E183 VanDerWaalsContact C-N 3.33Å; T181-E183 PolarHBondContact O-N 3.05Å; E183-L185 VanDerWaalsContact C-N 3.28Å; E183-V186 PolarHBondContact O-N 2.85Å; E183-R187 PolarHBondContact O-N 3.19Å; E183-R187 PolarHBondContact O-NE 2.95Å; E183-R187 IonicContact OE1-CZ 3.43Å; E183-R187 IonicContact OE1-NE 2.67Å; E183-R187 PolarHBondContact OE1-NE 3.19Å; E183-R187 IonicContact OE1-NH1 2.8Å; E183-R187 PolarHBondContact OE1-NH1 3.34Å; E183-R187 IonicContact OE1-NH2 3.55Å; E183-R187 PolarHBondContact OE1-NH2 3.12Å; E183-R187 VanDerWaalsContact OE1-NH2 3.07Å; E183-R187 IonicContact OE2-CZ 3.08Å; E183-R187 IonicContact OE2-NE 2.68Å; E183-R187 IonicContact OE2-NH2 2.56Å; E183-R187 PolarHBondContact OE2-NH2 3.07Å
184	Q	78.3	Confident	62.5	Low	13 Å²	13	48.8 Å²	48.8	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-40	168.2	-76	177	-14.8	0	0	111	D39 R180 T181 V186 R187 G188 V189	D39-Q184 PolarHBondContact OD1-NE2 2.7Å; D39-Q184 PolarHBondContact OD2-NE2 2.96Å; R180-Q184 WeakPolarHBondContact O-CB 3.19Å; R180-Q184 WeakPolarHBondContact O-CG 3.27Å; R180-Q184 PolarHBondContact O-N 3.01Å; T181-Q184 PolarHBondContact O-N 2.96Å; Q184-V186 VanDerWaalsContact C-N 3.33Å; Q184-V186 PolarHBondContact O-N 2.97Å; Q184-R187 CarbonylContact O-C 3.59Å; Q184-R187 WeakPolarHBondContact O-CA 3.24Å; Q184-R187 PolarHBondContact O-N 2.95Å; Q184-G188 PolarHBondContact O-N 2.98Å; Q184-V189 CarbonylContact C-O 3.58Å; Q184-V189 HydrophobicContact CB-CB 4.4Å; Q184-V189 WeakPolarHBondContact CB-O 3.38Å; Q184-V189 PolarHBondContact O-N 3.15Å
185	L	78.9	Confident	63.5	Low	87 Å²	87	50.4 Å²	50.4	46%	0.455	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-40.4	176.2	-176.8	69.7	0	0	0	112.1	T181 F182 E183 R187 G188 V189 W190	T181-L185 PolarHBondContact O-N 2.89Å; F182-L185 HydrophobicContact CD2-CD2 4.42Å; F182-L185 HydrophobicContact CE2-CD2 4.49Å; F182-L185 WeakPolarHBondContact O-CB 3.33Å; F182-L185 PolarHBondContact O-N 3.42Å; E183-L185 VanDerWaalsContact C-N 3.28Å; L185-R187 PolarHBondContact O-N 3.42Å; L185-G188 PolarHBondContact O-N 2.9Å; L185-V189 PolarHBondContact N-O 3.22Å; L185-W190 HydrophobicContact CD1-CE3 4.07Å; L185-W190 HydrophobicContact CD1-CZ3 4.47Å
186	V	73.9	Confident	64.6	Low	49 Å²	49	50.7 Å²	50.7	30%	0.297	29%	0.288	S	S	.	.	H	α-helix	trans	-63.7	-21.3	175.6	167	0	0	0	0	113.2	S54 L57 M61 F182 E183 Q184	S54-V186 PolarHBondContact OG-O 3.39Å; L57-V186 HydrophobicContact CB-CG1 4.46Å; L57-V186 HydrophobicContact CD2-CG1 3.85Å; L57-V186 HydrophobicContact CG-CG1 4.16Å; M61-V186 HydrophobicContact CE-CB 3.54Å; M61-V186 HydrophobicContact CE-CG1 3.84Å; M61-V186 HydrophobicContact CE-CG2 3.38Å; M61-V186 HydrophobicContact SD-CG2 4.04Å; F182-V186 PolarHBondContact O-N 3.41Å; E183-V186 PolarHBondContact O-N 2.85Å; Q184-V186 VanDerWaalsContact C-N 3.33Å; Q184-V186 PolarHBondContact O-N 2.97Å
187	R	76.7	Confident	65.2	Low	19 Å²	19	56.1 Å²	56.1	7%	0.072	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	0.9	173.7	-62.8	177.3	-69.8	174.5	6.9	113	V36 D39 F47 S58 E183 Q184 L185	V36-R187 PolarHBondContact O-NH1 3.27Å; D39-R187 IonicContact OD2-CZ 3.72Å; D39-R187 IonicContact OD2-NH1 3.32Å; D39-R187 IonicContact OD2-NH2 3.37Å; D39-R187 PolarHBondContact OD2-NH2 2.83Å; F47-R187 HydrophobicContact CE1-CB 4.33Å; F47-R187 HydrophobicContact CE1-CG 3.9Å; F47-R187 HydrophobicContact CE2-CB 4.32Å; F47-R187 HydrophobicContact CZ-CB 3.7Å; F47-R187 HydrophobicContact CZ-CG 3.71Å; S58-R187 WeakPolarHBondContact OG-CD 3.24Å; E183-R187 PolarHBondContact O-N 3.19Å; E183-R187 PolarHBondContact O-NE 2.95Å; E183-R187 IonicContact OE1-CZ 3.43Å; E183-R187 IonicContact OE1-NE 2.67Å; E183-R187 PolarHBondContact OE1-NE 3.19Å; E183-R187 IonicContact OE1-NH1 2.8Å; E183-R187 PolarHBondContact OE1-NH1 3.34Å; E183-R187 IonicContact OE1-NH2 3.55Å; E183-R187 PolarHBondContact OE1-NH2 3.12Å; E183-R187 VanDerWaalsContact OE1-NH2 3.07Å; E183-R187 IonicContact OE2-CZ 3.08Å; E183-R187 IonicContact OE2-NE 2.68Å; E183-R187 IonicContact OE2-NH2 2.56Å; E183-R187 PolarHBondContact OE2-NH2 3.07Å; Q184-R187 CarbonylContact O-C 3.59Å; Q184-R187 WeakPolarHBondContact O-CA 3.24Å; Q184-R187 PolarHBondContact O-N 2.95Å; L185-R187 PolarHBondContact O-N 3.42Å
188	G	74.8	Confident	65	Low	70 Å²	70	62.8 Å²	62.8	72%	0.722	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	16.8	-177.9	0	0	0	0	0	114.4	Q184 L185	Q184-G188 PolarHBondContact O-N 2.98Å; L185-G188 PolarHBondContact O-N 2.9Å
189	V	69.6	Low	64.8	Low	73 Å²	73	66.3 Å²	66.3	44%	0.442	36%	0.361	S	S	.	.			trans	-107	129.9	178.2	-177.9	0	0	0	0	108.9	Q184 L185	Q184-V189 CarbonylContact C-O 3.58Å; Q184-V189 HydrophobicContact CB-CB 4.4Å; Q184-V189 WeakPolarHBondContact CB-O 3.38Å; Q184-V189 PolarHBondContact O-N 3.15Å; L185-V189 PolarHBondContact N-O 3.22Å
190	W	63.9	Low	64.5	Low	164 Å²	164	67.5 Å²	67.5	62%	0.621	37%	0.371	S	S	*	.			trans	-121	110.2	175.5	-176.3	-106.7	0	0	0	109.9	T181 L185 P192	T181-W190 HydrophobicContact CG2-CE3 4.18Å; T181-W190 HydrophobicContact CG2-CH2 4.04Å; T181-W190 HydrophobicContact CG2-CZ3 3.71Å; L185-W190 HydrophobicContact CD1-CE3 4.07Å; L185-W190 HydrophobicContact CD1-CZ3 4.47Å; W190-P192 VanDerWaalsContact CD1-CD 3.46Å; W190-P192 HydrophobicContact CZ2-CB 3.96Å; W190-P192 HydrophobicContact CZ2-CG 4.46Å; W190-P192 VanDerWaalsContact NE1-CG 3.31Å
191	S	61.5	Low	64.5	Low	54 Å²	54	67.3 Å²	67.3	38%	0.378	37%	0.373	S	S	.	.			trans	-130.1	78.9	174.4	-164	0	0	0	0	110.9	S193	S191-S193 PolarHBondContact O-N 2.88Å
192	P	55.2	Low	64.4	Low	49 Å²	49	68.1 Å²	68.1	32%	0.318	38%	0.375	S	S	.	.			trans	-79.3	-6.5	-173.9	35.5	-39.2	0	0	0	113	W190 S194 N195	W190-P192 VanDerWaalsContact CD1-CD 3.46Å; W190-P192 HydrophobicContact CZ2-CB 3.96Å; W190-P192 HydrophobicContact CZ2-CG 4.46Å; W190-P192 VanDerWaalsContact NE1-CG 3.31Å; P192-S194 PolarHBondContact O-N 2.68Å; P192-N195 PolarHBondContact O-ND2 3.36Å
193	S	55.6	Low	64.5	Low	100 Å²	100	63.7 Å²	63.7	70%	0.699	36%	0.359	S	S	*	.	S	Bend	trans	-66.9	7.7	-171	-48.6	0	0	0	0	114.3	S191	S191-S193 PolarHBondContact O-N 2.88Å
194	S	52.3	Low	64.6	Low	29 Å²	29	64.3 Å²	64.3	20%	0.203	36%	0.362	C	S	.	.			trans	-146.1	67.8	-166	-65.7	0	0	0	0	109.6	A174 A176 P192	A174-S194 VanDerWaalsContact CA-CB 3.49Å; A174-S194 WeakPolarHBondContact CA-OG 3.35Å; A174-S194 WeakPolarHBondContact CB-OG 3.46Å; A176-S194 WeakPolarHBondContact CA-O 3.34Å; A176-S194 VanDerWaalsContact CB-O 3.23Å; A176-S194 WeakPolarHBondContact CB-O 3.42Å; A176-S194 PolarHBondContact N-O 2.66Å; P192-S194 PolarHBondContact O-N 2.68Å
195	N	54	Low	64.6	Low	70 Å²	70	65.7 Å²	65.7	37%	0.374	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-91.8	128.6	177.8	-71.5	-42.3	0	0	0	110.7	P192 V197 L198	P192-N195 PolarHBondContact O-ND2 3.36Å; N195-V197 PolarHBondContact O-N 3.21Å; N195-L198 HydrophobicContact CB-CB 4.47Å; N195-L198 VanDerWaalsContact O-CB 3.28Å; N195-L198 WeakPolarHBondContact O-CB 3.25Å; N195-L198 PolarHBondContact O-N 3.45Å
196	E	55.3	Low	64.8	Low	14 Å²	14	61.6 Å²	61.6	7%	0.065	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-29.9	173.4	-123.6	-166.6	117.5	0	0	113.2	V162 A176 G177 L198 R199 P200 T204	V162-E196 HydrophobicContact CB-CG 3.86Å; V162-E196 HydrophobicContact CG1-CG 3.63Å; V162-E196 HydrophobicContact CG2-CG 4.19Å; V162-E196 WeakPolarHBondContact CG2-OE1 3.09Å; A176-E196 PolarHBondContact O-N 2.82Å; A176-E196 VanDerWaalsContact O-N 3.08Å; G177-E196 WeakPolarHBondContact CA-OE2 3.47Å; E196-L198 PolarHBondContact O-N 3.48Å; E196-R199 CarbonylContact O-C 3.01Å; E196-R199 PolarHBondContact O-N 2.81Å; E196-P200 WeakPolarHBondContact O-CA 3.31Å; E196-T204 PolarHBondContact OE1-OG1 3.31Å
197	V	54.9	Low	65.4	Low	121 Å²	121	59.3 Å²	59.3	73%	0.733	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.2	175.9	-177.4	0	0	0	0	111.3	I178 N195	I178-V197 HydrophobicContact CD1-CG2 4.39Å; N195-V197 PolarHBondContact O-N 3.21Å
198	L	50.4	Low	65.9	Low	142 Å²	142	61.3 Å²	61.3	74%	0.743	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-32.8	-179.3	-164.9	71.7	0	0	0	112.2	N195 E196	N195-L198 HydrophobicContact CB-CB 4.47Å; N195-L198 VanDerWaalsContact O-CB 3.28Å; N195-L198 WeakPolarHBondContact O-CB 3.25Å; N195-L198 PolarHBondContact O-N 3.45Å; E196-L198 PolarHBondContact O-N 3.48Å
199	R	56.2	Low	66.5	Low	169 Å²	169	61.4 Å²	61.4	64%	0.638	33%	0.329	S	S	*	.	S	Bend	trans	-142.1	93.1	176.8	-70.9	-171.6	179.9	151.4	0.3	109.8	E196 S201	E196-R199 CarbonylContact O-C 3.01Å; E196-R199 PolarHBondContact O-N 2.81Å; R199-S201 PolarHBondContact O-N 3.31Å
200	P	60.8	Low	67.5	Low	47 Å²	47	58.1 Å²	58.1	31%	0.305	31%	0.309	S	S	.	.			trans	-64.9	123.7	178.9	24.7	-31.5	0	0	0	109.6	E196 T204 K205	E196-P200 WeakPolarHBondContact O-CA 3.31Å; P200-T204 HydrophobicContact CB-CG2 4.15Å; P200-K205 WeakPolarHBondContact O-CE 3.4Å; P200-K205 PolarHBondContact O-NZ 3.41Å
201	S	67	Low	68.7	Low	16 Å²	16	50.3 Å²	50.3	11%	0.112	28%	0.279	C	S	.	.			trans	-67.3	165.6	177.5	75.3	0	0	0	0	111.7	V162 R199 A203 T204 K205	V162-S201 VanDerWaalsContact CG1-CB 3.45Å; V162-S201 WeakPolarHBondContact CG1-OG 3.21Å; V162-S201 WeakPolarHBondContact CG2-OG 3.28Å; R199-S201 PolarHBondContact O-N 3.31Å; S201-A203 PolarHBondContact O-N 2.87Å; S201-A203 PolarHBondContact OG-N 3.44Å; S201-T204 PolarHBondContact N-OG1 3.18Å; S201-T204 WeakPolarHBondContact O-CA 3.34Å; S201-T204 VanDerWaalsContact O-CB 3.27Å; S201-T204 WeakPolarHBondContact O-CB 3.42Å; S201-T204 PolarHBondContact O-N 3.24Å; S201-T204 PolarHBondContact O-OG1 2.84Å; S201-T204 PolarHBondContact OG-N 3.15Å; S201-T204 PolarHBondContact OG-OG1 3.03Å; S201-K205 PolarHBondContact O-N 2.89Å
202	F	68.5	Low	70.1	Confident	32 Å²	32	51 Å²	51	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-51.8	-43.8	169.6	176.3	-86.8	0	0	0	112.9	T204 K205 A206 F237 F241 D252 P253 F254	F202-T204 PolarHBondContact O-N 3.5Å; F202-K205 PolarHBondContact O-N 3.33Å; F202-A206 HydrophobicContact CD1-CB 4.5Å; F202-A206 HydrophobicContact CE1-CB 4.16Å; F202-A206 VanDerWaalsContact O-CB 3.28Å; F202-A206 WeakPolarHBondContact O-CB 3.48Å; F202-A206 PolarHBondContact O-N 3.45Å; F202-F237 HydrophobicContact CZ-CE1 4.18Å; F202-F237 HydrophobicContact CZ-CZ 4.1Å; F202-F241 HydrophobicContact CE1-CB 3.59Å; F202-F241 AromaticContact CE1-CD1 3.88Å; F202-F241 HydrophobicContact CE1-CD1 3.88Å; F202-F241 HydrophobicContact CE1-CD2 4.29Å; F202-F241 AromaticContact CE1-CG 3.64Å; F202-F241 HydrophobicContact CE1-CG 3.64Å; F202-F241 AromaticContact CE2-CD1 3.74Å; F202-F241 HydrophobicContact CE2-CD1 3.74Å; F202-F241 AromaticContact CE2-CE1 3.84Å; F202-F241 HydrophobicContact CE2-CE1 3.84Å; F202-F241 HydrophobicContact CE2-CG 4.23Å; F202-F241 HydrophobicContact CE2-CZ 4.45Å; F202-F241 HydrophobicContact CZ-CB 3.78Å; F202-F241 AromaticContact CZ-CD1 3.2Å; F202-F241 HydrophobicContact CZ-CD1 3.2Å; F202-F241 AromaticContact CZ-CD2 3.73Å; F202-F241 HydrophobicContact CZ-CD2 3.73Å; F202-F241 AromaticContact CZ-CE1 3.63Å; F202-F241 HydrophobicContact CZ-CE1 3.63Å; F202-F241 HydrophobicContact CZ-CE2 4.16Å; F202-F241 AromaticContact CZ-CG 3.25Å; F202-F241 HydrophobicContact CZ-CG 3.25Å; F202-F241 HydrophobicContact CZ-CZ 4.09Å; F202-D252 WeakPolarHBondContact CB-OD1 3.4Å; F202-P253 HydrophobicContact CD2-CG 4.3Å; F202-P253 HydrophobicContact CE2-CG 3.89Å; F202-F254 AromaticContact CD2-CD2 3.43Å; F202-F254 HydrophobicContact CD2-CD2 3.43Å; F202-F254 VanDerWaalsContact CD2-CD2 3.43Å; F202-F254 AromaticContact CD2-CE2 3.84Å; F202-F254 HydrophobicContact CD2-CE2 3.84Å; F202-F254 AromaticContact CE2-CD2 3.25Å; F202-F254 HydrophobicContact CE2-CD2 3.25Å; F202-F254 AromaticContact CE2-CE2 3.18Å; F202-F254 HydrophobicContact CE2-CE2 3.18Å; F202-F254 HydrophobicContact CE2-CG 4.46Å; F202-F254 HydrophobicContact CE2-CZ 4.36Å; F202-F254 HydrophobicContact CZ-CD2 4.33Å; F202-F254 AromaticContact CZ-CE2 3.88Å; F202-F254 HydrophobicContact CZ-CE2 3.88Å
203	A	72.6	Confident	71.8	Confident	17 Å²	17	53.5 Å²	53.5	14%	0.14	28%	0.284	C	S	.	.	H	α-helix	trans	-59.3	-38.2	177.5	0	0	0	0	0	110.8	N158 V162 S201 A206 C207	N158-A203 PolarHBondContact OD1-O 3.26Å; V162-A203 HydrophobicContact CG2-CB 4.49Å; S201-A203 PolarHBondContact O-N 2.87Å; S201-A203 PolarHBondContact OG-N 3.44Å; A203-A206 PolarHBondContact O-N 3.4Å; A203-C207 PolarHBondContact O-N 3.43Å; A203-C207 PolarHBondContact O-SG 3.43Å
204	T	76.3	Confident	73.5	Confident	15 Å²	15	48.8 Å²	48.8	9%	0.092	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-53.4	177.7	-36.7	0	0	0	0	111.7	T154 N158 E196 P200 S201 F202 A206 C207 I208	T154-T204 HydrophobicContact CG2-CG2 4.48Å; N158-T204 VanDerWaalsContact CG-CA 3.48Å; N158-T204 VanDerWaalsContact ND2-CA 3.3Å; N158-T204 WeakPolarHBondContact ND2-CA 3.29Å; N158-T204 PolarHBondContact ND2-O 3.43Å; N158-T204 WeakPolarHBondContact OD1-CA 3.35Å; N158-T204 PolarHBondContact OD1-N 3.11Å; E196-T204 PolarHBondContact OE1-OG1 3.31Å; P200-T204 HydrophobicContact CB-CG2 4.15Å; S201-T204 PolarHBondContact N-OG1 3.18Å; S201-T204 WeakPolarHBondContact O-CA 3.34Å; S201-T204 VanDerWaalsContact O-CB 3.27Å; S201-T204 WeakPolarHBondContact O-CB 3.42Å; S201-T204 PolarHBondContact O-N 3.24Å; S201-T204 PolarHBondContact O-OG1 2.84Å; S201-T204 PolarHBondContact OG-N 3.15Å; S201-T204 PolarHBondContact OG-OG1 3.03Å; F202-T204 PolarHBondContact O-N 3.5Å; T204-A206 PolarHBondContact O-N 3.07Å; T204-C207 PolarHBondContact O-N 2.97Å; T204-I208 WeakPolarHBondContact O-CG1 3.34Å; T204-I208 PolarHBondContact O-N 3.27Å
205	K	78.9	Confident	75.3	Confident	42 Å²	42	47.8 Å²	47.8	18%	0.183	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-44.7	177.2	-65.8	168.8	-179.4	161.9	0	111.8	P200 S201 F202 C207 I208 L209 E258	P200-K205 WeakPolarHBondContact O-CE 3.4Å; P200-K205 PolarHBondContact O-NZ 3.41Å; S201-K205 PolarHBondContact O-N 2.89Å; F202-K205 PolarHBondContact O-N 3.33Å; K205-C207 PolarHBondContact O-N 2.86Å; K205-I208 WeakPolarHBondContact O-CB 3.31Å; K205-I208 PolarHBondContact O-N 3.19Å; K205-L209 WeakPolarHBondContact O-CG 3.49Å; K205-L209 PolarHBondContact O-N 3.07Å; K205-E258 IonicContact NZ-OE1 2.98Å; K205-E258 PolarHBondContact NZ-OE1 3Å; K205-E258 IonicContact NZ-OE2 2.58Å; K205-E258 PolarHBondContact NZ-OE2 2.97Å
206	A	83.4	Confident	77	Confident	2 Å²	2	47.6 Å²	47.6	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-60.9	-41.4	177.8	0	0	0	0	0	112.5	F202 A203 T204 L209 A210 F237 F238	F202-A206 HydrophobicContact CD1-CB 4.5Å; F202-A206 HydrophobicContact CE1-CB 4.16Å; F202-A206 VanDerWaalsContact O-CB 3.28Å; F202-A206 WeakPolarHBondContact O-CB 3.48Å; F202-A206 PolarHBondContact O-N 3.45Å; A203-A206 PolarHBondContact O-N 3.4Å; T204-A206 PolarHBondContact O-N 3.07Å; A206-L209 PolarHBondContact O-N 3.3Å; A206-A210 VanDerWaalsContact O-CB 3.29Å; A206-A210 WeakPolarHBondContact O-CB 3.23Å; A206-A210 PolarHBondContact O-N 2.83Å; A206-F237 HydrophobicContact CB-CE1 3.8Å; A206-F238 HydrophobicContact CB-CD1 4.33Å; A206-F238 HydrophobicContact CB-CE1 3.51Å; A206-F238 HydrophobicContact CB-CZ 3.91Å
207	C	85.5	Confident	78.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-72.9	-30.7	176.6	-56.4	0	0	0	0	113	V131 N158 A203 T204 K205 S211 F238	V131-C207 HydrophobicContact CG2-CB 3.99Å; N158-C207 WeakPolarHBondContact ND2-CB 3.35Å; N158-C207 PolarHBondContact OD1-SG 3.08Å; A203-C207 PolarHBondContact O-N 3.43Å; A203-C207 PolarHBondContact O-SG 3.43Å; T204-C207 PolarHBondContact O-N 2.97Å; K205-C207 PolarHBondContact O-N 2.86Å; C207-S211 WeakPolarHBondContact O-CB 3.43Å; C207-S211 PolarHBondContact O-N 2.97Å; C207-S211 PolarHBondContact O-OG 3.37Å; C207-F238 HydrophobicContact CB-CZ 4.41Å
208	I	86.7	Confident	79.8	Confident	62 Å²	62	46.7 Å²	46.7	32%	0.318	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-51.3	171.2	-68.3	167.7	0	0	0	109	V150 T154 T204 K205 A210 S211 I212	V150-I208 HydrophobicContact CG1-CG2 4.03Å; T154-I208 HydrophobicContact CG2-CD1 4.32Å; T154-I208 HydrophobicContact CG2-CG1 3.51Å; T154-I208 WeakPolarHBondContact OG1-CA 3.4Å; T154-I208 WeakPolarHBondContact OG1-CG1 3.48Å; T204-I208 WeakPolarHBondContact O-CG1 3.34Å; T204-I208 PolarHBondContact O-N 3.27Å; K205-I208 WeakPolarHBondContact O-CB 3.31Å; K205-I208 PolarHBondContact O-N 3.19Å; I208-A210 PolarHBondContact O-N 3.37Å; I208-S211 WeakPolarHBondContact O-CB 3.33Å; I208-S211 PolarHBondContact O-N 3.44Å; I208-I212 HydrophobicContact CG2-CD1 3.92Å; I208-I212 WeakPolarHBondContact O-CG1 3.42Å; I208-I212 PolarHBondContact O-N 2.56Å
209	L	88.4	Confident	81.3	Confident	72 Å²	72	43.4 Å²	43.4	38%	0.377	21%	0.208	S	C	.	.	H	α-helix	trans	-58.7	-48.1	176.9	-69.9	175	0	0	0	111.5	K205 A206 S211 I212 F213	K205-L209 WeakPolarHBondContact O-CG 3.49Å; K205-L209 PolarHBondContact O-N 3.07Å; A206-L209 PolarHBondContact O-N 3.3Å; L209-S211 VanDerWaalsContact C-N 3.3Å; L209-S211 PolarHBondContact O-N 3.19Å; L209-I212 WeakPolarHBondContact O-CB 3.33Å; L209-I212 PolarHBondContact O-N 2.96Å; L209-I212 VanDerWaalsContact O-N 3.14Å; L209-F213 HydrophobicContact CB-CE2 4.46Å; L209-F213 WeakPolarHBondContact O-CD2 3.06Å; L209-F213 PolarHBondContact O-N 3.5Å
210	A	90.5	Very high	82.1	Confident	4 Å²	4	37.5 Å²	37.5	3%	0.033	19%	0.191	C	C	.	.	H	α-helix	trans	-58.3	-41.3	176.6	0	0	0	0	0	112.2	V131 A206 I208 F213 F214 V234 F238	V131-A210 HydrophobicContact CG1-CB 4.21Å; A206-A210 VanDerWaalsContact O-CB 3.29Å; A206-A210 WeakPolarHBondContact O-CB 3.23Å; A206-A210 PolarHBondContact O-N 2.83Å; I208-A210 PolarHBondContact O-N 3.37Å; A210-F213 PolarHBondContact O-N 3.22Å; A210-F214 HydrophobicContact CB-CE2 4.36Å; A210-F214 WeakPolarHBondContact O-CD2 3.05Å; A210-F214 WeakPolarHBondContact O-CG 3.04Å; A210-F214 PolarHBondContact O-N 3.41Å; A210-V234 HydrophobicContact CB-CG1 3.67Å; A210-F238 HydrophobicContact CB-CE2 3.86Å; A210-F238 HydrophobicContact CB-CZ 4.16Å
211	S	89.5	Confident	82.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-43.9	176	-57	0	0	0	0	111.2	V131 T154 C207 I208 L209 F214 I215	V131-S211 WeakPolarHBondContact CG1-OG 3.35Å; T154-S211 PolarHBondContact N-OG 3.44Å; C207-S211 WeakPolarHBondContact O-CB 3.43Å; C207-S211 PolarHBondContact O-N 2.97Å; C207-S211 PolarHBondContact O-OG 3.37Å; I208-S211 WeakPolarHBondContact O-CB 3.33Å; I208-S211 PolarHBondContact O-N 3.44Å; L209-S211 VanDerWaalsContact C-N 3.3Å; L209-S211 PolarHBondContact O-N 3.19Å; S211-F214 PolarHBondContact O-N 3.37Å; S211-I215 VanDerWaalsContact O-CD1 3.31Å; S211-I215 WeakPolarHBondContact O-CD1 3.12Å; S211-I215 WeakPolarHBondContact O-CG1 3.19Å; S211-I215 PolarHBondContact O-N 3.35Å
212	I	90.8	Very high	82.1	Confident	67 Å²	67	48.4 Å²	48.4	34%	0.344	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-46.8	175.8	-66.8	165.4	0	0	0	110.6	V150 I208 L209 F214 I215 L216	V150-I212 HydrophobicContact CG1-CG1 4.4Å; V150-I212 HydrophobicContact CG2-CG1 3.85Å; I208-I212 HydrophobicContact CG2-CD1 3.92Å; I208-I212 WeakPolarHBondContact O-CG1 3.42Å; I208-I212 PolarHBondContact O-N 2.56Å; L209-I212 WeakPolarHBondContact O-CB 3.33Å; L209-I212 PolarHBondContact O-N 2.96Å; L209-I212 VanDerWaalsContact O-N 3.14Å; I212-F214 PolarHBondContact O-N 2.93Å; I212-I215 PolarHBondContact O-N 3.31Å; I212-L216 HydrophobicContact CG2-CD1 3.84Å; I212-L216 HydrophobicContact CG2-CG 4.22Å; I212-L216 WeakPolarHBondContact O-CG 2.89Å; I212-L216 PolarHBondContact O-N 2.94Å
213	F	90.7	Very high	81.9	Confident	103 Å²	103	49.4 Å²	49.4	45%	0.452	25%	0.251	S	S	.	.	H	α-helix	trans	-59.1	-46	177.8	-81	-66.5	0	0	0	112.4	L209 A210 I215 L216 E217	L209-F213 HydrophobicContact CB-CE2 4.46Å; L209-F213 WeakPolarHBondContact O-CD2 3.06Å; L209-F213 PolarHBondContact O-N 3.5Å; A210-F213 PolarHBondContact O-N 3.22Å; F213-I215 VanDerWaalsContact C-N 3.3Å; F213-I215 PolarHBondContact O-N 2.94Å; F213-L216 PolarHBondContact O-N 2.8Å; F213-E217 WeakPolarHBondContact O-CB 3.35Å; F213-E217 PolarHBondContact O-N 2.98Å
214	F	91.4	Very high	81.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.1	-30.8	177.4	-69.2	-47.3	0	0	0	113.5	T128 V131 Y132 V135 A210 S211 I212 K218 I230 Y231 V234	T128-F214 HydrophobicContact CG2-CE2 4.24Å; T128-F214 HydrophobicContact CG2-CZ 3.86Å; V131-F214 HydrophobicContact CB-CE2 4.49Å; V131-F214 HydrophobicContact CG1-CD2 4.11Å; V131-F214 HydrophobicContact CG1-CE2 4.18Å; Y132-F214 HydrophobicContact CD2-CB 4.33Å; Y132-F214 AromaticContact CD2-CD1 3.77Å; Y132-F214 HydrophobicContact CD2-CD1 3.77Å; Y132-F214 HydrophobicContact CD2-CD2 4.24Å; Y132-F214 HydrophobicContact CD2-CE1 4.08Å; Y132-F214 AromaticContact CD2-CG 3.87Å; Y132-F214 HydrophobicContact CD2-CG 3.87Å; Y132-F214 HydrophobicContact CD2-CZ 4.45Å; Y132-F214 HydrophobicContact CE2-CD1 4.42Å; V135-F214 HydrophobicContact CG1-CB 4.23Å; A210-F214 HydrophobicContact CB-CE2 4.36Å; A210-F214 WeakPolarHBondContact O-CD2 3.05Å; A210-F214 WeakPolarHBondContact O-CG 3.04Å; A210-F214 PolarHBondContact O-N 3.41Å; S211-F214 PolarHBondContact O-N 3.37Å; I212-F214 PolarHBondContact O-N 2.93Å; F214-K218 PolarHBondContact O-N 3.05Å; F214-I230 HydrophobicContact CD1-CG2 4.44Å; F214-I230 HydrophobicContact CE1-CG2 4.43Å; F214-Y231 AromaticContact CE1-CD2 3.99Å; F214-Y231 HydrophobicContact CE1-CD2 3.99Å; F214-Y231 AromaticContact CZ-CD2 3.87Å; F214-Y231 HydrophobicContact CZ-CD2 3.87Å; F214-Y231 HydrophobicContact CZ-CE2 4.38Å; F214-V234 HydrophobicContact CE1-CG2 4.31Å; F214-V234 HydrophobicContact CE2-CG1 4.22Å; F214-V234 HydrophobicContact CZ-CB 4.06Å; F214-V234 HydrophobicContact CZ-CG1 3.99Å; F214-V234 HydrophobicContact CZ-CG2 4.1Å
215	I	90.6	Very high	81.9	Confident	9 Å²	9	57 Å²	57	5%	0.046	29%	0.293	C	S	.	.	H	α-helix	trans	-70.6	-49.6	174.5	-69.4	162	0	0	0	110.1	V135 Y146 M149 V150 S211 I212 F213 E217 K218 K219	V135-I215 HydrophobicContact CG1-CD1 4.49Å; V135-I215 HydrophobicContact CG1-CG1 3.61Å; Y146-I215 HydrophobicContact CD1-CG2 3.62Å; Y146-I215 HydrophobicContact CE1-CG2 4.16Å; M149-I215 HydrophobicContact CB-CD1 3.49Å; M149-I215 VanDerWaalsContact CB-CD1 3.49Å; M149-I215 HydrophobicContact CB-CG1 3.96Å; M149-I215 HydrophobicContact SD-CD1 4.44Å; M149-I215 HydrophobicContact SD-CG1 4.14Å; M149-I215 HydrophobicContact SD-CG2 4.36Å; V150-I215 HydrophobicContact CB-CD1 4.37Å; V150-I215 HydrophobicContact CG2-CD1 3.4Å; V150-I215 VanDerWaalsContact CG2-CD1 3.4Å; S211-I215 VanDerWaalsContact O-CD1 3.31Å; S211-I215 WeakPolarHBondContact O-CD1 3.12Å; S211-I215 WeakPolarHBondContact O-CG1 3.19Å; S211-I215 PolarHBondContact O-N 3.35Å; I212-I215 PolarHBondContact O-N 3.31Å; F213-I215 VanDerWaalsContact C-N 3.3Å; F213-I215 PolarHBondContact O-N 2.94Å; I215-E217 VanDerWaalsContact C-N 3.31Å; I215-E217 PolarHBondContact O-N 2.98Å; I215-K218 PolarHBondContact O-N 3.48Å; I215-K219 WeakPolarHBondContact O-CB 3.28Å; I215-K219 PolarHBondContact O-N 3.32Å
216	L	88.2	Confident	82.2	Confident	66 Å²	66	58.2 Å²	58.2	35%	0.346	31%	0.305	S	S	.	.	H	α-helix	trans	-58.5	-44.4	179.9	-72.7	174.4	0	0	0	111.2	I212 F213 K218 T220 I223	I212-L216 HydrophobicContact CG2-CD1 3.84Å; I212-L216 HydrophobicContact CG2-CG 4.22Å; I212-L216 WeakPolarHBondContact O-CG 2.89Å; I212-L216 PolarHBondContact O-N 2.94Å; F213-L216 PolarHBondContact O-N 2.8Å; L216-K218 PolarHBondContact O-N 3.4Å; L216-T220 WeakPolarHBondContact O-CA 3.37Å; L216-T220 VanDerWaalsContact O-CB 3.27Å; L216-T220 WeakPolarHBondContact O-CB 3.3Å; L216-T220 PolarHBondContact O-N 3.41Å; L216-I223 HydrophobicContact CB-CD1 4.11Å
217	E	86.3	Confident	82.3	Confident	27 Å²	27	60.4 Å²	60.4	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-53.9	-50.7	174.2	177.9	-160.5	144.2	0	0	112.5	F213 I215 H227 I230	F213-E217 WeakPolarHBondContact O-CB 3.35Å; F213-E217 PolarHBondContact O-N 2.98Å; I215-E217 VanDerWaalsContact C-N 3.31Å; I215-E217 PolarHBondContact O-N 2.98Å; E217-H227 VanDerWaalsContact CD-ND1 3.3Å; E217-H227 WeakPolarHBondContact OE1-CA 3.43Å; E217-H227 WeakPolarHBondContact OE1-CB 3.44Å; E217-H227 IonicContact OE1-CE1 3.94Å; E217-H227 IonicContact OE1-CG 3.85Å; E217-H227 IonicContact OE1-ND1 3.17Å; E217-H227 PolarHBondContact OE1-ND1 3.29Å; E217-H227 IonicContact OE2-CE1 3.07Å; E217-H227 IonicContact OE2-ND1 3.62Å; E217-H227 PolarHBondContact OE2-ND1 3.44Å; E217-I230 HydrophobicContact CB-CD1 3.78Å; E217-I230 HydrophobicContact CG-CD1 3.35Å
218	K	83.7	Confident	82.6	Confident	88 Å²	88	62.1 Å²	62.1	38%	0.383	32%	0.324	S	S	.	.	H	α-helix	trans	-82.2	-27.9	-171.3	-78	-160.1	178.5	-59.5	0	114.5	Y132 V136 M139 F214 I215 L216	Y132-K218 WeakPolarHBondContact OH-CE 3.4Å; Y132-K218 PolarHBondContact OH-NZ 2.83Å; Y132-K218 VanDerWaalsContact OH-NZ 3.12Å; V136-K218 HydrophobicContact CG2-CD 4.22Å; M139-K218 HydrophobicContact CE-CB 3.86Å; M139-K218 HydrophobicContact CE-CD 3.97Å; M139-K218 HydrophobicContact CE-CG 4.44Å; M139-K218 HydrophobicContact SD-CB 3.79Å; M139-K218 HydrophobicContact SD-CD 3.81Å; M139-K218 HydrophobicContact SD-CG 4.46Å; F214-K218 PolarHBondContact O-N 3.05Å; I215-K218 PolarHBondContact O-N 3.48Å; L216-K218 PolarHBondContact O-N 3.4Å
219	K	81.9	Confident	82.7	Confident	74 Å²	74	60.7 Å²	60.7	32%	0.322	32%	0.317	S	S	.	.	H	α-helix	trans	-102.9	-15.9	-173.4	-77	-80.9	172.3	174.9	0	113.1	M139 P143 Y146 I215	M139-K219 HydrophobicContact SD-CG 4.3Å; P143-K219 WeakPolarHBondContact O-CE 3.44Å; P143-K219 PolarHBondContact O-NZ 3.26Å; Y146-K219 HydrophobicContact CE1-CB 4.04Å; Y146-K219 HydrophobicContact CE1-CD 4.24Å; Y146-K219 HydrophobicContact CE1-CG 3.95Å; I215-K219 WeakPolarHBondContact O-CB 3.28Å; I215-K219 PolarHBondContact O-N 3.32Å
220	T	72.6	Confident	82.8	Confident	44 Å²	44	57.9 Å²	57.9	27%	0.27	30%	0.302	S	S	.	.			trans	-134.7	122.9	-170.2	-39.8	0	0	0	0	110	L216 L222	L216-T220 WeakPolarHBondContact O-CA 3.37Å; L216-T220 VanDerWaalsContact O-CB 3.27Å; L216-T220 WeakPolarHBondContact O-CB 3.3Å; L216-T220 PolarHBondContact O-N 3.41Å; T220-L222 HydrophobicContact CG2-CB 3.72Å; T220-L222 HydrophobicContact CG2-CD1 3.2Å; T220-L222 HydrophobicContact CG2-CG 3.84Å; T220-L222 PolarHBondContact O-N 3.16Å
221	D	66.5	Low	82.8	Confident	150 Å²	150	57.8 Å²	57.8	80%	0.802	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	9.5	172.9	-58.4	-41.6	0	0	0	113	I223	D221-I223 VanDerWaalsContact C-N 3.25Å; D221-I223 PolarHBondContact O-N 3.32Å
222	L	60.8	Low	82.9	Confident	142 Å²	142	59.3 Å²	59.3	74%	0.743	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-30.4	175.7	-101.1	144.3	0	0	0	111.8	T220	T220-L222 HydrophobicContact CG2-CB 3.72Å; T220-L222 HydrophobicContact CG2-CD1 3.2Å; T220-L222 HydrophobicContact CG2-CG 3.84Å; T220-L222 PolarHBondContact O-N 3.16Å
223	I	65.7	Low	83	Confident	54 Å²	54	60.9 Å²	60.9	28%	0.277	32%	0.317	S	S	.	.			trans	-112.8	91.5	178.1	-53.1	178.1	0	0	0	108.9	L216 D221 A225 I230	L216-I223 HydrophobicContact CB-CD1 4.11Å; D221-I223 VanDerWaalsContact C-N 3.25Å; D221-I223 PolarHBondContact O-N 3.32Å; I223-A225 HydrophobicContact CG2-CB 3.79Å; I223-A225 PolarHBondContact O-N 3.27Å; I223-I230 HydrophobicContact CG2-CD1 3.65Å; I223-I230 HydrophobicContact CG2-CG1 4.37Å
224	N	70.1	Confident	83	Confident	158 Å²	158	56.6 Å²	56.6	85%	0.845	30%	0.299	S	S	*	.			trans	-73	29.4	173.9	-87.3	-18.8	0	0	0	113.8
225	A	77.6	Confident	83.1	Confident	34 Å²	34	57 Å²	57	28%	0.281	30%	0.301	S	S	.	.	S	Bend	trans	-97.2	145.1	177.8	0	0	0	0	0	110.7	I223 L229 I230	I223-A225 HydrophobicContact CG2-CB 3.79Å; I223-A225 PolarHBondContact O-N 3.27Å; A225-L229 HydrophobicContact CB-CD2 4.37Å; A225-I230 HydrophobicContact CB-CD1 4.08Å; A225-I230 HydrophobicContact CB-CG1 4.08Å
226	P	84.2	Confident	83	Confident	66 Å²	66	58.6 Å²	58.6	43%	0.429	31%	0.313	S	S	.	.			trans	-63.6	141.9	176.6	25.6	-31.7	0	0	0	110.6	L9 D228 L229 I230	L9-P226 HydrophobicContact CD2-CG 4.08Å; P226-D228 PolarHBondContact O-N 2.85Å; P226-D228 VanDerWaalsContact O-N 3.13Å; P226-L229 HydrophobicContact CG-CB 3.81Å; P226-L229 HydrophobicContact CG-CD2 4.49Å; P226-L229 WeakPolarHBondContact O-CB 3.4Å; P226-L229 PolarHBondContact O-N 3.41Å; P226-I230 PolarHBondContact O-N 2.98Å
227	H	86.9	Confident	83	Confident	48 Å²	48	58.7 Å²	58.7	22%	0.222	31%	0.311	C	S	.	.	H	α-helix	trans	-47.3	-45.1	179.4	175.8	55	0	0	0	112.4	Y132 E217 L229 I230 Y231	Y132-H227 AromaticContact CD2-CE1 3.76Å; Y132-H227 AromaticContact CE1-CE1 3.97Å; Y132-H227 AromaticContact CE1-NE2 3.7Å; Y132-H227 AromaticContact CE2-CE1 3.11Å; Y132-H227 WeakPolarHBondContact CE2-CE1 3.32Å; Y132-H227 AromaticContact CE2-ND1 3.97Å; Y132-H227 AromaticContact CE2-NE2 3.69Å; Y132-H227 AromaticContact CZ-CE1 3.22Å; Y132-H227 AromaticContact CZ-NE2 3.27Å; Y132-H227 VanDerWaalsContact CZ-NE2 3.27Å; Y132-H227 PolarHBondContact OH-CE1 3.36Å; Y132-H227 PolarHBondContact OH-NE2 2.87Å; E217-H227 VanDerWaalsContact CD-ND1 3.3Å; E217-H227 WeakPolarHBondContact OE1-CA 3.43Å; E217-H227 WeakPolarHBondContact OE1-CB 3.44Å; E217-H227 IonicContact OE1-CE1 3.94Å; E217-H227 IonicContact OE1-CG 3.85Å; E217-H227 IonicContact OE1-ND1 3.17Å; E217-H227 PolarHBondContact OE1-ND1 3.29Å; E217-H227 IonicContact OE2-CE1 3.07Å; E217-H227 IonicContact OE2-ND1 3.62Å; E217-H227 PolarHBondContact OE2-ND1 3.44Å; H227-L229 PolarHBondContact O-N 3.49Å; H227-I230 PolarHBondContact O-N 3.34Å; H227-I230 VanDerWaalsContact O-N 3.14Å; H227-Y231 WeakPolarHBondContact O-CB 3.38Å; H227-Y231 PolarHBondContact O-N 2.68Å
228	D	90.5	Very high	83.1	Confident	37 Å²	37	57.6 Å²	57.6	20%	0.198	31%	0.306	C	S	.	.	H	α-helix	trans	-57.7	-39.4	-177.7	-62	2	0	0	0	111.7	S12 H13 A16 P226 F232	S12-D228 WeakPolarHBondContact CB-O 3.32Å; H13-D228 IonicContact CE1-OD2 2.65Å; H13-D228 IonicContact CG-OD2 3.78Å; H13-D228 IonicContact ND1-OD2 3.19Å; H13-D228 PolarHBondContact ND1-OD2 3.18Å; A16-D228 HydrophobicContact CB-CB 3.84Å; P226-D228 PolarHBondContact O-N 2.85Å; P226-D228 VanDerWaalsContact O-N 3.13Å; D228-F232 WeakPolarHBondContact O-CB 3.27Å; D228-F232 PolarHBondContact O-N 3.49Å
229	L	89.1	Confident	83.3	Confident	32 Å²	32	54.9 Å²	54.9	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-69.1	-43.6	178.4	-179.4	62.9	0	0	0	111.6	L8 A225 P226 H227 F232 L233	L8-L229 HydrophobicContact CD2-CD1 3.67Å; L8-L229 HydrophobicContact CG-CD1 4.02Å; A225-L229 HydrophobicContact CB-CD2 4.37Å; P226-L229 HydrophobicContact CG-CB 3.81Å; P226-L229 HydrophobicContact CG-CD2 4.49Å; P226-L229 WeakPolarHBondContact O-CB 3.4Å; P226-L229 PolarHBondContact O-N 3.41Å; H227-L229 PolarHBondContact O-N 3.49Å; L229-F232 PolarHBondContact O-N 3.25Å; L229-L233 HydrophobicContact CG-CD1 4.36Å; L229-L233 VanDerWaalsContact O-CG 3.28Å; L229-L233 WeakPolarHBondContact O-CG 3.35Å; L229-L233 PolarHBondContact O-N 3.1Å
230	I	90.2	Very high	83.5	Confident	13 Å²	13	58.4 Å²	58.4	7%	0.067	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-46.1	178.7	-65.1	163.6	0	0	0	109.9	F214 E217 I223 A225 P226 H227 F232 L233 V234	F214-I230 HydrophobicContact CD1-CG2 4.44Å; F214-I230 HydrophobicContact CE1-CG2 4.43Å; E217-I230 HydrophobicContact CB-CD1 3.78Å; E217-I230 HydrophobicContact CG-CD1 3.35Å; I223-I230 HydrophobicContact CG2-CD1 3.65Å; I223-I230 HydrophobicContact CG2-CG1 4.37Å; A225-I230 HydrophobicContact CB-CD1 4.08Å; A225-I230 HydrophobicContact CB-CG1 4.08Å; P226-I230 PolarHBondContact O-N 2.98Å; H227-I230 PolarHBondContact O-N 3.34Å; H227-I230 VanDerWaalsContact O-N 3.14Å; I230-F232 VanDerWaalsContact C-N 3.31Å; I230-F232 PolarHBondContact O-N 3.19Å; I230-L233 PolarHBondContact O-N 3Å; I230-V234 WeakPolarHBondContact O-CG2 3.29Å; I230-V234 PolarHBondContact O-N 2.48Å
231	Y	91.9	Very high	83.9	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.008	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-46.9	175.1	-173.7	-92.8	0	0	0	111.3	I15 A16 V125 T128 N129 F214 H227 L233 V234 V235	I15-Y231 HydrophobicContact CG2-CD1 4.27Å; I15-Y231 HydrophobicContact CG2-CE1 4.12Å; A16-Y231 HydrophobicContact CB-CD1 4.12Å; V125-Y231 PolarHBondContact O-OH 2.93Å; T128-Y231 HydrophobicContact CG2-CD2 4.24Å; T128-Y231 HydrophobicContact CG2-CE2 3.74Å; N129-Y231 WeakPolarHBondContact CA-OH 3.36Å; N129-Y231 WeakPolarHBondContact CB-OH 3.4Å; N129-Y231 VanDerWaalsContact CG-OH 3.29Å; N129-Y231 PolarHBondContact N-OH 2.67Å; N129-Y231 PolarHBondContact ND2-OH 3.07Å; F214-Y231 AromaticContact CE1-CD2 3.99Å; F214-Y231 HydrophobicContact CE1-CD2 3.99Å; F214-Y231 AromaticContact CZ-CD2 3.87Å; F214-Y231 HydrophobicContact CZ-CD2 3.87Å; F214-Y231 HydrophobicContact CZ-CE2 4.38Å; H227-Y231 WeakPolarHBondContact O-CB 3.38Å; H227-Y231 PolarHBondContact O-N 2.68Å; Y231-L233 PolarHBondContact O-N 3.46Å; Y231-V234 PolarHBondContact O-N 3.5Å; Y231-V235 HydrophobicContact CD1-CG2 3.93Å; Y231-V235 HydrophobicContact CE1-CG2 3.44Å; Y231-V235 VanDerWaalsContact CE1-CG2 3.44Å; Y231-V235 WeakPolarHBondContact O-CG2 3.06Å; Y231-V235 PolarHBondContact O-N 3.31Å
232	F	92	Very high	84.5	Confident	32 Å²	32	52.7 Å²	52.7	14%	0.14	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-43.3	176	173.9	-97.3	0	0	0	113.1	L8 I15 D228 L229 I230 V235 S236	L8-F232 HydrophobicContact CD1-CD1 3.96Å; L8-F232 HydrophobicContact CD1-CE1 3.39Å; L8-F232 HydrophobicContact CD1-CZ 4.07Å; I15-F232 HydrophobicContact CB-CD2 4.26Å; I15-F232 HydrophobicContact CD1-CD2 3.38Å; I15-F232 HydrophobicContact CD1-CE2 3.36Å; I15-F232 HydrophobicContact CG1-CD2 4.38Å; I15-F232 HydrophobicContact CG2-CD2 4.42Å; D228-F232 WeakPolarHBondContact O-CB 3.27Å; D228-F232 PolarHBondContact O-N 3.49Å; L229-F232 PolarHBondContact O-N 3.25Å; I230-F232 VanDerWaalsContact C-N 3.31Å; I230-F232 PolarHBondContact O-N 3.19Å; F232-V235 PolarHBondContact O-N 3.31Å; F232-S236 WeakPolarHBondContact CZ-OG 3.13Å; F232-S236 VanDerWaalsContact O-CB 3.27Å; F232-S236 WeakPolarHBondContact O-CB 3.19Å; F232-S236 PolarHBondContact O-N 3.18Å; F232-S236 PolarHBondContact O-OG 3Å
233	L	91.8	Very high	85.5	Confident	100 Å²	100	48.5 Å²	48.5	52%	0.524	25%	0.251	S	S	.	.	H	α-helix	trans	-63.6	-42.4	177.5	-73.3	173	0	0	0	111.6	L229 I230 Y231 S236 F237	L229-L233 HydrophobicContact CG-CD1 4.36Å; L229-L233 VanDerWaalsContact O-CG 3.28Å; L229-L233 WeakPolarHBondContact O-CG 3.35Å; L229-L233 PolarHBondContact O-N 3.1Å; I230-L233 PolarHBondContact O-N 3Å; Y231-L233 PolarHBondContact O-N 3.46Å; L233-S236 PolarHBondContact O-N 3.32Å; L233-F237 WeakPolarHBondContact O-CB 3.14Å; L233-F237 PolarHBondContact O-N 3.2Å
234	V	92	Very high	86	Confident	13 Å²	13	46.6 Å²	46.6	8%	0.079	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-43.7	177.2	177.9	0	0	0	0	111	T128 A210 F214 I230 Y231 F237 F238	T128-V234 HydrophobicContact CG2-CB 4.05Å; T128-V234 HydrophobicContact CG2-CG1 3.53Å; A210-V234 HydrophobicContact CB-CG1 3.67Å; F214-V234 HydrophobicContact CE1-CG2 4.31Å; F214-V234 HydrophobicContact CE2-CG1 4.22Å; F214-V234 HydrophobicContact CZ-CB 4.06Å; F214-V234 HydrophobicContact CZ-CG1 3.99Å; F214-V234 HydrophobicContact CZ-CG2 4.1Å; I230-V234 WeakPolarHBondContact O-CG2 3.29Å; I230-V234 PolarHBondContact O-N 2.48Å; Y231-V234 PolarHBondContact O-N 3.5Å; V234-F237 WeakPolarHBondContact O-CB 3.35Å; V234-F237 PolarHBondContact O-N 2.95Å; V234-F238 HydrophobicContact CG1-CD2 3.8Å; V234-F238 HydrophobicContact CG1-CE2 3.64Å; V234-F238 VanDerWaalsContact O-CD2 3.28Å; V234-F238 WeakPolarHBondContact O-CD2 3.24Å; V234-F238 PolarHBondContact O-N 2.93Å
235	V	91.8	Very high	86.2	Confident	7 Å²	7	40 Å²	40	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-49.1	174.1	170	0	0	0	0	110.6	I15 V125 T128 Y231 F232 F237 F238 V239	I15-V235 HydrophobicContact CG2-CB 4.48Å; I15-V235 HydrophobicContact CG2-CG1 4.34Å; I15-V235 HydrophobicContact CG2-CG2 4.31Å; V125-V235 HydrophobicContact CB-CG1 4.36Å; V125-V235 HydrophobicContact CG1-CG1 4.31Å; V125-V235 HydrophobicContact CG1-CG2 4.47Å; V125-V235 HydrophobicContact CG2-CG1 3.82Å; T128-V235 HydrophobicContact CG2-CG2 3.65Å; Y231-V235 HydrophobicContact CD1-CG2 3.93Å; Y231-V235 HydrophobicContact CE1-CG2 3.44Å; Y231-V235 VanDerWaalsContact CE1-CG2 3.44Å; Y231-V235 WeakPolarHBondContact O-CG2 3.06Å; Y231-V235 PolarHBondContact O-N 3.31Å; F232-V235 PolarHBondContact O-N 3.31Å; V235-F237 VanDerWaalsContact C-N 3.27Å; V235-F237 PolarHBondContact O-N 3.49Å; V235-F238 PolarHBondContact O-N 3.39Å; V235-V239 HydrophobicContact CG1-CG2 4.17Å; V235-V239 WeakPolarHBondContact O-CB 3.46Å; V235-V239 WeakPolarHBondContact O-CG2 3.33Å; V235-V239 PolarHBondContact O-N 3.32Å
236	S	89.1	Confident	86	Confident	44 Å²	44	40.1 Å²	40.1	31%	0.308	21%	0.206	S	C	.	.	H	α-helix	trans	-59	-41	179.2	-62.7	0	0	0	0	111.1	F232 L233 Y240	F232-S236 WeakPolarHBondContact CZ-OG 3.13Å; F232-S236 VanDerWaalsContact O-CB 3.27Å; F232-S236 WeakPolarHBondContact O-CB 3.19Å; F232-S236 PolarHBondContact O-N 3.18Å; F232-S236 PolarHBondContact O-OG 3Å; L233-S236 PolarHBondContact O-N 3.32Å; S236-Y240 WeakPolarHBondContact O-CB 3.39Å; S236-Y240 PolarHBondContact O-N 2.8Å
237	F	88.9	Confident	85.6	Confident	67 Å²	67	41 Å²	41	29%	0.294	21%	0.207	S	C	.	.	H	α-helix	trans	-58.2	-55.7	173.3	178.5	-85.4	0	0	0	111.1	F202 A206 L233 V234 V235 V239 Y240 F241 F254	F202-F237 HydrophobicContact CZ-CE1 4.18Å; F202-F237 HydrophobicContact CZ-CZ 4.1Å; A206-F237 HydrophobicContact CB-CE1 3.8Å; L233-F237 WeakPolarHBondContact O-CB 3.14Å; L233-F237 PolarHBondContact O-N 3.2Å; V234-F237 WeakPolarHBondContact O-CB 3.35Å; V234-F237 PolarHBondContact O-N 2.95Å; V235-F237 VanDerWaalsContact C-N 3.27Å; V235-F237 PolarHBondContact O-N 3.49Å; F237-V239 PolarHBondContact O-N 3.46Å; F237-Y240 PolarHBondContact O-N 3.3Å; F237-F241 AromaticContact CD1-CD2 3.88Å; F237-F241 HydrophobicContact CD1-CD2 3.88Å; F237-F241 HydrophobicContact CD1-CE2 4.29Å; F237-F241 AromaticContact CD2-CD2 3.78Å; F237-F241 HydrophobicContact CD2-CD2 3.78Å; F237-F241 AromaticContact CD2-CE2 3.39Å; F237-F241 HydrophobicContact CD2-CE2 3.39Å; F237-F241 AromaticContact CE1-CD2 3.72Å; F237-F241 HydrophobicContact CE1-CD2 3.72Å; F237-F241 AromaticContact CE1-CE2 3.98Å; F237-F241 HydrophobicContact CE1-CE2 3.98Å; F237-F241 AromaticContact CE2-CD2 3.66Å; F237-F241 HydrophobicContact CE2-CD2 3.66Å; F237-F241 AromaticContact CE2-CE2 3.05Å; F237-F241 HydrophobicContact CE2-CE2 3.05Å; F237-F241 AromaticContact CE2-CZ 3.9Å; F237-F241 HydrophobicContact CE2-CZ 3.9Å; F237-F241 AromaticContact CG-CD2 3.89Å; F237-F241 HydrophobicContact CG-CD2 3.89Å; F237-F241 HydrophobicContact CG-CE2 4Å; F237-F241 AromaticContact CZ-CD2 3.6Å; F237-F241 HydrophobicContact CZ-CD2 3.6Å; F237-F241 AromaticContact CZ-CE2 3.36Å; F237-F241 HydrophobicContact CZ-CE2 3.36Å; F237-F241 HydrophobicContact CZ-CZ 4.12Å; F237-F241 VanDerWaalsContact O-CD2 3.24Å; F237-F241 WeakPolarHBondContact O-CD2 3.33Å; F237-F241 PolarHBondContact O-N 3.32Å; F237-F254 HydrophobicContact CZ-CE2 4.41Å; F237-F254 HydrophobicContact CZ-CZ 4.44Å
238	F	87.8	Confident	84.8	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-60	-44.2	-179.6	-82.5	-69.6	0	0	0	113.1	E124 T128 A206 C207 A210 V234 V235 K242	E124-F238 HydrophobicContact CB-CB 4.22Å; T128-F238 WeakPolarHBondContact OG1-CD2 3.29Å; A206-F238 HydrophobicContact CB-CD1 4.33Å; A206-F238 HydrophobicContact CB-CE1 3.51Å; A206-F238 HydrophobicContact CB-CZ 3.91Å; C207-F238 HydrophobicContact CB-CZ 4.41Å; A210-F238 HydrophobicContact CB-CE2 3.86Å; A210-F238 HydrophobicContact CB-CZ 4.16Å; V234-F238 HydrophobicContact CG1-CD2 3.8Å; V234-F238 HydrophobicContact CG1-CE2 3.64Å; V234-F238 VanDerWaalsContact O-CD2 3.28Å; V234-F238 WeakPolarHBondContact O-CD2 3.24Å; V234-F238 PolarHBondContact O-N 2.93Å; V235-F238 PolarHBondContact O-N 3.39Å; F238-K242 VanDerWaalsContact O-CB 3.28Å; F238-K242 WeakPolarHBondContact O-CB 3.38Å; F238-K242 PolarHBondContact O-N 3.45Å
239	V	88	Confident	83.7	Confident	31 Å²	31	47.2 Å²	47.2	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-47.1	178.3	172.5	0	0	0	0	110.6	M121 E124 V125 V235 F237 F241 K242 L243	M121-V239 HydrophobicContact CB-CG1 4.4Å; M121-V239 HydrophobicContact CG-CG1 4.05Å; M121-V239 HydrophobicContact SD-CG1 4.06Å; E124-V239 HydrophobicContact CB-CG2 3.98Å; V125-V239 HydrophobicContact CG2-CG2 4.27Å; V235-V239 HydrophobicContact CG1-CG2 4.17Å; V235-V239 WeakPolarHBondContact O-CB 3.46Å; V235-V239 WeakPolarHBondContact O-CG2 3.33Å; V235-V239 PolarHBondContact O-N 3.32Å; F237-V239 PolarHBondContact O-N 3.46Å; V239-F241 PolarHBondContact O-N 3.04Å; V239-K242 PolarHBondContact O-N 3.4Å; V239-L243 VanDerWaalsContact O-CB 3.28Å; V239-L243 WeakPolarHBondContact O-CB 3.27Å; V239-L243 PolarHBondContact O-N 2.97Å
240	Y	86.1	Confident	82.4	Confident	148 Å²	148	50.2 Å²	50.2	58%	0.58	25%	0.25	S	S	*	.	H	α-helix	trans	-59.2	-48.7	178.8	172.9	-97.6	0	0	0	112.1	S236 F237 K242 L243 S244	S236-Y240 WeakPolarHBondContact O-CB 3.39Å; S236-Y240 PolarHBondContact O-N 2.8Å; F237-Y240 PolarHBondContact O-N 3.3Å; Y240-K242 VanDerWaalsContact C-N 3.34Å; Y240-K242 PolarHBondContact O-N 2.85Å; Y240-L243 PolarHBondContact O-N 2.96Å; Y240-S244 WeakPolarHBondContact O-CB 3.33Å; Y240-S244 PolarHBondContact O-N 2.88Å; Y240-S244 PolarHBondContact O-OG 3.08Å
241	F	80.9	Confident	81	Confident	45 Å²	45	57 Å²	57	20%	0.197	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-38.8	179.4	-85.1	-75.9	0	0	0	111.9	F202 F237 V239 S244 S245 P253	F202-F241 HydrophobicContact CE1-CB 3.59Å; F202-F241 AromaticContact CE1-CD1 3.88Å; F202-F241 HydrophobicContact CE1-CD1 3.88Å; F202-F241 HydrophobicContact CE1-CD2 4.29Å; F202-F241 AromaticContact CE1-CG 3.64Å; F202-F241 HydrophobicContact CE1-CG 3.64Å; F202-F241 AromaticContact CE2-CD1 3.74Å; F202-F241 HydrophobicContact CE2-CD1 3.74Å; F202-F241 AromaticContact CE2-CE1 3.84Å; F202-F241 HydrophobicContact CE2-CE1 3.84Å; F202-F241 HydrophobicContact CE2-CG 4.23Å; F202-F241 HydrophobicContact CE2-CZ 4.45Å; F202-F241 HydrophobicContact CZ-CB 3.78Å; F202-F241 AromaticContact CZ-CD1 3.2Å; F202-F241 HydrophobicContact CZ-CD1 3.2Å; F202-F241 AromaticContact CZ-CD2 3.73Å; F202-F241 HydrophobicContact CZ-CD2 3.73Å; F202-F241 AromaticContact CZ-CE1 3.63Å; F202-F241 HydrophobicContact CZ-CE1 3.63Å; F202-F241 HydrophobicContact CZ-CE2 4.16Å; F202-F241 AromaticContact CZ-CG 3.25Å; F202-F241 HydrophobicContact CZ-CG 3.25Å; F202-F241 HydrophobicContact CZ-CZ 4.09Å; F237-F241 AromaticContact CD1-CD2 3.88Å; F237-F241 HydrophobicContact CD1-CD2 3.88Å; F237-F241 HydrophobicContact CD1-CE2 4.29Å; F237-F241 AromaticContact CD2-CD2 3.78Å; F237-F241 HydrophobicContact CD2-CD2 3.78Å; F237-F241 AromaticContact CD2-CE2 3.39Å; F237-F241 HydrophobicContact CD2-CE2 3.39Å; F237-F241 AromaticContact CE1-CD2 3.72Å; F237-F241 HydrophobicContact CE1-CD2 3.72Å; F237-F241 AromaticContact CE1-CE2 3.98Å; F237-F241 HydrophobicContact CE1-CE2 3.98Å; F237-F241 AromaticContact CE2-CD2 3.66Å; F237-F241 HydrophobicContact CE2-CD2 3.66Å; F237-F241 AromaticContact CE2-CE2 3.05Å; F237-F241 HydrophobicContact CE2-CE2 3.05Å; F237-F241 AromaticContact CE2-CZ 3.9Å; F237-F241 HydrophobicContact CE2-CZ 3.9Å; F237-F241 AromaticContact CG-CD2 3.89Å; F237-F241 HydrophobicContact CG-CD2 3.89Å; F237-F241 HydrophobicContact CG-CE2 4Å; F237-F241 AromaticContact CZ-CD2 3.6Å; F237-F241 HydrophobicContact CZ-CD2 3.6Å; F237-F241 AromaticContact CZ-CE2 3.36Å; F237-F241 HydrophobicContact CZ-CE2 3.36Å; F237-F241 HydrophobicContact CZ-CZ 4.12Å; F237-F241 VanDerWaalsContact O-CD2 3.24Å; F237-F241 WeakPolarHBondContact O-CD2 3.33Å; F237-F241 PolarHBondContact O-N 3.32Å; V239-F241 PolarHBondContact O-N 3.04Å; F241-S244 PolarHBondContact O-N 2.89Å; F241-S245 WeakPolarHBondContact O-CB 3.36Å; F241-S245 PolarHBondContact O-N 2.78Å; F241-P253 HydrophobicContact CD1-CG 4.15Å; F241-P253 HydrophobicContact CE1-CG 3.59Å
242	K	80.1	Confident	79.5	Confident	29 Å²	29	60.1 Å²	60.1	13%	0.126	29%	0.292	C	S	.	.	H	α-helix	trans	-68.7	-39.4	177.2	180	52	86.1	-168.9	0	111.8	T120 E124 D166 F238 V239 Y240 S244 S245 V246	T120-K242 HydrophobicContact CG2-CD 3.54Å; T120-K242 HydrophobicContact CG2-CG 3.38Å; E124-K242 HydrophobicContact CG-CB 3.67Å; E124-K242 HydrophobicContact CG-CG 3.75Å; D166-K242 IonicContact OD1-NZ 3.19Å; D166-K242 PolarHBondContact OD1-NZ 3.31Å; D166-K242 IonicContact OD2-NZ 2.75Å; D166-K242 PolarHBondContact OD2-NZ 3.4Å; F238-K242 VanDerWaalsContact O-CB 3.28Å; F238-K242 WeakPolarHBondContact O-CB 3.38Å; F238-K242 PolarHBondContact O-N 3.45Å; V239-K242 PolarHBondContact O-N 3.4Å; Y240-K242 VanDerWaalsContact C-N 3.34Å; Y240-K242 PolarHBondContact O-N 2.85Å; K242-S244 VanDerWaalsContact C-N 3.29Å; K242-S244 PolarHBondContact O-N 3.39Å; K242-S245 PolarHBondContact O-N 3.45Å; K242-V246 HydrophobicContact CD-CG2 3.9Å; K242-V246 WeakPolarHBondContact O-CB 3.24Å; K242-V246 VanDerWaalsContact O-CG2 3.28Å; K242-V246 WeakPolarHBondContact O-CG2 3.2Å; K242-V246 PolarHBondContact O-N 3.24Å
243	L	80	Confident	78.1	Confident	54 Å²	54	61.1 Å²	61.1	28%	0.283	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-43.5	172.3	-166.3	76.5	0	0	0	110.7	L117 M121 V239 Y240 V246 I247	L117-L243 HydrophobicContact CD1-CD1 3.65Å; L117-L243 HydrophobicContact CD2-CD1 4.09Å; L117-L243 HydrophobicContact CG-CD1 4.04Å; M121-L243 HydrophobicContact SD-CD1 4.02Å; V239-L243 VanDerWaalsContact O-CB 3.28Å; V239-L243 WeakPolarHBondContact O-CB 3.27Å; V239-L243 PolarHBondContact O-N 2.97Å; Y240-L243 PolarHBondContact O-N 2.96Å; L243-V246 PolarHBondContact O-N 3.11Å; L243-I247 HydrophobicContact CD1-CD1 3.85Å; L243-I247 HydrophobicContact CD2-CD1 4.31Å; L243-I247 HydrophobicContact CG-CD1 3.72Å; L243-I247 HydrophobicContact CG-CG1 4.42Å; L243-I247 WeakPolarHBondContact O-CB 3.16Å; L243-I247 WeakPolarHBondContact O-CG1 3.43Å; L243-I247 PolarHBondContact O-N 3.47Å
244	S	76.6	Confident	76.8	Confident	14 Å²	14	59.3 Å²	59.3	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-42	179.1	-59.5	0	0	0	0	112.5	Y240 F241 K242 F248	Y240-S244 WeakPolarHBondContact O-CB 3.33Å; Y240-S244 PolarHBondContact O-N 2.88Å; Y240-S244 PolarHBondContact O-OG 3.08Å; F241-S244 PolarHBondContact O-N 2.89Å; K242-S244 VanDerWaalsContact C-N 3.29Å; K242-S244 PolarHBondContact O-N 3.39Å; S244-F248 WeakPolarHBondContact O-CA 3.49Å; S244-F248 WeakPolarHBondContact O-CB 3.18Å; S244-F248 PolarHBondContact O-N 3.36Å
245	S	73.9	Confident	75.7	Confident	21 Å²	21	62.4 Å²	62.4	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-64.1	-43.4	174.7	165.1	0	0	0	0	111.4	D166 F241 K242 N249	D166-S245 PolarHBondContact OD1-OG 2.89Å; D166-S245 PolarHBondContact OD2-OG 3.22Å; D166-S245 VanDerWaalsContact OD2-OG 3.13Å; F241-S245 WeakPolarHBondContact O-CB 3.36Å; F241-S245 PolarHBondContact O-N 2.78Å; K242-S245 PolarHBondContact O-N 3.45Å; S245-N249 VanDerWaalsContact O-CA 3.24Å; S245-N249 WeakPolarHBondContact O-CA 3.41Å; S245-N249 PolarHBondContact O-N 3.12Å; S245-N249 VanDerWaalsContact O-N 3.11Å
246	V	74.9	Confident	74.5	Confident	35 Å²	35	66 Å²	66	21%	0.212	33%	0.328	C	S	.	.	H	α-helix	trans	-71.6	-38.4	-178.4	173.9	0	0	0	0	112.8	F113 L117 K242 L243	F113-V246 HydrophobicContact CE2-CG1 3.81Å; F113-V246 HydrophobicContact CZ-CG1 4.27Å; L117-V246 HydrophobicContact CD1-CB 4.27Å; L117-V246 HydrophobicContact CD1-CG1 3.77Å; K242-V246 HydrophobicContact CD-CG2 3.9Å; K242-V246 WeakPolarHBondContact O-CB 3.24Å; K242-V246 VanDerWaalsContact O-CG2 3.28Å; K242-V246 WeakPolarHBondContact O-CG2 3.2Å; K242-V246 PolarHBondContact O-N 3.24Å; L243-V246 PolarHBondContact O-N 3.11Å
247	I	74.3	Confident	73.6	Confident	86 Å²	86	70.5 Å²	70.5	44%	0.441	34%	0.343	S	S	.	.	H	α-helix	trans	-87.5	-50.6	-176.5	-63.6	-179.1	0	0	0	111.7	L243	L243-I247 HydrophobicContact CD1-CD1 3.85Å; L243-I247 HydrophobicContact CD2-CD1 4.31Å; L243-I247 HydrophobicContact CG-CD1 3.72Å; L243-I247 HydrophobicContact CG-CG1 4.42Å; L243-I247 WeakPolarHBondContact O-CB 3.16Å; L243-I247 WeakPolarHBondContact O-CG1 3.43Å; L243-I247 PolarHBondContact O-N 3.47Å
248	F	71.3	Confident	72.6	Confident	143 Å²	143	70.2 Å²	70.2	63%	0.627	34%	0.342	S	S	*	.	H	α-helix	trans	-94.7	-5.4	-172.7	-61.8	-75.7	0	0	0	113.5	S244 I250	S244-F248 WeakPolarHBondContact O-CA 3.49Å; S244-F248 WeakPolarHBondContact O-CB 3.18Å; S244-F248 PolarHBondContact O-N 3.36Å; F248-I250 HydrophobicContact CB-CD1 3.61Å; F248-I250 HydrophobicContact CB-CG1 3.68Å; F248-I250 HydrophobicContact CG-CD1 4.27Å; F248-I250 PolarHBondContact O-N 3.46Å; F248-I250 VanDerWaalsContact O-N 3.07Å
249	N	66.1	Low	71.9	Confident	72 Å²	72	74.7 Å²	74.7	39%	0.385	37%	0.366	S	S	.	.			trans	53.2	28.4	-176.2	-159.2	12.2	0	0	0	112.7	S169 S245 R251	S169-N249 WeakPolarHBondContact CB-ND2 3.48Å; S169-N249 PolarHBondContact OG-ND2 3.15Å; S245-N249 VanDerWaalsContact O-CA 3.24Å; S245-N249 WeakPolarHBondContact O-CA 3.41Å; S245-N249 PolarHBondContact O-N 3.12Å; S245-N249 VanDerWaalsContact O-N 3.11Å; N249-R251 PolarHBondContact O-N 3.22Å
250	I	62.9	Low	71.1	Confident	95 Å²	95	78.1 Å²	78.1	49%	0.487	38%	0.383	S	S	.	.			trans	-77.3	114.3	176.4	-63.6	169	0	0	0	107	F248	F248-I250 HydrophobicContact CB-CD1 3.61Å; F248-I250 HydrophobicContact CB-CG1 3.68Å; F248-I250 HydrophobicContact CG-CD1 4.27Å; F248-I250 PolarHBondContact O-N 3.46Å; F248-I250 VanDerWaalsContact O-N 3.07Å
251	R	59.9	Low	70.6	Confident	155 Å²	155	76.2 Å²	76.2	59%	0.585	38%	0.378	S	S	*	.			trans	-76.9	-53.6	-166.3	-61.5	179.7	-162.6	166.6	2.6	113.3	N249	N249-R251 PolarHBondContact O-N 3.22Å
252	D	61.6	Low	70.1	Confident	68 Å²	68	76.1 Å²	76.1	36%	0.364	38%	0.383	S	S	.	.			trans	-154.7	99.3	-177.3	-77.1	-49.8	0	0	0	112.2	F202 F254 L255	F202-D252 WeakPolarHBondContact CB-OD1 3.4Å; D252-F254 PolarHBondContact O-N 3.06Å; D252-L255 HydrophobicContact CB-CB 3.98Å; D252-L255 WeakPolarHBondContact O-CB 3.5Å; D252-L255 PolarHBondContact O-N 3.27Å
253	P	61.7	Low	69.6	Low	52 Å²	52	76.2 Å²	76.2	34%	0.338	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.2	177.8	22.3	-25.9	0	0	0	113.4	F202 F241 P256	F202-P253 HydrophobicContact CD2-CG 4.3Å; F202-P253 HydrophobicContact CE2-CG 3.89Å; F241-P253 HydrophobicContact CD1-CG 4.15Å; F241-P253 HydrophobicContact CE1-CG 3.59Å; P253-P256 WeakPolarHBondContact O-CD 3.43Å
254	F	64.3	Low	69.4	Low	62 Å²	62	78 Å²	78	27%	0.272	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.8	176.5	-70.2	-60.9	0	0	0	114.4	F202 F237 D252 P256 F257 E258	F202-F254 AromaticContact CD2-CD2 3.43Å; F202-F254 HydrophobicContact CD2-CD2 3.43Å; F202-F254 VanDerWaalsContact CD2-CD2 3.43Å; F202-F254 AromaticContact CD2-CE2 3.84Å; F202-F254 HydrophobicContact CD2-CE2 3.84Å; F202-F254 AromaticContact CE2-CD2 3.25Å; F202-F254 HydrophobicContact CE2-CD2 3.25Å; F202-F254 AromaticContact CE2-CE2 3.18Å; F202-F254 HydrophobicContact CE2-CE2 3.18Å; F202-F254 HydrophobicContact CE2-CG 4.46Å; F202-F254 HydrophobicContact CE2-CZ 4.36Å; F202-F254 HydrophobicContact CZ-CD2 4.33Å; F202-F254 AromaticContact CZ-CE2 3.88Å; F202-F254 HydrophobicContact CZ-CE2 3.88Å; F237-F254 HydrophobicContact CZ-CE2 4.41Å; F237-F254 HydrophobicContact CZ-CZ 4.44Å; D252-F254 PolarHBondContact O-N 3.06Å; F254-P256 VanDerWaalsContact C-CD 3.5Å; F254-F257 HydrophobicContact CD1-CD2 4.31Å; F254-F257 WeakPolarHBondContact O-CB 3.37Å; F254-F257 PolarHBondContact O-N 2.96Å; F254-E258 PolarHBondContact O-N 3.02Å
255	L	69.4	Low	69.2	Low	79 Å²	79	84.3 Å²	84.3	41%	0.414	42%	0.423	S	S	.	.	H	α-helix	trans	-52.4	-44.5	-178.7	-168	62.8	0	0	0	114.2	D252 F257 E258 N259	D252-L255 HydrophobicContact CB-CB 3.98Å; D252-L255 WeakPolarHBondContact O-CB 3.5Å; D252-L255 PolarHBondContact O-N 3.27Å; L255-F257 VanDerWaalsContact C-N 3.33Å; L255-F257 PolarHBondContact O-N 2.78Å; L255-E258 PolarHBondContact O-N 3.46Å; L255-N259 WeakPolarHBondContact O-CB 3.23Å; L255-N259 VanDerWaalsContact O-CG 3.29Å; L255-N259 PolarHBondContact O-N 3.45Å; L255-N259 PolarHBondContact O-ND2 3.32Å
256	P	66.1	Low	69	Low	82 Å²	82	90.1 Å²	90.1	53%	0.532	45%	0.45	S	S	.	.	H	α-helix	trans	-63.7	-36.9	176.1	23.2	-34	0	0	0	113	P253 F254 L260	P253-P256 WeakPolarHBondContact O-CD 3.43Å; F254-P256 VanDerWaalsContact C-CD 3.5Å; P256-L260 WeakPolarHBondContact O-CB 3.32Å; P256-L260 PolarHBondContact O-N 3.23Å
257	F	71.3	Confident	68.8	Low	138 Å²	138	89.8 Å²	89.8	61%	0.605	45%	0.453	S	S	*	.	H	α-helix	trans	-69.7	-40.4	178.3	-65.2	-75.9	0	0	0	112.1	F254 L255 L260 F261	F254-F257 HydrophobicContact CD1-CD2 4.31Å; F254-F257 WeakPolarHBondContact O-CB 3.37Å; F254-F257 PolarHBondContact O-N 2.96Å; L255-F257 VanDerWaalsContact C-N 3.33Å; L255-F257 PolarHBondContact O-N 2.78Å; F257-L260 PolarHBondContact O-N 3.41Å; F257-F261 WeakPolarHBondContact O-CB 3.4Å; F257-F261 PolarHBondContact O-N 3.16Å
258	E	66.9	Low	68.6	Low	62 Å²	62	87.1 Å²	87.1	29%	0.29	45%	0.447	S	S	.	.	H	α-helix	trans	-64.1	-45.7	174.8	178.8	177	-143.7	0	0	111.4	K205 F254 L255 L260 F261 C262	K205-E258 IonicContact NZ-OE1 2.98Å; K205-E258 PolarHBondContact NZ-OE1 3Å; K205-E258 IonicContact NZ-OE2 2.58Å; K205-E258 PolarHBondContact NZ-OE2 2.97Å; F254-E258 PolarHBondContact O-N 3.02Å; L255-E258 PolarHBondContact O-N 3.46Å; E258-L260 VanDerWaalsContact C-N 3.27Å; E258-L260 PolarHBondContact O-N 3.04Å; E258-F261 PolarHBondContact O-N 3.48Å; E258-F261 VanDerWaalsContact O-N 3.17Å; E258-C262 WeakPolarHBondContact O-CB 3.25Å; E258-C262 PolarHBondContact O-N 3.12Å; E258-C262 PolarHBondContact O-SG 2.82Å; E258-C262 VanDerWaalsContact O-SG 3.42Å
259	N	73.2	Confident	68.7	Low	98 Å²	98	84.9 Å²	84.9	52%	0.524	44%	0.441	S	S	.	.	H	α-helix	trans	-60.7	-39.2	176.5	-73.2	-16.6	0	0	0	111.5	L255 A263	L255-N259 WeakPolarHBondContact O-CB 3.23Å; L255-N259 VanDerWaalsContact O-CG 3.29Å; L255-N259 PolarHBondContact O-N 3.45Å; L255-N259 PolarHBondContact O-ND2 3.32Å; N259-A263 WeakPolarHBondContact O-CB 3.22Å; N259-A263 PolarHBondContact O-N 3.26Å
260	L	72.5	Confident	68.7	Low	102 Å²	102	89.2 Å²	89.2	53%	0.534	45%	0.452	S	S	.	.	H	α-helix	trans	-65	-44.8	174.5	-176.4	64.5	0	0	0	111.7	P256 F257 E258 A263 I264	P256-L260 WeakPolarHBondContact O-CB 3.32Å; P256-L260 PolarHBondContact O-N 3.23Å; F257-L260 PolarHBondContact O-N 3.41Å; E258-L260 VanDerWaalsContact C-N 3.27Å; E258-L260 PolarHBondContact O-N 3.04Å; L260-A263 WeakPolarHBondContact O-CB 3.27Å; L260-A263 PolarHBondContact O-N 3.48Å; L260-I264 HydrophobicContact CD1-CD1 3.82Å; L260-I264 HydrophobicContact CD1-CG1 4.31Å; L260-I264 HydrophobicContact CG-CD1 3.81Å; L260-I264 VanDerWaalsContact O-CG1 3.27Å; L260-I264 WeakPolarHBondContact O-CG1 3.34Å; L260-I264 PolarHBondContact O-N 3.25Å
261	F	75.1	Confident	69.3	Low	108 Å²	108	89.4 Å²	89.4	47%	0.474	45%	0.454	S	S	.	.	H	α-helix	trans	-62.5	-46.6	177.3	-177	-92	0	0	0	111.8	F257 E258 A263 I264 F265	F257-F261 WeakPolarHBondContact O-CB 3.4Å; F257-F261 PolarHBondContact O-N 3.16Å; E258-F261 PolarHBondContact O-N 3.48Å; E258-F261 VanDerWaalsContact O-N 3.17Å; F261-A263 VanDerWaalsContact C-N 3.31Å; F261-A263 PolarHBondContact O-N 3.47Å; F261-I264 PolarHBondContact O-N 2.88Å; F261-F265 AromaticContact CD2-CD2 3.4Å; F261-F265 HydrophobicContact CD2-CD2 3.4Å; F261-F265 AromaticContact CD2-CE2 3.78Å; F261-F265 HydrophobicContact CD2-CE2 3.78Å; F261-F265 HydrophobicContact CD2-CG 4.37Å; F261-F265 HydrophobicContact CE1-CB 4.25Å; F261-F265 HydrophobicContact CE1-CD2 4.48Å; F261-F265 HydrophobicContact CE2-CB 4.39Å; F261-F265 AromaticContact CE2-CD2 3.29Å; F261-F265 HydrophobicContact CE2-CD2 3.29Å; F261-F265 AromaticContact CE2-CE2 3.66Å; F261-F265 HydrophobicContact CE2-CE2 3.66Å; F261-F265 AromaticContact CE2-CG 3.94Å; F261-F265 HydrophobicContact CE2-CG 3.94Å; F261-F265 HydrophobicContact CG-CD2 4.07Å; F261-F265 HydrophobicContact CZ-CB 4.11Å; F261-F265 AromaticContact CZ-CD2 3.89Å; F261-F265 HydrophobicContact CZ-CD2 3.89Å; F261-F265 HydrophobicContact CZ-CG 4.09Å; F261-F265 PolarHBondContact O-N 3.2Å
262	C	70.4	Confident	69.9	Low	44 Å²	44	84.8 Å²	84.8	30%	0.297	45%	0.449	S	S	.	.	H	α-helix	trans	-62.5	-38.5	175.3	-71.8	0	0	0	0	111.8	E258 M266 G268	E258-C262 WeakPolarHBondContact O-CB 3.25Å; E258-C262 PolarHBondContact O-N 3.12Å; E258-C262 PolarHBondContact O-SG 2.82Å; E258-C262 VanDerWaalsContact O-SG 3.42Å; C262-M266 CarbonylContact O-C 3.57Å; C262-M266 WeakPolarHBondContact O-CA 3.32Å; C262-M266 WeakPolarHBondContact O-CB 3.34Å; C262-M266 PolarHBondContact O-N 2.99Å; C262-M266 VanDerWaalsContact O-N 3.08Å; C262-G268 PolarHBondContact O-N 3.4Å
263	A	69.6	Low	70.7	Confident	30 Å²	30	85.7 Å²	85.7	25%	0.248	45%	0.453	C	S	.	.	H	α-helix	trans	-61.1	-48.3	174.3	0	0	0	0	0	111.3	N259 L260 F261 G268 I269	N259-A263 WeakPolarHBondContact O-CB 3.22Å; N259-A263 PolarHBondContact O-N 3.26Å; L260-A263 WeakPolarHBondContact O-CB 3.27Å; L260-A263 PolarHBondContact O-N 3.48Å; F261-A263 VanDerWaalsContact C-N 3.31Å; F261-A263 PolarHBondContact O-N 3.47Å; A263-G268 PolarHBondContact O-N 2.87Å; A263-I269 HydrophobicContact CB-CG1 4.2Å; A263-I269 WeakPolarHBondContact O-CB 3.42Å; A263-I269 WeakPolarHBondContact O-CG1 3.33Å; A263-I269 PolarHBondContact O-N 3.34Å
264	I	74.8	Confident	71.5	Confident	91 Å²	91	86.2 Å²	86.2	47%	0.467	45%	0.453	S	S	.	.	H	α-helix	trans	-73.4	-52.6	-175.3	-65.1	168.5	0	0	0	112	L260 F261 I269	L260-I264 HydrophobicContact CD1-CD1 3.82Å; L260-I264 HydrophobicContact CD1-CG1 4.31Å; L260-I264 HydrophobicContact CG-CD1 3.81Å; L260-I264 VanDerWaalsContact O-CG1 3.27Å; L260-I264 WeakPolarHBondContact O-CG1 3.34Å; L260-I264 PolarHBondContact O-N 3.25Å; F261-I264 PolarHBondContact O-N 2.88Å; I264-I269 HydrophobicContact CB-CD1 4.45Å; I264-I269 HydrophobicContact CG1-CD1 4.01Å
265	F	73.9	Confident	72.3	Confident	147 Å²	147	92.1 Å²	92.1	65%	0.645	47%	0.474	S	S	*	.	H	α-helix	trans	-98.7	-31.3	-167.5	-69.4	-79.8	0	0	0	114.1	F261 G267	F261-F265 AromaticContact CD2-CD2 3.4Å; F261-F265 HydrophobicContact CD2-CD2 3.4Å; F261-F265 AromaticContact CD2-CE2 3.78Å; F261-F265 HydrophobicContact CD2-CE2 3.78Å; F261-F265 HydrophobicContact CD2-CG 4.37Å; F261-F265 HydrophobicContact CE1-CB 4.25Å; F261-F265 HydrophobicContact CE1-CD2 4.48Å; F261-F265 HydrophobicContact CE2-CB 4.39Å; F261-F265 AromaticContact CE2-CD2 3.29Å; F261-F265 HydrophobicContact CE2-CD2 3.29Å; F261-F265 AromaticContact CE2-CE2 3.66Å; F261-F265 HydrophobicContact CE2-CE2 3.66Å; F261-F265 AromaticContact CE2-CG 3.94Å; F261-F265 HydrophobicContact CE2-CG 3.94Å; F261-F265 HydrophobicContact CG-CD2 4.07Å; F261-F265 HydrophobicContact CZ-CB 4.11Å; F261-F265 AromaticContact CZ-CD2 3.89Å; F261-F265 HydrophobicContact CZ-CD2 3.89Å; F261-F265 HydrophobicContact CZ-CG 4.09Å; F261-F265 PolarHBondContact O-N 3.2Å; F265-G267 VanDerWaalsContact C-N 3.33Å
266	M	69.4	Low	72.7	Confident	143 Å²	143	90.8 Å²	90.8	70%	0.704	47%	0.474	S	S	*	.	S	Bend	trans	-95.3	16.6	-177.4	-63.9	-164.2	171.6	0	0	113.5	C262 G268	C262-M266 CarbonylContact O-C 3.57Å; C262-M266 WeakPolarHBondContact O-CA 3.32Å; C262-M266 WeakPolarHBondContact O-CB 3.34Å; C262-M266 PolarHBondContact O-N 2.99Å; C262-M266 VanDerWaalsContact O-N 3.08Å; M266-G268 VanDerWaalsContact C-N 3.35Å; M266-G268 PolarHBondContact O-N 3.4Å
267	G	69.6	Low	73.6	Confident	28 Å²	28	89.9 Å²	89.9	29%	0.289	47%	0.467	S	S	.	.	S	Bend	trans	80.1	10.1	175.1	0	0	0	0	0	114.7	F265 I269 W270 D271	F265-G267 VanDerWaalsContact C-N 3.33Å; G267-I269 PolarHBondContact O-N 3.32Å; G267-W270 CarbonylContact O-C 3.56Å; G267-W270 WeakPolarHBondContact O-CA 3.43Å; G267-W270 WeakPolarHBondContact O-CB 3.49Å; G267-W270 PolarHBondContact O-N 3.27Å; G267-D271 PolarHBondContact O-N 3.48Å
268	G	71.3	Confident	74.1	Confident	30 Å²	30	87.9 Å²	87.9	31%	0.309	46%	0.462	S	S	.	.	H	α-helix	trans	-60.9	-31.2	175.9	0	0	0	0	0	113.1	C262 A263 M266 A272	C262-G268 PolarHBondContact O-N 3.4Å; A263-G268 PolarHBondContact O-N 2.87Å; M266-G268 VanDerWaalsContact C-N 3.35Å; M266-G268 PolarHBondContact O-N 3.4Å; G268-A272 VanDerWaalsContact O-CB 3.25Å; G268-A272 WeakPolarHBondContact O-CB 3.46Å; G268-A272 PolarHBondContact O-N 3.28Å
269	I	71.8	Confident	74.8	Confident	97 Å²	97	87.9 Å²	87.9	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-65.7	-40.1	169.2	-69.6	166.9	0	0	0	110.8	A263 I264 G267 A272 L273	A263-I269 HydrophobicContact CB-CG1 4.2Å; A263-I269 WeakPolarHBondContact O-CB 3.42Å; A263-I269 WeakPolarHBondContact O-CG1 3.33Å; A263-I269 PolarHBondContact O-N 3.34Å; I264-I269 HydrophobicContact CB-CD1 4.45Å; I264-I269 HydrophobicContact CG1-CD1 4.01Å; G267-I269 PolarHBondContact O-N 3.32Å; I269-A272 PolarHBondContact O-N 3.48Å; I269-L273 WeakPolarHBondContact O-CB 3.26Å; I269-L273 PolarHBondContact O-N 2.96Å
270	W	68.1	Low	75.1	Confident	162 Å²	162	86.4 Å²	86.4	61%	0.614	46%	0.464	S	S	*	.	H	α-helix	trans	-67.2	-40.4	179	-165.4	-111.5	0	0	0	111.8	G267 L273 N274	G267-W270 CarbonylContact O-C 3.56Å; G267-W270 WeakPolarHBondContact O-CA 3.43Å; G267-W270 WeakPolarHBondContact O-CB 3.49Å; G267-W270 PolarHBondContact O-N 3.27Å; W270-L273 HydrophobicContact CE3-CD2 4Å; W270-L273 HydrophobicContact CZ3-CD2 3.87Å; W270-L273 PolarHBondContact O-N 3.31Å; W270-N274 VanDerWaalsContact CD1-ND2 3.33Å; W270-N274 PolarHBondContact NE1-ND2 3.11Å; W270-N274 WeakPolarHBondContact O-CB 3.18Å; W270-N274 VanDerWaalsContact O-CG 3.31Å; W270-N274 PolarHBondContact O-N 3.48Å; W270-N274 PolarHBondContact O-ND2 2.69Å
271	D	74.6	Confident	75.5	Confident	100 Å²	100	90.5 Å²	90.5	54%	0.535	47%	0.472	S	S	.	.	H	α-helix	trans	-67.3	-41.9	174.4	-81	-8.4	0	0	0	112.1	G267 L273 N274 R275	G267-D271 PolarHBondContact O-N 3.48Å; D271-L273 VanDerWaalsContact C-N 3.34Å; D271-N274 PolarHBondContact O-N 3.19Å; D271-R275 WeakPolarHBondContact O-CB 3.36Å; D271-R275 VanDerWaalsContact O-CG 3.31Å; D271-R275 WeakPolarHBondContact O-CG 3.28Å; D271-R275 PolarHBondContact O-N 2.62Å
272	A	73.1	Confident	75.6	Confident	58 Å²	58	91 Å²	91	48%	0.479	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-40.8	174.6	0	0	0	0	0	111.5	G268 I269 R275 A276	G268-A272 VanDerWaalsContact O-CB 3.25Å; G268-A272 WeakPolarHBondContact O-CB 3.46Å; G268-A272 PolarHBondContact O-N 3.28Å; I269-A272 PolarHBondContact O-N 3.48Å; A272-R275 PolarHBondContact O-N 2.75Å; A272-A276 WeakPolarHBondContact O-CB 3.44Å; A272-A276 PolarHBondContact O-N 3.07Å
273	L	77.3	Confident	75.9	Confident	86 Å²	86	97.7 Å²	97.7	45%	0.45	50%	0.495	S	S	.	.	H	α-helix	trans	-65.1	-46.9	175.5	-173.7	69.4	0	0	0	111	I269 W270 D271 R275 A276 V277	I269-L273 WeakPolarHBondContact O-CB 3.26Å; I269-L273 PolarHBondContact O-N 2.96Å; W270-L273 HydrophobicContact CE3-CD2 4Å; W270-L273 HydrophobicContact CZ3-CD2 3.87Å; W270-L273 PolarHBondContact O-N 3.31Å; D271-L273 VanDerWaalsContact C-N 3.34Å; L273-R275 VanDerWaalsContact C-N 3.33Å; L273-R275 PolarHBondContact O-N 3.38Å; L273-A276 PolarHBondContact O-N 2.94Å; L273-V277 HydrophobicContact CG-CG2 4.49Å; L273-V277 WeakPolarHBondContact O-CB 3.43Å; L273-V277 VanDerWaalsContact O-CG2 3.27Å; L273-V277 WeakPolarHBondContact O-CG2 3.31Å; L273-V277 PolarHBondContact O-N 3.46Å
274	N	79.9	Confident	76.1	Confident	64 Å²	64	105.5 Å²	105.5	34%	0.342	52%	0.518	S	S	.	.	H	α-helix	trans	-59.1	-44	176.5	-80.6	-28.3	0	0	0	111.4	W270 D271 V277 I278	W270-N274 VanDerWaalsContact CD1-ND2 3.33Å; W270-N274 PolarHBondContact NE1-ND2 3.11Å; W270-N274 WeakPolarHBondContact O-CB 3.18Å; W270-N274 VanDerWaalsContact O-CG 3.31Å; W270-N274 PolarHBondContact O-N 3.48Å; W270-N274 PolarHBondContact O-ND2 2.69Å; D271-N274 PolarHBondContact O-N 3.19Å; N274-V277 PolarHBondContact O-N 3.41Å; N274-I278 WeakPolarHBondContact O-CD1 3.38Å; N274-I278 WeakPolarHBondContact O-CG1 3.49Å; N274-I278 PolarHBondContact O-N 3.46Å
275	R	79.4	Confident	76.1	Confident	185 Å²	185	104.7 Å²	104.7	70%	0.698	52%	0.52	S	S	*	.	H	α-helix	trans	-61.5	-46.4	174.3	-74.8	174.2	-177.7	-96.1	0.7	111.7	D271 A272 L273 V277 I278 T279	D271-R275 WeakPolarHBondContact O-CB 3.36Å; D271-R275 VanDerWaalsContact O-CG 3.31Å; D271-R275 WeakPolarHBondContact O-CG 3.28Å; D271-R275 PolarHBondContact O-N 2.62Å; A272-R275 PolarHBondContact O-N 2.75Å; L273-R275 VanDerWaalsContact C-N 3.33Å; L273-R275 PolarHBondContact O-N 3.38Å; R275-V277 VanDerWaalsContact C-N 3.33Å; R275-V277 PolarHBondContact O-N 2.92Å; R275-I278 PolarHBondContact O-N 2.64Å; R275-T279 PolarHBondContact O-N 3.38Å; R275-T279 PolarHBondContact O-OG1 3.22Å; R275-T279 VanDerWaalsContact O-OG1 3.05Å
276	A	79.5	Confident	76	Confident	51 Å²	51	99.6 Å²	99.6	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-38.3	178.7	0	0	0	0	0	112.6	A272 L273 S280	A272-A276 WeakPolarHBondContact O-CB 3.44Å; A272-A276 PolarHBondContact O-N 3.07Å; L273-A276 PolarHBondContact O-N 2.94Å; A276-S280 VanDerWaalsContact O-CB 3.3Å; A276-S280 WeakPolarHBondContact O-CB 3.34Å; A276-S280 PolarHBondContact O-N 3.49Å; A276-S280 PolarHBondContact O-OG 3.34Å
277	V	83.3	Confident	75.6	Confident	64 Å²	64	98.1 Å²	98.1	39%	0.388	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-44.7	175.4	170.8	0	0	0	0	111	L273 N274 R275 S280 R281	L273-V277 HydrophobicContact CG-CG2 4.49Å; L273-V277 WeakPolarHBondContact O-CB 3.43Å; L273-V277 VanDerWaalsContact O-CG2 3.27Å; L273-V277 WeakPolarHBondContact O-CG2 3.31Å; L273-V277 PolarHBondContact O-N 3.46Å; N274-V277 PolarHBondContact O-N 3.41Å; R275-V277 VanDerWaalsContact C-N 3.33Å; R275-V277 PolarHBondContact O-N 2.92Å; V277-S280 PolarHBondContact O-N 3.23Å; V277-R281 WeakPolarHBondContact O-CG 3.25Å; V277-R281 PolarHBondContact O-N 3.22Å
278	I	81.9	Confident	75.1	Confident	95 Å²	95	102.9 Å²	102.9	49%	0.487	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-50	177	-68.4	164.3	0	0	0	110.3	N274 R275 S280 R281 E282	N274-I278 WeakPolarHBondContact O-CD1 3.38Å; N274-I278 WeakPolarHBondContact O-CG1 3.49Å; N274-I278 PolarHBondContact O-N 3.46Å; R275-I278 PolarHBondContact O-N 2.64Å; I278-S280 VanDerWaalsContact C-N 3.26Å; I278-S280 PolarHBondContact O-N 2.92Å; I278-R281 WeakPolarHBondContact O-CB 3.32Å; I278-R281 PolarHBondContact O-N 2.9Å; I278-R281 VanDerWaalsContact O-N 3.07Å; I278-E282 PolarHBondContact O-N 2.86Å
279	T	82.1	Confident	74.4	Confident	63 Å²	63	103.2 Å²	103.2	39%	0.387	52%	0.521	S	S	.	.	H	α-helix	trans	-62.1	-33.5	177.7	-54.7	0	0	0	0	112.5	R275 E282 R283	R275-T279 PolarHBondContact O-N 3.38Å; R275-T279 PolarHBondContact O-OG1 3.22Å; R275-T279 VanDerWaalsContact O-OG1 3.05Å; T279-E282 PolarHBondContact O-N 2.9Å; T279-R283 WeakPolarHBondContact O-CG 3.38Å; T279-R283 PolarHBondContact O-N 2.8Å
280	S	79.4	Confident	73.8	Confident	67 Å²	67	103.3 Å²	103.3	47%	0.469	53%	0.526	S	S	.	.	H	α-helix	trans	-68.7	-36.7	174.9	-61.9	0	0	0	0	112.4	A276 V277 I278 R284	A276-S280 VanDerWaalsContact O-CB 3.3Å; A276-S280 WeakPolarHBondContact O-CB 3.34Å; A276-S280 PolarHBondContact O-N 3.49Å; A276-S280 PolarHBondContact O-OG 3.34Å; V277-S280 PolarHBondContact O-N 3.23Å; I278-S280 VanDerWaalsContact C-N 3.26Å; I278-S280 PolarHBondContact O-N 2.92Å; S280-R284 PolarHBondContact O-N 2.85Å; S280-R284 VanDerWaalsContact O-N 3.11Å
281	R	80.6	Confident	73.3	Confident	188 Å²	188	99.5 Å²	99.5	71%	0.709	52%	0.52	S	S	*	.	H	α-helix	trans	-65.7	-45.4	173.6	-74.4	-178.7	176.2	-172.2	-0.5	111.1	V277 I278 R283 R284 S285	V277-R281 WeakPolarHBondContact O-CG 3.25Å; V277-R281 PolarHBondContact O-N 3.22Å; I278-R281 WeakPolarHBondContact O-CB 3.32Å; I278-R281 PolarHBondContact O-N 2.9Å; I278-R281 VanDerWaalsContact O-N 3.07Å; R281-R283 VanDerWaalsContact C-N 3.34Å; R281-R283 PolarHBondContact O-N 3.5Å; R281-R284 PolarHBondContact O-N 3.28Å; R281-R284 VanDerWaalsContact O-N 3.16Å; R281-S285 PolarHBondContact O-N 3.4Å; R281-S285 PolarHBondContact O-OG 2.85Å
282	E	78.5	Confident	72.3	Confident	118 Å²	118	100.6 Å²	100.6	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-59.9	-41.7	177	-71.2	172.9	170.2	0	0	112.3	I278 T279 S285 G286	I278-E282 PolarHBondContact O-N 2.86Å; T279-E282 PolarHBondContact O-N 2.9Å; E282-S285 WeakPolarHBondContact CA-OG 3.07Å; E282-S285 PolarHBondContact O-N 2.69Å; E282-S285 PolarHBondContact O-OG 3.12Å; E282-G286 PolarHBondContact O-N 2.9Å
283	R	76.7	Confident	71.3	Confident	185 Å²	185	105.4 Å²	105.4	70%	0.698	54%	0.539	S	S	*	.	H	α-helix	trans	-64.1	-41	174.2	-77.5	-175.5	-175.6	176.9	2.1	112.5	T279 R281 G286 I287	T279-R283 WeakPolarHBondContact O-CG 3.38Å; T279-R283 PolarHBondContact O-N 2.8Å; R281-R283 VanDerWaalsContact C-N 3.34Å; R281-R283 PolarHBondContact O-N 3.5Å; R283-G286 PolarHBondContact O-N 3.32Å; R283-I287 VanDerWaalsContact O-CG1 3.29Å; R283-I287 WeakPolarHBondContact O-CG1 3.47Å; R283-I287 PolarHBondContact O-N 3.31Å
284	R	73.8	Confident	70	Confident	194 Å²	194	105.1 Å²	105.1	73%	0.732	55%	0.549	S	S	*	.	H	α-helix	trans	-64.3	-43.4	177.1	-80	-173.6	-178.8	-174.9	1.1	112	S280 R281 G286 I287 Q288	S280-R284 PolarHBondContact O-N 2.85Å; S280-R284 VanDerWaalsContact O-N 3.11Å; R281-R284 PolarHBondContact O-N 3.28Å; R281-R284 VanDerWaalsContact O-N 3.16Å; R284-G286 VanDerWaalsContact C-N 3.33Å; R284-G286 PolarHBondContact O-N 3.1Å; R284-I287 PolarHBondContact O-N 3.38Å; R284-Q288 PolarHBondContact O-N 3.1Å
285	S	73.6	Confident	68.2	Low	73 Å²	73	107.6 Å²	107.6	51%	0.51	56%	0.562	S	S	.	*	H	α-helix	trans	-65	-37.4	175.6	49.4	0	0	0	0	112.2	R281 E282 G289	R281-S285 PolarHBondContact O-N 3.4Å; R281-S285 PolarHBondContact O-OG 2.85Å; E282-S285 WeakPolarHBondContact CA-OG 3.07Å; E282-S285 PolarHBondContact O-N 2.69Å; E282-S285 PolarHBondContact O-OG 3.12Å; S285-G289 PolarHBondContact O-N 2.85Å
286	G	71.5	Confident	66.8	Low	41 Å²	41	103.7 Å²	103.7	42%	0.423	56%	0.561	S	S	.	*	H	α-helix	trans	-64.2	-43	174.8	0	0	0	0	0	112.7	E282 R283 R284 G289 V290	E282-G286 PolarHBondContact O-N 2.9Å; R283-G286 PolarHBondContact O-N 3.32Å; R284-G286 VanDerWaalsContact C-N 3.33Å; R284-G286 PolarHBondContact O-N 3.1Å; G286-G289 PolarHBondContact O-N 3.47Å; G286-V290 WeakPolarHBondContact O-CG2 3.45Å; G286-V290 PolarHBondContact O-N 3.4Å
287	I	62.2	Low	65.3	Low	112 Å²	112	106.4 Å²	106.4	57%	0.574	58%	0.577	S	S	*	*	H	α-helix	trans	-66.5	-44.1	177.2	-66.1	165.6	0	0	0	110.7	R283 R284 G289 V290 T291	R283-I287 VanDerWaalsContact O-CG1 3.29Å; R283-I287 WeakPolarHBondContact O-CG1 3.47Å; R283-I287 PolarHBondContact O-N 3.31Å; R284-I287 PolarHBondContact O-N 3.38Å; I287-G289 VanDerWaalsContact C-N 3.3Å; I287-G289 PolarHBondContact O-N 3Å; I287-V290 PolarHBondContact O-N 3.3Å; I287-T291 PolarHBondContact O-N 3.2Å; I287-T291 PolarHBondContact O-OG1 3.21Å
288	Q	58.9	Low	63.5	Low	128 Å²	128	107.6 Å²	107.6	60%	0.598	59%	0.588	S	S	*	*	H	α-helix	trans	-58	-43.1	175.3	-89.5	177.3	-32.6	0	0	111.8	R284 V290 T291 D292	R284-Q288 PolarHBondContact O-N 3.1Å; Q288-V290 VanDerWaalsContact C-N 3.26Å; Q288-V290 PolarHBondContact O-N 2.83Å; Q288-T291 PolarHBondContact O-N 3.02Å; Q288-T291 VanDerWaalsContact O-N 3.16Å; Q288-D292 WeakPolarHBondContact O-CB 3.39Å; Q288-D292 PolarHBondContact O-N 3.32Å
289	G	56.9	Low	61.8	Low	36 Å²	36	110.3 Å²	110.3	37%	0.371	60%	0.602	S	S	.	*	H	α-helix	trans	-58.6	-34.3	174.2	0	0	0	0	0	114	S285 G286 I287 Q293	S285-G289 PolarHBondContact O-N 2.85Å; G286-G289 PolarHBondContact O-N 3.47Å; I287-G289 VanDerWaalsContact C-N 3.3Å; I287-G289 PolarHBondContact O-N 3Å; G289-Q293 WeakPolarHBondContact O-CG 3.44Å; G289-Q293 PolarHBondContact O-N 3.05Å
290	V	58.3	Low	60.1	Low	100 Å²	100	119 Å²	119	61%	0.606	63%	0.627	S	S	*	*	H	α-helix	trans	-75.7	-40.1	175.3	177.5	0	0	0	0	111.6	G286 I287 Q288 Q293 A294	G286-V290 WeakPolarHBondContact O-CG2 3.45Å; G286-V290 PolarHBondContact O-N 3.4Å; I287-V290 PolarHBondContact O-N 3.3Å; Q288-V290 VanDerWaalsContact C-N 3.26Å; Q288-V290 PolarHBondContact O-N 2.83Å; V290-Q293 PolarHBondContact O-N 2.94Å; V290-A294 PolarHBondContact O-N 3.09Å; V290-A294 VanDerWaalsContact O-N 3.13Å
291	T	57	Low	58.5	Low	81 Å²	81	125.5 Å²	125.5	50%	0.497	65%	0.65	S	S	.	*	H	α-helix	trans	-67.3	-37.8	177.2	-2.1	0	0	0	0	112.5	I287 Q288 Q293 A294 N295	I287-T291 PolarHBondContact O-N 3.2Å; I287-T291 PolarHBondContact O-OG1 3.21Å; Q288-T291 PolarHBondContact O-N 3.02Å; Q288-T291 VanDerWaalsContact O-N 3.16Å; T291-Q293 VanDerWaalsContact C-N 3.29Å; T291-Q293 PolarHBondContact O-N 3.49Å; T291-A294 PolarHBondContact O-N 2.82Å; T291-A294 VanDerWaalsContact O-N 3.13Å; T291-N295 PolarHBondContact O-N 2.9Å
292	D	54.1	Low	56.9	Low	123 Å²	123	121.1 Å²	121.1	66%	0.658	66%	0.655	S	S	*	*	H	α-helix	trans	-68.1	-31.2	177.2	-71.3	-21.2	0	0	0	111.5	Q288 A294	Q288-D292 WeakPolarHBondContact O-CB 3.39Å; Q288-D292 PolarHBondContact O-N 3.32Å; D292-A294 VanDerWaalsContact C-N 3.34Å
293	Q	52.1	Low	55.3	Low	160 Å²	160	125 Å²	125	75%	0.748	67%	0.669	S	S	*	*	H	α-helix	trans	-75.4	-20.7	172.1	-74.9	-174.3	-1.6	0	0	113.8	G289 V290 T291 P296	G289-Q293 WeakPolarHBondContact O-CG 3.44Å; G289-Q293 PolarHBondContact O-N 3.05Å; V290-Q293 PolarHBondContact O-N 2.94Å; T291-Q293 VanDerWaalsContact C-N 3.29Å; T291-Q293 PolarHBondContact O-N 3.49Å; Q293-P296 VanDerWaalsContact O-CD 3.26Å; Q293-P296 WeakPolarHBondContact O-CD 3.07Å
294	A	50.7	Low	53.6	Low	79 Å²	79	124.9 Å²	124.9	65%	0.653	67%	0.674	S	S	*	*	H	α-helix	trans	-85.3	-10.5	179.1	0	0	0	0	0	113.8	V290 T291 D292	V290-A294 PolarHBondContact O-N 3.09Å; V290-A294 VanDerWaalsContact O-N 3.13Å; T291-A294 PolarHBondContact O-N 2.82Å; T291-A294 VanDerWaalsContact O-N 3.13Å; D292-A294 VanDerWaalsContact C-N 3.34Å
295	N	42.1	Very low	52.2	Low	116 Å²	116	123.2 Å²	123.2	62%	0.62	68%	0.68	S	S	*	*			trans	-127.6	45.3	177.9	-156.6	16.6	0	0	0	117.6	T291	T291-N295 PolarHBondContact O-N 2.9Å
296	P	48.8	Very low	50.6	Low	104 Å²	104	132.5 Å²	132.5	68%	0.675	72%	0.715	S	S	*	*			trans	-85.2	-4.5	172.8	0.6	19.8	0	0	0	114	Q293	Q293-P296 VanDerWaalsContact O-CD 3.26Å; Q293-P296 WeakPolarHBondContact O-CD 3.07Å
297	S	49.3	Very low	49.6	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	73%	0.73	S	S	*	*	S	Bend	trans	-107.7	63.4	-172.4	58.3	0	0	0	0	113.3
298	S	45.1	Very low	48.9	Very low	89 Å²	89	138.4 Å²	138.4	62%	0.622	74%	0.738	S	S	*	*	S	Bend	trans	-156.7	-5.5	157.5	56.1	0	0	0	0	116.7
299	I	45.8	Very low	48.4	Very low	151 Å²	151	138.9 Å²	138.9	77%	0.774	75%	0.746	S	S	*	*	S	Bend	trans	-130.8	72.5	-175	-46.5	179.5	0	0	0	110.6
300	R	46.6	Very low	47.9	Very low	245 Å²	245	145 Å²	145	93%	0.925	77%	0.768	S	S	*	*	S	Bend	trans	-161.7	5.1	152	-113.7	167.9	-167.5	-157.4	2.7	118.1	A302	R300-A302 VanDerWaalsContact C-N 3.33Å
301	E	47	Very low	47.2	Very low	204 Å²	204	147.8 Å²	147.8	95%	0.953	78%	0.778	S	S	*	*	S	Bend	trans	-84.7	-2.2	169.8	-73.5	-170.5	161.2	0	0	114.2
302	A	46.4	Very low	46.6	Very low	97 Å²	97	152.3 Å²	152.3	80%	0.802	80%	0.796	S	S	*	*			trans	-116.4	68.7	-178.1	0	0	0	0	0	112.9	R300	R300-A302 VanDerWaalsContact C-N 3.33Å
303	K	44.7	Very low	46	Very low	198 Å²	198	154.4 Å²	154.4	86%	0.861	81%	0.806	S	S	*	*	S	Bend	trans	-166.4	80.1	149.2	-108.9	174	-178.3	-176.4	0	107
304	K	41	Very low	45.6	Very low	183 Å²	183	153.9 Å²	153.9	80%	0.796	81%	0.811	S	S	*	*				67.7	106	98	-90.4	-174	169.4	-177	0	110.5
305	D	43.9	Very low	45.1	Very low	160 Å²	160	160.2 Å²	160.2	86%	0.856	82%	0.824	S	S	*	*				42.2	75.7	73.4	-66.5	-29.7	0	0	0	110.5
306	Q	41	Very low	45.4	Very low	267 Å²	267	164.2 Å²	164.2	100%	1.248	84%	0.842	S	S	*	*			trans	-161.4	0	147.1	-109.2	175.8	-5	0	0	109.6

Retrieved 306 of 306 residues in 1286.3 ms (Link to these results)

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