A0A3Q0KU38_SCHMA Loading...

Innexin AlphaSync

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A3Q0KU38, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene inx, Length 541 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	60.5	Low	67.2	Low	183 Å²	183	110.4 Å²	110.4	90%	0.901	59%	0.591	S	S	*	*				0	-60.9	0	-102.6	167.3	160	0	0	112.1	A3 S4 E5	M1-A3 PolarHBondContact O-N 3.49Å; M1-S4 PolarHBondContact O-N 2.82Å; M1-S4 PolarHBondContact O-OG 3.04Å; M1-E5 WeakPolarHBondContact O-CB 3.34Å; M1-E5 WeakPolarHBondContact O-CG 3.42Å; M1-E5 PolarHBondContact O-N 3.41Å
2	V	76.1	Confident	66.4	Low	119 Å²	119	107.7 Å²	107.7	72%	0.721	59%	0.587	S	S	*	*	H	α-helix	trans	-59.1	-40.6	-177	-175.1	0	0	0	0	113.9	F6	V2-F6 WeakPolarHBondContact O-CB 3.37Å; V2-F6 PolarHBondContact O-N 3Å
3	A	70.6	Confident	65.4	Low	70 Å²	70	108.7 Å²	108.7	58%	0.579	58%	0.582	S	S	*	*	H	α-helix	trans	-69.1	-38.3	178.9	0	0	0	0	0	113.3	M1 L7	M1-A3 PolarHBondContact O-N 3.49Å; A3-L7 VanDerWaalsContact O-CB 3.3Å; A3-L7 WeakPolarHBondContact O-CB 2.98Å; A3-L7 WeakPolarHBondContact O-CG 3.39Å; A3-L7 PolarHBondContact O-N 2.97Å
4	S	74.9	Confident	64.8	Low	76 Å²	76	106.1 Å²	106.1	53%	0.531	58%	0.577	S	S	.	*	H	α-helix	trans	-73	-34.6	176.8	51.9	0	0	0	0	111.9	M1 G8	M1-S4 PolarHBondContact O-N 2.82Å; M1-S4 PolarHBondContact O-OG 3.04Å; S4-G8 PolarHBondContact O-N 3.49Å
5	E	76.3	Confident	64.2	Low	120 Å²	120	101.7 Å²	101.7	56%	0.561	56%	0.555	S	S	*	*	H	α-helix	trans	-69.4	-41.2	172.2	-73.5	176	174.7	0	0	111.3	M1 G8 Y9	M1-E5 WeakPolarHBondContact O-CB 3.34Å; M1-E5 WeakPolarHBondContact O-CG 3.42Å; M1-E5 PolarHBondContact O-N 3.41Å; E5-G8 CarbonylContact O-C 3.55Å; E5-G8 PolarHBondContact O-N 3.19Å; E5-Y9 WeakPolarHBondContact O-CB 3.5Å; E5-Y9 PolarHBondContact O-N 3.15Å
6	F	71.2	Confident	63.6	Low	139 Å²	139	102 Å²	102	61%	0.61	57%	0.565	S	S	*	*	H	α-helix	trans	-63	-45.7	172.9	-178.1	-99.5	0	0	0	111.2	V2 G8 Y9 V10	V2-F6 WeakPolarHBondContact O-CB 3.37Å; V2-F6 PolarHBondContact O-N 3Å; F6-G8 VanDerWaalsContact C-N 3.33Å; F6-G8 PolarHBondContact O-N 2.96Å; F6-Y9 PolarHBondContact O-N 2.69Å; F6-V10 HydrophobicContact CD1-CG2 4.01Å; F6-V10 HydrophobicContact CE1-CG2 3.66Å; F6-V10 HydrophobicContact CE2-CG2 4.2Å; F6-V10 HydrophobicContact CG-CG2 4.44Å; F6-V10 HydrophobicContact CZ-CG2 3.76Å; F6-V10 WeakPolarHBondContact O-CB 3.48Å; F6-V10 WeakPolarHBondContact O-CG2 3.04Å; F6-V10 PolarHBondContact O-N 3.44Å
7	L	66.8	Low	63.6	Low	106 Å²	106	102.6 Å²	102.6	56%	0.555	57%	0.567	S	S	*	*	H	α-helix	trans	-63.2	-38.7	174.3	-75.2	170.6	0	0	0	111.9	A3 V10 Q11	A3-L7 VanDerWaalsContact O-CB 3.3Å; A3-L7 WeakPolarHBondContact O-CB 2.98Å; A3-L7 WeakPolarHBondContact O-CG 3.39Å; A3-L7 PolarHBondContact O-N 2.97Å; L7-V10 PolarHBondContact O-N 2.86Å; L7-Q11 VanDerWaalsContact O-CB 3.31Å; L7-Q11 WeakPolarHBondContact O-CB 3.46Å; L7-Q11 WeakPolarHBondContact O-CG 3.3Å; L7-Q11 PolarHBondContact O-N 2.9Å
8	G	65.8	Low	64.1	Low	34 Å²	34	99.1 Å²	99.1	35%	0.351	55%	0.545	S	S	.	.	H	α-helix	trans	-63.8	-39.9	172.8	0	0	0	0	0	112	S4 E5 F6 Q11 S12	S4-G8 PolarHBondContact O-N 3.49Å; E5-G8 CarbonylContact O-C 3.55Å; E5-G8 PolarHBondContact O-N 3.19Å; F6-G8 VanDerWaalsContact C-N 3.33Å; F6-G8 PolarHBondContact O-N 2.96Å; G8-Q11 PolarHBondContact O-N 2.66Å; G8-S12 VanDerWaalsContact O-CB 3.27Å; G8-S12 WeakPolarHBondContact O-CB 3.46Å; G8-S12 PolarHBondContact O-N 3.44Å
9	Y	62.3	Low	64.8	Low	157 Å²	157	95.1 Å²	95.1	62%	0.616	52%	0.524	S	S	*	.	H	α-helix	trans	-69.4	-41.2	176.1	-138.2	-87.6	0	0	0	111.2	E5 F6 S12 F13	E5-Y9 WeakPolarHBondContact O-CB 3.5Å; E5-Y9 PolarHBondContact O-N 3.15Å; F6-Y9 PolarHBondContact O-N 2.69Å; Y9-S12 WeakPolarHBondContact CA-OG 3.43Å; Y9-S12 CarbonylContact O-C 3.44Å; Y9-S12 WeakPolarHBondContact O-CB 3.35Å; Y9-S12 PolarHBondContact O-N 3.47Å; Y9-S12 VanDerWaalsContact O-N 3.17Å; Y9-S12 PolarHBondContact O-OG 3.46Å; Y9-F13 AromaticContact CD1-CD2 4Å; Y9-F13 HydrophobicContact CD1-CD2 4Å; Y9-F13 AromaticContact CD1-CE2 3.85Å; Y9-F13 HydrophobicContact CD1-CE2 3.85Å; Y9-F13 HydrophobicContact CE1-CD2 4.44Å; Y9-F13 AromaticContact CE1-CE2 3.93Å; Y9-F13 HydrophobicContact CE1-CE2 3.93Å; Y9-F13 WeakPolarHBondContact O-CD2 3.31Å; Y9-F13 PolarHBondContact O-N 2.98Å
10	V	56.8	Low	65.6	Low	65 Å²	65	90.3 Å²	90.3	39%	0.394	50%	0.497	S	S	.	.	H	α-helix	trans	-66.9	-36.1	174.8	171.5	0	0	0	0	111.3	F6 L7 F13	F6-V10 HydrophobicContact CD1-CG2 4.01Å; F6-V10 HydrophobicContact CE1-CG2 3.66Å; F6-V10 HydrophobicContact CE2-CG2 4.2Å; F6-V10 HydrophobicContact CG-CG2 4.44Å; F6-V10 HydrophobicContact CZ-CG2 3.76Å; F6-V10 WeakPolarHBondContact O-CB 3.48Å; F6-V10 WeakPolarHBondContact O-CG2 3.04Å; F6-V10 PolarHBondContact O-N 3.44Å; L7-V10 PolarHBondContact O-N 2.86Å; V10-F13 WeakPolarHBondContact O-CB 3.38Å; V10-F13 PolarHBondContact O-N 3.37Å
11	Q	57.7	Low	66.6	Low	145 Å²	145	86 Å²	86	68%	0.678	47%	0.474	S	S	*	.	H	α-helix	trans	-69.6	-35	170.2	-79.6	-179.4	-17.1	0	0	112	L7 G8 F13	L7-Q11 VanDerWaalsContact O-CB 3.31Å; L7-Q11 WeakPolarHBondContact O-CB 3.46Å; L7-Q11 WeakPolarHBondContact O-CG 3.3Å; L7-Q11 PolarHBondContact O-N 2.9Å; G8-Q11 PolarHBondContact O-N 2.66Å; Q11-F13 VanDerWaalsContact C-N 3.28Å
12	S	57.7	Low	68	Low	78 Å²	78	77.3 Å²	77.3	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-70.2	-26.9	174.8	84.7	0	0	0	0	112.2	G8 Y9 S14	G8-S12 VanDerWaalsContact O-CB 3.27Å; G8-S12 WeakPolarHBondContact O-CB 3.46Å; G8-S12 PolarHBondContact O-N 3.44Å; Y9-S12 WeakPolarHBondContact CA-OG 3.43Å; Y9-S12 CarbonylContact O-C 3.44Å; Y9-S12 WeakPolarHBondContact O-CB 3.35Å; Y9-S12 PolarHBondContact O-N 3.47Å; Y9-S12 VanDerWaalsContact O-N 3.17Å; Y9-S12 PolarHBondContact O-OG 3.46Å; S12-S14 PolarHBondContact O-N 2.98Å
13	F	54	Low	68.7	Low	121 Å²	121	73 Å²	73	53%	0.531	40%	0.404	S	S	.	.	S	Bend	trans	-65.8	80.7	159.1	-92	-81	0	0	0	107.3	Y9 V10 Q11 V15	Y9-F13 AromaticContact CD1-CD2 4Å; Y9-F13 HydrophobicContact CD1-CD2 4Å; Y9-F13 AromaticContact CD1-CE2 3.85Å; Y9-F13 HydrophobicContact CD1-CE2 3.85Å; Y9-F13 HydrophobicContact CE1-CD2 4.44Å; Y9-F13 AromaticContact CE1-CE2 3.93Å; Y9-F13 HydrophobicContact CE1-CE2 3.93Å; Y9-F13 WeakPolarHBondContact O-CD2 3.31Å; Y9-F13 PolarHBondContact O-N 2.98Å; V10-F13 WeakPolarHBondContact O-CB 3.38Å; V10-F13 PolarHBondContact O-N 3.37Å; Q11-F13 VanDerWaalsContact C-N 3.28Å; F13-V15 HydrophobicContact CB-CG2 4.43Å; F13-V15 HydrophobicContact CD1-CG2 3.85Å; F13-V15 PolarHBondContact O-N 3.34Å
14	S	56.3	Low	69.7	Low	72 Å²	72	74 Å²	74	50%	0.503	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54	5.3	172.3	-179.5	0	0	0	0	113.5	S12 N17 F18	S12-S14 PolarHBondContact O-N 2.98Å; S14-N17 CarbonylContact O-C 3.57Å; S14-N17 PolarHBondContact O-N 3.47Å; S14-F18 PolarHBondContact O-N 3.29Å
15	V	56.8	Low	70.5	Confident	40 Å²	40	70.7 Å²	70.7	24%	0.242	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-47.7	177	176.1	0	0	0	0	110.4	F13 N17 Q31 I35	F13-V15 HydrophobicContact CB-CG2 4.43Å; F13-V15 HydrophobicContact CD1-CG2 3.85Å; F13-V15 PolarHBondContact O-N 3.34Å; V15-N17 VanDerWaalsContact C-N 3.33Å; V15-N17 PolarHBondContact O-N 3.48Å; V15-Q31 VanDerWaalsContact C-NE2 3.32Å; V15-Q31 HydrophobicContact CG1-CG 4.12Å; V15-Q31 VanDerWaalsContact CG1-NE2 3.29Å; V15-Q31 PolarHBondContact O-NE2 3.45Å; V15-I35 HydrophobicContact CB-CD1 4.31Å; V15-I35 HydrophobicContact CG1-CD1 3.37Å; V15-I35 HydrophobicContact CG2-CD1 3.89Å
16	C	54.6	Low	71.3	Confident	107 Å²	107	65 Å²	65	72%	0.723	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-27.3	179.2	-65	0	0	0	0	113
17	N	63.1	Low	72.2	Confident	112 Å²	112	60.1 Å²	60.1	60%	0.599	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	10.2	-178.3	-69.1	-30	0	0	0	113.5	S14 V15 V19	S14-N17 CarbonylContact O-C 3.57Å; S14-N17 PolarHBondContact O-N 3.47Å; V15-N17 VanDerWaalsContact C-N 3.33Å; V15-N17 PolarHBondContact O-N 3.48Å; N17-V19 PolarHBondContact O-N 3.05Å
18	F	72.1	Confident	73.5	Confident	40 Å²	40	55.1 Å²	55.1	18%	0.175	30%	0.301	C	S	.	.			trans	-65	108.1	179.3	179.8	-96.2	0	0	0	109.1	S14 R27 F30	S14-F18 PolarHBondContact O-N 3.29Å; F18-R27 PolarHBondContact O-NH1 3.03Å; F18-F30 HydrophobicContact CD1-CZ 4.2Å; F18-F30 HydrophobicContact CE1-CE2 4.26Å; F18-F30 AromaticContact CE1-CZ 3.79Å; F18-F30 HydrophobicContact CE1-CZ 3.79Å
19	V	77.3	Confident	74.8	Confident	22 Å²	22	53.5 Å²	53.5	13%	0.133	28%	0.284	C	S	.	.			trans	-102.2	123.1	173.2	-177.7	0	0	0	0	108.9	N17 I145 R146 N149 N376	N17-V19 PolarHBondContact O-N 3.05Å; V19-I145 HydrophobicContact CG1-CG2 3.83Å; V19-R146 WeakPolarHBondContact O-CG 3.27Å; V19-R146 PolarHBondContact O-NE 3.16Å; V19-N149 HydrophobicContact CB-CB 4.37Å; V19-N149 HydrophobicContact CG1-CB 3.89Å; V19-N149 WeakPolarHBondContact CG2-ND2 3.46Å; V19-N376 HydrophobicContact CG1-CB 4.1Å
20	G	80.8	Confident	76.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.258	C	S	.	.			trans	-148.4	173.5	-176.3	0	0	0	0	0	112.1	E22 N376	G20-E22 PolarHBondContact O-N 3.31Å; G20-N376 VanDerWaalsContact O-CG 3.29Å; G20-N376 PolarHBondContact O-ND2 3.17Å
21	F	87.4	Confident	77.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-78.1	54.9	179.8	-167.6	-101	0	0	0	112.5	W129 T133 L141 Q142 I145 L206 F368 I369 M372	F21-W129 AromaticContact CD1-CE2 3.92Å; F21-W129 HydrophobicContact CD1-CH2 4.29Å; F21-W129 AromaticContact CD1-CZ2 3.35Å; F21-W129 HydrophobicContact CD1-CZ2 3.35Å; F21-W129 AromaticContact CD1-NE1 4Å; F21-W129 AromaticContact CE1-CH2 3.9Å; F21-W129 HydrophobicContact CE1-CH2 3.9Å; F21-W129 AromaticContact CE1-CZ2 3.37Å; F21-W129 HydrophobicContact CE1-CZ2 3.37Å; F21-W129 PolarHBondContact O-NE1 3.45Å; F21-W129 VanDerWaalsContact O-NE1 3.09Å; F21-T133 HydrophobicContact CD1-CG2 4.27Å; F21-L141 HydrophobicContact CD1-CB 4.3Å; F21-L141 HydrophobicContact CD1-CD1 4.32Å; F21-L141 HydrophobicContact CD2-CB 3.93Å; F21-L141 HydrophobicContact CE1-CD1 3.86Å; F21-L141 HydrophobicContact CE2-CB 4.28Å; F21-L141 HydrophobicContact CE2-CD1 4.23Å; F21-L141 HydrophobicContact CG-CB 4.02Å; F21-L141 HydrophobicContact CZ-CD1 3.86Å; F21-Q142 HydrophobicContact CB-CG 4.03Å; F21-I145 HydrophobicContact CB-CD1 4.32Å; F21-I145 HydrophobicContact CD2-CD1 3.27Å; F21-I145 HydrophobicContact CD2-CG1 3.83Å; F21-I145 HydrophobicContact CE2-CD1 3.9Å; F21-I145 HydrophobicContact CG-CD1 4.2Å; F21-L206 HydrophobicContact CZ-CD2 4.29Å; F21-F368 AromaticContact CE1-CE1 3.73Å; F21-F368 HydrophobicContact CE1-CE1 3.73Å; F21-F368 HydrophobicContact CE1-CZ 4.42Å; F21-F368 HydrophobicContact CZ-CD1 4.15Å; F21-F368 AromaticContact CZ-CE1 3.59Å; F21-F368 HydrophobicContact CZ-CE1 3.59Å; F21-F368 HydrophobicContact CZ-CZ 4.48Å; F21-I369 HydrophobicContact CE2-CG1 4.42Å; F21-I369 HydrophobicContact CE2-CG2 4.49Å; F21-I369 HydrophobicContact CZ-CG1 4.21Å; F21-M372 HydrophobicContact CD2-CB 4.25Å; F21-M372 HydrophobicContact CE2-CB 3.74Å; F21-M372 HydrophobicContact CE2-CG 4.07Å; F21-M372 HydrophobicContact CZ-CB 4.19Å; F21-M372 HydrophobicContact CZ-CG 4.04Å
22	E	89.7	Confident	79.5	Confident	1 Å²	1	42 Å²	42	1%	0.005	23%	0.228	C	C	.	.	S	Bend	trans	-152.9	155	-168.8	-73.2	173.2	152.7	0	0	111.1	G20 D26 F30 R126 N376	G20-E22 PolarHBondContact O-N 3.31Å; E22-D26 HydrophobicContact CB-CB 4.13Å; E22-D26 HydrophobicContact CG-CB 4.43Å; E22-F30 VanDerWaalsContact CD-CE1 3.44Å; E22-F30 WeakPolarHBondContact OE2-CE1 3.31Å; E22-F30 WeakPolarHBondContact OE2-CZ 3.46Å; E22-R126 WeakPolarHBondContact OE1-CD 3.27Å; E22-R126 IonicContact OE1-CZ 3.47Å; E22-R126 IonicContact OE1-NE 3.56Å; E22-R126 PolarHBondContact OE1-NE 3.5Å; E22-R126 IonicContact OE1-NH1 3.48Å; E22-R126 PolarHBondContact OE1-NH1 3.13Å; E22-R126 IonicContact OE2-CZ 3.81Å; E22-R126 IonicContact OE2-NE 2.67Å; E22-R126 IonicContact OE2-NH1 3.23Å; E22-R126 PolarHBondContact OE2-NH1 3.01Å; E22-N376 PolarHBondContact O-ND2 2.78Å; E22-N376 PolarHBondContact O-OD1 3.48Å; E22-N376 VanDerWaalsContact O-OD1 3.12Å
23	D	91.2	Very high	81.3	Confident	28 Å²	28	38.2 Å²	38.2	15%	0.15	20%	0.202	C	C	.	.			trans	-87.3	165	174.8	-164.9	3.7	0	0	0	111.3	A25 D26 R27 W319	D23-A25 PolarHBondContact O-N 3.4Å; D23-D26 PolarHBondContact N-OD2 3.18Å; D23-D26 PolarHBondContact O-N 2.86Å; D23-R27 PolarHBondContact O-N 3.34Å; D23-R27 VanDerWaalsContact O-N 3.09Å; D23-W319 HydrophobicContact CB-CZ2 4.3Å; D23-W319 PolarHBondContact OD2-NE1 3.43Å
24	L	90.4	Very high	83.3	Confident	90 Å²	90	33.4 Å²	33.4	47%	0.471	18%	0.182	S	C	.	.	H	α-helix	trans	-53.9	-41.8	179.1	-179.4	67.2	0	0	0	112.2	D26 R27 A28 W32 M311	L24-D26 VanDerWaalsContact C-N 3.3Å; L24-D26 PolarHBondContact O-N 3.25Å; L24-R27 PolarHBondContact O-N 2.88Å; L24-A28 PolarHBondContact O-N 2.83Å; L24-W32 HydrophobicContact CD1-CH2 3.91Å; L24-W32 HydrophobicContact CD1-CZ2 3.97Å; L24-W32 HydrophobicContact CG-CH2 4.48Å; L24-M311 HydrophobicContact CD2-CE 4.27Å; L24-M311 HydrophobicContact CG-CE 4.43Å
25	A	92.7	Very high	85	Confident	7 Å²	7	33.5 Å²	33.5	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-62.6	-36.6	178.3	0	0	0	0	0	112.3	D23 A28 N29	D23-A25 PolarHBondContact O-N 3.4Å; A25-A28 PolarHBondContact O-N 3.47Å; A25-N29 PolarHBondContact O-N 3.34Å; A25-N29 PolarHBondContact O-ND2 2.95Å
26	D	92.3	Very high	86.9	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.011	17%	0.172	C	C	.	.	H	α-helix	trans	-71.1	-42.7	178.3	-54.8	-42	0	0	0	109.9	E22 D23 L24 A28 N29 F30 Y210 K214 Y217	E22-D26 HydrophobicContact CB-CB 4.13Å; E22-D26 HydrophobicContact CG-CB 4.43Å; D23-D26 PolarHBondContact N-OD2 3.18Å; D23-D26 PolarHBondContact O-N 2.86Å; L24-D26 VanDerWaalsContact C-N 3.3Å; L24-D26 PolarHBondContact O-N 3.25Å; D26-A28 VanDerWaalsContact C-N 3.3Å; D26-A28 PolarHBondContact O-N 2.8Å; D26-N29 WeakPolarHBondContact O-CB 3.19Å; D26-N29 PolarHBondContact O-N 3.25Å; D26-F30 WeakPolarHBondContact O-CD1 3.47Å; D26-F30 WeakPolarHBondContact O-CE1 3.45Å; D26-F30 PolarHBondContact O-N 3.32Å; D26-Y210 PolarHBondContact OD2-OH 2.88Å; D26-Y210 VanDerWaalsContact OD2-OH 3.06Å; D26-K214 IonicContact OD1-NZ 2.67Å; D26-K214 PolarHBondContact OD1-NZ 2.76Å; D26-K214 IonicContact OD2-NZ 3.67Å; D26-K214 PolarHBondContact OD2-NZ 3.28Å; D26-Y217 HydrophobicContact CB-CE2 4.11Å
27	R	91.6	Very high	88.8	Confident	36 Å²	36	27.7 Å²	27.7	14%	0.136	14%	0.137	C	C	.	.	H	α-helix	trans	-55.9	-44	173.2	-63	-179.9	-169.9	-175.4	-0.7	111.8	F18 D23 L24 N29 F30 Q31 W32 N376	F18-R27 PolarHBondContact O-NH1 3.03Å; D23-R27 PolarHBondContact O-N 3.34Å; D23-R27 VanDerWaalsContact O-N 3.09Å; L24-R27 PolarHBondContact O-N 2.88Å; R27-N29 PolarHBondContact O-N 3.36Å; R27-N29 VanDerWaalsContact O-N 3.16Å; R27-F30 HydrophobicContact CB-CE1 4.28Å; R27-F30 HydrophobicContact CB-CZ 4.42Å; R27-F30 HydrophobicContact CG-CE1 4.12Å; R27-F30 HydrophobicContact CG-CZ 4.15Å; R27-Q31 WeakPolarHBondContact O-CA 3.26Å; R27-Q31 WeakPolarHBondContact O-CB 3.37Å; R27-Q31 PolarHBondContact O-N 3.48Å; R27-W32 PolarHBondContact O-N 3.28Å; R27-N376 PolarHBondContact NH2-OD1 3.28Å
28	A	92.7	Very high	90.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-56.5	-33.6	176.5	0	0	0	0	0	112.8	L24 A25 D26 W32 N33 V308	L24-A28 PolarHBondContact O-N 2.83Å; A25-A28 PolarHBondContact O-N 3.47Å; D26-A28 VanDerWaalsContact C-N 3.3Å; D26-A28 PolarHBondContact O-N 2.8Å; A28-W32 HydrophobicContact CB-CD2 3.93Å; A28-W32 HydrophobicContact CB-CE3 3.41Å; A28-W32 VanDerWaalsContact CB-CE3 3.41Å; A28-W32 HydrophobicContact CB-CZ3 3.77Å; A28-W32 WeakPolarHBondContact O-CB 3.38Å; A28-W32 PolarHBondContact O-N 2.9Å; A28-N33 PolarHBondContact O-N 3.44Å; A28-V308 HydrophobicContact CB-CG1 3.75Å; A28-V308 HydrophobicContact CB-CG2 4.25Å
29	N	94.1	Very high	91.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-76.5	-62.5	-179.7	-76.3	-93.8	0	0	0	113.2	A25 D26 R27 Q31 N33 Y122 Y217 T312	A25-N29 PolarHBondContact O-N 3.34Å; A25-N29 PolarHBondContact O-ND2 2.95Å; D26-N29 WeakPolarHBondContact O-CB 3.19Å; D26-N29 PolarHBondContact O-N 3.25Å; R27-N29 PolarHBondContact O-N 3.36Å; R27-N29 VanDerWaalsContact O-N 3.16Å; N29-Q31 VanDerWaalsContact C-N 3.27Å; N29-Q31 PolarHBondContact O-N 2.97Å; N29-N33 WeakPolarHBondContact O-CB 3.42Å; N29-Y122 HydrophobicContact CB-CD1 4.49Å; N29-Y217 HydrophobicContact CB-CD1 3.49Å; N29-Y217 VanDerWaalsContact CB-CD1 3.49Å; N29-Y217 HydrophobicContact CB-CE1 3.63Å; N29-Y217 HydrophobicContact CB-CG 4.25Å; N29-T312 WeakPolarHBondContact ND2-CG2 3.41Å
30	F	92	Very high	92.3	Very high	13 Å²	13	28.5 Å²	28.5	6%	0.057	14%	0.142	C	C	.	.	I	π-helix	trans	-77.8	-16.5	-173.3	74.6	-96	0	0	0	112.7	F18 E22 D26 R27 V34 Y123 R126 Y217	F18-F30 HydrophobicContact CD1-CZ 4.2Å; F18-F30 HydrophobicContact CE1-CE2 4.26Å; F18-F30 AromaticContact CE1-CZ 3.79Å; F18-F30 HydrophobicContact CE1-CZ 3.79Å; E22-F30 VanDerWaalsContact CD-CE1 3.44Å; E22-F30 WeakPolarHBondContact OE2-CE1 3.31Å; E22-F30 WeakPolarHBondContact OE2-CZ 3.46Å; D26-F30 WeakPolarHBondContact O-CD1 3.47Å; D26-F30 WeakPolarHBondContact O-CE1 3.45Å; D26-F30 PolarHBondContact O-N 3.32Å; R27-F30 HydrophobicContact CB-CE1 4.28Å; R27-F30 HydrophobicContact CB-CZ 4.42Å; R27-F30 HydrophobicContact CG-CE1 4.12Å; R27-F30 HydrophobicContact CG-CZ 4.15Å; F30-V34 WeakPolarHBondContact O-CB 3.46Å; F30-V34 WeakPolarHBondContact O-CG2 3.41Å; F30-Y123 HydrophobicContact CB-CD2 4.23Å; F30-Y123 HydrophobicContact CD2-CE2 4.35Å; F30-R126 HydrophobicContact CB-CB 3.81Å; F30-R126 HydrophobicContact CB-CG 4.31Å; F30-R126 HydrophobicContact CD1-CB 4.35Å; F30-R126 HydrophobicContact CD1-CG 4.39Å; F30-R126 HydrophobicContact CD2-CG 4.09Å; F30-R126 HydrophobicContact CG-CB 3.98Å; F30-R126 HydrophobicContact CG-CG 4Å; F30-Y217 HydrophobicContact CB-CE1 4.42Å
31	Q	90.6	Very high	93	Very high	22 Å²	22	31.3 Å²	31.3	10%	0.103	16%	0.156	C	C	.	.	I	π-helix	trans	-106.8	-62.8	-176.2	-158.9	178.6	3.5	0	0	111.4	V15 R27 N29 I35	V15-Q31 VanDerWaalsContact C-NE2 3.32Å; V15-Q31 HydrophobicContact CG1-CG 4.12Å; V15-Q31 VanDerWaalsContact CG1-NE2 3.29Å; V15-Q31 PolarHBondContact O-NE2 3.45Å; R27-Q31 WeakPolarHBondContact O-CA 3.26Å; R27-Q31 WeakPolarHBondContact O-CB 3.37Å; R27-Q31 PolarHBondContact O-N 3.48Å; N29-Q31 VanDerWaalsContact C-N 3.27Å; N29-Q31 PolarHBondContact O-N 2.97Å; Q31-I35 HydrophobicContact CG-CD1 4.07Å; Q31-I35 WeakPolarHBondContact O-CB 3.41Å; Q31-I35 WeakPolarHBondContact O-CD1 3.41Å; Q31-I35 WeakPolarHBondContact O-CG1 3.33Å; Q31-I35 PolarHBondContact O-N 2.93Å
32	W	93.1	Very high	93.4	Very high	90 Å²	90	33.7 Å²	33.7	34%	0.341	18%	0.176	S	C	.	.	I	π-helix	trans	-69.6	-47.4	-174	-54.7	-15.2	0	0	0	111.9	L24 R27 A28 V34 I35 V36 F304	L24-W32 HydrophobicContact CD1-CH2 3.91Å; L24-W32 HydrophobicContact CD1-CZ2 3.97Å; L24-W32 HydrophobicContact CG-CH2 4.48Å; R27-W32 PolarHBondContact O-N 3.28Å; A28-W32 HydrophobicContact CB-CD2 3.93Å; A28-W32 HydrophobicContact CB-CE3 3.41Å; A28-W32 VanDerWaalsContact CB-CE3 3.41Å; A28-W32 HydrophobicContact CB-CZ3 3.77Å; A28-W32 WeakPolarHBondContact O-CB 3.38Å; A28-W32 PolarHBondContact O-N 2.9Å; W32-V34 VanDerWaalsContact C-N 3.34Å; W32-V34 PolarHBondContact O-N 2.89Å; W32-I35 PolarHBondContact O-N 3.49Å; W32-V36 WeakPolarHBondContact O-CB 3.25Å; W32-V36 WeakPolarHBondContact O-CG2 3.15Å; W32-V36 PolarHBondContact O-N 2.87Å; W32-F304 HydrophobicContact CB-CZ 4.09Å
33	N	94.8	Very high	93.6	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	I	π-helix	trans	-60.9	-43.4	177.1	-63.4	-20.6	0	0	0	111.7	A28 N29 V36 L37 Y122 F304 L305 V308	A28-N33 PolarHBondContact O-N 3.44Å; N29-N33 WeakPolarHBondContact O-CB 3.42Å; N33-V36 PolarHBondContact O-N 3.36Å; N33-L37 VanDerWaalsContact O-CB 3.29Å; N33-L37 WeakPolarHBondContact O-CB 3.39Å; N33-L37 WeakPolarHBondContact O-CD1 3.39Å; N33-L37 WeakPolarHBondContact O-CG 3.31Å; N33-L37 PolarHBondContact O-N 3.29Å; N33-Y122 HydrophobicContact CB-CD1 4.23Å; N33-Y122 HydrophobicContact CB-CD2 4.03Å; N33-Y122 HydrophobicContact CB-CE1 4.39Å; N33-Y122 HydrophobicContact CB-CE2 4.17Å; N33-Y122 HydrophobicContact CB-CG 4.05Å; N33-Y122 WeakPolarHBondContact ND2-CE1 3.43Å; N33-F304 WeakPolarHBondContact OD1-CE1 3.29Å; N33-L305 HydrophobicContact CB-CD2 3.76Å; N33-L305 VanDerWaalsContact CG-CD2 3.47Å; N33-L305 WeakPolarHBondContact OD1-CD2 3.47Å; N33-V308 WeakPolarHBondContact ND2-CG1 3.43Å; N33-V308 WeakPolarHBondContact OD1-CG2 3.18Å
34	V	95	Very high	93.7	Very high	20 Å²	20	36.6 Å²	36.6	12%	0.121	19%	0.191	C	C	.	.	H	α-helix	trans	-62.2	-46.5	179.3	176.4	0	0	0	0	110.9	F30 W32 V36 L37 L38 A119	F30-V34 WeakPolarHBondContact O-CB 3.46Å; F30-V34 WeakPolarHBondContact O-CG2 3.41Å; W32-V34 VanDerWaalsContact C-N 3.34Å; W32-V34 PolarHBondContact O-N 2.89Å; V34-V36 PolarHBondContact O-N 3.44Å; V34-L37 PolarHBondContact O-N 2.83Å; V34-L38 HydrophobicContact CG1-CD1 3.9Å; V34-L38 HydrophobicContact CG1-CG 4.37Å; V34-L38 WeakPolarHBondContact O-CB 3.14Å; V34-L38 VanDerWaalsContact O-CG 3.24Å; V34-L38 WeakPolarHBondContact O-CG 2.97Å; V34-L38 PolarHBondContact O-N 3.46Å; V34-A119 HydrophobicContact CG1-CB 4.4Å
35	I	93.4	Very high	93.9	Very high	73 Å²	73	34.1 Å²	34.1	37%	0.374	18%	0.179	S	C	.	.	H	α-helix	trans	-60.7	-46.9	177.5	-71.2	167.2	0	0	0	111	V15 Q31 W32 L38 L39	V15-I35 HydrophobicContact CB-CD1 4.31Å; V15-I35 HydrophobicContact CG1-CD1 3.37Å; V15-I35 HydrophobicContact CG2-CD1 3.89Å; Q31-I35 HydrophobicContact CG-CD1 4.07Å; Q31-I35 WeakPolarHBondContact O-CB 3.41Å; Q31-I35 WeakPolarHBondContact O-CD1 3.41Å; Q31-I35 WeakPolarHBondContact O-CG1 3.33Å; Q31-I35 PolarHBondContact O-N 2.93Å; W32-I35 PolarHBondContact O-N 3.49Å; I35-L38 PolarHBondContact O-N 3.2Å; I35-L39 WeakPolarHBondContact O-CB 3.48Å; I35-L39 PolarHBondContact O-N 3.43Å
36	V	95.4	Very high	93.9	Very high	25 Å²	25	38.6 Å²	38.6	15%	0.152	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-44	-179.6	168	0	0	0	0	111.5	W32 N33 V34 L39 C40 F300 L301 F304	W32-V36 WeakPolarHBondContact O-CB 3.25Å; W32-V36 WeakPolarHBondContact O-CG2 3.15Å; W32-V36 PolarHBondContact O-N 2.87Å; N33-V36 PolarHBondContact O-N 3.36Å; V34-V36 PolarHBondContact O-N 3.44Å; V36-L39 PolarHBondContact O-N 2.91Å; V36-C40 PolarHBondContact O-N 3.41Å; V36-C40 PolarHBondContact O-SG 2.89Å; V36-C40 VanDerWaalsContact O-SG 3.35Å; V36-F300 HydrophobicContact CG1-CE1 3.64Å; V36-F300 HydrophobicContact CG1-CZ 4.27Å; V36-L301 HydrophobicContact CG1-CD2 3.83Å; V36-F304 HydrophobicContact CB-CD1 4.23Å; V36-F304 HydrophobicContact CB-CE1 3.85Å; V36-F304 HydrophobicContact CB-CZ 4.34Å; V36-F304 HydrophobicContact CG1-CD1 3.98Å; V36-F304 HydrophobicContact CG1-CE1 4.12Å; V36-F304 HydrophobicContact CG2-CD1 4.24Å; V36-F304 HydrophobicContact CG2-CE1 3.62Å; V36-F304 HydrophobicContact CG2-CE2 4.19Å; V36-F304 HydrophobicContact CG2-CZ 3.59Å
37	L	95.9	Very high	93.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-42.2	177.7	-74.3	167.2	0	0	0	112.1	N33 V34 C40 M41 L115 Q118 A119 Y122 L301 L305	N33-L37 VanDerWaalsContact O-CB 3.29Å; N33-L37 WeakPolarHBondContact O-CB 3.39Å; N33-L37 WeakPolarHBondContact O-CD1 3.39Å; N33-L37 WeakPolarHBondContact O-CG 3.31Å; N33-L37 PolarHBondContact O-N 3.29Å; V34-L37 PolarHBondContact O-N 2.83Å; L37-C40 PolarHBondContact O-N 2.91Å; L37-M41 WeakPolarHBondContact O-CB 3.45Å; L37-M41 PolarHBondContact O-N 3.34Å; L37-L115 HydrophobicContact CD2-CD2 3.95Å; L37-Q118 HydrophobicContact CD1-CB 4.03Å; L37-Q118 HydrophobicContact CD2-CB 4.31Å; L37-A119 HydrophobicContact CB-CB 3.99Å; L37-A119 HydrophobicContact CD1-CB 4.43Å; L37-Y122 HydrophobicContact CD1-CD2 3.51Å; L37-Y122 HydrophobicContact CD1-CE2 3.86Å; L37-L301 HydrophobicContact CD2-CD1 4.23Å; L37-L301 HydrophobicContact CD2-CD2 3.98Å; L37-L305 HydrophobicContact CD2-CD1 4.45Å
38	L	95.3	Very high	93.8	Very high	83 Å²	83	41.4 Å²	41.4	44%	0.435	21%	0.212	S	C	.	.	H	α-helix	trans	-65.9	-37.6	175.9	-70.6	176.2	0	0	0	112	V34 I35 M41 A42 A119	V34-L38 HydrophobicContact CG1-CD1 3.9Å; V34-L38 HydrophobicContact CG1-CG 4.37Å; V34-L38 WeakPolarHBondContact O-CB 3.14Å; V34-L38 VanDerWaalsContact O-CG 3.24Å; V34-L38 WeakPolarHBondContact O-CG 2.97Å; V34-L38 PolarHBondContact O-N 3.46Å; I35-L38 PolarHBondContact O-N 3.2Å; L38-M41 HydrophobicContact CD2-SD 4.31Å; L38-M41 WeakPolarHBondContact O-CB 3.39Å; L38-M41 PolarHBondContact O-N 3Å; L38-A42 WeakPolarHBondContact O-CB 3.13Å; L38-A42 PolarHBondContact O-N 3.45Å; L38-A119 HydrophobicContact CD2-CB 4.03Å; L38-A119 HydrophobicContact CG-CB 4.15Å
39	L	95.4	Very high	93.6	Very high	104 Å²	104	49.5 Å²	49.5	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-65.4	-45.1	174.5	-175.9	143.7	0	0	0	111.2	I35 V36 A42 L43	I35-L39 WeakPolarHBondContact O-CB 3.48Å; I35-L39 PolarHBondContact O-N 3.43Å; V36-L39 PolarHBondContact O-N 2.91Å; L39-A42 PolarHBondContact O-N 2.84Å; L39-L43 HydrophobicContact CD2-CD1 3.68Å; L39-L43 HydrophobicContact CD2-CG 4.31Å; L39-L43 WeakPolarHBondContact O-CG 3.49Å; L39-L43 PolarHBondContact O-N 3.13Å
40	C	95.5	Very high	93.4	Very high	4 Å²	4	57.1 Å²	57.1	3%	0.027	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-42.3	174.2	-70	0	0	0	0	112	V36 L37 A42 L43 V44 L115 I297	V36-C40 PolarHBondContact O-N 3.41Å; V36-C40 PolarHBondContact O-SG 2.89Å; V36-C40 VanDerWaalsContact O-SG 3.35Å; L37-C40 PolarHBondContact O-N 2.91Å; C40-A42 VanDerWaalsContact C-N 3.34Å; C40-A42 PolarHBondContact O-N 3.49Å; C40-L43 PolarHBondContact O-N 3.15Å; C40-V44 WeakPolarHBondContact O-CG2 3.38Å; C40-V44 PolarHBondContact O-N 3.29Å; C40-L115 HydrophobicContact CB-CD1 4.18Å; C40-I297 HydrophobicContact CB-CG2 4.02Å
41	M	95.3	Very high	93.2	Very high	59 Å²	59	61.4 Å²	61.4	29%	0.291	30%	0.298	S	S	.	.	H	α-helix	trans	-56.6	-48.4	174	178.6	-158.4	179.5	0	0	110.7	L37 L38 L43 V44 T45 P112 L115	L37-M41 WeakPolarHBondContact O-CB 3.45Å; L37-M41 PolarHBondContact O-N 3.34Å; L38-M41 HydrophobicContact CD2-SD 4.31Å; L38-M41 WeakPolarHBondContact O-CB 3.39Å; L38-M41 PolarHBondContact O-N 3Å; M41-L43 PolarHBondContact O-N 3.07Å; M41-V44 PolarHBondContact O-N 3.31Å; M41-T45 VanDerWaalsContact O-CB 3.28Å; M41-T45 WeakPolarHBondContact O-CB 3.27Å; M41-T45 PolarHBondContact O-N 2.87Å; M41-T45 PolarHBondContact O-OG1 3.06Å; M41-P112 HydrophobicContact CG-CB 4.32Å; M41-P112 WeakPolarHBondContact CG-O 3.37Å; M41-L115 HydrophobicContact CB-CB 3.98Å
42	A	94.6	Very high	93.1	Very high	50 Å²	50	64.6 Å²	64.6	41%	0.413	32%	0.32	S	S	.	.	H	α-helix	trans	-61.1	-44.3	178.4	0	0	0	0	0	111.6	L38 L39 C40 T45 M46	L38-A42 WeakPolarHBondContact O-CB 3.13Å; L38-A42 PolarHBondContact O-N 3.45Å; L39-A42 PolarHBondContact O-N 2.84Å; C40-A42 VanDerWaalsContact C-N 3.34Å; C40-A42 PolarHBondContact O-N 3.49Å; A42-T45 PolarHBondContact O-N 2.88Å; A42-M46 WeakPolarHBondContact O-CB 3.44Å; A42-M46 WeakPolarHBondContact O-CG 3.36Å; A42-M46 PolarHBondContact O-N 3.1Å
43	L	94.7	Very high	92.9	Very high	91 Å²	91	61.4 Å²	61.4	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-45.6	178	-71.9	175.4	0	0	0	112.9	L39 C40 M41 M46 R47	L39-L43 HydrophobicContact CD2-CD1 3.68Å; L39-L43 HydrophobicContact CD2-CG 4.31Å; L39-L43 WeakPolarHBondContact O-CG 3.49Å; L39-L43 PolarHBondContact O-N 3.13Å; C40-L43 PolarHBondContact O-N 3.15Å; M41-L43 PolarHBondContact O-N 3.07Å; L43-M46 PolarHBondContact O-N 3.38Å; L43-R47 PolarHBondContact O-N 3.49Å; L43-R47 VanDerWaalsContact O-N 3.1Å
44	V	94	Very high	92.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-67	-42.6	177.9	-179	0	0	0	0	110.6	C40 M41 M46 R47 Q48 V111 P112 L115 I297	C40-V44 WeakPolarHBondContact O-CG2 3.38Å; C40-V44 PolarHBondContact O-N 3.29Å; M41-V44 PolarHBondContact O-N 3.31Å; V44-M46 VanDerWaalsContact C-N 3.31Å; V44-M46 PolarHBondContact O-N 3.01Å; V44-R47 PolarHBondContact O-N 3.31Å; V44-R47 VanDerWaalsContact O-N 3.15Å; V44-Q48 WeakPolarHBondContact O-CB 3.22Å; V44-Q48 PolarHBondContact O-N 2.94Å; V44-V111 HydrophobicContact CB-CG1 4.44Å; V44-V111 HydrophobicContact CG1-CB 4.21Å; V44-V111 HydrophobicContact CG1-CG1 3.89Å; V44-V111 HydrophobicContact CG2-CG1 4.13Å; V44-P112 HydrophobicContact CB-CG 4.33Å; V44-P112 HydrophobicContact CG1-CG 3.82Å; V44-L115 HydrophobicContact CG2-CD1 4.23Å; V44-I297 HydrophobicContact CG2-CD1 3.41Å; V44-I297 VanDerWaalsContact CG2-CD1 3.41Å
45	T	94	Very high	92.6	Very high	37 Å²	37	63.9 Å²	63.9	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-59.5	-43.6	176.6	-56.3	0	0	0	0	111	M41 A42 R47 Q48 Y49 P112	M41-T45 VanDerWaalsContact O-CB 3.28Å; M41-T45 WeakPolarHBondContact O-CB 3.27Å; M41-T45 PolarHBondContact O-N 2.87Å; M41-T45 PolarHBondContact O-OG1 3.06Å; A42-T45 PolarHBondContact O-N 2.88Å; T45-R47 VanDerWaalsContact C-N 3.33Å; T45-R47 PolarHBondContact O-N 3.16Å; T45-Q48 PolarHBondContact O-N 3.4Å; T45-Y49 HydrophobicContact CG2-CD2 3.57Å; T45-Y49 HydrophobicContact CG2-CE2 3.9Å; T45-Y49 WeakPolarHBondContact O-CD2 3.35Å; T45-Y49 PolarHBondContact O-N 2.95Å; T45-P112 WeakPolarHBondContact OG1-CB 3.42Å
46	M	92.9	Very high	92.6	Very high	101 Å²	101	61.5 Å²	61.5	50%	0.498	32%	0.315	S	S	.	.	H	α-helix	trans	-58.3	-45.9	175.4	-74.9	-67.9	-176.7	0	0	111.3	A42 L43 V44 Q48 F50	A42-M46 WeakPolarHBondContact O-CB 3.44Å; A42-M46 WeakPolarHBondContact O-CG 3.36Å; A42-M46 PolarHBondContact O-N 3.1Å; L43-M46 PolarHBondContact O-N 3.38Å; V44-M46 VanDerWaalsContact C-N 3.31Å; V44-M46 PolarHBondContact O-N 3.01Å; M46-Q48 VanDerWaalsContact C-N 3.31Å; M46-Q48 PolarHBondContact O-N 3.29Å; M46-F50 HydrophobicContact CE-CE2 4.19Å; M46-F50 WeakPolarHBondContact O-CB 3.43Å; M46-F50 PolarHBondContact O-N 3.01Å; M46-F50 HydrophobicContact SD-CD2 3.37Å; M46-F50 WeakPolarHBondContact SD-CD2 3.41Å; M46-F50 HydrophobicContact SD-CE2 3.36Å; M46-F50 WeakPolarHBondContact SD-CE2 3.39Å; M46-F50 HydrophobicContact SD-CG 4.09Å; M46-F50 HydrophobicContact SD-CZ 4.1Å
47	R	91.4	Very high	92.4	Very high	76 Å²	76	67.7 Å²	67.7	29%	0.287	34%	0.337	S	S	.	.	H	α-helix	trans	-66.3	-31.8	177.6	-170.1	64.5	-176.8	-178.8	2.8	113.1	L43 V44 T45 M51 P289 L293	L43-R47 PolarHBondContact O-N 3.49Å; L43-R47 VanDerWaalsContact O-N 3.1Å; V44-R47 PolarHBondContact O-N 3.31Å; V44-R47 VanDerWaalsContact O-N 3.15Å; T45-R47 VanDerWaalsContact C-N 3.33Å; T45-R47 PolarHBondContact O-N 3.16Å; R47-M51 VanDerWaalsContact CD-SD 3.56Å; R47-M51 PolarHBondContact NH1-SD 3.35Å; R47-M51 CarbonylContact O-C 3.52Å; R47-M51 VanDerWaalsContact O-O 3.13Å; R47-P289 VanDerWaalsContact NH2-CB 3.3Å; R47-L293 HydrophobicContact CB-CD2 3.72Å; R47-L293 HydrophobicContact CG-CD2 3.9Å
48	Q	90.2	Very high	92	Very high	21 Å²	21	68.9 Å²	68.9	10%	0.098	34%	0.343	C	S	.	.	H	α-helix	trans	-80.1	-37.7	-176.7	-177.7	171.1	-17.8	0	0	113.4	V44 T45 M46 W76 I290	V44-Q48 WeakPolarHBondContact O-CB 3.22Å; V44-Q48 PolarHBondContact O-N 2.94Å; T45-Q48 PolarHBondContact O-N 3.4Å; M46-Q48 VanDerWaalsContact C-N 3.31Å; M46-Q48 PolarHBondContact O-N 3.29Å; Q48-W76 HydrophobicContact CG-CH2 4.41Å; Q48-W76 HydrophobicContact CG-CZ2 3.89Å; Q48-I290 HydrophobicContact CB-CD1 4.48Å
49	Y	88.7	Confident	91.5	Very high	171 Å²	171	69.4 Å²	69.4	67%	0.671	35%	0.351	S	S	*	.	H	α-helix	trans	-105.4	-33.2	-173.5	-69.4	-76.9	0	0	0	114.4	T45	T45-Y49 HydrophobicContact CG2-CD2 3.57Å; T45-Y49 HydrophobicContact CG2-CE2 3.9Å; T45-Y49 WeakPolarHBondContact O-CD2 3.35Å; T45-Y49 PolarHBondContact O-N 2.95Å
50	F	89.1	Confident	90.9	Very high	159 Å²	159	68.2 Å²	68.2	70%	0.697	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-18.4	-178.5	-66.3	-95.3	0	0	0	113	M46	M46-F50 HydrophobicContact CE-CE2 4.19Å; M46-F50 WeakPolarHBondContact O-CB 3.43Å; M46-F50 PolarHBondContact O-N 3.01Å; M46-F50 HydrophobicContact SD-CD2 3.37Å; M46-F50 WeakPolarHBondContact SD-CD2 3.41Å; M46-F50 HydrophobicContact SD-CE2 3.36Å; M46-F50 WeakPolarHBondContact SD-CE2 3.39Å; M46-F50 HydrophobicContact SD-CG 4.09Å; M46-F50 HydrophobicContact SD-CZ 4.1Å
51	M	88.5	Confident	90.2	Very high	104 Å²	104	75 Å²	75	51%	0.512	39%	0.389	S	S	.	.	S	Bend	trans	-122.3	163.6	179	-59.1	-178.9	178.5	0	0	109.7	R47 P53	R47-M51 VanDerWaalsContact CD-SD 3.56Å; R47-M51 PolarHBondContact NH1-SD 3.35Å; R47-M51 CarbonylContact O-C 3.52Å; R47-M51 VanDerWaalsContact O-O 3.13Å; M51-P53 VanDerWaalsContact O-CD 3.27Å; M51-P53 WeakPolarHBondContact O-CD 3.42Å
52	T	87.3	Confident	89.3	Confident	89 Å²	89	73.9 Å²	73.9	55%	0.546	39%	0.386	S	S	.	.			trans	-74.7	113.3	175.8	53.6	0	0	0	0	109.8	L54	T52-L54 VanDerWaalsContact C-N 3.32Å; T52-L54 PolarHBondContact O-N 3.44Å
53	P	89	Confident	88.4	Confident	22 Å²	22	77.7 Å²	77.7	14%	0.143	41%	0.41	C	S	.	.	S	Bend	trans	-69.7	-31.1	-174.8	27.5	-34.7	0	0	0	112.6	M51 W76 P289 I290	M51-P53 VanDerWaalsContact O-CD 3.27Å; M51-P53 WeakPolarHBondContact O-CD 3.42Å; P53-W76 HydrophobicContact CB-CD2 4.43Å; P53-W76 HydrophobicContact CB-CE3 3.91Å; P53-W76 HydrophobicContact CB-CH2 3.88Å; P53-W76 HydrophobicContact CB-CZ2 4.4Å; P53-W76 HydrophobicContact CB-CZ3 3.62Å; P53-W76 HydrophobicContact CG-CD2 3.95Å; P53-W76 HydrophobicContact CG-CE3 3.84Å; P53-W76 HydrophobicContact CG-CH2 4.36Å; P53-W76 HydrophobicContact CG-CZ2 4.46Å; P53-W76 HydrophobicContact CG-CZ3 4.05Å; P53-P289 WeakPolarHBondContact O-CD 2.98Å; P53-I290 HydrophobicContact CB-CD1 4.31Å; P53-I290 PolarHBondContact O-N 2.85Å
54	L	91.6	Very high	87.6	Confident	1 Å²	1	76 Å²	76	1%	0.005	41%	0.414	C	S	.	.			trans	-143.4	160.4	173.3	68.2	82	0	0	0	110.5	T52 C56 T72 W76 C286 V287 L288	T52-L54 VanDerWaalsContact C-N 3.32Å; T52-L54 PolarHBondContact O-N 3.44Å; L54-C56 WeakPolarHBondContact CD1-SG 3.37Å; L54-T72 HydrophobicContact CD1-CG2 3.79Å; L54-W76 HydrophobicContact CD2-CB 4.01Å; L54-W76 HydrophobicContact CD2-CE3 3.74Å; L54-W76 HydrophobicContact CG-CB 4.47Å; L54-W76 HydrophobicContact CG-CE3 4.28Å; L54-C286 HydrophobicContact CD1-CB 4.29Å; L54-V287 VanDerWaalsContact CA-O 3.3Å; L54-V287 WeakPolarHBondContact CA-O 3.26Å; L54-V287 WeakPolarHBondContact CB-O 3.36Å; L54-L288 HydrophobicContact CB-CG 4.41Å
55	V	92.9	Very high	86.9	Confident	72 Å²	72	82.9 Å²	82.9	44%	0.436	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.5	173.5	176.9	0	0	0	0	107.8	C286 V287	V55-C286 CarbonylContact O-C 3.49Å; V55-C286 VanDerWaalsContact O-CA 3.26Å; V55-C286 WeakPolarHBondContact O-CA 3.19Å; V55-V287 HydrophobicContact CB-CG2 3.91Å; V55-V287 PolarHBondContact N-O 3.47Å; V55-V287 VanDerWaalsContact N-O 3.14Å; V55-V287 WeakPolarHBondContact O-CG2 3.27Å; V55-V287 PolarHBondContact O-N 3.42Å
56	C	93.1	Very high	86.5	Confident	23 Å²	23	86.7 Å²	86.7	16%	0.155	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	139.6	-179.5	-60.4	0	0	0	0	111.8	L54 A284 Q285 C286	L54-C56 WeakPolarHBondContact CD1-SG 3.37Å; C56-A284 HydrophobicContact CB-CB 4.16Å; C56-Q285 CarbonylContact C-O 3.57Å; C56-Q285 WeakPolarHBondContact CA-O 3.32Å; C56-C286 HydrophobicContact CB-CB 4.12Å; C56-C286 WeakPolarHBondContact CB-SG 3.38Å; C56-C286 WeakPolarHBondContact SG-CB 3.4Å; C56-C286 CovalentContact SG-SG 2.05Å; C56-C286 PolarHBondContact SG-SG 2.92Å
57	Y	91.1	Very high	86.1	Confident	155 Å²	155	82.7 Å²	82.7	61%	0.608	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	135	169.1	174.8	-102	0	0	0	109.5	P59 Q285	Y57-P59 HydrophobicContact CE1-CB 4.44Å; Y57-Q285 PolarHBondContact N-O 2.87Å; Y57-Q285 PolarHBondContact O-N 2.85Å
58	L	88.7	Confident	85.9	Confident	25 Å²	25	84.2 Å²	84.2	13%	0.131	47%	0.471	C	S	.	.			trans	-120.1	122.9	-179.1	-139.4	72.1	0	0	0	109.9	T60 V62 I71 L282 A284	L58-T60 WeakPolarHBondContact CD2-O 3.34Å; L58-T60 PolarHBondContact O-N 3.34Å; L58-V62 HydrophobicContact CD2-CB 4.31Å; L58-V62 HydrophobicContact CD2-CG1 3.66Å; L58-V62 HydrophobicContact CD2-CG2 3.65Å; L58-I71 HydrophobicContact CD1-CD1 4.36Å; L58-I71 HydrophobicContact CD1-CG2 4.21Å; L58-I71 HydrophobicContact CD2-CD1 3.48Å; L58-I71 VanDerWaalsContact CD2-CD1 3.48Å; L58-L282 HydrophobicContact CD1-CD1 4.04Å; L58-L282 HydrophobicContact CD1-CD2 3.79Å; L58-L282 HydrophobicContact CD1-CG 3.93Å; L58-L282 HydrophobicContact CD2-CD1 3.74Å; L58-L282 HydrophobicContact CD2-CD2 3.9Å; L58-L282 HydrophobicContact CD2-CG 4.28Å; L58-L282 HydrophobicContact CG-CD1 3.91Å; L58-L282 HydrophobicContact CG-CD2 4.32Å; L58-L282 HydrophobicContact CG-CG 4.35Å; L58-A284 HydrophobicContact CD1-CB 3.35Å
59	P	84.1	Confident	85.8	Confident	93 Å²	93	86.5 Å²	86.5	60%	0.604	49%	0.49	S	S	*	.	S	Bend	trans	-74.8	-14.7	179.3	29.8	-34.6	0	0	0	113.1	Y57	Y57-P59 HydrophobicContact CE1-CB 4.44Å
60	T	83	Confident	85.9	Confident	79 Å²	79	84.6 Å²	84.6	49%	0.485	48%	0.482	S	S	.	.	S	Bend	trans	-115.1	137.6	-179.4	55.4	0	0	0	0	109.7	L58 V62 L282	L58-T60 WeakPolarHBondContact CD2-O 3.34Å; L58-T60 PolarHBondContact O-N 3.34Å; T60-V62 PolarHBondContact O-N 2.98Å; T60-L282 WeakPolarHBondContact OG1-CD1 3.37Å
61	T	79.9	Confident	85.9	Confident	146 Å²	146	77.4 Å²	77.4	90%	0.896	45%	0.451	S	S	*	.			trans	-75.1	115.6	174.6	48.9	0	0	0	0	109.1
62	V	77.1	Confident	86	Confident	36 Å²	36	73.9 Å²	73.9	22%	0.218	44%	0.435	C	S	.	.			trans	-87.6	130.3	173.6	-78.8	0	0	0	0	109	L58 T60 G64 A67 I71 L273 L282	L58-V62 HydrophobicContact CD2-CB 4.31Å; L58-V62 HydrophobicContact CD2-CG1 3.66Å; L58-V62 HydrophobicContact CD2-CG2 3.65Å; T60-V62 PolarHBondContact O-N 2.98Å; V62-G64 PolarHBondContact O-N 3.31Å; V62-A67 HydrophobicContact CB-CB 3.88Å; V62-A67 HydrophobicContact CG2-CB 3.3Å; V62-I71 HydrophobicContact CB-CD1 4.45Å; V62-I71 HydrophobicContact CG1-CD1 4.16Å; V62-I71 HydrophobicContact CG2-CD1 3.76Å; V62-L273 HydrophobicContact CG1-CD1 4.27Å; V62-L282 HydrophobicContact CG1-CD1 4.18Å
63	S	75.6	Confident	86.2	Confident	131 Å²	131	74.3 Å²	74.3	92%	0.916	43%	0.434	S	S	*	.			trans	-73	119.9	177.4	-66.8	0	0	0	0	109.9
64	G	78.7	Confident	86.3	Confident	54 Å²	54	74.3 Å²	74.3	56%	0.557	43%	0.433	S	S	*	.	S	Bend	trans	153.9	137.9	174.2	0	0	0	0	0	112.6	V62 N66 A67	V62-G64 PolarHBondContact O-N 3.31Å; G64-N66 PolarHBondContact O-N 3.48Å; G64-A67 PolarHBondContact O-N 3.4Å
65	V	78.1	Confident	86.3	Confident	146 Å²	146	74.4 Å²	74.4	89%	0.885	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.9	-172.9	-178.8	0	0	0	0	113.1
66	N	84.8	Confident	86.2	Confident	117 Å²	117	72.5 Å²	72.5	63%	0.626	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.7	27.6	-179.4	-64.6	-42.4	0	0	0	113.2	G64 D68 S69 Y70	G64-N66 PolarHBondContact O-N 3.48Å; N66-D68 VanDerWaalsContact C-N 3.33Å; N66-D68 PolarHBondContact O-N 3.05Å; N66-S69 PolarHBondContact O-N 3.43Å; N66-Y70 PolarHBondContact O-N 3.47Å
67	A	86	Confident	86.1	Confident	17 Å²	17	76.4 Å²	76.4	14%	0.14	44%	0.437	C	S	.	.	H	α-helix	trans	-63.3	-37.9	-171.8	0	0	0	0	0	112.6	V62 G64 Y70 I71	V62-A67 HydrophobicContact CB-CB 3.88Å; V62-A67 HydrophobicContact CG2-CB 3.3Å; G64-A67 PolarHBondContact O-N 3.4Å; A67-Y70 PolarHBondContact O-N 3.45Å; A67-I71 WeakPolarHBondContact O-CD1 3.48Å; A67-I71 VanDerWaalsContact O-CG1 3.29Å; A67-I71 WeakPolarHBondContact O-CG1 3.41Å; A67-I71 PolarHBondContact O-N 2.85Å
68	D	86.9	Confident	86	Confident	107 Å²	107	73.8 Å²	73.8	57%	0.572	43%	0.43	S	S	*	.	H	α-helix	trans	-64.2	-42.6	178.1	-63.4	-18.1	0	0	0	112.8	N66 I71 T72	N66-D68 VanDerWaalsContact C-N 3.33Å; N66-D68 PolarHBondContact O-N 3.05Å; D68-I71 PolarHBondContact O-N 2.72Å; D68-T72 WeakPolarHBondContact O-CB 3.46Å; D68-T72 PolarHBondContact O-N 3.19Å; D68-T72 PolarHBondContact O-OG1 3.16Å
69	S	88.6	Confident	86	Confident	69 Å²	69	72.7 Å²	72.7	48%	0.483	43%	0.425	S	S	.	.	H	α-helix	trans	-67.1	-38.9	175.5	-55.1	0	0	0	0	111.7	N66 T72 N73	N66-S69 PolarHBondContact O-N 3.43Å; S69-T72 PolarHBondContact O-N 2.86Å; S69-N73 WeakPolarHBondContact O-CB 3.35Å; S69-N73 VanDerWaalsContact O-CG 3.29Å; S69-N73 PolarHBondContact O-N 2.98Å; S69-N73 PolarHBondContact O-ND2 3.45Å
70	Y	89.3	Confident	86.4	Confident	131 Å²	131	68.2 Å²	68.2	51%	0.514	40%	0.396	S	S	.	.	H	α-helix	trans	-61.1	-48.9	174.8	175.1	-101.9	0	0	0	111.3	N66 A67 T72 N73 L74 L273	N66-Y70 PolarHBondContact O-N 3.47Å; A67-Y70 PolarHBondContact O-N 3.45Å; Y70-T72 VanDerWaalsContact C-N 3.35Å; Y70-T72 PolarHBondContact O-N 3.27Å; Y70-N73 PolarHBondContact O-N 3.28Å; Y70-L74 HydrophobicContact CE1-CD2 3.91Å; Y70-L74 VanDerWaalsContact O-CB 3.26Å; Y70-L74 WeakPolarHBondContact O-CB 3.14Å; Y70-L74 PolarHBondContact O-N 3.23Å; Y70-L273 HydrophobicContact CE1-CD2 4.11Å
71	I	89.4	Confident	86.6	Confident	8 Å²	8	65.3 Å²	65.3	4%	0.041	38%	0.377	C	S	.	.	H	α-helix	trans	-65.4	-41.1	179.8	-66.7	157.4	0	0	0	110.8	L58 V62 A67 D68 N73 L74 C75 L282 A284	L58-I71 HydrophobicContact CD1-CD1 4.36Å; L58-I71 HydrophobicContact CD1-CG2 4.21Å; L58-I71 HydrophobicContact CD2-CD1 3.48Å; L58-I71 VanDerWaalsContact CD2-CD1 3.48Å; V62-I71 HydrophobicContact CB-CD1 4.45Å; V62-I71 HydrophobicContact CG1-CD1 4.16Å; V62-I71 HydrophobicContact CG2-CD1 3.76Å; A67-I71 WeakPolarHBondContact O-CD1 3.48Å; A67-I71 VanDerWaalsContact O-CG1 3.29Å; A67-I71 WeakPolarHBondContact O-CG1 3.41Å; A67-I71 PolarHBondContact O-N 2.85Å; D68-I71 PolarHBondContact O-N 2.72Å; I71-N73 PolarHBondContact O-N 3.09Å; I71-L74 PolarHBondContact O-N 3.37Å; I71-C75 VanDerWaalsContact O-CB 3.32Å; I71-C75 WeakPolarHBondContact O-CB 3.15Å; I71-C75 PolarHBondContact O-N 3.28Å; I71-C75 PolarHBondContact O-SG 3.08Å; I71-L282 HydrophobicContact CD1-CD2 3.54Å; I71-L282 HydrophobicContact CG1-CD2 3.9Å; I71-L282 HydrophobicContact CG2-CD2 4.21Å; I71-A284 HydrophobicContact CG2-CB 4.07Å
72	T	91.4	Very high	86.9	Confident	30 Å²	30	59 Å²	59	18%	0.184	34%	0.338	C	S	.	.	H	α-helix	trans	-58.6	-46.7	176.6	-67.2	0	0	0	0	111.2	L54 D68 S69 Y70 W76	L54-T72 HydrophobicContact CD1-CG2 3.79Å; D68-T72 WeakPolarHBondContact O-CB 3.46Å; D68-T72 PolarHBondContact O-N 3.19Å; D68-T72 PolarHBondContact O-OG1 3.16Å; S69-T72 PolarHBondContact O-N 2.86Å; Y70-T72 VanDerWaalsContact C-N 3.35Å; Y70-T72 PolarHBondContact O-N 3.27Å; T72-W76 WeakPolarHBondContact O-CB 3.45Å; T72-W76 PolarHBondContact O-N 3.46Å
73	N	90.8	Very high	87	Confident	98 Å²	98	58 Å²	58	52%	0.524	33%	0.332	S	S	.	.	H	α-helix	trans	-68.3	-38.5	177.2	-71.8	-26.2	0	0	0	112.2	S69 Y70 I71 W76 I77	S69-N73 WeakPolarHBondContact O-CB 3.35Å; S69-N73 VanDerWaalsContact O-CG 3.29Å; S69-N73 PolarHBondContact O-N 2.98Å; S69-N73 PolarHBondContact O-ND2 3.45Å; Y70-N73 PolarHBondContact O-N 3.28Å; I71-N73 PolarHBondContact O-N 3.09Å; N73-W76 WeakPolarHBondContact O-CB 3.43Å; N73-W76 PolarHBondContact O-N 2.91Å; N73-I77 VanDerWaalsContact O-CG1 3.31Å; N73-I77 WeakPolarHBondContact O-CG1 3.39Å; N73-I77 PolarHBondContact O-N 2.86Å
74	L	90.9	Very high	87.1	Confident	23 Å²	23	53.8 Å²	53.8	12%	0.12	30%	0.299	C	S	.	.	H	α-helix	trans	-64.2	-45.5	177.5	-175.2	61.1	0	0	0	111.5	Y70 I71 W76 I77 E78 H271	Y70-L74 HydrophobicContact CE1-CD2 3.91Å; Y70-L74 VanDerWaalsContact O-CB 3.26Å; Y70-L74 WeakPolarHBondContact O-CB 3.14Å; Y70-L74 PolarHBondContact O-N 3.23Å; I71-L74 PolarHBondContact O-N 3.37Å; L74-W76 VanDerWaalsContact C-N 3.27Å; L74-W76 PolarHBondContact O-N 3.31Å; L74-I77 PolarHBondContact O-N 3.42Å; L74-E78 HydrophobicContact CD1-CG 4.26Å; L74-E78 WeakPolarHBondContact O-CB 3.19Å; L74-E78 PolarHBondContact O-N 3.27Å; L74-H271 HydrophobicContact CD2-CB 4.28Å; L74-H271 WeakPolarHBondContact CD2-CD2 3.36Å
75	C	91.6	Very high	87	Confident	2 Å²	2	54 Å²	54	1%	0.014	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-31	174.6	-67	0	0	0	0	112.5	I71 G79 C269	I71-C75 VanDerWaalsContact O-CB 3.32Å; I71-C75 WeakPolarHBondContact O-CB 3.15Å; I71-C75 PolarHBondContact O-N 3.28Å; I71-C75 PolarHBondContact O-SG 3.08Å; C75-G79 CarbonylContact O-C 3.5Å; C75-G79 VanDerWaalsContact O-CA 3.31Å; C75-G79 WeakPolarHBondContact O-CA 3.33Å; C75-G79 PolarHBondContact O-N 3.03Å; C75-C269 WeakPolarHBondContact CA-SG 3.36Å; C75-C269 HydrophobicContact CB-CB 3.7Å; C75-C269 WeakPolarHBondContact CB-SG 3.46Å; C75-C269 WeakPolarHBondContact SG-CB 3.39Å; C75-C269 CovalentContact SG-SG 2.04Å; C75-C269 PolarHBondContact SG-SG 2.98Å
76	W	91.2	Very high	86.8	Confident	33 Å²	33	52.7 Å²	52.7	13%	0.125	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-44.2	170.9	173.9	-105.1	0	0	0	112.1	Q48 P53 L54 T72 N73 L74 Y108 Q109 I290	Q48-W76 HydrophobicContact CG-CH2 4.41Å; Q48-W76 HydrophobicContact CG-CZ2 3.89Å; P53-W76 HydrophobicContact CB-CD2 4.43Å; P53-W76 HydrophobicContact CB-CE3 3.91Å; P53-W76 HydrophobicContact CB-CH2 3.88Å; P53-W76 HydrophobicContact CB-CZ2 4.4Å; P53-W76 HydrophobicContact CB-CZ3 3.62Å; P53-W76 HydrophobicContact CG-CD2 3.95Å; P53-W76 HydrophobicContact CG-CE3 3.84Å; P53-W76 HydrophobicContact CG-CH2 4.36Å; P53-W76 HydrophobicContact CG-CZ2 4.46Å; P53-W76 HydrophobicContact CG-CZ3 4.05Å; L54-W76 HydrophobicContact CD2-CB 4.01Å; L54-W76 HydrophobicContact CD2-CE3 3.74Å; L54-W76 HydrophobicContact CG-CB 4.47Å; L54-W76 HydrophobicContact CG-CE3 4.28Å; T72-W76 WeakPolarHBondContact O-CB 3.45Å; T72-W76 PolarHBondContact O-N 3.46Å; N73-W76 WeakPolarHBondContact O-CB 3.43Å; N73-W76 PolarHBondContact O-N 2.91Å; L74-W76 VanDerWaalsContact C-N 3.27Å; L74-W76 PolarHBondContact O-N 3.31Å; W76-Y108 AromaticContact CE3-CD2 3.93Å; W76-Y108 HydrophobicContact CE3-CD2 3.93Å; W76-Y108 AromaticContact CE3-CE2 3.87Å; W76-Y108 HydrophobicContact CE3-CE2 3.87Å; W76-Y108 AromaticContact CH2-CD2 3.49Å; W76-Y108 HydrophobicContact CH2-CD2 3.49Å; W76-Y108 VanDerWaalsContact CH2-CD2 3.49Å; W76-Y108 HydrophobicContact CH2-CE2 4.26Å; W76-Y108 HydrophobicContact CH2-CG 4.26Å; W76-Y108 HydrophobicContact CZ2-CD2 4.34Å; W76-Y108 AromaticContact CZ3-CD2 3.23Å; W76-Y108 HydrophobicContact CZ3-CD2 3.23Å; W76-Y108 AromaticContact CZ3-CE2 3.63Å; W76-Y108 HydrophobicContact CZ3-CE2 3.63Å; W76-Y108 HydrophobicContact CZ3-CG 4.09Å; W76-Q109 HydrophobicContact CH2-CG 4.4Å; W76-Q109 HydrophobicContact CZ2-CB 4.49Å; W76-Q109 HydrophobicContact CZ2-CG 3.83Å; W76-Q109 PolarHBondContact O-NE2 2.96Å; W76-I290 HydrophobicContact CH2-CD1 3.76Å; W76-I290 HydrophobicContact CZ3-CD1 4.3Å; W76-I290 HydrophobicContact CZ3-CG2 4.24Å
77	I	90.5	Very high	86.3	Confident	104 Å²	104	50.1 Å²	50.1	53%	0.533	27%	0.271	S	S	.	.	H	α-helix	trans	-70.2	-50.4	-177.1	-68.1	165.4	0	0	0	111.6	N73 L74 G79 N106 Q109	N73-I77 VanDerWaalsContact O-CG1 3.31Å; N73-I77 WeakPolarHBondContact O-CG1 3.39Å; N73-I77 PolarHBondContact O-N 2.86Å; L74-I77 PolarHBondContact O-N 3.42Å; I77-G79 VanDerWaalsContact C-N 3.34Å; I77-N106 PolarHBondContact O-ND2 3.42Å; I77-N106 VanDerWaalsContact O-ND2 3.14Å; I77-Q109 VanDerWaalsContact CA-NE2 3.33Å; I77-Q109 PolarHBondContact O-NE2 3.1Å; I77-Q109 VanDerWaalsContact O-NE2 3.08Å
78	E	88.8	Confident	85.6	Confident	100 Å²	100	52.5 Å²	52.5	47%	0.467	30%	0.297	S	S	.	.	H	α-helix	trans	-70.5	-32.2	-179.7	-70.1	-67.9	161.9	0	0	111.8	L74 Q104	L74-E78 HydrophobicContact CD1-CG 4.26Å; L74-E78 WeakPolarHBondContact O-CB 3.19Å; L74-E78 PolarHBondContact O-N 3.27Å; E78-Q104 PolarHBondContact O-NE2 3.18Å
79	G	89.9	Confident	84.9	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.021	30%	0.3	C	S	.	.			trans	89.7	175.8	-172.9	0	0	0	0	0	112.9	C75 I77 M105 Y108	C75-G79 CarbonylContact O-C 3.5Å; C75-G79 VanDerWaalsContact O-CA 3.31Å; C75-G79 WeakPolarHBondContact O-CA 3.33Å; C75-G79 PolarHBondContact O-N 3.03Å; I77-G79 VanDerWaalsContact C-N 3.34Å; G79-M105 WeakPolarHBondContact CA-O 3.39Å; G79-Y108 WeakPolarHBondContact CA-OH 3.16Å
80	T	90.8	Very high	84.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-124.2	157.3	-171.9	59.3	0	0	0	0	111.7	M105 Y108 C269 C286	T80-M105 PolarHBondContact N-O 3Å; T80-M105 WeakPolarHBondContact O-CG 3.46Å; T80-M105 PolarHBondContact O-N 2.85Å; T80-M105 WeakPolarHBondContact OG1-CE 3.3Å; T80-M105 VanDerWaalsContact OG1-CG 3.23Å; T80-M105 WeakPolarHBondContact OG1-CG 3.23Å; T80-M105 PolarHBondContact OG1-SD 3.23Å; T80-Y108 PolarHBondContact N-OH 3.18Å; T80-Y108 PolarHBondContact OG1-OH 3.49Å; T80-C269 HydrophobicContact CG2-CB 4.44Å; T80-C286 HydrophobicContact CG2-CB 4.36Å
81	F	89.1	Confident	84	Confident	17 Å²	17	47 Å²	47	8%	0.075	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	128.9	176.2	-63	-84.2	0	0	0	110.1	I83 W97 L100 Q104 G267 M268	F81-I83 HydrophobicContact CB-CD1 4.5Å; F81-I83 HydrophobicContact CB-CG1 4.34Å; F81-I83 PolarHBondContact O-N 2.98Å; F81-W97 HydrophobicContact CB-CZ3 4.14Å; F81-W97 HydrophobicContact CD2-CE3 4.02Å; F81-W97 AromaticContact CD2-CZ3 3.75Å; F81-W97 HydrophobicContact CD2-CZ3 3.75Å; F81-W97 HydrophobicContact CE2-CE3 4.27Å; F81-W97 HydrophobicContact CE2-CZ3 4.38Å; F81-W97 HydrophobicContact CG-CE3 4.21Å; F81-W97 AromaticContact CG-CZ3 3.97Å; F81-W97 HydrophobicContact CG-CZ3 3.97Å; F81-L100 HydrophobicContact CD1-CB 3.98Å; F81-L100 HydrophobicContact CE1-CB 4.45Å; F81-Q104 HydrophobicContact CD1-CB 4.21Å; F81-Q104 HydrophobicContact CE1-CB 3.94Å; F81-Q104 HydrophobicContact CE1-CG 4.18Å; F81-Q104 HydrophobicContact CZ-CG 4.31Å; F81-G267 CarbonylContact O-C 3.51Å; F81-G267 WeakPolarHBondContact O-CA 3.48Å; F81-M268 WeakPolarHBondContact CD2-O 3.41Å; F81-M268 PolarHBondContact N-O 3.39Å; F81-M268 PolarHBondContact O-N 3.16Å
82	P	84.5	Confident	83.5	Confident	14 Å²	14	55 Å²	55	9%	0.091	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	115.8	171.8	28.2	-30.8	0	0	0	109.2	Q103 M105 P264	P82-Q103 WeakPolarHBondContact CD-O 3.29Å; P82-Q103 HydrophobicContact CG-CB 3.9Å; P82-Q103 WeakPolarHBondContact CG-O 3.47Å; P82-M105 HydrophobicContact CB-CE 3.95Å; P82-P264 HydrophobicContact CB-CB 4.21Å; P82-P264 HydrophobicContact CB-CG 4.05Å
83	I	80.5	Confident	83.2	Confident	15 Å²	15	60 Å²	60	8%	0.077	33%	0.328	C	S	.	.			trans	-130.4	131.3	175.8	-57.9	-174.9	0	0	0	107.9	F81 L85 W97 L100 M268	F81-I83 HydrophobicContact CB-CD1 4.5Å; F81-I83 HydrophobicContact CB-CG1 4.34Å; F81-I83 PolarHBondContact O-N 2.98Å; I83-L85 PolarHBondContact O-N 2.99Å; I83-L85 VanDerWaalsContact O-N 3.11Å; I83-W97 HydrophobicContact CD1-CH2 3.58Å; I83-W97 HydrophobicContact CD1-CZ2 4.46Å; I83-W97 HydrophobicContact CD1-CZ3 3.81Å; I83-L100 HydrophobicContact CD1-CD1 4.47Å; I83-M268 HydrophobicContact CB-CG 4.45Å; I83-M268 HydrophobicContact CD1-CB 3.82Å; I83-M268 HydrophobicContact CD1-CG 3.93Å; I83-M268 HydrophobicContact CG1-CB 4.4Å; I83-M268 HydrophobicContact CG1-CG 4.46Å
84	N	78.1	Confident	82.7	Confident	42 Å²	42	60.1 Å²	60.1	23%	0.225	33%	0.328	C	S	.	.			trans	-78.5	95.3	173.1	-170.9	4.5	0	0	0	110.4	T86 S87	N84-T86 PolarHBondContact ND2-OG1 3.47Å; N84-T86 PolarHBondContact O-N 3.44Å; N84-T86 VanDerWaalsContact O-N 3.16Å; N84-T86 PolarHBondContact OD1-N 3.4Å; N84-T86 PolarHBondContact OD1-OG1 3.23Å; N84-S87 PolarHBondContact O-N 2.67Å; N84-S87 VanDerWaalsContact O-N 3.13Å; N84-S87 PolarHBondContact O-OG 3.33Å
85	L	75.4	Confident	82.4	Confident	60 Å²	60	66.3 Å²	66.3	31%	0.314	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-60.3	-23.5	-179.6	-74.4	157.6	0	0	0	113.7	I83 S87 G88 V266 M268 Q285	I83-L85 PolarHBondContact O-N 2.99Å; I83-L85 VanDerWaalsContact O-N 3.11Å; L85-S87 PolarHBondContact O-N 3.15Å; L85-G88 PolarHBondContact O-N 3.21Å; L85-V266 HydrophobicContact CD1-CB 4.25Å; L85-V266 HydrophobicContact CD1-CG1 3.42Å; L85-V266 VanDerWaalsContact CD1-CG1 3.42Å; L85-M268 HydrophobicContact CD1-CE 4.35Å; L85-M268 HydrophobicContact CD2-CE 3.28Å; L85-M268 HydrophobicContact CG-CE 4.29Å; L85-Q285 HydrophobicContact CD1-CG 4.2Å
86	T	73.8	Confident	82.1	Confident	117 Å²	117	70.1 Å²	70.1	72%	0.718	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-70.7	-20.9	179.1	65.3	0	0	0	0	112.9	N84 G88	N84-T86 PolarHBondContact ND2-OG1 3.47Å; N84-T86 PolarHBondContact O-N 3.44Å; N84-T86 VanDerWaalsContact O-N 3.16Å; N84-T86 PolarHBondContact OD1-N 3.4Å; N84-T86 PolarHBondContact OD1-OG1 3.23Å; T86-G88 PolarHBondContact O-N 3.33Å
87	S	74.3	Confident	81.7	Confident	64 Å²	64	68.8 Å²	68.8	45%	0.448	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-73.7	-16.6	175.6	68.5	0	0	0	0	113.1	N84 L85 I89	N84-S87 PolarHBondContact O-N 2.67Å; N84-S87 VanDerWaalsContact O-N 3.13Å; N84-S87 PolarHBondContact O-OG 3.33Å; L85-S87 PolarHBondContact O-N 3.15Å; S87-I89 PolarHBondContact O-N 3.33Å; S87-I89 VanDerWaalsContact O-N 3.09Å
88	G	71.9	Confident	81.4	Confident	67 Å²	67	66.7 Å²	66.7	69%	0.691	36%	0.359	S	S	*	.			trans	68.2	-1.9	-175.9	0	0	0	0	0	114.9	L85 T86	L85-G88 PolarHBondContact O-N 3.21Å; T86-G88 PolarHBondContact O-N 3.33Å
89	I	71.8	Confident	81.2	Confident	126 Å²	126	65.4 Å²	65.4	65%	0.646	37%	0.365	S	S	*	.			trans	-95.9	101.6	-176.8	-58.8	161.5	0	0	0	108.2	S87	S87-I89 PolarHBondContact O-N 3.33Å; S87-I89 VanDerWaalsContact O-N 3.09Å
90	V	78.9	Confident	80.9	Confident	47 Å²	47	67 Å²	67	29%	0.285	37%	0.373	S	S	.	.			trans	-98.8	131.2	167.1	-179.3	0	0	0	0	107.8	H92 W97	V90-H92 PolarHBondContact O-CD2 3.13Å; V90-H92 PolarHBondContact O-N 3.13Å; V90-W97 HydrophobicContact CG1-CH2 4.44Å; V90-W97 HydrophobicContact CG1-CZ2 3.91Å
91	P	81.1	Confident	80.4	Confident	18 Å²	18	73.8 Å²	73.8	12%	0.117	40%	0.399	C	S	.	.			trans	-56.6	126.3	179.1	-22	29.9	0	0	0	112.1	E96 W97 L100	P91-E96 VanDerWaalsContact CA-OE2 3.27Å; P91-E96 WeakPolarHBondContact CA-OE2 3.41Å; P91-E96 HydrophobicContact CB-CB 3.65Å; P91-E96 WeakPolarHBondContact CB-OE2 3.31Å; P91-W97 HydrophobicContact CB-CD2 4.35Å; P91-W97 HydrophobicContact CB-CG 4.39Å; P91-W97 HydrophobicContact CB-CZ2 4.45Å; P91-W97 HydrophobicContact CG-CZ2 4.46Å; P91-W97 PolarHBondContact O-NE1 3.39Å; P91-L100 HydrophobicContact CG-CD1 3.56Å
92	H	79	Confident	80	Confident	177 Å²	177	76.8 Å²	76.8	82%	0.819	42%	0.42	S	S	*	.			trans	-96.3	-26.8	-179.2	-67.7	-71.9	0	0	0	111.9	V90 E96	V90-H92 PolarHBondContact O-CD2 3.13Å; V90-H92 PolarHBondContact O-N 3.13Å; H92-E96 PolarHBondContact N-OE2 3.29Å
93	K	83.4	Confident	79.7	Confident	133 Å²	133	81.4 Å²	81.4	58%	0.578	44%	0.44	S	S	*	.	S	Bend	trans	-95.5	143.9	-177.7	-64.2	177.9	-177.9	172.7	0	111.1	Q95 E96 W97	K93-Q95 PolarHBondContact O-N 3.16Å; K93-E96 HydrophobicContact CB-CG 4.12Å; K93-E96 PolarHBondContact N-OE2 3.13Å; K93-E96 WeakPolarHBondContact O-CB 3.17Å; K93-E96 PolarHBondContact O-N 3.28Å; K93-E96 VanDerWaalsContact O-N 3.09Å; K93-W97 PolarHBondContact O-N 2.94Å
94	L	82.3	Confident	79.9	Confident	102 Å²	102	82.9 Å²	82.9	53%	0.534	45%	0.447	S	S	.	.	H	α-helix	trans	-56.9	-38.8	176.6	-175	64	0	0	0	112.4	E96 W97 D98	L94-E96 VanDerWaalsContact C-N 3.26Å; L94-E96 PolarHBondContact O-N 3.12Å; L94-W97 WeakPolarHBondContact O-CB 3.43Å; L94-W97 PolarHBondContact O-N 3.29Å; L94-D98 PolarHBondContact O-N 2.58Å
95	Q	84	Confident	80.1	Confident	153 Å²	153	81.3 Å²	81.3	72%	0.715	44%	0.439	S	S	*	.	H	α-helix	trans	-60.4	-34	178.2	-69.4	176.7	-20.3	0	0	112.9	K93 D98 A99	K93-Q95 PolarHBondContact O-N 3.16Å; Q95-D98 PolarHBondContact O-N 3.48Å; Q95-A99 PolarHBondContact O-N 3.07Å
96	E	84.4	Confident	80.6	Confident	81 Å²	81	80.9 Å²	80.9	38%	0.379	44%	0.436	S	S	.	.	H	α-helix	trans	-73.5	-36.9	178.9	-63.5	163.8	-174.9	0	0	111	P91 H92 K93 L94 D98 A99 L100	P91-E96 VanDerWaalsContact CA-OE2 3.27Å; P91-E96 WeakPolarHBondContact CA-OE2 3.41Å; P91-E96 HydrophobicContact CB-CB 3.65Å; P91-E96 WeakPolarHBondContact CB-OE2 3.31Å; H92-E96 PolarHBondContact N-OE2 3.29Å; K93-E96 HydrophobicContact CB-CG 4.12Å; K93-E96 PolarHBondContact N-OE2 3.13Å; K93-E96 WeakPolarHBondContact O-CB 3.17Å; K93-E96 PolarHBondContact O-N 3.28Å; K93-E96 VanDerWaalsContact O-N 3.09Å; L94-E96 VanDerWaalsContact C-N 3.26Å; L94-E96 PolarHBondContact O-N 3.12Å; E96-D98 VanDerWaalsContact C-N 3.33Å; E96-A99 WeakPolarHBondContact O-CB 3.4Å; E96-A99 PolarHBondContact O-N 2.99Å; E96-L100 PolarHBondContact O-N 3.3Å
97	W	83.6	Confident	81.2	Confident	6 Å²	6	76.8 Å²	76.8	2%	0.023	41%	0.408	C	S	.	.	H	α-helix	trans	-64.3	-38.8	171.1	-74.2	99.2	0	0	0	112.1	F81 I83 V90 P91 K93 L94 A99 L100 R101 M268 R270 F283	F81-W97 HydrophobicContact CB-CZ3 4.14Å; F81-W97 HydrophobicContact CD2-CE3 4.02Å; F81-W97 AromaticContact CD2-CZ3 3.75Å; F81-W97 HydrophobicContact CD2-CZ3 3.75Å; F81-W97 HydrophobicContact CE2-CE3 4.27Å; F81-W97 HydrophobicContact CE2-CZ3 4.38Å; F81-W97 HydrophobicContact CG-CE3 4.21Å; F81-W97 AromaticContact CG-CZ3 3.97Å; F81-W97 HydrophobicContact CG-CZ3 3.97Å; I83-W97 HydrophobicContact CD1-CH2 3.58Å; I83-W97 HydrophobicContact CD1-CZ2 4.46Å; I83-W97 HydrophobicContact CD1-CZ3 3.81Å; V90-W97 HydrophobicContact CG1-CH2 4.44Å; V90-W97 HydrophobicContact CG1-CZ2 3.91Å; P91-W97 HydrophobicContact CB-CD2 4.35Å; P91-W97 HydrophobicContact CB-CG 4.39Å; P91-W97 HydrophobicContact CB-CZ2 4.45Å; P91-W97 HydrophobicContact CG-CZ2 4.46Å; P91-W97 PolarHBondContact O-NE1 3.39Å; K93-W97 PolarHBondContact O-N 2.94Å; L94-W97 WeakPolarHBondContact O-CB 3.43Å; L94-W97 PolarHBondContact O-N 3.29Å; W97-A99 VanDerWaalsContact C-N 3.29Å; W97-A99 PolarHBondContact O-N 2.89Å; W97-L100 PolarHBondContact O-N 2.96Å; W97-L100 VanDerWaalsContact O-N 3.14Å; W97-R101 PolarHBondContact O-N 2.84Å; W97-M268 HydrophobicContact CH2-CB 4.12Å; W97-M268 HydrophobicContact CZ3-CB 4.47Å; W97-R270 HydrophobicContact CE3-CB 4.44Å; W97-R270 HydrophobicContact CZ3-CB 4.38Å; W97-F283 AromaticContact CE2-CE1 3.82Å; W97-F283 HydrophobicContact CH2-CD1 4.28Å; W97-F283 HydrophobicContact CH2-CE1 4.24Å; W97-F283 AromaticContact CZ2-CD1 3.92Å; W97-F283 HydrophobicContact CZ2-CD1 3.92Å; W97-F283 AromaticContact CZ2-CE1 3.51Å; W97-F283 HydrophobicContact CZ2-CE1 3.51Å
98	D	83.9	Confident	81.9	Confident	59 Å²	59	73.7 Å²	73.7	32%	0.316	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-33.5	176.8	-68	-23.3	0	0	0	111.7	L94 Q95 E96 L100 R101	L94-D98 PolarHBondContact O-N 2.58Å; Q95-D98 PolarHBondContact O-N 3.48Å; E96-D98 VanDerWaalsContact C-N 3.33Å; D98-L100 VanDerWaalsContact C-N 3.28Å; D98-L100 PolarHBondContact O-N 2.98Å; D98-R101 VanDerWaalsContact CG-NH2 3.28Å; D98-R101 VanDerWaalsContact O-CB 3.25Å; D98-R101 WeakPolarHBondContact O-CB 3.35Å; D98-R101 PolarHBondContact O-N 3.21Å; D98-R101 IonicContact OD1-CZ 3.48Å; D98-R101 IonicContact OD1-NH2 2.84Å; D98-R101 PolarHBondContact OD1-NH2 2.96Å; D98-R101 IonicContact OD2-NH2 2.88Å
99	A	83.8	Confident	82.7	Confident	73 Å²	73	72.6 Å²	72.6	60%	0.603	36%	0.363	S	S	*	.	H	α-helix	trans	-67.3	-25.7	172.1	0	0	0	0	0	113.4	Q95 E96 W97 P102	Q95-A99 PolarHBondContact O-N 3.07Å; E96-A99 WeakPolarHBondContact O-CB 3.4Å; E96-A99 PolarHBondContact O-N 2.99Å; W97-A99 VanDerWaalsContact C-N 3.29Å; W97-A99 PolarHBondContact O-N 2.89Å; A99-P102 VanDerWaalsContact O-CD 3.26Å; A99-P102 WeakPolarHBondContact O-CD 3.3Å
100	L	83.3	Confident	83.6	Confident	35 Å²	35	73.4 Å²	73.4	18%	0.183	36%	0.358	C	S	.	.	H	α-helix	trans	-85.2	-11.3	175.4	-70.4	170	0	0	0	113.7	F81 I83 P91 E96 W97 D98 P102 Q103 Q104	F81-L100 HydrophobicContact CD1-CB 3.98Å; F81-L100 HydrophobicContact CE1-CB 4.45Å; I83-L100 HydrophobicContact CD1-CD1 4.47Å; P91-L100 HydrophobicContact CG-CD1 3.56Å; E96-L100 PolarHBondContact O-N 3.3Å; W97-L100 PolarHBondContact O-N 2.96Å; W97-L100 VanDerWaalsContact O-N 3.14Å; D98-L100 VanDerWaalsContact C-N 3.28Å; D98-L100 PolarHBondContact O-N 2.98Å; L100-P102 VanDerWaalsContact C-N 3.32Å; L100-Q103 WeakPolarHBondContact O-CA 3.44Å; L100-Q103 WeakPolarHBondContact O-CB 3.11Å; L100-Q103 PolarHBondContact O-N 3.28Å; L100-Q104 PolarHBondContact O-N 3.38Å
101	R	82.2	Confident	84.3	Confident	143 Å²	143	71.1 Å²	71.1	54%	0.54	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-52.1	-39.7	178.3	-158.4	-175.8	-61.3	164.7	-1.2	114.3	W97 D98 Q103 Q104	W97-R101 PolarHBondContact O-N 2.84Å; D98-R101 VanDerWaalsContact CG-NH2 3.28Å; D98-R101 VanDerWaalsContact O-CB 3.25Å; D98-R101 WeakPolarHBondContact O-CB 3.35Å; D98-R101 PolarHBondContact O-N 3.21Å; D98-R101 IonicContact OD1-CZ 3.48Å; D98-R101 IonicContact OD1-NH2 2.84Å; D98-R101 PolarHBondContact OD1-NH2 2.96Å; D98-R101 IonicContact OD2-NH2 2.88Å; R101-Q103 PolarHBondContact O-N 3.36Å; R101-Q104 WeakPolarHBondContact O-CB 3.21Å; R101-Q104 PolarHBondContact O-N 2.8Å; R101-Q104 VanDerWaalsContact O-N 3.11Å
102	P	80.1	Confident	84.9	Confident	81 Å²	81	70.7 Å²	70.7	53%	0.526	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-59.8	-29.4	173.6	-23.3	35.1	0	0	0	113.1	A99 L100 R233	A99-P102 VanDerWaalsContact O-CD 3.26Å; A99-P102 WeakPolarHBondContact O-CD 3.3Å; L100-P102 VanDerWaalsContact C-N 3.32Å; P102-R233 PolarHBondContact O-NH1 3.38Å; P102-R233 PolarHBondContact O-NH2 3.39Å
103	Q	77.4	Confident	85.6	Confident	110 Å²	110	67.4 Å²	67.4	51%	0.514	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-89.9	-1.2	-179.5	-59.4	-178	-1.1	0	0	113.2	P82 L100 R101 M105	P82-Q103 WeakPolarHBondContact CD-O 3.29Å; P82-Q103 HydrophobicContact CG-CB 3.9Å; P82-Q103 WeakPolarHBondContact CG-O 3.47Å; L100-Q103 WeakPolarHBondContact O-CA 3.44Å; L100-Q103 WeakPolarHBondContact O-CB 3.11Å; L100-Q103 PolarHBondContact O-N 3.28Å; R101-Q103 PolarHBondContact O-N 3.36Å; Q103-M105 PolarHBondContact O-N 3.1Å; Q103-M105 VanDerWaalsContact O-N 3.16Å
104	Q	84.2	Confident	86.1	Confident	46 Å²	46	62.1 Å²	62.1	22%	0.215	31%	0.308	C	S	.	.			trans	-56	122.3	175.9	-172.1	173.3	2.3	0	0	109.8	E78 F81 L100 R101 R233	E78-Q104 PolarHBondContact O-NE2 3.18Å; F81-Q104 HydrophobicContact CD1-CB 4.21Å; F81-Q104 HydrophobicContact CE1-CB 3.94Å; F81-Q104 HydrophobicContact CE1-CG 4.18Å; F81-Q104 HydrophobicContact CZ-CG 4.31Å; L100-Q104 PolarHBondContact O-N 3.38Å; R101-Q104 WeakPolarHBondContact O-CB 3.21Å; R101-Q104 PolarHBondContact O-N 2.8Å; R101-Q104 VanDerWaalsContact O-N 3.11Å; Q104-R233 PolarHBondContact O-NH1 3.17Å
105	M	82.6	Confident	86.7	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.049	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-89.9	115.7	179.6	49	169.1	128.7	0	0	108.7	G79 T80 P82 Q103 Y107 Y108 P264 L288	G79-M105 WeakPolarHBondContact CA-O 3.39Å; T80-M105 PolarHBondContact N-O 3Å; T80-M105 WeakPolarHBondContact O-CG 3.46Å; T80-M105 PolarHBondContact O-N 2.85Å; T80-M105 WeakPolarHBondContact OG1-CE 3.3Å; T80-M105 VanDerWaalsContact OG1-CG 3.23Å; T80-M105 WeakPolarHBondContact OG1-CG 3.23Å; T80-M105 PolarHBondContact OG1-SD 3.23Å; P82-M105 HydrophobicContact CB-CE 3.95Å; Q103-M105 PolarHBondContact O-N 3.1Å; Q103-M105 VanDerWaalsContact O-N 3.16Å; M105-Y107 HydrophobicContact CB-CD1 4.41Å; M105-Y107 HydrophobicContact CB-CE1 4.45Å; M105-Y108 HydrophobicContact CB-CE1 3.74Å; M105-Y108 HydrophobicContact CG-CE1 3.75Å; M105-Y108 WeakPolarHBondContact O-CE1 3.46Å; M105-Y108 PolarHBondContact O-OH 2.94Å; M105-Y108 HydrophobicContact SD-CE1 3.83Å; M105-P264 HydrophobicContact CE-CB 3.89Å; M105-P264 HydrophobicContact CE-CG 3.24Å; M105-P264 HydrophobicContact SD-CG 3.72Å; M105-L288 HydrophobicContact SD-CD2 3.54Å; M105-L288 VanDerWaalsContact SD-CD2 3.54Å
106	N	85.8	Confident	87.3	Confident	50 Å²	50	50.6 Å²	50.6	27%	0.267	26%	0.255	S	S	.	.			trans	-138.7	17.1	171	-160.8	4	0	0	0	112	I77 Y108 Q109	I77-N106 PolarHBondContact O-ND2 3.42Å; I77-N106 VanDerWaalsContact O-ND2 3.14Å; N106-Y108 VanDerWaalsContact C-N 3.33Å; N106-Q109 WeakPolarHBondContact OD1-CG 3.29Å; N106-Q109 PolarHBondContact OD1-NE2 3.3Å; N106-Q109 PolarHBondContact OD1-OE1 2.98Å; N106-Q109 VanDerWaalsContact OD1-OE1 3.11Å
107	Y	87.6	Confident	87.8	Confident	31 Å²	31	51 Å²	51	12%	0.122	26%	0.26	C	S	.	.			trans	-74.9	-26.7	-176.2	74.8	-90.1	0	0	0	111.9	M105 Q109 W110 V111 F231 L232 F263 N291	M105-Y107 HydrophobicContact CB-CD1 4.41Å; M105-Y107 HydrophobicContact CB-CE1 4.45Å; Y107-Q109 PolarHBondContact O-N 3.33Å; Y107-W110 WeakPolarHBondContact O-CB 3.28Å; Y107-W110 PolarHBondContact O-N 3.46Å; Y107-V111 HydrophobicContact CD2-CG2 4.06Å; Y107-V111 HydrophobicContact CE2-CG2 4.19Å; Y107-V111 PolarHBondContact O-N 3.14Å; Y107-F231 AromaticContact CD2-CE1 3.78Å; Y107-F231 HydrophobicContact CD2-CE1 3.78Å; Y107-F231 HydrophobicContact CD2-CZ 4.12Å; Y107-F231 VanDerWaalsContact O-CZ 3.3Å; Y107-F231 WeakPolarHBondContact O-CZ 3.48Å; Y107-L232 HydrophobicContact CE2-CD2 4.21Å; Y107-F263 VanDerWaalsContact OH-CD1 3.28Å; Y107-F263 WeakPolarHBondContact OH-CD1 3.5Å; Y107-F263 WeakPolarHBondContact OH-CE1 3.41Å; Y107-N291 PolarHBondContact OH-OD1 3.07Å
108	Y	87.6	Confident	88.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-61.6	-28.3	-173.8	30.4	-102	0	0	0	113.7	W76 G79 T80 M105 N106 W110 V111 L288	W76-Y108 AromaticContact CE3-CD2 3.93Å; W76-Y108 HydrophobicContact CE3-CD2 3.93Å; W76-Y108 AromaticContact CE3-CE2 3.87Å; W76-Y108 HydrophobicContact CE3-CE2 3.87Å; W76-Y108 AromaticContact CH2-CD2 3.49Å; W76-Y108 HydrophobicContact CH2-CD2 3.49Å; W76-Y108 VanDerWaalsContact CH2-CD2 3.49Å; W76-Y108 HydrophobicContact CH2-CE2 4.26Å; W76-Y108 HydrophobicContact CH2-CG 4.26Å; W76-Y108 HydrophobicContact CZ2-CD2 4.34Å; W76-Y108 AromaticContact CZ3-CD2 3.23Å; W76-Y108 HydrophobicContact CZ3-CD2 3.23Å; W76-Y108 AromaticContact CZ3-CE2 3.63Å; W76-Y108 HydrophobicContact CZ3-CE2 3.63Å; W76-Y108 HydrophobicContact CZ3-CG 4.09Å; G79-Y108 WeakPolarHBondContact CA-OH 3.16Å; T80-Y108 PolarHBondContact N-OH 3.18Å; T80-Y108 PolarHBondContact OG1-OH 3.49Å; M105-Y108 HydrophobicContact CB-CE1 3.74Å; M105-Y108 HydrophobicContact CG-CE1 3.75Å; M105-Y108 WeakPolarHBondContact O-CE1 3.46Å; M105-Y108 PolarHBondContact O-OH 2.94Å; M105-Y108 HydrophobicContact SD-CE1 3.83Å; N106-Y108 VanDerWaalsContact C-N 3.33Å; Y108-W110 PolarHBondContact O-N 3.34Å; Y108-V111 PolarHBondContact O-N 3.44Å; Y108-L288 HydrophobicContact CD1-CD2 4.45Å; Y108-L288 HydrophobicContact CE1-CD2 3.78Å
109	Q	89.5	Confident	88.9	Confident	43 Å²	43	48.1 Å²	48.1	20%	0.201	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-62.4	-30.6	174	-62.2	179	-11.3	0	0	112.7	W76 I77 N106 Y107	W76-Q109 HydrophobicContact CH2-CG 4.4Å; W76-Q109 HydrophobicContact CZ2-CB 4.49Å; W76-Q109 HydrophobicContact CZ2-CG 3.83Å; W76-Q109 PolarHBondContact O-NE2 2.96Å; I77-Q109 VanDerWaalsContact CA-NE2 3.33Å; I77-Q109 PolarHBondContact O-NE2 3.1Å; I77-Q109 VanDerWaalsContact O-NE2 3.08Å; N106-Q109 WeakPolarHBondContact OD1-CG 3.29Å; N106-Q109 PolarHBondContact OD1-NE2 3.3Å; N106-Q109 PolarHBondContact OD1-OE1 2.98Å; N106-Q109 VanDerWaalsContact OD1-OE1 3.11Å; Y107-Q109 PolarHBondContact O-N 3.33Å
110	W	91.7	Very high	89.5	Confident	143 Å²	143	49.6 Å²	49.6	54%	0.542	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-93	-11.5	-173.2	-62.4	95.3	0	0	0	113.4	Y107 Y108 L113 V114 F231	Y107-W110 WeakPolarHBondContact O-CB 3.28Å; Y107-W110 PolarHBondContact O-N 3.46Å; Y108-W110 PolarHBondContact O-N 3.34Å; W110-L113 HydrophobicContact CE3-CD1 3.75Å; W110-L113 HydrophobicContact CZ3-CD1 3.92Å; W110-L113 PolarHBondContact O-N 3.45Å; W110-L113 VanDerWaalsContact O-N 3.16Å; W110-V114 WeakPolarHBondContact O-CG2 2.92Å; W110-V114 PolarHBondContact O-N 3.49Å; W110-F231 HydrophobicContact CB-CE2 3.8Å; W110-F231 HydrophobicContact CB-CZ 3.95Å
111	V	93	Very high	90	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-54	-50.4	-174.3	174.4	0	0	0	0	112.1	V44 Y107 Y108 L113 V114 L115 F231 Y298	V44-V111 HydrophobicContact CB-CG1 4.44Å; V44-V111 HydrophobicContact CG1-CB 4.21Å; V44-V111 HydrophobicContact CG1-CG1 3.89Å; V44-V111 HydrophobicContact CG2-CG1 4.13Å; Y107-V111 HydrophobicContact CD2-CG2 4.06Å; Y107-V111 HydrophobicContact CE2-CG2 4.19Å; Y107-V111 PolarHBondContact O-N 3.14Å; Y108-V111 PolarHBondContact O-N 3.44Å; V111-L113 VanDerWaalsContact C-N 3.34Å; V111-L113 PolarHBondContact O-N 2.91Å; V111-V114 PolarHBondContact O-N 3.32Å; V111-L115 HydrophobicContact CG1-CD1 3.86Å; V111-L115 HydrophobicContact CG1-CG 4.3Å; V111-L115 WeakPolarHBondContact O-CG 3.25Å; V111-L115 PolarHBondContact O-N 3.01Å; V111-F231 HydrophobicContact CB-CE1 4.46Å; V111-F231 HydrophobicContact CG2-CE1 3.66Å; V111-F231 HydrophobicContact CG2-CZ 3.89Å; V111-Y298 HydrophobicContact CG1-CE2 4.2Å; V111-Y298 HydrophobicContact CG2-CE2 4.49Å
112	P	93.1	Very high	90.6	Very high	8 Å²	8	43.1 Å²	43.1	5%	0.052	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-38.8	-179.8	-22.2	34.2	0	0	0	113.4	M41 V44 T45 L115 G116	M41-P112 HydrophobicContact CG-CB 4.32Å; M41-P112 WeakPolarHBondContact CG-O 3.37Å; V44-P112 HydrophobicContact CB-CG 4.33Å; V44-P112 HydrophobicContact CG1-CG 3.82Å; T45-P112 WeakPolarHBondContact OG1-CB 3.42Å; P112-L115 PolarHBondContact O-N 3.17Å; P112-G116 PolarHBondContact O-N 2.97Å
113	L	93.7	Very high	91.3	Very high	108 Å²	108	44.3 Å²	44.3	57%	0.565	21%	0.213	S	C	*	.	H	α-helix	trans	-66.1	-42.3	179.5	-64.5	176.4	0	0	0	111	W110 V111 G116 L117	W110-L113 HydrophobicContact CE3-CD1 3.75Å; W110-L113 HydrophobicContact CZ3-CD1 3.92Å; W110-L113 PolarHBondContact O-N 3.45Å; W110-L113 VanDerWaalsContact O-N 3.16Å; V111-L113 VanDerWaalsContact C-N 3.34Å; V111-L113 PolarHBondContact O-N 2.91Å; L113-G116 PolarHBondContact O-N 2.98Å; L113-L117 PolarHBondContact O-N 2.81Å
114	V	94.7	Very high	92.1	Very high	22 Å²	22	42.2 Å²	42.2	13%	0.133	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-47	176.3	171.2	0	0	0	0	110.7	W110 V111 G116 L117 Q118 L227 F231	W110-V114 WeakPolarHBondContact O-CG2 2.92Å; W110-V114 PolarHBondContact O-N 3.49Å; V111-V114 PolarHBondContact O-N 3.32Å; V114-G116 VanDerWaalsContact C-N 3.28Å; V114-G116 PolarHBondContact O-N 2.87Å; V114-L117 WeakPolarHBondContact O-CB 3.42Å; V114-L117 PolarHBondContact O-N 3.15Å; V114-L117 VanDerWaalsContact O-N 3.12Å; V114-Q118 HydrophobicContact CG1-CG 4.24Å; V114-Q118 VanDerWaalsContact O-CG 3.27Å; V114-Q118 WeakPolarHBondContact O-CG 3.48Å; V114-Q118 PolarHBondContact O-N 3.44Å; V114-L227 HydrophobicContact CG1-CD2 3.41Å; V114-L227 VanDerWaalsContact CG1-CD2 3.41Å; V114-F231 HydrophobicContact CB-CE2 4.36Å; V114-F231 HydrophobicContact CB-CZ 4.49Å; V114-F231 HydrophobicContact CG1-CD2 4.46Å; V114-F231 HydrophobicContact CG1-CG 4.45Å; V114-F231 HydrophobicContact CG2-CD2 3.86Å; V114-F231 HydrophobicContact CG2-CE2 3.58Å; V114-F231 HydrophobicContact CG2-CZ 4.11Å
115	L	95.4	Very high	92.6	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.7	-39.9	176.5	-69.8	173.6	0	0	0	112.2	L37 C40 M41 V44 V111 P112 Q118 A119 L301	L37-L115 HydrophobicContact CD2-CD2 3.95Å; C40-L115 HydrophobicContact CB-CD1 4.18Å; M41-L115 HydrophobicContact CB-CB 3.98Å; V44-L115 HydrophobicContact CG2-CD1 4.23Å; V111-L115 HydrophobicContact CG1-CD1 3.86Å; V111-L115 HydrophobicContact CG1-CG 4.3Å; V111-L115 WeakPolarHBondContact O-CG 3.25Å; V111-L115 PolarHBondContact O-N 3.01Å; P112-L115 PolarHBondContact O-N 3.17Å; L115-Q118 PolarHBondContact O-N 3.49Å; L115-A119 PolarHBondContact O-N 2.9Å; L115-L301 HydrophobicContact CD2-CD1 3.65Å
116	G	95.2	Very high	93	Very high	13 Å²	13	40.2 Å²	40.2	13%	0.134	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-44.5	173.4	0	0	0	0	0	112.9	P112 L113 V114 Q118 A119 I120	P112-G116 PolarHBondContact O-N 2.97Å; L113-G116 PolarHBondContact O-N 2.98Å; V114-G116 VanDerWaalsContact C-N 3.28Å; V114-G116 PolarHBondContact O-N 2.87Å; G116-Q118 PolarHBondContact O-N 3.32Å; G116-A119 WeakPolarHBondContact O-CB 3.25Å; G116-A119 PolarHBondContact O-N 3.43Å; G116-I120 WeakPolarHBondContact O-CG1 3.32Å; G116-I120 PolarHBondContact O-N 3.41Å; G116-I120 VanDerWaalsContact O-N 3.12Å
117	L	95.2	Very high	93.3	Very high	90 Å²	90	41.7 Å²	41.7	47%	0.471	20%	0.201	S	C	.	.	H	α-helix	trans	-61.6	-43.2	174.7	178.9	63.6	0	0	0	111.6	L113 V114 A119 I120 L121	L113-L117 PolarHBondContact O-N 2.81Å; V114-L117 WeakPolarHBondContact O-CB 3.42Å; V114-L117 PolarHBondContact O-N 3.15Å; V114-L117 VanDerWaalsContact O-N 3.12Å; L117-A119 VanDerWaalsContact C-N 3.3Å; L117-A119 PolarHBondContact O-N 3.41Å; L117-I120 PolarHBondContact O-N 3.16Å; L117-L121 HydrophobicContact CG-CD1 4.31Å; L117-L121 WeakPolarHBondContact O-CG 3.17Å; L117-L121 PolarHBondContact O-N 3.42Å
118	Q	95.8	Very high	93.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.6	-41.4	176.2	-68.9	-170.1	-36.8	0	0	111.4	L37 V114 L115 G116 I120 L121 Y122 Q224 L227	L37-Q118 HydrophobicContact CD1-CB 4.03Å; L37-Q118 HydrophobicContact CD2-CB 4.31Å; V114-Q118 HydrophobicContact CG1-CG 4.24Å; V114-Q118 VanDerWaalsContact O-CG 3.27Å; V114-Q118 WeakPolarHBondContact O-CG 3.48Å; V114-Q118 PolarHBondContact O-N 3.44Å; L115-Q118 PolarHBondContact O-N 3.49Å; G116-Q118 PolarHBondContact O-N 3.32Å; Q118-I120 PolarHBondContact O-N 3.26Å; Q118-L121 PolarHBondContact O-N 3.25Å; Q118-Y122 WeakPolarHBondContact O-CD2 3.29Å; Q118-Y122 PolarHBondContact O-N 3.36Å; Q118-Y122 VanDerWaalsContact O-N 3.16Å; Q118-Q224 PolarHBondContact O-NE2 3.49Å; Q118-L227 HydrophobicContact CG-CD2 4.22Å
119	A	95.8	Very high	93.7	Very high	4 Å²	4	43 Å²	43	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-61.7	-43.3	176.3	0	0	0	0	0	111.8	V34 L37 L38 L115 G116 L117 L121 Y122 Y123	V34-A119 HydrophobicContact CG1-CB 4.4Å; L37-A119 HydrophobicContact CB-CB 3.99Å; L37-A119 HydrophobicContact CD1-CB 4.43Å; L38-A119 HydrophobicContact CD2-CB 4.03Å; L38-A119 HydrophobicContact CG-CB 4.15Å; L115-A119 PolarHBondContact O-N 2.9Å; G116-A119 WeakPolarHBondContact O-CB 3.25Å; G116-A119 PolarHBondContact O-N 3.43Å; L117-A119 VanDerWaalsContact C-N 3.3Å; L117-A119 PolarHBondContact O-N 3.41Å; A119-L121 PolarHBondContact O-N 3.46Å; A119-Y122 PolarHBondContact O-N 2.99Å; A119-Y123 PolarHBondContact O-N 3.04Å
120	I	94.8	Very high	93.7	Very high	105 Å²	105	42.8 Å²	42.8	54%	0.538	21%	0.213	S	C	.	.	H	α-helix	trans	-60.8	-47.1	176.4	-65.9	166.8	0	0	0	110.6	G116 L117 Q118 Y122 Y123 I124	G116-I120 WeakPolarHBondContact O-CG1 3.32Å; G116-I120 PolarHBondContact O-N 3.41Å; G116-I120 VanDerWaalsContact O-N 3.12Å; L117-I120 PolarHBondContact O-N 3.16Å; Q118-I120 PolarHBondContact O-N 3.26Å; I120-Y122 VanDerWaalsContact C-N 3.32Å; I120-Y122 PolarHBondContact O-N 3.27Å; I120-Y123 WeakPolarHBondContact O-CB 3.45Å; I120-Y123 PolarHBondContact O-N 3.11Å; I120-I124 PolarHBondContact O-N 3.29Å
121	L	95.3	Very high	93.5	Very high	40 Å²	40	40.1 Å²	40.1	21%	0.209	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-37.9	-178.8	-71.9	173.3	0	0	0	113	L117 Q118 A119 Y123 I124 P125 F223 Q224	L117-L121 HydrophobicContact CG-CD1 4.31Å; L117-L121 WeakPolarHBondContact O-CG 3.17Å; L117-L121 PolarHBondContact O-N 3.42Å; Q118-L121 PolarHBondContact O-N 3.25Å; A119-L121 PolarHBondContact O-N 3.46Å; L121-Y123 VanDerWaalsContact C-N 3.25Å; L121-Y123 PolarHBondContact O-N 3.13Å; L121-I124 HydrophobicContact CD2-CD1 3.91Å; L121-I124 PolarHBondContact O-N 2.93Å; L121-P125 WeakPolarHBondContact O-CD 3.34Å; L121-F223 HydrophobicContact CD1-CD1 4.19Å; L121-F223 HydrophobicContact CD1-CE1 3.73Å; L121-Q224 VanDerWaalsContact CB-NE2 3.33Å
122	Y	94.9	Very high	93.2	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-66.8	-24.4	173.8	-89.5	-66.6	0	0	0	113.6	N29 N33 L37 Q118 A119 I120 V220 Q224 L305	N29-Y122 HydrophobicContact CB-CD1 4.49Å; N33-Y122 HydrophobicContact CB-CD1 4.23Å; N33-Y122 HydrophobicContact CB-CD2 4.03Å; N33-Y122 HydrophobicContact CB-CE1 4.39Å; N33-Y122 HydrophobicContact CB-CE2 4.17Å; N33-Y122 HydrophobicContact CB-CG 4.05Å; N33-Y122 WeakPolarHBondContact ND2-CE1 3.43Å; L37-Y122 HydrophobicContact CD1-CD2 3.51Å; L37-Y122 HydrophobicContact CD1-CE2 3.86Å; Q118-Y122 WeakPolarHBondContact O-CD2 3.29Å; Q118-Y122 PolarHBondContact O-N 3.36Å; Q118-Y122 VanDerWaalsContact O-N 3.16Å; A119-Y122 PolarHBondContact O-N 2.99Å; I120-Y122 VanDerWaalsContact C-N 3.32Å; I120-Y122 PolarHBondContact O-N 3.27Å; Y122-V220 HydrophobicContact CD1-CG1 3.9Å; Y122-V220 HydrophobicContact CE1-CG1 4.11Å; Y122-V220 HydrophobicContact CG-CG1 4.31Å; Y122-Q224 HydrophobicContact CD2-CG 4.05Å; Y122-Q224 HydrophobicContact CE1-CG 4.31Å; Y122-Q224 HydrophobicContact CE2-CB 3.9Å; Y122-Q224 HydrophobicContact CE2-CG 3.43Å; Y122-Q224 VanDerWaalsContact CE2-CG 3.43Å; Y122-L305 HydrophobicContact CE2-CD1 4.37Å; Y122-L305 HydrophobicContact CE2-CD2 3.93Å
123	Y	94.1	Very high	92.8	Very high	106 Å²	106	44.1 Å²	44.1	42%	0.416	23%	0.225	S	C	.	.	H	α-helix	trans	-86.8	-21.5	-179.9	-164.2	-103.2	0	0	0	113.5	F30 A119 I120 L121 R126 I127	F30-Y123 HydrophobicContact CB-CD2 4.23Å; F30-Y123 HydrophobicContact CD2-CE2 4.35Å; A119-Y123 PolarHBondContact O-N 3.04Å; I120-Y123 WeakPolarHBondContact O-CB 3.45Å; I120-Y123 PolarHBondContact O-N 3.11Å; L121-Y123 VanDerWaalsContact C-N 3.25Å; L121-Y123 PolarHBondContact O-N 3.13Å; Y123-R126 HydrophobicContact CE2-CG 4.22Å; Y123-R126 WeakPolarHBondContact O-CB 3.43Å; Y123-R126 PolarHBondContact O-N 3.32Å; Y123-I127 HydrophobicContact CD1-CD1 3.67Å; Y123-I127 HydrophobicContact CD1-CG1 3.74Å; Y123-I127 HydrophobicContact CE1-CD1 3.87Å; Y123-I127 HydrophobicContact CE1-CG1 3.64Å; Y123-I127 PolarHBondContact O-N 3.21Å
124	I	94.2	Very high	92.3	Very high	66 Å²	66	46.4 Å²	46.4	34%	0.338	23%	0.227	S	C	.	.	H	α-helix	trans	-54.8	-47.2	-178.7	-70	172.8	0	0	0	113.6	I120 L121 R126 I127 I128	I120-I124 PolarHBondContact O-N 3.29Å; L121-I124 HydrophobicContact CD2-CD1 3.91Å; L121-I124 PolarHBondContact O-N 2.93Å; I124-R126 PolarHBondContact O-N 2.99Å; I124-I127 WeakPolarHBondContact O-CB 3.43Å; I124-I127 PolarHBondContact O-N 3.47Å; I124-I128 HydrophobicContact CG2-CD1 3.7Å; I124-I128 HydrophobicContact CG2-CG1 4.26Å; I124-I128 WeakPolarHBondContact O-CG1 3.36Å; I124-I128 PolarHBondContact O-N 2.93Å
125	P	93.9	Very high	91.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-62.4	-30.1	-177.8	-21.9	33.6	0	0	0	112.9	L121 I128 W129 L216 Y217 V220	L121-P125 WeakPolarHBondContact O-CD 3.34Å; P125-I128 PolarHBondContact O-N 3.44Å; P125-W129 WeakPolarHBondContact O-CB 3.43Å; P125-W129 PolarHBondContact O-N 2.9Å; P125-L216 HydrophobicContact CB-CD2 3.85Å; P125-L216 HydrophobicContact CB-CG 4.13Å; P125-L216 HydrophobicContact CG-CD2 4.01Å; P125-L216 HydrophobicContact CG-CG 3.95Å; P125-Y217 HydrophobicContact CB-CD1 3.8Å; P125-Y217 HydrophobicContact CB-CD2 4.3Å; P125-Y217 HydrophobicContact CB-CE1 3.55Å; P125-Y217 HydrophobicContact CB-CE2 4.08Å; P125-Y217 HydrophobicContact CB-CG 4.17Å; P125-Y217 HydrophobicContact CG-CD1 3.81Å; P125-Y217 HydrophobicContact CG-CE1 3.83Å; P125-Y217 HydrophobicContact CG-CG 4.44Å; P125-V220 HydrophobicContact CG-CG2 4.09Å
126	R	92.1	Very high	90.4	Very high	15 Å²	15	56.4 Å²	56.4	6%	0.057	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-43.6	173.6	173.9	65.2	-178.7	142.9	9	111.7	E22 F30 Y123 I124 W129 S130 Q142 Y217	E22-R126 WeakPolarHBondContact OE1-CD 3.27Å; E22-R126 IonicContact OE1-CZ 3.47Å; E22-R126 IonicContact OE1-NE 3.56Å; E22-R126 PolarHBondContact OE1-NE 3.5Å; E22-R126 IonicContact OE1-NH1 3.48Å; E22-R126 PolarHBondContact OE1-NH1 3.13Å; E22-R126 IonicContact OE2-CZ 3.81Å; E22-R126 IonicContact OE2-NE 2.67Å; E22-R126 IonicContact OE2-NH1 3.23Å; E22-R126 PolarHBondContact OE2-NH1 3.01Å; F30-R126 HydrophobicContact CB-CB 3.81Å; F30-R126 HydrophobicContact CB-CG 4.31Å; F30-R126 HydrophobicContact CD1-CB 4.35Å; F30-R126 HydrophobicContact CD1-CG 4.39Å; F30-R126 HydrophobicContact CD2-CG 4.09Å; F30-R126 HydrophobicContact CG-CB 3.98Å; F30-R126 HydrophobicContact CG-CG 4Å; Y123-R126 HydrophobicContact CE2-CG 4.22Å; Y123-R126 WeakPolarHBondContact O-CB 3.43Å; Y123-R126 PolarHBondContact O-N 3.32Å; I124-R126 PolarHBondContact O-N 2.99Å; R126-W129 PolarHBondContact O-N 3.37Å; R126-S130 WeakPolarHBondContact O-CB 2.92Å; R126-S130 PolarHBondContact O-N 3.07Å; R126-Q142 VanDerWaalsContact NH2-NE2 3.18Å; R126-Y217 PolarHBondContact N-OH 3.05Å
127	I	91.9	Very high	89.2	Confident	80 Å²	80	56.7 Å²	56.7	41%	0.41	27%	0.271	S	S	.	.	H	α-helix	trans	-60.3	-49	175.5	-64.3	172.9	0	0	0	109.6	Y123 I124 W129 S130 I131	Y123-I127 HydrophobicContact CD1-CD1 3.67Å; Y123-I127 HydrophobicContact CD1-CG1 3.74Å; Y123-I127 HydrophobicContact CE1-CD1 3.87Å; Y123-I127 HydrophobicContact CE1-CG1 3.64Å; Y123-I127 PolarHBondContact O-N 3.21Å; I124-I127 WeakPolarHBondContact O-CB 3.43Å; I124-I127 PolarHBondContact O-N 3.47Å; I127-W129 VanDerWaalsContact C-N 3.34Å; I127-W129 PolarHBondContact O-N 2.89Å; I127-S130 PolarHBondContact O-N 3.33Å; I127-I131 HydrophobicContact CG2-CD1 3.71Å; I127-I131 HydrophobicContact CG2-CG1 4.34Å; I127-I131 VanDerWaalsContact O-CG1 3.29Å; I127-I131 WeakPolarHBondContact O-CG1 3.39Å; I127-I131 PolarHBondContact O-N 3.28Å
128	I	92.3	Very high	87.9	Confident	56 Å²	56	55.2 Å²	55.2	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-59.3	-47.1	179.9	-63	170.2	0	0	0	110.2	I124 P125 S130 I131 F132 I213 L216	I124-I128 HydrophobicContact CG2-CD1 3.7Å; I124-I128 HydrophobicContact CG2-CG1 4.26Å; I124-I128 WeakPolarHBondContact O-CG1 3.36Å; I124-I128 PolarHBondContact O-N 2.93Å; P125-I128 PolarHBondContact O-N 3.44Å; I128-S130 PolarHBondContact O-N 2.91Å; I128-I131 PolarHBondContact O-N 3.33Å; I128-F132 HydrophobicContact CG2-CD2 3.7Å; I128-F132 HydrophobicContact CG2-CE2 3.58Å; I128-F132 VanDerWaalsContact O-CD2 3.22Å; I128-F132 WeakPolarHBondContact O-CD2 3.36Å; I128-F132 PolarHBondContact O-N 3.2Å; I128-I213 HydrophobicContact CB-CD1 4.09Å; I128-I213 HydrophobicContact CG2-CD1 3.7Å; I128-L216 HydrophobicContact CD1-CD2 3.71Å
129	W	91.6	Very high	86.8	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.008	29%	0.292	C	S	.	.	H	α-helix	trans	-57.5	-46.9	175.9	178.5	-128.1	0	0	0	112.2	F21 P125 R126 I127 I131 F132 T133 L206 V209 Y210 I213 F368	F21-W129 AromaticContact CD1-CE2 3.92Å; F21-W129 HydrophobicContact CD1-CH2 4.29Å; F21-W129 AromaticContact CD1-CZ2 3.35Å; F21-W129 HydrophobicContact CD1-CZ2 3.35Å; F21-W129 AromaticContact CD1-NE1 4Å; F21-W129 AromaticContact CE1-CH2 3.9Å; F21-W129 HydrophobicContact CE1-CH2 3.9Å; F21-W129 AromaticContact CE1-CZ2 3.37Å; F21-W129 HydrophobicContact CE1-CZ2 3.37Å; F21-W129 PolarHBondContact O-NE1 3.45Å; F21-W129 VanDerWaalsContact O-NE1 3.09Å; P125-W129 WeakPolarHBondContact O-CB 3.43Å; P125-W129 PolarHBondContact O-N 2.9Å; R126-W129 PolarHBondContact O-N 3.37Å; I127-W129 VanDerWaalsContact C-N 3.34Å; I127-W129 PolarHBondContact O-N 2.89Å; W129-I131 PolarHBondContact O-N 3.42Å; W129-F132 PolarHBondContact O-N 3.37Å; W129-T133 HydrophobicContact CD2-CG2 3.93Å; W129-T133 HydrophobicContact CE3-CG2 4.2Å; W129-T133 HydrophobicContact CH2-CG2 4.21Å; W129-T133 HydrophobicContact CZ2-CG2 3.97Å; W129-T133 HydrophobicContact CZ3-CG2 4.32Å; W129-T133 WeakPolarHBondContact O-CG2 3.46Å; W129-T133 PolarHBondContact O-N 2.91Å; W129-T133 PolarHBondContact O-OG1 2.84Å; W129-L206 HydrophobicContact CH2-CD1 3.81Å; W129-L206 HydrophobicContact CZ3-CD1 4.19Å; W129-V209 HydrophobicContact CE3-CG1 4.18Å; W129-V209 HydrophobicContact CZ3-CG1 3.96Å; W129-Y210 AromaticContact CH2-CD2 3.61Å; W129-Y210 HydrophobicContact CH2-CD2 3.61Å; W129-Y210 HydrophobicContact CH2-CG 4.04Å; W129-Y210 AromaticContact CZ2-CD2 3.61Å; W129-Y210 HydrophobicContact CZ2-CD2 3.61Å; W129-Y210 HydrophobicContact CZ2-CE2 4.31Å; W129-Y210 HydrophobicContact CZ2-CG 4.45Å; W129-Y210 HydrophobicContact CZ3-CD2 4.16Å; W129-I213 HydrophobicContact CB-CD1 4.26Å; W129-I213 HydrophobicContact CB-CG1 4.18Å; W129-I213 HydrophobicContact CB-CG2 4.21Å; W129-I213 HydrophobicContact CE3-CG1 3.9Å; W129-F368 HydrophobicContact CH2-CE1 4.41Å; W129-F368 HydrophobicContact CH2-CZ 4.48Å
130	S	88.7	Confident	86.1	Confident	40 Å²	40	59.6 Å²	59.6	28%	0.28	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-41.7	-179.9	-161.9	0	0	0	0	112.5	R126 I127 I128 T133 Y134 Q142	R126-S130 WeakPolarHBondContact O-CB 2.92Å; R126-S130 PolarHBondContact O-N 3.07Å; I127-S130 PolarHBondContact O-N 3.33Å; I128-S130 PolarHBondContact O-N 2.91Å; S130-T133 WeakPolarHBondContact CA-OG1 3.42Å; S130-T133 PolarHBondContact O-N 3.2Å; S130-T133 PolarHBondContact O-OG1 3.22Å; S130-Y134 VanDerWaalsContact O-CB 3.3Å; S130-Y134 WeakPolarHBondContact O-CB 3.48Å; S130-Y134 PolarHBondContact O-N 3Å; S130-Q142 PolarHBondContact OG-NE2 2.95Å
131	I	88.5	Confident	85.7	Confident	86 Å²	86	54.7 Å²	54.7	44%	0.441	28%	0.277	S	S	.	.	H	α-helix	trans	-61.1	-45.6	175.5	-68.8	169	0	0	0	110.3	I127 I128 W129 Y134 N135	I127-I131 HydrophobicContact CG2-CD1 3.71Å; I127-I131 HydrophobicContact CG2-CG1 4.34Å; I127-I131 VanDerWaalsContact O-CG1 3.29Å; I127-I131 WeakPolarHBondContact O-CG1 3.39Å; I127-I131 PolarHBondContact O-N 3.28Å; I128-I131 PolarHBondContact O-N 3.33Å; W129-I131 PolarHBondContact O-N 3.42Å; I131-Y134 PolarHBondContact O-N 2.95Å; I131-N135 WeakPolarHBondContact CG2-ND2 3.37Å; I131-N135 VanDerWaalsContact O-CB 3.32Å; I131-N135 WeakPolarHBondContact O-CB 3.34Å; I131-N135 PolarHBondContact O-N 3.42Å
132	F	86.5	Confident	85.3	Confident	92 Å²	92	53.3 Å²	53.3	40%	0.404	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-42.9	177.9	-86.6	-69.4	0	0	0	112.3	I128 W129 R136 V209	I128-F132 HydrophobicContact CG2-CD2 3.7Å; I128-F132 HydrophobicContact CG2-CE2 3.58Å; I128-F132 VanDerWaalsContact O-CD2 3.22Å; I128-F132 WeakPolarHBondContact O-CD2 3.36Å; I128-F132 PolarHBondContact O-N 3.2Å; W129-F132 PolarHBondContact O-N 3.37Å; F132-R136 WeakPolarHBondContact O-CB 3.41Å; F132-R136 PolarHBondContact O-N 2.67Å; F132-R136 VanDerWaalsContact O-N 3.12Å; F132-V209 HydrophobicContact CB-CG1 3.98Å; F132-V209 HydrophobicContact CD1-CG1 4.21Å; F132-V209 HydrophobicContact CD2-CG1 4.06Å; F132-V209 HydrophobicContact CG-CG1 3.83Å
133	T	84.9	Confident	84.9	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-46.4	177.8	52.5	0	0	0	0	111.1	F21 W129 S130 T137 L141	F21-T133 HydrophobicContact CD1-CG2 4.27Å; W129-T133 HydrophobicContact CD2-CG2 3.93Å; W129-T133 HydrophobicContact CE3-CG2 4.2Å; W129-T133 HydrophobicContact CH2-CG2 4.21Å; W129-T133 HydrophobicContact CZ2-CG2 3.97Å; W129-T133 HydrophobicContact CZ3-CG2 4.32Å; W129-T133 WeakPolarHBondContact O-CG2 3.46Å; W129-T133 PolarHBondContact O-N 2.91Å; W129-T133 PolarHBondContact O-OG1 2.84Å; S130-T133 WeakPolarHBondContact CA-OG1 3.42Å; S130-T133 PolarHBondContact O-N 3.2Å; S130-T133 PolarHBondContact O-OG1 3.22Å; T133-T137 WeakPolarHBondContact O-CB 3.49Å; T133-T137 PolarHBondContact O-N 3.16Å; T133-T137 PolarHBondContact O-OG1 3.44Å; T133-L141 HydrophobicContact CG2-CD1 4.43Å
134	Y	82.8	Confident	84.8	Confident	155 Å²	155	51.6 Å²	51.6	61%	0.608	27%	0.267	S	S	*	.	H	α-helix	trans	-68.2	-53	-176.4	-175.2	-98.4	0	0	0	112.1	S130 I131 G138	S130-Y134 VanDerWaalsContact O-CB 3.3Å; S130-Y134 WeakPolarHBondContact O-CB 3.48Å; S130-Y134 PolarHBondContact O-N 3Å; I131-Y134 PolarHBondContact O-N 2.95Å; Y134-G138 PolarHBondContact O-N 3.21Å
135	N	80	Confident	84.6	Confident	115 Å²	115	48.5 Å²	48.5	62%	0.615	25%	0.251	S	S	*	.	H	α-helix	trans	-72	-37.4	-174	-70.7	-18.3	0	0	0	113	I131	I131-N135 WeakPolarHBondContact CG2-ND2 3.37Å; I131-N135 VanDerWaalsContact O-CB 3.32Å; I131-N135 WeakPolarHBondContact O-CB 3.34Å; I131-N135 PolarHBondContact O-N 3.42Å
136	R	70.9	Confident	84.4	Confident	118 Å²	118	53 Å²	53	45%	0.445	27%	0.268	S	S	.	.	H	α-helix	trans	-96.7	-28	-168.4	-159.7	166.1	-178.4	78.6	18	113.8	F132 N205	F132-R136 WeakPolarHBondContact O-CB 3.41Å; F132-R136 PolarHBondContact O-N 2.67Å; F132-R136 VanDerWaalsContact O-N 3.12Å; R136-N205 PolarHBondContact NE-ND2 3.21Å; R136-N205 PolarHBondContact NH2-ND2 3.45Å
137	T	69.5	Low	84.3	Confident	19 Å²	19	55.3 Å²	55.3	12%	0.117	28%	0.28	C	S	.	.	H	α-helix	trans	-91.6	-10.5	176.2	73.7	0	0	0	0	112.3	T133 T139 L141 L173 L206	T133-T137 WeakPolarHBondContact O-CB 3.49Å; T133-T137 PolarHBondContact O-N 3.16Å; T133-T137 PolarHBondContact O-OG1 3.44Å; T137-T139 PolarHBondContact O-N 2.91Å; T137-T139 PolarHBondContact OG1-O 2.83Å; T137-L141 HydrophobicContact CG2-CD1 3.79Å; T137-L141 HydrophobicContact CG2-CG 4.49Å; T137-L173 WeakPolarHBondContact O-CD2 3.21Å; T137-L206 HydrophobicContact CG2-CD1 4.44Å
138	G	68.2	Low	84.3	Confident	59 Å²	59	51.5 Å²	51.5	61%	0.608	26%	0.26	S	S	*	.	S	Bend	trans	67.6	3.3	175.5	0	0	0	0	0	113.9	Y134	Y134-G138 PolarHBondContact O-N 3.21Å
139	T	72.3	Confident	84.1	Confident	49 Å²	49	51.1 Å²	51.1	30%	0.301	26%	0.259	S	S	.	.	S	Bend	trans	-144.3	156.8	175.2	62.1	0	0	0	0	108.6	T137 L141 L173	T137-T139 PolarHBondContact O-N 2.91Å; T137-T139 PolarHBondContact OG1-O 2.83Å; T139-L141 PolarHBondContact O-N 3.42Å; T139-L141 VanDerWaalsContact O-N 3.1Å; T139-L173 HydrophobicContact CG2-CD2 3.76Å; T139-L173 HydrophobicContact CG2-CG 4.36Å; T139-L173 WeakPolarHBondContact OG1-CD1 3.27Å; T139-L173 WeakPolarHBondContact OG1-CD2 3.21Å
140	D	81	Confident	84.1	Confident	47 Å²	47	55.4 Å²	55.4	25%	0.251	28%	0.281	S	S	.	.			trans	-81.4	93	175.9	-172	-6.4	0	0	0	110.4	Q142 N143 L144	D140-Q142 PolarHBondContact O-N 3.33Å; D140-Q142 WeakPolarHBondContact OD1-CA 3.35Å; D140-Q142 WeakPolarHBondContact OD1-CB 3.37Å; D140-Q142 WeakPolarHBondContact OD1-CG 3.38Å; D140-Q142 PolarHBondContact OD1-N 2.97Å; D140-N143 HydrophobicContact CB-CB 3.92Å; D140-N143 PolarHBondContact O-N 3.25Å; D140-N143 VanDerWaalsContact O-N 3.07Å; D140-N143 PolarHBondContact OD1-N 3.49Å; D140-N143 PolarHBondContact OD2-ND2 3.2Å; D140-N143 PolarHBondContact OD2-OD1 3.38Å; D140-L144 PolarHBondContact O-N 2.99Å
141	L	86.4	Confident	84.2	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-55.4	-27.1	172.2	-75.1	176.4	0	0	0	112.7	F21 T133 T137 T139 L144 I145 L173 L206 I369	F21-L141 HydrophobicContact CD1-CB 4.3Å; F21-L141 HydrophobicContact CD1-CD1 4.32Å; F21-L141 HydrophobicContact CD2-CB 3.93Å; F21-L141 HydrophobicContact CE1-CD1 3.86Å; F21-L141 HydrophobicContact CE2-CB 4.28Å; F21-L141 HydrophobicContact CE2-CD1 4.23Å; F21-L141 HydrophobicContact CG-CB 4.02Å; F21-L141 HydrophobicContact CZ-CD1 3.86Å; T133-L141 HydrophobicContact CG2-CD1 4.43Å; T137-L141 HydrophobicContact CG2-CD1 3.79Å; T137-L141 HydrophobicContact CG2-CG 4.49Å; T139-L141 PolarHBondContact O-N 3.42Å; T139-L141 VanDerWaalsContact O-N 3.1Å; L141-L144 PolarHBondContact O-N 3.39Å; L141-I145 PolarHBondContact O-N 3.23Å; L141-I145 VanDerWaalsContact O-N 3.14Å; L141-L173 HydrophobicContact CD2-CD1 4.01Å; L141-L206 HydrophobicContact CD1-CD1 4.43Å; L141-L206 HydrophobicContact CD1-CD2 4.27Å; L141-I369 HydrophobicContact CD2-CD1 4.32Å
142	Q	86.7	Confident	84	Confident	11 Å²	11	52.4 Å²	52.4	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-71.3	-43.8	176.9	-47.2	179.5	6.9	0	0	110.1	F21 R126 S130 D140 L144 I145 R146	F21-Q142 HydrophobicContact CB-CG 4.03Å; R126-Q142 VanDerWaalsContact NH2-NE2 3.18Å; S130-Q142 PolarHBondContact OG-NE2 2.95Å; D140-Q142 PolarHBondContact O-N 3.33Å; D140-Q142 WeakPolarHBondContact OD1-CA 3.35Å; D140-Q142 WeakPolarHBondContact OD1-CB 3.37Å; D140-Q142 WeakPolarHBondContact OD1-CG 3.38Å; D140-Q142 PolarHBondContact OD1-N 2.97Å; Q142-L144 VanDerWaalsContact C-N 3.28Å; Q142-L144 PolarHBondContact O-N 2.94Å; Q142-I145 PolarHBondContact O-N 3.22Å; Q142-R146 WeakPolarHBondContact O-CB 3.41Å; Q142-R146 VanDerWaalsContact O-CG 3.29Å; Q142-R146 WeakPolarHBondContact O-CG 3.44Å; Q142-R146 PolarHBondContact O-N 3.32Å
143	N	87	Confident	84	Confident	66 Å²	66	55.8 Å²	55.8	35%	0.353	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-33.7	173	-74.3	-20	0	0	0	112.2	D140 R146 Q147	D140-N143 HydrophobicContact CB-CB 3.92Å; D140-N143 PolarHBondContact O-N 3.25Å; D140-N143 VanDerWaalsContact O-N 3.07Å; D140-N143 PolarHBondContact OD1-N 3.49Å; D140-N143 PolarHBondContact OD2-ND2 3.2Å; D140-N143 PolarHBondContact OD2-OD1 3.38Å; N143-R146 PolarHBondContact O-N 3.39Å; N143-Q147 WeakPolarHBondContact O-CB 3.38Å; N143-Q147 VanDerWaalsContact O-CG 3.26Å; N143-Q147 WeakPolarHBondContact O-CG 3.21Å; N143-Q147 PolarHBondContact O-N 2.94Å; N143-Q147 PolarHBondContact O-NE2 2.9Å
144	L	90.6	Very high	84.3	Confident	6 Å²	6	59.3 Å²	59.3	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-46	175.1	-175.3	131.2	0	0	0	111.8	D140 L141 Q142 Q147 A148 I166 T169 L173	D140-L144 PolarHBondContact O-N 2.99Å; L141-L144 PolarHBondContact O-N 3.39Å; Q142-L144 VanDerWaalsContact C-N 3.28Å; Q142-L144 PolarHBondContact O-N 2.94Å; L144-Q147 PolarHBondContact O-N 3.19Å; L144-A148 PolarHBondContact O-N 2.85Å; L144-I166 HydrophobicContact CD1-CG2 4.18Å; L144-I166 HydrophobicContact CD2-CG2 4.23Å; L144-I166 HydrophobicContact CG-CG2 4.06Å; L144-T169 HydrophobicContact CD1-CG2 3.68Å; L144-L173 HydrophobicContact CD1-CD1 4.32Å
145	I	90.5	Very high	84.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-69.5	-37.2	176.3	-70.9	-160.1	0	0	0	112	V19 F21 L141 Q142 A148 N149 M372 L373 N376	V19-I145 HydrophobicContact CG1-CG2 3.83Å; F21-I145 HydrophobicContact CB-CD1 4.32Å; F21-I145 HydrophobicContact CD2-CD1 3.27Å; F21-I145 HydrophobicContact CD2-CG1 3.83Å; F21-I145 HydrophobicContact CE2-CD1 3.9Å; F21-I145 HydrophobicContact CG-CD1 4.2Å; L141-I145 PolarHBondContact O-N 3.23Å; L141-I145 VanDerWaalsContact O-N 3.14Å; Q142-I145 PolarHBondContact O-N 3.22Å; I145-A148 WeakPolarHBondContact O-CB 3.35Å; I145-A148 PolarHBondContact O-N 3.5Å; I145-N149 PolarHBondContact O-N 3.26Å; I145-M372 HydrophobicContact CD1-CB 3.97Å; I145-L373 HydrophobicContact CG1-CD1 4.16Å; I145-N376 HydrophobicContact CD1-CB 4.39Å; I145-N376 HydrophobicContact CG2-CB 3.51Å
146	R	89.2	Confident	85	Confident	94 Å²	94	55 Å²	55	36%	0.355	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-45.9	174.4	-75	172.3	178.4	175.5	-1.3	111.6	V19 Q142 N143 A148 N149 L150	V19-R146 WeakPolarHBondContact O-CG 3.27Å; V19-R146 PolarHBondContact O-NE 3.16Å; Q142-R146 WeakPolarHBondContact O-CB 3.41Å; Q142-R146 VanDerWaalsContact O-CG 3.29Å; Q142-R146 WeakPolarHBondContact O-CG 3.44Å; Q142-R146 PolarHBondContact O-N 3.32Å; N143-R146 PolarHBondContact O-N 3.39Å; R146-A148 VanDerWaalsContact C-N 3.3Å; R146-A148 PolarHBondContact O-N 2.73Å; R146-N149 PolarHBondContact O-N 3.39Å; R146-L150 WeakPolarHBondContact O-CG 3.47Å; R146-L150 PolarHBondContact O-N 3.15Å
147	Q	90.4	Very high	86	Confident	65 Å²	65	55.4 Å²	55.4	30%	0.304	31%	0.305	S	S	.	.	H	α-helix	trans	-58	-45.2	173.4	-76.2	174.8	63.6	0	0	110.5	N143 L144 N149 L150 I151 M162 I166	N143-Q147 WeakPolarHBondContact O-CB 3.38Å; N143-Q147 VanDerWaalsContact O-CG 3.26Å; N143-Q147 WeakPolarHBondContact O-CG 3.21Å; N143-Q147 PolarHBondContact O-N 2.94Å; N143-Q147 PolarHBondContact O-NE2 2.9Å; L144-Q147 PolarHBondContact O-N 3.19Å; Q147-N149 VanDerWaalsContact C-N 3.27Å; Q147-N149 PolarHBondContact O-N 3.41Å; Q147-L150 WeakPolarHBondContact O-CA 3.43Å; Q147-L150 WeakPolarHBondContact O-CB 3.35Å; Q147-L150 PolarHBondContact O-N 2.85Å; Q147-I151 WeakPolarHBondContact O-CG1 3.33Å; Q147-I151 PolarHBondContact O-N 3.38Å; Q147-I151 VanDerWaalsContact O-N 3.09Å; Q147-M162 HydrophobicContact CB-SD 4.46Å; Q147-M162 VanDerWaalsContact O-SD 3.32Å; Q147-I166 HydrophobicContact CB-CD1 3.93Å; Q147-I166 HydrophobicContact CB-CG1 4.46Å
148	A	91.7	Very high	87	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.4	-36.7	177.2	0	0	0	0	0	113.2	L144 I145 R146 L150 I151 I166 L373 A377 I381 I385	L144-A148 PolarHBondContact O-N 2.85Å; I145-A148 WeakPolarHBondContact O-CB 3.35Å; I145-A148 PolarHBondContact O-N 3.5Å; R146-A148 VanDerWaalsContact C-N 3.3Å; R146-A148 PolarHBondContact O-N 2.73Å; A148-L150 VanDerWaalsContact C-N 3.35Å; A148-I151 WeakPolarHBondContact O-CB 3.31Å; A148-I151 PolarHBondContact O-N 3.11Å; A148-I166 HydrophobicContact CB-CD1 3.81Å; A148-L373 HydrophobicContact CB-CD1 3.35Å; A148-A377 HydrophobicContact CB-CB 3.78Å; A148-I381 HydrophobicContact CB-CG2 4.47Å; A148-I381 WeakPolarHBondContact O-CD1 3.31Å; A148-I385 HydrophobicContact CB-CD1 4.45Å
149	N	89.7	Confident	88.1	Confident	48 Å²	48	60.6 Å²	60.6	26%	0.257	31%	0.308	S	S	.	.	H	α-helix	trans	-74.2	-25	175.1	-169.7	53.2	0	0	0	113.2	V19 I145 R146 Q147 I151 S152	V19-N149 HydrophobicContact CB-CB 4.37Å; V19-N149 HydrophobicContact CG1-CB 3.89Å; V19-N149 WeakPolarHBondContact CG2-ND2 3.46Å; I145-N149 PolarHBondContact O-N 3.26Å; R146-N149 PolarHBondContact O-N 3.39Å; Q147-N149 VanDerWaalsContact C-N 3.27Å; Q147-N149 PolarHBondContact O-N 3.41Å; N149-I151 VanDerWaalsContact C-N 3.33Å; N149-S152 WeakPolarHBondContact O-CB 3.41Å; N149-S152 PolarHBondContact O-N 2.65Å; N149-S152 PolarHBondContact O-OG 2.94Å
150	L	89.8	Confident	89	Confident	91 Å²	91	62.4 Å²	62.4	48%	0.476	31%	0.314	S	S	.	.	H	α-helix	trans	-72.1	-28.4	172.3	-67.6	172.4	0	0	0	112	R146 Q147 A148 S152 K153 M162	R146-L150 WeakPolarHBondContact O-CG 3.47Å; R146-L150 PolarHBondContact O-N 3.15Å; Q147-L150 WeakPolarHBondContact O-CA 3.43Å; Q147-L150 WeakPolarHBondContact O-CB 3.35Å; Q147-L150 PolarHBondContact O-N 2.85Å; A148-L150 VanDerWaalsContact C-N 3.35Å; L150-S152 PolarHBondContact O-N 3.25Å; L150-S152 VanDerWaalsContact O-N 3.15Å; L150-K153 PolarHBondContact O-N 2.83Å; L150-M162 HydrophobicContact CB-SD 4.38Å
151	I	91.4	Very high	89.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-54.1	-33.2	172.8	-62.3	178.4	0	0	0	111.1	Q147 A148 N149 K153 E154 R159 M162 V163 I166 I381	Q147-I151 WeakPolarHBondContact O-CG1 3.33Å; Q147-I151 PolarHBondContact O-N 3.38Å; Q147-I151 VanDerWaalsContact O-N 3.09Å; A148-I151 WeakPolarHBondContact O-CB 3.31Å; A148-I151 PolarHBondContact O-N 3.11Å; N149-I151 VanDerWaalsContact C-N 3.33Å; I151-K153 PolarHBondContact O-N 2.79Å; I151-K153 VanDerWaalsContact O-N 3.13Å; I151-E154 PolarHBondContact O-N 3.17Å; I151-R159 HydrophobicContact CG2-CG 3.56Å; I151-M162 HydrophobicContact CB-SD 4.37Å; I151-M162 HydrophobicContact CD1-CB 4.18Å; I151-M162 HydrophobicContact CD1-CG 3.93Å; I151-M162 HydrophobicContact CD1-SD 4.14Å; I151-M162 HydrophobicContact CG1-CB 3.96Å; I151-M162 HydrophobicContact CG1-CE 4.49Å; I151-M162 HydrophobicContact CG1-CG 3.66Å; I151-M162 HydrophobicContact CG1-SD 3.25Å; I151-M162 WeakPolarHBondContact CG1-SD 3.45Å; I151-V163 HydrophobicContact CD1-CB 4.46Å; I151-V163 HydrophobicContact CD1-CG2 3.76Å; I151-V163 HydrophobicContact CG2-CG2 3.85Å; I151-I166 HydrophobicContact CD1-CD1 3.51Å; I151-I166 HydrophobicContact CG1-CD1 4.44Å; I151-I381 HydrophobicContact CB-CD1 4.32Å; I151-I381 HydrophobicContact CB-CG2 4.36Å; I151-I381 HydrophobicContact CD1-CG2 4.22Å; I151-I381 HydrophobicContact CG2-CD1 4.49Å; I151-I381 HydrophobicContact CG2-CG1 4.21Å; I151-I381 HydrophobicContact CG2-CG2 4.3Å
152	S	85.3	Confident	89.9	Confident	63 Å²	63	67.5 Å²	67.5	44%	0.441	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.8	178.9	-50	0	0	0	0	113.8	N149 L150 I381	N149-S152 WeakPolarHBondContact O-CB 3.41Å; N149-S152 PolarHBondContact O-N 2.65Å; N149-S152 PolarHBondContact O-OG 2.94Å; L150-S152 PolarHBondContact O-N 3.25Å; L150-S152 VanDerWaalsContact O-N 3.15Å; S152-I381 WeakPolarHBondContact OG-CD1 3.33Å
153	K	86.3	Confident	90.2	Very high	164 Å²	164	67 Å²	67	71%	0.713	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-9.8	-175	-60.5	-174.9	179.4	-176.7	0	113.3	L150 I151	L150-K153 PolarHBondContact O-N 2.83Å; I151-K153 PolarHBondContact O-N 2.79Å; I151-K153 VanDerWaalsContact O-N 3.13Å
154	E	90.4	Very high	90.5	Very high	75 Å²	75	68.7 Å²	68.7	35%	0.35	34%	0.338	S	S	.	.			trans	-105.8	138.3	-175.4	-67	-72.6	164.6	0	0	110.1	I151 R159 M162	I151-E154 PolarHBondContact O-N 3.17Å; E154-R159 WeakPolarHBondContact O-CB 3.22Å; E154-M162 HydrophobicContact CG-CE 4.1Å
155	D	89.2	Confident	90.6	Very high	129 Å²	129	73.2 Å²	73.2	69%	0.69	36%	0.359	S	S	*	.			trans	-116.6	158.9	179.8	-72.1	-44.6	0	0	0	112.5
156	G	88.9	Confident	90.7	Very high	51 Å²	51	73.3 Å²	73.3	53%	0.526	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	-143.4	174	0	0	0	0	0	115.1	K158 R159 Q160	G156-K158 VanDerWaalsContact C-N 3.29Å; G156-K158 PolarHBondContact O-N 2.75Å; G156-R159 WeakPolarHBondContact O-CB 3.46Å; G156-R159 PolarHBondContact O-N 3.42Å; G156-Q160 PolarHBondContact O-N 3.29Å
157	E	90.9	Very high	90.8	Very high	125 Å²	125	68.8 Å²	68.8	58%	0.584	34%	0.342	S	S	*	.	H	α-helix	trans	-63.9	-32.6	-173.9	-163.5	-168	169	0	0	112.6	R159 Q160 K161	E157-R159 PolarHBondContact O-N 3.42Å; E157-Q160 PolarHBondContact O-N 2.78Å; E157-K161 HydrophobicContact CG-CD 4.45Å; E157-K161 WeakPolarHBondContact O-CG 3.49Å; E157-K161 PolarHBondContact O-N 3.47Å; E157-K161 WeakPolarHBondContact OE1-CE 2.95Å; E157-K161 IonicContact OE1-NZ 2.82Å; E157-K161 PolarHBondContact OE1-NZ 2.92Å; E157-K161 IonicContact OE2-NZ 3.49Å
158	K	90.9	Very high	90.9	Very high	142 Å²	142	68.7 Å²	68.7	62%	0.617	34%	0.341	S	S	*	.	H	α-helix	trans	-61.4	-44.4	177.8	-69.4	-176.3	-178	177.5	0	111.7	G156 Q160 K161 M162	G156-K158 VanDerWaalsContact C-N 3.29Å; G156-K158 PolarHBondContact O-N 2.75Å; K158-Q160 VanDerWaalsContact C-N 3.35Å; K158-Q160 PolarHBondContact O-N 3.2Å; K158-K161 PolarHBondContact O-N 2.78Å; K158-M162 PolarHBondContact O-N 2.84Å
159	R	92.1	Very high	90.8	Very high	45 Å²	45	70.1 Å²	70.1	17%	0.17	35%	0.349	C	S	.	.	H	α-helix	trans	-55.6	-50.8	175.1	-172.7	-171.9	168.9	143.2	-9.3	110.5	I151 E154 G156 E157 K161 M162 V163 E384	I151-R159 HydrophobicContact CG2-CG 3.56Å; E154-R159 WeakPolarHBondContact O-CB 3.22Å; G156-R159 WeakPolarHBondContact O-CB 3.46Å; G156-R159 PolarHBondContact O-N 3.42Å; E157-R159 PolarHBondContact O-N 3.42Å; R159-K161 PolarHBondContact O-N 2.79Å; R159-M162 PolarHBondContact O-N 3.21Å; R159-V163 VanDerWaalsContact O-CG2 3.29Å; R159-V163 WeakPolarHBondContact O-CG2 3.27Å; R159-V163 PolarHBondContact O-N 2.75Å; R159-E384 IonicContact CZ-OE1 3.8Å; R159-E384 IonicContact CZ-OE2 2.67Å; R159-E384 IonicContact NE-OE1 3.36Å; R159-E384 IonicContact NE-OE2 3.16Å; R159-E384 PolarHBondContact NE-OE2 2.95Å; R159-E384 IonicContact NH2-OE1 3.38Å; R159-E384 PolarHBondContact NH2-OE1 3.38Å; R159-E384 IonicContact NH2-OE2 3.45Å; R159-E384 PolarHBondContact NH2-OE2 2.74Å
160	Q	91.6	Very high	90.8	Very high	88 Å²	88	67.8 Å²	67.8	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-61.9	-44.3	-178.8	-65.3	-176.6	-6.6	0	0	112.3	G156 E157 K158 M162 V163 Q164	G156-Q160 PolarHBondContact O-N 3.29Å; E157-Q160 PolarHBondContact O-N 2.78Å; K158-Q160 VanDerWaalsContact C-N 3.35Å; K158-Q160 PolarHBondContact O-N 3.2Å; Q160-M162 VanDerWaalsContact C-N 3.32Å; Q160-M162 PolarHBondContact O-N 3.28Å; Q160-V163 PolarHBondContact O-N 3.44Å; Q160-Q164 WeakPolarHBondContact O-CB 3.4Å; Q160-Q164 VanDerWaalsContact O-CG 3.3Å; Q160-Q164 WeakPolarHBondContact O-CG 3.32Å; Q160-Q164 PolarHBondContact O-N 3.41Å
161	K	92.6	Very high	90.8	Very high	114 Å²	114	63.6 Å²	63.6	50%	0.496	32%	0.315	S	S	.	.	H	α-helix	trans	-60	-41.5	175.3	-73.9	175.6	179.9	165.6	0	111.8	E157 K158 R159 Q164 H165	E157-K161 HydrophobicContact CG-CD 4.45Å; E157-K161 WeakPolarHBondContact O-CG 3.49Å; E157-K161 PolarHBondContact O-N 3.47Å; E157-K161 WeakPolarHBondContact OE1-CE 2.95Å; E157-K161 IonicContact OE1-NZ 2.82Å; E157-K161 PolarHBondContact OE1-NZ 2.92Å; E157-K161 IonicContact OE2-NZ 3.49Å; K158-K161 PolarHBondContact O-N 2.78Å; R159-K161 PolarHBondContact O-N 2.79Å; K161-Q164 PolarHBondContact O-N 3.42Å; K161-H165 WeakPolarHBondContact O-CB 3.48Å; K161-H165 PolarHBondContact O-N 2.82Å
162	M	92.3	Very high	90.6	Very high	40 Å²	40	67.7 Å²	67.7	20%	0.197	34%	0.336	C	S	.	.	H	α-helix	trans	-67.7	-43.4	178.2	-162.6	-177.9	-47.9	0	0	111.8	Q147 L150 I151 E154 K158 R159 Q160 Q164 H165 I166	Q147-M162 HydrophobicContact CB-SD 4.46Å; Q147-M162 VanDerWaalsContact O-SD 3.32Å; L150-M162 HydrophobicContact CB-SD 4.38Å; I151-M162 HydrophobicContact CB-SD 4.37Å; I151-M162 HydrophobicContact CD1-CB 4.18Å; I151-M162 HydrophobicContact CD1-CG 3.93Å; I151-M162 HydrophobicContact CD1-SD 4.14Å; I151-M162 HydrophobicContact CG1-CB 3.96Å; I151-M162 HydrophobicContact CG1-CE 4.49Å; I151-M162 HydrophobicContact CG1-CG 3.66Å; I151-M162 HydrophobicContact CG1-SD 3.25Å; I151-M162 WeakPolarHBondContact CG1-SD 3.45Å; E154-M162 HydrophobicContact CG-CE 4.1Å; K158-M162 PolarHBondContact O-N 2.84Å; R159-M162 PolarHBondContact O-N 3.21Å; Q160-M162 VanDerWaalsContact C-N 3.32Å; Q160-M162 PolarHBondContact O-N 3.28Å; M162-Q164 VanDerWaalsContact C-N 3.34Å; M162-Q164 PolarHBondContact O-N 3.47Å; M162-H165 PolarHBondContact O-N 3.4Å; M162-I166 WeakPolarHBondContact O-CG1 2.86Å; M162-I166 PolarHBondContact O-N 3.41Å
163	V	93.3	Very high	90.6	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-58.8	-46.5	174.3	175.8	0	0	0	0	110.6	I151 R159 Q160 I166 A167 E384 I385 N388	I151-V163 HydrophobicContact CD1-CB 4.46Å; I151-V163 HydrophobicContact CD1-CG2 3.76Å; I151-V163 HydrophobicContact CG2-CG2 3.85Å; R159-V163 VanDerWaalsContact O-CG2 3.29Å; R159-V163 WeakPolarHBondContact O-CG2 3.27Å; R159-V163 PolarHBondContact O-N 2.75Å; Q160-V163 PolarHBondContact O-N 3.44Å; V163-I166 PolarHBondContact O-N 2.9Å; V163-A167 WeakPolarHBondContact O-CB 3.09Å; V163-A167 PolarHBondContact O-N 3.43Å; V163-E384 HydrophobicContact CG1-CB 4.02Å; V163-E384 HydrophobicContact CG2-CB 4.48Å; V163-I385 HydrophobicContact CG1-CG1 3.87Å; V163-N388 WeakPolarHBondContact CG1-ND2 3.34Å
164	Q	92.9	Very high	90.4	Very high	101 Å²	101	58.8 Å²	58.8	47%	0.472	29%	0.292	S	S	.	.	H	α-helix	trans	-62.5	-42.4	177.5	-73.6	174.4	3.1	0	0	111.9	Q160 K161 M162 I166 A167 K168	Q160-Q164 WeakPolarHBondContact O-CB 3.4Å; Q160-Q164 VanDerWaalsContact O-CG 3.3Å; Q160-Q164 WeakPolarHBondContact O-CG 3.32Å; Q160-Q164 PolarHBondContact O-N 3.41Å; K161-Q164 PolarHBondContact O-N 3.42Å; M162-Q164 VanDerWaalsContact C-N 3.34Å; M162-Q164 PolarHBondContact O-N 3.47Å; Q164-I166 PolarHBondContact O-N 3.4Å; Q164-A167 PolarHBondContact O-N 3.44Å; Q164-K168 VanDerWaalsContact O-CB 3.31Å; Q164-K168 WeakPolarHBondContact O-CB 2.92Å; Q164-K168 PolarHBondContact O-N 3.21Å
165	H	92.4	Very high	89.9	Confident	102 Å²	102	56.5 Å²	56.5	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-60.4	-44	175.8	179.5	-101.3	0	0	0	112	K161 M162 K168 T169	K161-H165 WeakPolarHBondContact O-CB 3.48Å; K161-H165 PolarHBondContact O-N 2.82Å; M162-H165 PolarHBondContact O-N 3.4Å; H165-K168 PolarHBondContact O-N 3.34Å; H165-T169 WeakPolarHBondContact O-CB 3.11Å; H165-T169 PolarHBondContact O-N 3.5Å; H165-T169 PolarHBondContact O-OG1 3.34Å
166	I	92.7	Very high	89.3	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-44.2	176.9	-66.1	-179.8	0	0	0	111.2	L144 Q147 A148 I151 M162 V163 Q164 K168 T169 L170 I385	L144-I166 HydrophobicContact CD1-CG2 4.18Å; L144-I166 HydrophobicContact CD2-CG2 4.23Å; L144-I166 HydrophobicContact CG-CG2 4.06Å; Q147-I166 HydrophobicContact CB-CD1 3.93Å; Q147-I166 HydrophobicContact CB-CG1 4.46Å; A148-I166 HydrophobicContact CB-CD1 3.81Å; I151-I166 HydrophobicContact CD1-CD1 3.51Å; I151-I166 HydrophobicContact CG1-CD1 4.44Å; M162-I166 WeakPolarHBondContact O-CG1 2.86Å; M162-I166 PolarHBondContact O-N 3.41Å; V163-I166 PolarHBondContact O-N 2.9Å; Q164-I166 PolarHBondContact O-N 3.4Å; I166-K168 VanDerWaalsContact C-N 3.32Å; I166-K168 PolarHBondContact O-N 2.93Å; I166-T169 PolarHBondContact O-N 2.96Å; I166-L170 WeakPolarHBondContact O-CB 3.29Å; I166-L170 PolarHBondContact O-N 3.47Å; I166-I385 HydrophobicContact CB-CD1 4.43Å; I166-I385 HydrophobicContact CD1-CD1 4.48Å; I166-I385 HydrophobicContact CG2-CD1 3.85Å; I166-I385 HydrophobicContact CG2-CG1 4.41Å; I166-I385 HydrophobicContact CG2-CG2 4.27Å
167	A	92.4	Very high	88.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-44	176.9	0	0	0	0	0	111.2	V163 Q164 L170 E171 N388	V163-A167 WeakPolarHBondContact O-CB 3.09Å; V163-A167 PolarHBondContact O-N 3.43Å; Q164-A167 PolarHBondContact O-N 3.44Å; A167-L170 PolarHBondContact O-N 3.05Å; A167-E171 WeakPolarHBondContact O-CB 3.41Å; A167-E171 PolarHBondContact O-N 3.17Å; A167-N388 HydrophobicContact CB-CB 3.92Å
168	K	91.4	Very high	87.3	Confident	62 Å²	62	52.9 Å²	52.9	27%	0.27	25%	0.245	S	C	.	.	H	α-helix	trans	-65	-42.6	176.5	-170	72.4	-159.9	160.5	0	112.6	Q164 H165 I166 L170 E171 L172 R396	Q164-K168 VanDerWaalsContact O-CB 3.31Å; Q164-K168 WeakPolarHBondContact O-CB 2.92Å; Q164-K168 PolarHBondContact O-N 3.21Å; H165-K168 PolarHBondContact O-N 3.34Å; I166-K168 VanDerWaalsContact C-N 3.32Å; I166-K168 PolarHBondContact O-N 2.93Å; K168-L170 VanDerWaalsContact C-N 3.33Å; K168-E171 WeakPolarHBondContact CD-OE2 3.49Å; K168-E171 IonicContact NZ-OE1 3.85Å; K168-E171 IonicContact NZ-OE2 2.66Å; K168-E171 PolarHBondContact NZ-OE2 3.38Å; K168-E171 WeakPolarHBondContact O-CB 3.46Å; K168-E171 PolarHBondContact O-N 3.36Å; K168-L172 WeakPolarHBondContact O-CG 3.38Å; K168-L172 PolarHBondContact O-N 3.06Å; K168-R396 VanDerWaalsContact NZ-NH2 3.17Å
169	T	90.6	Very high	85.5	Confident	30 Å²	30	53.4 Å²	53.4	18%	0.184	25%	0.25	C	C	.	.	H	α-helix	trans	-62.5	-43.8	176.4	-58	0	0	0	0	110.5	L144 H165 I166 L172 L173	L144-T169 HydrophobicContact CD1-CG2 3.68Å; H165-T169 WeakPolarHBondContact O-CB 3.11Å; H165-T169 PolarHBondContact O-N 3.5Å; H165-T169 PolarHBondContact O-OG1 3.34Å; I166-T169 PolarHBondContact O-N 2.96Å; T169-L172 PolarHBondContact O-N 3.23Å; T169-L173 HydrophobicContact CG2-CD1 4.1Å; T169-L173 WeakPolarHBondContact O-CB 3.22Å; T169-L173 VanDerWaalsContact O-CG 3.27Å; T169-L173 WeakPolarHBondContact O-CG 3.38Å; T169-L173 PolarHBondContact O-N 3.38Å
170	L	90.5	Very high	83.4	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.9	-40.6	176.7	-174.9	58.1	0	0	0	111.9	I166 A167 K168 L173 L174 I369 L370 L389	I166-L170 WeakPolarHBondContact O-CB 3.29Å; I166-L170 PolarHBondContact O-N 3.47Å; A167-L170 PolarHBondContact O-N 3.05Å; K168-L170 VanDerWaalsContact C-N 3.33Å; L170-L173 PolarHBondContact O-N 2.92Å; L170-L174 HydrophobicContact CD1-CD1 4.24Å; L170-L174 HydrophobicContact CD1-CG 4.18Å; L170-L174 HydrophobicContact CG-CD1 4.03Å; L170-L174 HydrophobicContact CG-CG 4.41Å; L170-L174 WeakPolarHBondContact O-CB 3.3Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3.32Å; L170-I369 HydrophobicContact CD1-CB 4.4Å; L170-I369 HydrophobicContact CD1-CD1 4.23Å; L170-I369 HydrophobicContact CD1-CG2 3.74Å; L170-L370 HydrophobicContact CD2-CD2 3.79Å; L170-L389 HydrophobicContact CD2-CD2 3.9Å; L170-L389 HydrophobicContact CG-CD2 4.37Å
171	E	88.7	Confident	81.1	Confident	3 Å²	3	65.6 Å²	65.6	1%	0.014	29%	0.293	C	S	.	.	H	α-helix	trans	-56.4	-51.2	173.2	-173.4	-162.1	163.6	0	0	111	A167 K168 L173 L174 F175 F361 L389 R396	A167-E171 WeakPolarHBondContact O-CB 3.41Å; A167-E171 PolarHBondContact O-N 3.17Å; K168-E171 WeakPolarHBondContact CD-OE2 3.49Å; K168-E171 IonicContact NZ-OE1 3.85Å; K168-E171 IonicContact NZ-OE2 2.66Å; K168-E171 PolarHBondContact NZ-OE2 3.38Å; K168-E171 WeakPolarHBondContact O-CB 3.46Å; K168-E171 PolarHBondContact O-N 3.36Å; E171-L173 VanDerWaalsContact C-N 3.31Å; E171-L173 PolarHBondContact O-N 3.07Å; E171-L174 PolarHBondContact O-N 3.09Å; E171-F175 HydrophobicContact CG-CD2 3.79Å; E171-F175 HydrophobicContact CG-CE2 3.58Å; E171-F175 WeakPolarHBondContact O-CD2 3.31Å; E171-F175 PolarHBondContact O-N 2.85Å; E171-F361 HydrophobicContact CB-CZ 4.45Å; E171-F361 HydrophobicContact CG-CE2 4.24Å; E171-F361 HydrophobicContact CG-CZ 4.07Å; E171-L389 HydrophobicContact CB-CD1 4.01Å; E171-R396 WeakPolarHBondContact OE1-CD 3.45Å; E171-R396 IonicContact OE1-CZ 2.69Å; E171-R396 IonicContact OE1-NE 3.51Å; E171-R396 IonicContact OE1-NH1 3.66Å
172	L	86.4	Confident	78.8	Confident	85 Å²	85	64.8 Å²	64.8	45%	0.445	30%	0.298	S	S	.	.	H	α-helix	trans	-60.3	-40.7	178.1	-70.1	171.3	0	0	0	111.9	K168 T169 F175 N176	K168-L172 WeakPolarHBondContact O-CG 3.38Å; K168-L172 PolarHBondContact O-N 3.06Å; T169-L172 PolarHBondContact O-N 3.23Å; L172-F175 PolarHBondContact O-N 2.7Å; L172-N176 WeakPolarHBondContact O-CB 3.48Å; L172-N176 PolarHBondContact O-N 3.11Å
173	L	85.5	Confident	76.5	Confident	20 Å²	20	68.5 Å²	68.5	11%	0.105	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-44	178	-76.6	168.4	0	0	0	112.8	T137 T139 L141 L144 T169 L170 E171 F175 R177	T137-L173 WeakPolarHBondContact O-CD2 3.21Å; T139-L173 HydrophobicContact CG2-CD2 3.76Å; T139-L173 HydrophobicContact CG2-CG 4.36Å; T139-L173 WeakPolarHBondContact OG1-CD1 3.27Å; T139-L173 WeakPolarHBondContact OG1-CD2 3.21Å; L141-L173 HydrophobicContact CD2-CD1 4.01Å; L144-L173 HydrophobicContact CD1-CD1 4.32Å; T169-L173 HydrophobicContact CG2-CD1 4.1Å; T169-L173 WeakPolarHBondContact O-CB 3.22Å; T169-L173 VanDerWaalsContact O-CG 3.27Å; T169-L173 WeakPolarHBondContact O-CG 3.38Å; T169-L173 PolarHBondContact O-N 3.38Å; L170-L173 PolarHBondContact O-N 2.92Å; E171-L173 VanDerWaalsContact C-N 3.31Å; E171-L173 PolarHBondContact O-N 3.07Å; L173-F175 VanDerWaalsContact C-N 3.31Å; L173-F175 PolarHBondContact O-N 3.45Å; L173-R177 PolarHBondContact O-N 3.33Å
174	L	83.8	Confident	74.2	Confident	21 Å²	21	73 Å²	73	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-67.4	-33.8	178.8	-66.2	172.9	0	0	0	111.5	L170 E171 F361 L362 G366 L389	L170-L174 HydrophobicContact CD1-CD1 4.24Å; L170-L174 HydrophobicContact CD1-CG 4.18Å; L170-L174 HydrophobicContact CG-CD1 4.03Å; L170-L174 HydrophobicContact CG-CG 4.41Å; L170-L174 WeakPolarHBondContact O-CB 3.3Å; L170-L174 WeakPolarHBondContact O-CG 3.49Å; L170-L174 PolarHBondContact O-N 3.32Å; E171-L174 PolarHBondContact O-N 3.09Å; L174-F361 HydrophobicContact CB-CZ 4.47Å; L174-F361 HydrophobicContact CD1-CD1 4.34Å; L174-F361 HydrophobicContact CD1-CE1 3.72Å; L174-F361 HydrophobicContact CD1-CZ 4.01Å; L174-L362 HydrophobicContact CD1-CD1 4.03Å; L174-G366 VanDerWaalsContact CD2-CA 3.42Å; L174-L389 HydrophobicContact CD1-CD2 4.4Å
175	F	79.9	Confident	72.3	Confident	26 Å²	26	74.9 Å²	74.9	11%	0.114	37%	0.366	C	S	.	.	H	α-helix	trans	-73.6	-44	174.3	-82	-58	0	0	0	113.9	E171 L172 L173 R177 R178 F361 F397 F402	E171-F175 HydrophobicContact CG-CD2 3.79Å; E171-F175 HydrophobicContact CG-CE2 3.58Å; E171-F175 WeakPolarHBondContact O-CD2 3.31Å; E171-F175 PolarHBondContact O-N 2.85Å; L172-F175 PolarHBondContact O-N 2.7Å; L173-F175 VanDerWaalsContact C-N 3.31Å; L173-F175 PolarHBondContact O-N 3.45Å; F175-R177 PolarHBondContact O-N 3.18Å; F175-R177 VanDerWaalsContact O-N 3.16Å; F175-R178 WeakPolarHBondContact O-CB 3.46Å; F175-R178 PolarHBondContact O-N 2.94Å; F175-F361 HydrophobicContact CD2-CE2 4.2Å; F175-F361 HydrophobicContact CE1-CD2 4.24Å; F175-F361 HydrophobicContact CE1-CE2 4.27Å; F175-F361 HydrophobicContact CE2-CD2 4.26Å; F175-F361 AromaticContact CE2-CE2 3.53Å; F175-F361 HydrophobicContact CE2-CE2 3.53Å; F175-F361 AromaticContact CZ-CD2 3.77Å; F175-F361 HydrophobicContact CZ-CD2 3.77Å; F175-F361 AromaticContact CZ-CE2 3.52Å; F175-F361 HydrophobicContact CZ-CE2 3.52Å; F175-F397 HydrophobicContact CE1-CE1 4.36Å; F175-F397 HydrophobicContact CE1-CZ 4.04Å; F175-F397 AromaticContact CE2-CE2 3.71Å; F175-F397 HydrophobicContact CE2-CE2 3.71Å; F175-F397 AromaticContact CE2-CZ 3.56Å; F175-F397 HydrophobicContact CE2-CZ 3.56Å; F175-F397 HydrophobicContact CZ-CD2 4.25Å; F175-F397 AromaticContact CZ-CE1 3.81Å; F175-F397 HydrophobicContact CZ-CE1 3.81Å; F175-F397 AromaticContact CZ-CE2 3.37Å; F175-F397 HydrophobicContact CZ-CE2 3.37Å; F175-F397 AromaticContact CZ-CZ 3.11Å; F175-F397 HydrophobicContact CZ-CZ 3.11Å; F175-F402 HydrophobicContact CE1-CE1 4.28Å
176	N	76.7	Confident	70.4	Confident	123 Å²	123	74.7 Å²	74.7	66%	0.658	37%	0.367	S	S	*	.	H	α-helix	trans	-60.3	-29.7	-180	-165.2	14.1	0	0	0	111.1	L172 R178	L172-N176 WeakPolarHBondContact O-CB 3.48Å; L172-N176 PolarHBondContact O-N 3.11Å; N176-R178 PolarHBondContact O-N 3.44Å
177	R	70.8	Confident	68.4	Low	64 Å²	64	77 Å²	77	24%	0.242	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-1.2	175.5	-151.2	172.4	-155	168.5	2	115	L173 F175 E179 L206 D365	L173-R177 PolarHBondContact O-N 3.33Å; F175-R177 PolarHBondContact O-N 3.18Å; F175-R177 VanDerWaalsContact O-N 3.16Å; R177-E179 PolarHBondContact O-N 3.21Å; R177-L206 VanDerWaalsContact NH2-CB 3.33Å; R177-D365 VanDerWaalsContact CD-OD2 3.31Å; R177-D365 WeakPolarHBondContact CD-OD2 3.13Å; R177-D365 IonicContact CZ-OD2 2.71Å; R177-D365 IonicContact NE-OD2 3.7Å; R177-D365 PolarHBondContact NE-OD2 3.04Å; R177-D365 VanDerWaalsContact NH1-CB 3.3Å; R177-D365 IonicContact NH1-OD1 3.36Å; R177-D365 IonicContact NH1-OD2 3.5Å; R177-D365 PolarHBondContact NH1-OD2 3.4Å; R177-D365 IonicContact NH2-OD2 3.71Å
178	R	65.2	Low	66.6	Low	43 Å²	43	80.5 Å²	80.5	16%	0.162	42%	0.421	C	S	.	.			trans	-78.4	68	173.1	-172.2	-177.1	-87.3	-180	-3.4	109.7	F175 N176 F402	F175-R178 WeakPolarHBondContact O-CB 3.46Å; F175-R178 PolarHBondContact O-N 2.94Å; N176-R178 PolarHBondContact O-N 3.44Å; R178-F402 VanDerWaalsContact CZ-CD1 3.45Å; R178-F402 VanDerWaalsContact NH2-CB 3.28Å
179	E	54.9	Low	64.8	Low	152 Å²	152	82.8 Å²	82.8	71%	0.71	45%	0.445	S	S	*	.			trans	-77.8	145.5	168.4	-78.9	-179.5	167.1	0	0	111.4	R177	R177-E179 PolarHBondContact O-N 3.21Å
180	Y	46.3	Very low	62.8	Low	179 Å²	179	87 Å²	87	70%	0.702	46%	0.461	S	S	*	.			trans	-44.5	132.1	-163.8	-112.8	-114.1	0	0	0	117.1	T182 P406	Y180-T182 PolarHBondContact O-N 2.71Å; Y180-P406 HydrophobicContact CE2-CG 4.3Å
181	R	45	Very low	60.8	Low	211 Å²	211	93.4 Å²	93.4	80%	0.796	49%	0.485	S	S	*	.			trans	-81.8	88.5	158.5	-178.9	-175.3	144	129.8	-2.4	107.8
182	T	44	Very low	58.9	Low	96 Å²	96	103.6 Å²	103.6	59%	0.589	52%	0.523	S	S	*	.			trans	-78.9	127.1	163.3	-44.5	0	0	0	0	108.2	Y180 D184	Y180-T182 PolarHBondContact O-N 2.71Å; T182-D184 PolarHBondContact O-N 3.36Å; T182-D184 VanDerWaalsContact O-N 3.13Å
183	T	42.5	Very low	57.1	Low	118 Å²	118	104.1 Å²	104.1	72%	0.724	53%	0.534	S	S	*	.			trans	-58.1	107.4	-178.7	-12.3	0	0	0	0	109.5
184	D	45.2	Very low	55.3	Low	95 Å²	95	107.3 Å²	107.3	51%	0.508	55%	0.549	S	S	.	.			trans	-126.3	126.2	175.6	-107.7	-8.4	0	0	0	110.2	T182 L186	T182-D184 PolarHBondContact O-N 3.36Å; T182-D184 VanDerWaalsContact O-N 3.13Å; D184-L186 PolarHBondContact O-N 2.91Å; D184-L186 VanDerWaalsContact O-N 3.11Å
185	T	53.5	Low	53.6	Low	142 Å²	142	108.5 Å²	108.5	87%	0.871	56%	0.563	S	S	*	*			trans	-76.8	23.1	-167.7	46	0	0	0	0	114.5	G187	T185-G187 PolarHBondContact O-N 3.26Å
186	L	53	Low	52.2	Low	97 Å²	97	116 Å²	116	51%	0.508	60%	0.595	S	S	.	*			trans	-78.5	124.2	177.6	-103.5	93.8	0	0	0	112.1	D184 F190 R191	D184-L186 PolarHBondContact O-N 2.91Å; D184-L186 VanDerWaalsContact O-N 3.11Å; L186-F190 HydrophobicContact CD2-CD1 3.83Å; L186-F190 HydrophobicContact CD2-CE1 4.24Å; L186-R191 PolarHBondContact O-NE 3.45Å; L186-R191 PolarHBondContact O-NH2 2.77Å
187	G	49.7	Very low	50.9	Low	50 Å²	50	115.8 Å²	115.8	52%	0.515	59%	0.592	S	S	.	*			trans	-52.6	148.8	-173.4	0	0	0	0	0	115.6	T185 S189 F190	T185-G187 PolarHBondContact O-N 3.26Å; G187-S189 PolarHBondContact O-N 3.4Å; G187-S189 VanDerWaalsContact O-N 3.12Å; G187-F190 PolarHBondContact O-N 2.62Å
188	A	55.5	Low	50	Low	74 Å²	74	117.5 Å²	117.5	61%	0.612	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-22.7	-173.8	0	0	0	0	0	114.8	R191	A188-R191 VanDerWaalsContact O-CB 3.31Å; A188-R191 WeakPolarHBondContact O-CB 3.45Å
189	S	53.2	Low	49.4	Very low	110 Å²	110	116.8 Å²	116.8	77%	0.769	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-46	-177.6	-156.7	0	0	0	0	112.5	G187 R191 R192	G187-S189 PolarHBondContact O-N 3.4Å; G187-S189 VanDerWaalsContact O-N 3.12Å; S189-R191 PolarHBondContact O-N 2.73Å; S189-R192 PolarHBondContact O-N 2.94Å
190	F	48.4	Very low	49.3	Very low	118 Å²	118	117 Å²	117	52%	0.518	62%	0.616	S	S	.	*	H	α-helix	trans	-63.9	-28.7	174.8	-163.3	-108.8	0	0	0	111.8	L186 G187 R192 S193 M194	L186-F190 HydrophobicContact CD2-CD1 3.83Å; L186-F190 HydrophobicContact CD2-CE1 4.24Å; G187-F190 PolarHBondContact O-N 2.62Å; F190-R192 VanDerWaalsContact C-N 3.32Å; F190-R192 PolarHBondContact O-N 3.12Å; F190-S193 PolarHBondContact O-N 3.17Å; F190-M194 HydrophobicContact CD1-CE 4.36Å; F190-M194 HydrophobicContact CD1-SD 4.09Å; F190-M194 HydrophobicContact CE1-CE 3.31Å; F190-M194 HydrophobicContact CE1-CG 4.45Å; F190-M194 HydrophobicContact CE1-SD 3.58Å; F190-M194 VanDerWaalsContact CE1-SD 3.58Å; F190-M194 HydrophobicContact CZ-CE 3.66Å; F190-M194 HydrophobicContact CZ-SD 4.4Å; F190-M194 PolarHBondContact O-N 2.69Å
191	R	48.2	Very low	49.5	Very low	134 Å²	134	115.7 Å²	115.7	51%	0.506	61%	0.61	S	S	.	*	H	α-helix	trans	-65.6	-25	178.5	-135.8	-177.5	-70.5	-169.1	-1.9	114.4	L186 A188 S189	L186-R191 PolarHBondContact O-NE 3.45Å; L186-R191 PolarHBondContact O-NH2 2.77Å; A188-R191 VanDerWaalsContact O-CB 3.31Å; A188-R191 WeakPolarHBondContact O-CB 3.45Å; S189-R191 PolarHBondContact O-N 2.73Å
192	R	49.4	Very low	49.9	Very low	217 Å²	217	110.3 Å²	110.3	82%	0.819	59%	0.594	S	S	*	*	H	α-helix	trans	-80.6	-38.1	177	-100.2	-177.5	-154.8	156.9	7	112.7	S189 F190 A195	S189-R192 PolarHBondContact O-N 2.94Å; F190-R192 VanDerWaalsContact C-N 3.32Å; F190-R192 PolarHBondContact O-N 3.12Å; R192-A195 WeakPolarHBondContact O-CB 3.37Å; R192-A195 PolarHBondContact O-N 3.25Å
193	S	47.7	Very low	51	Low	97 Å²	97	106.1 Å²	106.1	68%	0.678	57%	0.569	S	S	*	*	H	α-helix	trans	-72.1	-37.1	179.3	177.8	0	0	0	0	111.6	F190 A195	F190-S193 PolarHBondContact O-N 3.17Å; S193-A195 PolarHBondContact O-N 3.22Å
194	M	47.7	Very low	52.7	Low	86 Å²	86	102 Å²	102	42%	0.424	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-73.2	-1.7	175.9	-108.2	179.8	-164.5	0	0	115.3	F190 F196 M197	F190-M194 HydrophobicContact CD1-CE 4.36Å; F190-M194 HydrophobicContact CD1-SD 4.09Å; F190-M194 HydrophobicContact CE1-CE 3.31Å; F190-M194 HydrophobicContact CE1-CG 4.45Å; F190-M194 HydrophobicContact CE1-SD 3.58Å; F190-M194 VanDerWaalsContact CE1-SD 3.58Å; F190-M194 HydrophobicContact CZ-CE 3.66Å; F190-M194 HydrophobicContact CZ-SD 4.4Å; F190-M194 PolarHBondContact O-N 2.69Å; M194-F196 PolarHBondContact O-N 2.84Å; M194-F196 VanDerWaalsContact O-N 3.15Å; M194-M197 HydrophobicContact CE-SD 3.87Å; M194-M197 HydrophobicContact CG-CB 4.13Å; M194-M197 HydrophobicContact CG-SD 3.93Å; M194-M197 WeakPolarHBondContact O-CB 3.43Å; M194-M197 PolarHBondContact O-N 2.81Å
195	A	48.9	Very low	54.4	Low	47 Å²	47	98.9 Å²	98.9	39%	0.388	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-65.1	-15.8	178.8	0	0	0	0	0	113.6	R192 S193 Y208	R192-A195 WeakPolarHBondContact O-CB 3.37Å; R192-A195 PolarHBondContact O-N 3.25Å; S193-A195 PolarHBondContact O-N 3.22Å; A195-Y208 PolarHBondContact O-OH 2.89Å
196	F	49.8	Very low	56	Low	183 Å²	183	92.5 Å²	92.5	80%	0.803	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-91.5	-12.4	172.6	-76.7	-86	0	0	0	113.7	M194 Y208	M194-F196 PolarHBondContact O-N 2.84Å; M194-F196 VanDerWaalsContact O-N 3.15Å; F196-Y208 VanDerWaalsContact C-OH 3.26Å; F196-Y208 WeakPolarHBondContact O-CE1 3.41Å; F196-Y208 PolarHBondContact O-OH 3.47Å; F196-Y208 VanDerWaalsContact O-OH 3.05Å
197	M	51	Low	57.7	Low	119 Å²	119	88.3 Å²	88.3	59%	0.586	47%	0.465	S	S	*	.	S	Bend	trans	-85.1	138.1	-174.8	-131	179.1	168.5	0	0	111.2	M194 G199	M194-M197 HydrophobicContact CE-SD 3.87Å; M194-M197 HydrophobicContact CG-CB 4.13Å; M194-M197 HydrophobicContact CG-SD 3.93Å; M194-M197 WeakPolarHBondContact O-CB 3.43Å; M194-M197 PolarHBondContact O-N 2.81Å; M197-G199 PolarHBondContact O-N 3.43Å
198	P	51.7	Low	59.5	Low	99 Å²	99	88.3 Å²	88.3	64%	0.643	45%	0.45	S	S	*	.			trans	-65.9	92	179	26.7	-35.3	0	0	0	110.9	Y208	P198-Y208 HydrophobicContact CB-CD1 4.02Å; P198-Y208 HydrophobicContact CB-CD2 4.17Å; P198-Y208 HydrophobicContact CB-CE1 4.45Å; P198-Y208 HydrophobicContact CB-CG 3.87Å
199	G	50.8	Low	61.1	Low	29 Å²	29	86 Å²	86	30%	0.299	43%	0.428	S	S	.	.			trans	-112.2	128.7	177.6	0	0	0	0	0	111.6	M197 R201 H202	M197-G199 PolarHBondContact O-N 3.43Å; G199-R201 PolarHBondContact O-N 3.12Å; G199-H202 PolarHBondContact O-N 3.36Å
200	K	52.9	Low	63	Low	156 Å²	156	80.8 Å²	80.8	68%	0.678	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-50.2	-21.8	167.1	-65.7	178.3	-177.2	174.1	0	112.5	H202	K200-H202 VanDerWaalsContact C-N 3.34Å; K200-H202 PolarHBondContact O-N 3.44Å
201	R	51.4	Low	65.1	Low	152 Å²	152	76.3 Å²	76.3	57%	0.574	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-67.3	-14.4	-174.7	-157.5	170.1	-177.7	144.1	1.8	116.3	G199	G199-R201 PolarHBondContact O-N 3.12Å
202	H	54.2	Low	67.2	Low	98 Å²	98	74.1 Å²	74.1	45%	0.454	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-115.3	-4.1	-175.8	-73.8	-8.4	0	0	0	115.6	G199 K200 N204	G199-H202 PolarHBondContact O-N 3.36Å; K200-H202 VanDerWaalsContact C-N 3.34Å; K200-H202 PolarHBondContact O-N 3.44Å; H202-N204 PolarHBondContact O-N 3.15Å; H202-N204 PolarHBondContact O-OD1 2.98Å; H202-N204 VanDerWaalsContact O-OD1 3.13Å
203	G	65.4	Low	69.4	Low	8 Å²	8	64.1 Å²	64.1	8%	0.082	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	39.7	-172.6	0	0	0	0	0	111.7	D365	G203-D365 WeakPolarHBondContact O-CB 3.32Å; G203-D365 PolarHBondContact O-N 2.94Å
204	N	78.3	Confident	71.6	Confident	30 Å²	30	59.6 Å²	59.6	16%	0.16	31%	0.305	C	S	.	.			trans	-113.5	8.9	174.7	-64.9	11.3	0	0	0	111.1	H202 L206 V207 Y208 Q364 D365	H202-N204 PolarHBondContact O-N 3.15Å; H202-N204 PolarHBondContact O-OD1 2.98Å; H202-N204 VanDerWaalsContact O-OD1 3.13Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-L206 PolarHBondContact O-N 2.94Å; N204-V207 PolarHBondContact O-N 3.09Å; N204-Y208 HydrophobicContact CB-CD2 3.85Å; N204-Y208 HydrophobicContact CB-CE2 3.66Å; N204-Y208 WeakPolarHBondContact O-CD2 3.3Å; N204-Y208 PolarHBondContact O-N 3.22Å; N204-Q364 HydrophobicContact CB-CB 4.41Å; N204-Q364 HydrophobicContact CB-CG 4.26Å; N204-Q364 WeakPolarHBondContact OD1-CB 3.37Å; N204-Q364 WeakPolarHBondContact OD1-CG 3.29Å; N204-D365 WeakPolarHBondContact CA-OD1 2.93Å
205	N	82.2	Confident	73.8	Confident	31 Å²	31	59.7 Å²	59.7	17%	0.166	31%	0.307	C	S	.	.	H	α-helix	trans	-66.1	-37.8	-166.4	-174.4	1.7	0	0	0	111.2	R136 V207 Y208 V209 D365	R136-N205 PolarHBondContact NE-ND2 3.21Å; R136-N205 PolarHBondContact NH2-ND2 3.45Å; N205-V207 VanDerWaalsContact C-N 3.33Å; N205-V207 PolarHBondContact O-N 3.34Å; N205-Y208 PolarHBondContact O-N 3.05Å; N205-V209 VanDerWaalsContact O-CG2 3.31Å; N205-V209 WeakPolarHBondContact O-CG2 3.05Å; N205-V209 PolarHBondContact O-N 3.48Å; N205-D365 PolarHBondContact N-OD1 3.19Å; N205-D365 PolarHBondContact N-OD2 3.46Å
206	L	86.8	Confident	76.1	Confident	7 Å²	7	60 Å²	60	4%	0.037	30%	0.302	C	S	.	.	H	α-helix	trans	-67.5	-37.9	178.6	178.8	70.1	0	0	0	111.3	F21 W129 T137 L141 R177 N204 V209 Y210 D365 F368 I369	F21-L206 HydrophobicContact CZ-CD2 4.29Å; W129-L206 HydrophobicContact CH2-CD1 3.81Å; W129-L206 HydrophobicContact CZ3-CD1 4.19Å; T137-L206 HydrophobicContact CG2-CD1 4.44Å; L141-L206 HydrophobicContact CD1-CD1 4.43Å; L141-L206 HydrophobicContact CD1-CD2 4.27Å; R177-L206 VanDerWaalsContact NH2-CB 3.33Å; N204-L206 VanDerWaalsContact C-N 3.34Å; N204-L206 PolarHBondContact O-N 2.94Å; L206-V209 PolarHBondContact O-N 3.19Å; L206-Y210 VanDerWaalsContact O-CB 3.27Å; L206-Y210 WeakPolarHBondContact O-CB 3.49Å; L206-Y210 PolarHBondContact O-N 2.93Å; L206-D365 WeakPolarHBondContact CB-OD1 3.33Å; L206-D365 PolarHBondContact N-OD1 2.78Å; L206-D365 VanDerWaalsContact N-OD1 3.07Å; L206-F368 HydrophobicContact CD2-CD1 3.58Å; L206-F368 HydrophobicContact CD2-CE1 3.85Å; L206-F368 HydrophobicContact CG-CD1 3.79Å; L206-F368 HydrophobicContact CG-CE1 3.75Å; L206-I369 HydrophobicContact CD2-CD1 4.04Å; L206-I369 HydrophobicContact CD2-CG1 3.78Å
207	V	88.5	Confident	78.3	Confident	9 Å²	9	51.3 Å²	51.3	6%	0.055	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-44.7	175.6	-178.1	0	0	0	0	111.2	N204 N205 Y210 L211 M323 Q364 D365 F368	N204-V207 PolarHBondContact O-N 3.09Å; N205-V207 VanDerWaalsContact C-N 3.33Å; N205-V207 PolarHBondContact O-N 3.34Å; V207-Y210 PolarHBondContact O-N 3.21Å; V207-L211 HydrophobicContact CG1-CD1 4.11Å; V207-L211 HydrophobicContact CG1-CG 4.48Å; V207-L211 WeakPolarHBondContact O-CG 3.34Å; V207-L211 PolarHBondContact O-N 3.18Å; V207-M323 HydrophobicContact CG1-CB 4.18Å; V207-M323 HydrophobicContact CG1-CG 3.94Å; V207-M323 HydrophobicContact CG1-SD 4.48Å; V207-M323 HydrophobicContact CG2-SD 4.32Å; V207-Q364 HydrophobicContact CG2-CG 3.9Å; V207-D365 PolarHBondContact N-OD1 3.02Å; V207-F368 HydrophobicContact CG2-CB 3.58Å; V207-F368 HydrophobicContact CG2-CD2 4.07Å; V207-F368 HydrophobicContact CG2-CG 3.81Å
208	Y	87.8	Confident	80.4	Confident	51 Å²	51	46.2 Å²	46.2	20%	0.2	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-47.5	177.5	-78.8	-69.5	0	0	0	112.3	A195 F196 P198 N204 N205 Y210 L211 T212	A195-Y208 PolarHBondContact O-OH 2.89Å; F196-Y208 VanDerWaalsContact C-OH 3.26Å; F196-Y208 WeakPolarHBondContact O-CE1 3.41Å; F196-Y208 PolarHBondContact O-OH 3.47Å; F196-Y208 VanDerWaalsContact O-OH 3.05Å; P198-Y208 HydrophobicContact CB-CD1 4.02Å; P198-Y208 HydrophobicContact CB-CD2 4.17Å; P198-Y208 HydrophobicContact CB-CE1 4.45Å; P198-Y208 HydrophobicContact CB-CG 3.87Å; N204-Y208 HydrophobicContact CB-CD2 3.85Å; N204-Y208 HydrophobicContact CB-CE2 3.66Å; N204-Y208 WeakPolarHBondContact O-CD2 3.3Å; N204-Y208 PolarHBondContact O-N 3.22Å; N205-Y208 PolarHBondContact O-N 3.05Å; Y208-Y210 VanDerWaalsContact C-N 3.28Å; Y208-Y210 PolarHBondContact O-N 3.48Å; Y208-L211 PolarHBondContact O-N 3.39Å; Y208-T212 PolarHBondContact O-N 3Å; Y208-T212 PolarHBondContact O-OG1 3.29Å; Y208-T212 VanDerWaalsContact O-OG1 3.09Å
209	V	89.9	Confident	82.5	Confident	24 Å²	24	46.5 Å²	46.5	15%	0.145	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-44.4	176.7	173.8	0	0	0	0	110.4	W129 F132 N205 L206 L211 T212 I213	W129-V209 HydrophobicContact CE3-CG1 4.18Å; W129-V209 HydrophobicContact CZ3-CG1 3.96Å; F132-V209 HydrophobicContact CB-CG1 3.98Å; F132-V209 HydrophobicContact CD1-CG1 4.21Å; F132-V209 HydrophobicContact CD2-CG1 4.06Å; F132-V209 HydrophobicContact CG-CG1 3.83Å; N205-V209 VanDerWaalsContact O-CG2 3.31Å; N205-V209 WeakPolarHBondContact O-CG2 3.05Å; N205-V209 PolarHBondContact O-N 3.48Å; L206-V209 PolarHBondContact O-N 3.19Å; V209-L211 PolarHBondContact O-N 2.96Å; V209-T212 WeakPolarHBondContact O-CB 3.32Å; V209-T212 PolarHBondContact O-N 2.76Å; V209-I213 WeakPolarHBondContact O-CG1 3.05Å; V209-I213 PolarHBondContact O-N 3.24Å
210	Y	92.1	Very high	84.6	Confident	1 Å²	1	46 Å²	46	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-43.5	177.3	179.6	-111	0	0	0	112.9	D26 W129 L206 V207 Y208 T212 I213 K214 W319 F368 M372	D26-Y210 PolarHBondContact OD2-OH 2.88Å; D26-Y210 VanDerWaalsContact OD2-OH 3.06Å; W129-Y210 AromaticContact CH2-CD2 3.61Å; W129-Y210 HydrophobicContact CH2-CD2 3.61Å; W129-Y210 HydrophobicContact CH2-CG 4.04Å; W129-Y210 AromaticContact CZ2-CD2 3.61Å; W129-Y210 HydrophobicContact CZ2-CD2 3.61Å; W129-Y210 HydrophobicContact CZ2-CE2 4.31Å; W129-Y210 HydrophobicContact CZ2-CG 4.45Å; W129-Y210 HydrophobicContact CZ3-CD2 4.16Å; L206-Y210 VanDerWaalsContact O-CB 3.27Å; L206-Y210 WeakPolarHBondContact O-CB 3.49Å; L206-Y210 PolarHBondContact O-N 2.93Å; V207-Y210 PolarHBondContact O-N 3.21Å; Y208-Y210 VanDerWaalsContact C-N 3.28Å; Y208-Y210 PolarHBondContact O-N 3.48Å; Y210-T212 VanDerWaalsContact C-N 3.33Å; Y210-T212 PolarHBondContact O-N 3.44Å; Y210-I213 PolarHBondContact O-N 3Å; Y210-K214 HydrophobicContact CE1-CD 4.14Å; Y210-K214 HydrophobicContact CE1-CG 4.5Å; Y210-K214 PolarHBondContact O-N 3.37Å; Y210-K214 WeakPolarHBondContact OH-CE 2.94Å; Y210-K214 PolarHBondContact OH-NZ 2.78Å; Y210-W319 AromaticContact CE1-CD2 3.59Å; Y210-W319 HydrophobicContact CE1-CD2 3.59Å; Y210-W319 AromaticContact CE1-CE2 3.59Å; Y210-W319 AromaticContact CE1-CE3 3.94Å; Y210-W319 HydrophobicContact CE1-CE3 3.94Å; Y210-W319 AromaticContact CE1-CG 3.96Å; Y210-W319 HydrophobicContact CE1-CG 3.96Å; Y210-W319 HydrophobicContact CE1-CH2 4.17Å; Y210-W319 AromaticContact CE1-CZ2 3.87Å; Y210-W319 HydrophobicContact CE1-CZ2 3.87Å; Y210-W319 HydrophobicContact CE1-CZ3 4.25Å; Y210-W319 AromaticContact CZ-CE2 3.88Å; Y210-W319 AromaticContact CZ-CZ2 3.92Å; Y210-W319 VanDerWaalsContact OH-CE2 3.26Å; Y210-W319 VanDerWaalsContact OH-CZ2 3.29Å; Y210-W319 WeakPolarHBondContact OH-CZ2 3.48Å; Y210-W319 PolarHBondContact OH-NE1 3.19Å; Y210-F368 AromaticContact CD1-CE2 3.34Å; Y210-F368 HydrophobicContact CD1-CE2 3.34Å; Y210-F368 AromaticContact CD1-CZ 3.53Å; Y210-F368 HydrophobicContact CD1-CZ 3.53Å; Y210-F368 HydrophobicContact CD2-CE2 4.48Å; Y210-F368 AromaticContact CD2-CZ 3.85Å; Y210-F368 HydrophobicContact CD2-CZ 3.85Å; Y210-F368 AromaticContact CE1-CE2 3.63Å; Y210-F368 HydrophobicContact CE1-CE2 3.63Å; Y210-F368 AromaticContact CE1-CZ 3.94Å; Y210-F368 HydrophobicContact CE1-CZ 3.94Å; Y210-F368 HydrophobicContact CE2-CZ 4.26Å; Y210-F368 HydrophobicContact CG-CE1 4.48Å; Y210-F368 AromaticContact CG-CE2 3.78Å; Y210-F368 HydrophobicContact CG-CE2 3.78Å; Y210-F368 AromaticContact CG-CZ 3.43Å; Y210-F368 HydrophobicContact CG-CZ 3.43Å; Y210-F368 VanDerWaalsContact CG-CZ 3.43Å; Y210-M372 HydrophobicContact CD2-CE 4.08Å; Y210-M372 HydrophobicContact CE1-CE 3.86Å; Y210-M372 HydrophobicContact CE2-CE 3.31Å; Y210-M372 WeakPolarHBondContact OH-CE 3.48Å
211	L	92.8	Very high	86.6	Confident	24 Å²	24	38.6 Å²	38.6	13%	0.126	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-38.2	175.1	-71.4	171.4	0	0	0	111.9	V207 Y208 V209 I213 K214 L215 W319 L320	V207-L211 HydrophobicContact CG1-CD1 4.11Å; V207-L211 HydrophobicContact CG1-CG 4.48Å; V207-L211 WeakPolarHBondContact O-CG 3.34Å; V207-L211 PolarHBondContact O-N 3.18Å; Y208-L211 PolarHBondContact O-N 3.39Å; V209-L211 PolarHBondContact O-N 2.96Å; L211-I213 VanDerWaalsContact C-N 3.33Å; L211-K214 PolarHBondContact O-N 3.37Å; L211-L215 WeakPolarHBondContact O-CG 3.17Å; L211-L215 PolarHBondContact O-N 3.35Å; L211-W319 HydrophobicContact CD2-CB 4.24Å; L211-L320 HydrophobicContact CD1-CD2 3.7Å; L211-L320 HydrophobicContact CD2-CD2 4.03Å; L211-L320 HydrophobicContact CD2-CG 4.3Å
212	T	92.7	Very high	88.6	Confident	88 Å²	88	35.2 Å²	35.2	54%	0.54	18%	0.184	S	C	.	.	H	α-helix	trans	-61.9	-40.9	173	-59	0	0	0	0	111.5	Y208 V209 Y210 K214 L215 L216	Y208-T212 PolarHBondContact O-N 3Å; Y208-T212 PolarHBondContact O-OG1 3.29Å; Y208-T212 VanDerWaalsContact O-OG1 3.09Å; V209-T212 WeakPolarHBondContact O-CB 3.32Å; V209-T212 PolarHBondContact O-N 2.76Å; Y210-T212 VanDerWaalsContact C-N 3.33Å; Y210-T212 PolarHBondContact O-N 3.44Å; T212-K214 VanDerWaalsContact C-N 3.34Å; T212-K214 PolarHBondContact O-N 2.88Å; T212-L215 PolarHBondContact O-N 3.44Å; T212-L216 WeakPolarHBondContact O-CB 3.39Å; T212-L216 PolarHBondContact O-N 2.68Å
213	I	94	Very high	90.5	Very high	7 Å²	7	35.2 Å²	35.2	4%	0.036	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-39.5	174.8	-66	-62.9	0	0	0	111.4	I128 W129 V209 Y210 L211 L216 Y217	I128-I213 HydrophobicContact CB-CD1 4.09Å; I128-I213 HydrophobicContact CG2-CD1 3.7Å; W129-I213 HydrophobicContact CB-CD1 4.26Å; W129-I213 HydrophobicContact CB-CG1 4.18Å; W129-I213 HydrophobicContact CB-CG2 4.21Å; W129-I213 HydrophobicContact CE3-CG1 3.9Å; V209-I213 WeakPolarHBondContact O-CG1 3.05Å; V209-I213 PolarHBondContact O-N 3.24Å; Y210-I213 PolarHBondContact O-N 3Å; L211-I213 VanDerWaalsContact C-N 3.33Å; I213-L216 WeakPolarHBondContact O-CB 3.24Å; I213-L216 PolarHBondContact O-N 3.41Å; I213-Y217 HydrophobicContact CG2-CD2 3.89Å; I213-Y217 HydrophobicContact CG2-CE2 3.59Å; I213-Y217 WeakPolarHBondContact O-CD2 3.4Å; I213-Y217 PolarHBondContact O-N 2.9Å
214	K	94.7	Very high	91.9	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.009	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-41.5	174.6	-70.8	-161	176.3	-71.5	0	113.2	D26 Y210 L211 T212 L216 Y217 S218 I316 W319	D26-K214 IonicContact OD1-NZ 2.67Å; D26-K214 PolarHBondContact OD1-NZ 2.76Å; D26-K214 IonicContact OD2-NZ 3.67Å; D26-K214 PolarHBondContact OD2-NZ 3.28Å; Y210-K214 HydrophobicContact CE1-CD 4.14Å; Y210-K214 HydrophobicContact CE1-CG 4.5Å; Y210-K214 PolarHBondContact O-N 3.37Å; Y210-K214 WeakPolarHBondContact OH-CE 2.94Å; Y210-K214 PolarHBondContact OH-NZ 2.78Å; L211-K214 PolarHBondContact O-N 3.37Å; T212-K214 VanDerWaalsContact C-N 3.34Å; T212-K214 PolarHBondContact O-N 2.88Å; K214-L216 VanDerWaalsContact C-N 3.26Å; K214-L216 PolarHBondContact O-N 3Å; K214-Y217 PolarHBondContact O-N 3.41Å; K214-S218 WeakPolarHBondContact O-CB 3.5Å; K214-S218 PolarHBondContact O-N 3.07Å; K214-I316 HydrophobicContact CB-CD1 4.45Å; K214-I316 HydrophobicContact CB-CG1 3.8Å; K214-I316 HydrophobicContact CD-CG1 4.27Å; K214-W319 HydrophobicContact CD-CG 4.5Å
215	L	95	Very high	92.6	Very high	89 Å²	89	33.8 Å²	33.8	47%	0.466	17%	0.173	S	C	.	.	H	α-helix	trans	-62.7	-37.9	173.2	-71.3	171.9	0	0	0	111	L211 T212 S218 I219 I316	L211-L215 WeakPolarHBondContact O-CG 3.17Å; L211-L215 PolarHBondContact O-N 3.35Å; T212-L215 PolarHBondContact O-N 3.44Å; L215-S218 WeakPolarHBondContact O-CB 3.5Å; L215-S218 PolarHBondContact O-N 2.97Å; L215-I219 VanDerWaalsContact O-CG1 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.06Å; L215-I316 HydrophobicContact CD2-CD1 4.12Å
216	L	95.8	Very high	93	Very high	52 Å²	52	37.4 Å²	37.4	27%	0.272	19%	0.185	S	C	.	.	H	α-helix	trans	-63.8	-43.8	175.3	-175.8	62.3	0	0	0	112	P125 I128 T212 I213 K214 S218 I219 V220	P125-L216 HydrophobicContact CB-CD2 3.85Å; P125-L216 HydrophobicContact CB-CG 4.13Å; P125-L216 HydrophobicContact CG-CD2 4.01Å; P125-L216 HydrophobicContact CG-CG 3.95Å; I128-L216 HydrophobicContact CD1-CD2 3.71Å; T212-L216 WeakPolarHBondContact O-CB 3.39Å; T212-L216 PolarHBondContact O-N 2.68Å; I213-L216 WeakPolarHBondContact O-CB 3.24Å; I213-L216 PolarHBondContact O-N 3.41Å; K214-L216 VanDerWaalsContact C-N 3.26Å; K214-L216 PolarHBondContact O-N 3Å; L216-S218 VanDerWaalsContact C-N 3.3Å; L216-S218 PolarHBondContact O-N 3.01Å; L216-I219 PolarHBondContact O-N 3.29Å; L216-V220 HydrophobicContact CD1-CG2 4.5Å; L216-V220 WeakPolarHBondContact O-CB 2.97Å; L216-V220 VanDerWaalsContact O-CG2 3.29Å; L216-V220 WeakPolarHBondContact O-CG2 3.45Å; L216-V220 PolarHBondContact O-N 2.77Å
217	Y	95.8	Very high	93.2	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-58.9	-41.7	172.6	-80.2	-60.6	0	0	0	112.3	D26 N29 F30 P125 R126 I213 K214 V220 G221	D26-Y217 HydrophobicContact CB-CE2 4.11Å; N29-Y217 HydrophobicContact CB-CD1 3.49Å; N29-Y217 VanDerWaalsContact CB-CD1 3.49Å; N29-Y217 HydrophobicContact CB-CE1 3.63Å; N29-Y217 HydrophobicContact CB-CG 4.25Å; F30-Y217 HydrophobicContact CB-CE1 4.42Å; P125-Y217 HydrophobicContact CB-CD1 3.8Å; P125-Y217 HydrophobicContact CB-CD2 4.3Å; P125-Y217 HydrophobicContact CB-CE1 3.55Å; P125-Y217 HydrophobicContact CB-CE2 4.08Å; P125-Y217 HydrophobicContact CB-CG 4.17Å; P125-Y217 HydrophobicContact CG-CD1 3.81Å; P125-Y217 HydrophobicContact CG-CE1 3.83Å; P125-Y217 HydrophobicContact CG-CG 4.44Å; R126-Y217 PolarHBondContact N-OH 3.05Å; I213-Y217 HydrophobicContact CG2-CD2 3.89Å; I213-Y217 HydrophobicContact CG2-CE2 3.59Å; I213-Y217 WeakPolarHBondContact O-CD2 3.4Å; I213-Y217 PolarHBondContact O-N 2.9Å; K214-Y217 PolarHBondContact O-N 3.41Å; Y217-V220 PolarHBondContact O-N 3.47Å; Y217-G221 PolarHBondContact O-N 3.09Å
218	S	94.9	Very high	93.3	Very high	12 Å²	12	38 Å²	38	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-60.7	-47.6	175.9	157.4	0	0	0	0	112	K214 L215 L216 G221 F222 M313	K214-S218 WeakPolarHBondContact O-CB 3.5Å; K214-S218 PolarHBondContact O-N 3.07Å; L215-S218 WeakPolarHBondContact O-CB 3.5Å; L215-S218 PolarHBondContact O-N 2.97Å; L216-S218 VanDerWaalsContact C-N 3.3Å; L216-S218 PolarHBondContact O-N 3.01Å; S218-G221 PolarHBondContact O-N 3.24Å; S218-F222 VanDerWaalsContact O-CD2 3.23Å; S218-F222 WeakPolarHBondContact O-CD2 3.17Å; S218-F222 PolarHBondContact O-N 3.35Å; S218-F222 VanDerWaalsContact O-N 3.08Å; S218-M313 WeakPolarHBondContact OG-CE 3.38Å; S218-M313 PolarHBondContact OG-SD 3.43Å
219	I	95.7	Very high	93.3	Very high	105 Å²	105	36.1 Å²	36.1	54%	0.538	18%	0.18	S	C	.	.	H	α-helix	trans	-62.6	-44.2	176.2	-68.2	164.5	0	0	0	111.1	L215 L216 G221 F222 F223	L215-I219 VanDerWaalsContact O-CG1 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.38Å; L215-I219 PolarHBondContact O-N 3.06Å; L216-I219 PolarHBondContact O-N 3.29Å; I219-G221 VanDerWaalsContact C-N 3.32Å; I219-G221 PolarHBondContact O-N 3.24Å; I219-F222 PolarHBondContact O-N 3.29Å; I219-F223 WeakPolarHBondContact O-CB 3.47Å; I219-F223 PolarHBondContact O-N 2.94Å
220	V	96.5	Very high	93.1	Very high	20 Å²	20	41.7 Å²	41.7	12%	0.121	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-44.3	175.3	171	0	0	0	0	110	Y122 P125 L216 Y217 F222 F223 Q224	Y122-V220 HydrophobicContact CD1-CG1 3.9Å; Y122-V220 HydrophobicContact CE1-CG1 4.11Å; Y122-V220 HydrophobicContact CG-CG1 4.31Å; P125-V220 HydrophobicContact CG-CG2 4.09Å; L216-V220 HydrophobicContact CD1-CG2 4.5Å; L216-V220 WeakPolarHBondContact O-CB 2.97Å; L216-V220 VanDerWaalsContact O-CG2 3.29Å; L216-V220 WeakPolarHBondContact O-CG2 3.45Å; L216-V220 PolarHBondContact O-N 2.77Å; Y217-V220 PolarHBondContact O-N 3.47Å; V220-F222 PolarHBondContact O-N 2.93Å; V220-F223 PolarHBondContact O-N 3.16Å; V220-Q224 HydrophobicContact CG1-CG 3.98Å; V220-Q224 WeakPolarHBondContact O-CB 3.36Å; V220-Q224 WeakPolarHBondContact O-CG 3.36Å; V220-Q224 PolarHBondContact O-N 3.31Å
221	G	95	Very high	92.9	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-56.2	-47.6	176.1	0	0	0	0	0	113.5	Y217 S218 I219 Q224 L225	Y217-G221 PolarHBondContact O-N 3.09Å; S218-G221 PolarHBondContact O-N 3.24Å; I219-G221 VanDerWaalsContact C-N 3.32Å; I219-G221 PolarHBondContact O-N 3.24Å; G221-Q224 PolarHBondContact O-N 3.48Å; G221-L225 PolarHBondContact O-N 3.32Å
222	F	93.5	Very high	92.4	Very high	81 Å²	81	42.8 Å²	42.8	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-63.9	-44.1	175.2	-77	-66.9	0	0	0	112.4	S218 I219 V220 Q224 L225 Y226 W241 M309 M313	S218-F222 VanDerWaalsContact O-CD2 3.23Å; S218-F222 WeakPolarHBondContact O-CD2 3.17Å; S218-F222 PolarHBondContact O-N 3.35Å; S218-F222 VanDerWaalsContact O-N 3.08Å; I219-F222 PolarHBondContact O-N 3.29Å; V220-F222 PolarHBondContact O-N 2.93Å; F222-Q224 VanDerWaalsContact C-N 3.25Å; F222-Q224 PolarHBondContact O-N 3.18Å; F222-L225 PolarHBondContact O-N 2.87Å; F222-Y226 WeakPolarHBondContact O-CB 3.41Å; F222-Y226 PolarHBondContact O-N 2.97Å; F222-W241 HydrophobicContact CB-CH2 4.3Å; F222-W241 HydrophobicContact CB-CZ3 4.17Å; F222-W241 HydrophobicContact CD1-CE3 4.26Å; F222-W241 HydrophobicContact CD1-CH2 4.13Å; F222-W241 AromaticContact CD1-CZ3 3.72Å; F222-W241 HydrophobicContact CD1-CZ3 3.72Å; F222-W241 HydrophobicContact CG-CZ3 4.44Å; F222-M309 HydrophobicContact CD1-CE 4.42Å; F222-M309 HydrophobicContact CD1-SD 3.84Å; F222-M309 HydrophobicContact CD2-SD 4.47Å; F222-M309 HydrophobicContact CE1-CE 4.11Å; F222-M309 HydrophobicContact CE1-SD 3.95Å; F222-M309 HydrophobicContact CG-SD 4.11Å; F222-M309 HydrophobicContact CZ-SD 4.32Å; F222-M313 HydrophobicContact CD2-CE 3.77Å; F222-M313 HydrophobicContact CE2-CE 3.21Å; F222-M313 HydrophobicContact CE2-SD 3.99Å; F222-M313 HydrophobicContact CZ-CE 3.83Å; F222-M313 HydrophobicContact CZ-SD 4.47Å
223	F	94	Very high	91.6	Very high	97 Å²	97	45.5 Å²	45.5	43%	0.425	21%	0.208	S	C	.	.	H	α-helix	trans	-60.3	-37.2	178.1	179.9	-104.5	0	0	0	111.9	L121 I219 V220 Y226 L227	L121-F223 HydrophobicContact CD1-CD1 4.19Å; L121-F223 HydrophobicContact CD1-CE1 3.73Å; I219-F223 WeakPolarHBondContact O-CB 3.47Å; I219-F223 PolarHBondContact O-N 2.94Å; V220-F223 PolarHBondContact O-N 3.16Å; F223-Y226 PolarHBondContact O-N 3.24Å; F223-L227 HydrophobicContact CE1-CD1 3.92Å; F223-L227 HydrophobicContact CZ-CD1 4.25Å; F223-L227 WeakPolarHBondContact O-CB 3.47Å; F223-L227 PolarHBondContact O-N 3.49Å
224	Q	94.2	Very high	90.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-68.3	-44.4	-179.8	-67	-83	20.6	0	0	112	Q118 L121 Y122 V220 G221 F222 Y226 L227 M228	Q118-Q224 PolarHBondContact O-NE2 3.49Å; L121-Q224 VanDerWaalsContact CB-NE2 3.33Å; Y122-Q224 HydrophobicContact CD2-CG 4.05Å; Y122-Q224 HydrophobicContact CE1-CG 4.31Å; Y122-Q224 HydrophobicContact CE2-CB 3.9Å; Y122-Q224 HydrophobicContact CE2-CG 3.43Å; Y122-Q224 VanDerWaalsContact CE2-CG 3.43Å; V220-Q224 HydrophobicContact CG1-CG 3.98Å; V220-Q224 WeakPolarHBondContact O-CB 3.36Å; V220-Q224 WeakPolarHBondContact O-CG 3.36Å; V220-Q224 PolarHBondContact O-N 3.31Å; G221-Q224 PolarHBondContact O-N 3.48Å; F222-Q224 VanDerWaalsContact C-N 3.25Å; F222-Q224 PolarHBondContact O-N 3.18Å; Q224-Y226 VanDerWaalsContact C-N 3.32Å; Q224-Y226 PolarHBondContact O-N 2.94Å; Q224-L227 PolarHBondContact O-N 3.33Å; Q224-M228 WeakPolarHBondContact O-CG 3.29Å; Q224-M228 PolarHBondContact O-N 3.21Å
225	L	92.3	Very high	89	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-40.7	173.5	-67.7	177.4	0	0	0	111.5	G221 F222 M228 Y229 F302 M309	G221-L225 PolarHBondContact O-N 3.32Å; F222-L225 PolarHBondContact O-N 2.87Å; L225-M228 HydrophobicContact CD2-SD 4.43Å; L225-M228 PolarHBondContact O-N 3.41Å; L225-Y229 PolarHBondContact O-N 3.34Å; L225-F302 HydrophobicContact CD2-CD2 4.18Å; L225-M309 HydrophobicContact CD1-CE 3.48Å; L225-M309 VanDerWaalsContact CD1-CE 3.48Å; L225-M309 HydrophobicContact CD1-SD 3.68Å
226	Y	90.7	Very high	87.4	Confident	108 Å²	108	49.8 Å²	49.8	42%	0.424	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-41.1	174.9	177.7	-100.8	0	0	0	112.1	F222 F223 Q224 M228 Y229 F230	F222-Y226 WeakPolarHBondContact O-CB 3.41Å; F222-Y226 PolarHBondContact O-N 2.97Å; F223-Y226 PolarHBondContact O-N 3.24Å; Q224-Y226 VanDerWaalsContact C-N 3.32Å; Q224-Y226 PolarHBondContact O-N 2.94Å; Y226-M228 VanDerWaalsContact C-N 3.33Å; Y226-M228 PolarHBondContact O-N 3.12Å; Y226-Y229 WeakPolarHBondContact O-CB 3.44Å; Y226-Y229 PolarHBondContact O-N 3Å; Y226-F230 WeakPolarHBondContact O-CB 3.41Å; Y226-F230 PolarHBondContact O-N 2.88Å
227	L	91.6	Very high	85.7	Confident	27 Å²	27	54.8 Å²	54.8	14%	0.141	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-44	176.4	-166.1	158.2	0	0	0	110.6	V114 Q118 F223 Q224 F230 F231	V114-L227 HydrophobicContact CG1-CD2 3.41Å; V114-L227 VanDerWaalsContact CG1-CD2 3.41Å; Q118-L227 HydrophobicContact CG-CD2 4.22Å; F223-L227 HydrophobicContact CE1-CD1 3.92Å; F223-L227 HydrophobicContact CZ-CD1 4.25Å; F223-L227 WeakPolarHBondContact O-CB 3.47Å; F223-L227 PolarHBondContact O-N 3.49Å; Q224-L227 PolarHBondContact O-N 3.33Å; L227-F230 PolarHBondContact O-N 3.31Å; L227-F231 HydrophobicContact CD2-CB 4.44Å; L227-F231 WeakPolarHBondContact O-CB 3.47Å; L227-F231 PolarHBondContact O-N 3.02Å
228	M	90.4	Very high	84	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.6	-45.8	175.6	-67.2	170.3	71.3	0	0	111.8	Q224 L225 Y226 F231 L232 F243 Y298 L301 L305	Q224-M228 WeakPolarHBondContact O-CG 3.29Å; Q224-M228 PolarHBondContact O-N 3.21Å; L225-M228 HydrophobicContact CD2-SD 4.43Å; L225-M228 PolarHBondContact O-N 3.41Å; Y226-M228 VanDerWaalsContact C-N 3.33Å; Y226-M228 PolarHBondContact O-N 3.12Å; M228-F231 PolarHBondContact O-N 3.34Å; M228-L232 WeakPolarHBondContact O-CG 3.14Å; M228-L232 PolarHBondContact O-N 2.89Å; M228-L232 VanDerWaalsContact O-N 3.08Å; M228-F243 HydrophobicContact CB-CE1 4.33Å; M228-F243 HydrophobicContact CB-CZ 4Å; M228-F243 HydrophobicContact CE-CZ 4.25Å; M228-Y298 HydrophobicContact CB-CD1 4.47Å; M228-Y298 HydrophobicContact CB-CE1 4.46Å; M228-Y298 HydrophobicContact CE-CD1 3.56Å; M228-Y298 HydrophobicContact CE-CE1 4.24Å; M228-Y298 HydrophobicContact CG-CD1 4.36Å; M228-Y298 HydrophobicContact CG-CE1 4.21Å; M228-L301 HydrophobicContact CE-CB 3.59Å; M228-L301 HydrophobicContact CE-CD1 4.5Å; M228-L305 HydrophobicContact SD-CD1 3.89Å
229	Y	87.4	Confident	82.5	Confident	12 Å²	12	57 Å²	57	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-58.5	-49.2	176.7	168.8	-93.8	0	0	0	111.8	L225 Y226 F234 N235 S236 Y240 F243	L225-Y229 PolarHBondContact O-N 3.34Å; Y226-Y229 WeakPolarHBondContact O-CB 3.44Å; Y226-Y229 PolarHBondContact O-N 3Å; Y229-F234 HydrophobicContact CD2-CB 3.7Å; Y229-F234 HydrophobicContact CD2-CD2 4.19Å; Y229-F234 HydrophobicContact CD2-CG 4.34Å; Y229-F234 HydrophobicContact CE2-CB 3.31Å; Y229-F234 HydrophobicContact CE2-CG 4.3Å; Y229-F234 PolarHBondContact OH-O 3.49Å; Y229-F234 VanDerWaalsContact OH-O 3.1Å; Y229-N235 VanDerWaalsContact OH-C 3.25Å; Y229-N235 PolarHBondContact OH-O 3.16Å; Y229-S236 WeakPolarHBondContact OH-CA 3.35Å; Y229-S236 PolarHBondContact OH-N 3.41Å; Y229-Y240 HydrophobicContact CD1-CD1 4.17Å; Y229-Y240 WeakPolarHBondContact CD2-O 3.49Å; Y229-Y240 AromaticContact CE1-CD1 3.39Å; Y229-Y240 HydrophobicContact CE1-CD1 3.39Å; Y229-Y240 AromaticContact CE1-CE1 3.9Å; Y229-Y240 HydrophobicContact CE1-CE1 3.9Å; Y229-Y240 HydrophobicContact CE1-CG 4.45Å; Y229-Y240 HydrophobicContact CE2-CD1 4.21Å; Y229-Y240 AromaticContact CZ-CD1 3.41Å; Y229-Y240 VanDerWaalsContact CZ-CD1 3.41Å; Y229-Y240 AromaticContact CZ-CE1 3.87Å; Y229-Y240 WeakPolarHBondContact OH-CD1 3.47Å; Y229-Y240 WeakPolarHBondContact OH-CE1 3.42Å; Y229-F243 HydrophobicContact CD2-CB 4.39Å; Y229-F243 HydrophobicContact CD2-CD1 4.38Å
230	F	86.5	Confident	81	Confident	141 Å²	141	57.2 Å²	57.2	62%	0.618	27%	0.265	S	S	*	.	H	α-helix	trans	-64.1	-43.6	180	178.6	-100.2	0	0	0	111.8	Y226 L227 L232 R233	Y226-F230 WeakPolarHBondContact O-CB 3.41Å; Y226-F230 PolarHBondContact O-N 2.88Å; L227-F230 PolarHBondContact O-N 3.31Å; F230-L232 VanDerWaalsContact C-N 3.35Å; F230-L232 PolarHBondContact O-N 3.42Å; F230-R233 PolarHBondContact O-N 3.26Å
231	F	87.5	Confident	79.8	Confident	29 Å²	29	62.4 Å²	62.4	13%	0.127	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-36.1	-177.7	-178.3	-102.9	0	0	0	112.9	Y107 W110 V111 V114 L227 M228 R233 Y298	Y107-F231 AromaticContact CD2-CE1 3.78Å; Y107-F231 HydrophobicContact CD2-CE1 3.78Å; Y107-F231 HydrophobicContact CD2-CZ 4.12Å; Y107-F231 VanDerWaalsContact O-CZ 3.3Å; Y107-F231 WeakPolarHBondContact O-CZ 3.48Å; W110-F231 HydrophobicContact CB-CE2 3.8Å; W110-F231 HydrophobicContact CB-CZ 3.95Å; V111-F231 HydrophobicContact CB-CE1 4.46Å; V111-F231 HydrophobicContact CG2-CE1 3.66Å; V111-F231 HydrophobicContact CG2-CZ 3.89Å; V114-F231 HydrophobicContact CB-CE2 4.36Å; V114-F231 HydrophobicContact CB-CZ 4.49Å; V114-F231 HydrophobicContact CG1-CD2 4.46Å; V114-F231 HydrophobicContact CG1-CG 4.45Å; V114-F231 HydrophobicContact CG2-CD2 3.86Å; V114-F231 HydrophobicContact CG2-CE2 3.58Å; V114-F231 HydrophobicContact CG2-CZ 4.11Å; L227-F231 HydrophobicContact CD2-CB 4.44Å; L227-F231 WeakPolarHBondContact O-CB 3.47Å; L227-F231 PolarHBondContact O-N 3.02Å; M228-F231 PolarHBondContact O-N 3.34Å; F231-R233 PolarHBondContact O-N 2.91Å; F231-Y298 VanDerWaalsContact CD1-OH 3.27Å; F231-Y298 WeakPolarHBondContact CD1-OH 3.4Å; F231-Y298 WeakPolarHBondContact CE1-OH 3.28Å
232	L	82.1	Confident	79.2	Confident	20 Å²	20	68.1 Å²	68.1	11%	0.105	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	1.3	175.4	-67.6	174.5	0	0	0	113.5	Y107 M228 F230 F234 F243 F263 Y298	Y107-L232 HydrophobicContact CE2-CD2 4.21Å; M228-L232 WeakPolarHBondContact O-CG 3.14Å; M228-L232 PolarHBondContact O-N 2.89Å; M228-L232 VanDerWaalsContact O-N 3.08Å; F230-L232 VanDerWaalsContact C-N 3.35Å; F230-L232 PolarHBondContact O-N 3.42Å; L232-F234 HydrophobicContact CB-CD2 3.66Å; L232-F234 HydrophobicContact CB-CE2 3.47Å; L232-F234 VanDerWaalsContact CB-CE2 3.47Å; L232-F234 HydrophobicContact CB-CZ 4.27Å; L232-F234 HydrophobicContact CD1-CD2 4.39Å; L232-F234 HydrophobicContact CD1-CE2 3.59Å; L232-F234 HydrophobicContact CD1-CZ 4.38Å; L232-F234 HydrophobicContact CG-CE2 4.17Å; L232-F234 PolarHBondContact O-N 3.12Å; L232-F243 HydrophobicContact CD1-CE2 3.98Å; L232-F263 HydrophobicContact CD1-CE2 4.4Å; L232-F263 HydrophobicContact CD1-CZ 3.7Å; L232-F263 HydrophobicContact CD2-CE1 3.45Å; L232-F263 VanDerWaalsContact CD2-CE1 3.45Å; L232-F263 HydrophobicContact CD2-CZ 3.36Å; L232-F263 HydrophobicContact CG-CZ 4.11Å; L232-Y298 HydrophobicContact CD1-CD1 3.8Å; L232-Y298 HydrophobicContact CD1-CD2 4.46Å; L232-Y298 HydrophobicContact CD1-CE1 4.38Å; L232-Y298 HydrophobicContact CD1-CG 3.87Å; L232-Y298 HydrophobicContact CD2-CD1 4.48Å; L232-Y298 HydrophobicContact CD2-CD2 4.06Å; L232-Y298 HydrophobicContact CD2-CE2 4.08Å; L232-Y298 HydrophobicContact CD2-CG 4.3Å; L232-Y298 HydrophobicContact CG-CD1 4.32Å; L232-Y298 HydrophobicContact CG-CE1 4.43Å; L232-Y298 HydrophobicContact CG-CG 4.5Å
233	R	75.7	Confident	78.8	Confident	145 Å²	145	64.4 Å²	64.4	55%	0.547	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	36.4	178.7	-56.4	-179.1	69.2	-167.7	-2.4	112.7	P102 Q104 F230 F231 N235	P102-R233 PolarHBondContact O-NH1 3.38Å; P102-R233 PolarHBondContact O-NH2 3.39Å; Q104-R233 PolarHBondContact O-NH1 3.17Å; F230-R233 PolarHBondContact O-N 3.26Å; F231-R233 PolarHBondContact O-N 2.91Å; R233-N235 PolarHBondContact O-N 2.93Å
234	F	69.7	Low	78.3	Confident	21 Å²	21	59.8 Å²	59.8	9%	0.092	28%	0.276	C	S	.	.			trans	-62.8	131	171.3	-77.3	-63.1	0	0	0	109.3	Y229 L232 E238 F243 I247 V262 F263	Y229-F234 HydrophobicContact CD2-CB 3.7Å; Y229-F234 HydrophobicContact CD2-CD2 4.19Å; Y229-F234 HydrophobicContact CD2-CG 4.34Å; Y229-F234 HydrophobicContact CE2-CB 3.31Å; Y229-F234 HydrophobicContact CE2-CG 4.3Å; Y229-F234 PolarHBondContact OH-O 3.49Å; Y229-F234 VanDerWaalsContact OH-O 3.1Å; L232-F234 HydrophobicContact CB-CD2 3.66Å; L232-F234 HydrophobicContact CB-CE2 3.47Å; L232-F234 VanDerWaalsContact CB-CE2 3.47Å; L232-F234 HydrophobicContact CB-CZ 4.27Å; L232-F234 HydrophobicContact CD1-CD2 4.39Å; L232-F234 HydrophobicContact CD1-CE2 3.59Å; L232-F234 HydrophobicContact CD1-CZ 4.38Å; L232-F234 HydrophobicContact CG-CE2 4.17Å; L232-F234 PolarHBondContact O-N 3.12Å; F234-E238 HydrophobicContact CB-CB 4.38Å; F234-E238 HydrophobicContact CD1-CB 4.21Å; F234-E238 HydrophobicContact CD1-CG 4.21Å; F234-F243 HydrophobicContact CD2-CB 4.24Å; F234-F243 HydrophobicContact CD2-CD2 4.07Å; F234-F243 HydrophobicContact CD2-CG 4.22Å; F234-F243 HydrophobicContact CE2-CB 4.34Å; F234-F243 AromaticContact CE2-CD2 3.54Å; F234-F243 HydrophobicContact CE2-CD2 3.54Å; F234-F243 HydrophobicContact CE2-CE2 4.14Å; F234-F243 HydrophobicContact CE2-CG 4.14Å; F234-F243 HydrophobicContact CZ-CD2 4.31Å; F234-I247 HydrophobicContact CE1-CD1 4.38Å; F234-I247 HydrophobicContact CE2-CD1 4.03Å; F234-I247 HydrophobicContact CZ-CD1 3.51Å; F234-I247 HydrophobicContact CZ-CG1 4.19Å; F234-V262 HydrophobicContact CD1-CG2 4.43Å; F234-V262 HydrophobicContact CE1-CB 4.27Å; F234-V262 HydrophobicContact CE1-CG1 3.46Å; F234-V262 VanDerWaalsContact CE1-CG1 3.46Å; F234-V262 HydrophobicContact CE1-CG2 3.75Å; F234-V262 HydrophobicContact CZ-CG1 3.67Å; F234-F263 HydrophobicContact CZ-CE2 4.38Å
235	N	63.8	Low	77.9	Confident	89 Å²	89	66.8 Å²	66.8	48%	0.476	30%	0.304	S	S	.	.			trans	-68.7	154.1	173.1	-71.7	-39.9	0	0	0	110.1	Y229 R233 Y237 E238	Y229-N235 VanDerWaalsContact OH-C 3.25Å; Y229-N235 PolarHBondContact OH-O 3.16Å; R233-N235 PolarHBondContact O-N 2.93Å; N235-Y237 HydrophobicContact CB-CD1 3.3Å; N235-Y237 HydrophobicContact CB-CE1 2.97Å; N235-Y237 HydrophobicContact CB-CE2 4.4Å; N235-Y237 HydrophobicContact CB-CG 4.14Å; N235-Y237 VanDerWaalsContact CG-CE1 3.42Å; N235-Y237 WeakPolarHBondContact ND2-CE1 2.81Å; N235-Y237 PolarHBondContact ND2-OH 3Å; N235-Y237 PolarHBondContact O-N 3.24Å; N235-E238 WeakPolarHBondContact O-CB 3.32Å; N235-E238 PolarHBondContact O-N 3.26Å
236	S	61.6	Low	77.6	Confident	77 Å²	77	71 Å²	71	54%	0.538	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-52.8	-26.8	179.5	-67.7	0	0	0	0	114.5	Y229 E238 Y240	Y229-S236 WeakPolarHBondContact OH-CA 3.35Å; Y229-S236 PolarHBondContact OH-N 3.41Å; S236-E238 VanDerWaalsContact C-N 3.25Å; S236-E238 PolarHBondContact O-N 3.39Å; S236-Y240 WeakPolarHBondContact CB-OH 3.46Å; S236-Y240 PolarHBondContact OG-OH 2.75Å
237	Y	61.2	Low	77.4	Confident	158 Å²	158	66.6 Å²	66.6	62%	0.62	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-71.5	-15.8	179.1	63	-101.5	0	0	0	114	N235 G239 R246	N235-Y237 HydrophobicContact CB-CD1 3.3Å; N235-Y237 HydrophobicContact CB-CE1 2.97Å; N235-Y237 HydrophobicContact CB-CE2 4.4Å; N235-Y237 HydrophobicContact CB-CG 4.14Å; N235-Y237 VanDerWaalsContact CG-CE1 3.42Å; N235-Y237 WeakPolarHBondContact ND2-CE1 2.81Å; N235-Y237 PolarHBondContact ND2-OH 3Å; N235-Y237 PolarHBondContact O-N 3.24Å; Y237-G239 VanDerWaalsContact C-N 3.33Å; Y237-G239 PolarHBondContact O-N 2.91Å; Y237-R246 PolarHBondContact O-NH1 3.47Å
238	E	59.9	Low	77.1	Confident	26 Å²	26	68 Å²	68	12%	0.121	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-81.4	-10.7	-176.3	-70.5	-62.7	124.1	0	0	114.1	F234 N235 S236 R246	F234-E238 HydrophobicContact CB-CB 4.38Å; F234-E238 HydrophobicContact CD1-CB 4.21Å; F234-E238 HydrophobicContact CD1-CG 4.21Å; N235-E238 WeakPolarHBondContact O-CB 3.32Å; N235-E238 PolarHBondContact O-N 3.26Å; S236-E238 VanDerWaalsContact C-N 3.25Å; S236-E238 PolarHBondContact O-N 3.39Å; E238-R246 VanDerWaalsContact CD-NH2 3.26Å; E238-R246 WeakPolarHBondContact O-CD 3.46Å; E238-R246 PolarHBondContact O-NH1 2.7Å; E238-R246 IonicContact OE1-CZ 2.84Å; E238-R246 IonicContact OE1-NE 3.15Å; E238-R246 IonicContact OE1-NH1 3.45Å; E238-R246 IonicContact OE1-NH2 2.89Å; E238-R246 PolarHBondContact OE1-NH2 3.02Å; E238-R246 VanDerWaalsContact OE2-CD 3.24Å; E238-R246 WeakPolarHBondContact OE2-CD 3.19Å; E238-R246 IonicContact OE2-CZ 3.05Å; E238-R246 IonicContact OE2-NE 3.59Å; E238-R246 PolarHBondContact OE2-NE 3.43Å; E238-R246 IonicContact OE2-NH1 3.87Å; E238-R246 PolarHBondContact OE2-NH1 3.01Å; E238-R246 IonicContact OE2-NH2 2.81Å; E238-R246 PolarHBondContact OE2-NH2 3.36Å; E238-R246 VanDerWaalsContact OE2-NH2 3.15Å
239	G	62.7	Low	77	Confident	33 Å²	33	69.5 Å²	69.5	34%	0.34	32%	0.32	S	S	.	.			trans	85.7	109.8	-178.6	0	0	0	0	0	112.1	Y237 W241	Y237-G239 VanDerWaalsContact C-N 3.33Å; Y237-G239 PolarHBondContact O-N 2.91Å; G239-W241 PolarHBondContact O-N 3.48Å
240	Y	65.6	Low	76.9	Confident	110 Å²	110	70 Å²	70	43%	0.431	32%	0.324	S	S	.	.	S	Bend	trans	-55.2	-50.1	-169	-58.6	-81.2	0	0	0	114.8	Y229 S236	Y229-Y240 HydrophobicContact CD1-CD1 4.17Å; Y229-Y240 WeakPolarHBondContact CD2-O 3.49Å; Y229-Y240 AromaticContact CE1-CD1 3.39Å; Y229-Y240 HydrophobicContact CE1-CD1 3.39Å; Y229-Y240 AromaticContact CE1-CE1 3.9Å; Y229-Y240 HydrophobicContact CE1-CE1 3.9Å; Y229-Y240 HydrophobicContact CE1-CG 4.45Å; Y229-Y240 HydrophobicContact CE2-CD1 4.21Å; Y229-Y240 AromaticContact CZ-CD1 3.41Å; Y229-Y240 VanDerWaalsContact CZ-CD1 3.41Å; Y229-Y240 AromaticContact CZ-CE1 3.87Å; Y229-Y240 WeakPolarHBondContact OH-CD1 3.47Å; Y229-Y240 WeakPolarHBondContact OH-CE1 3.42Å; S236-Y240 WeakPolarHBondContact CB-OH 3.46Å; S236-Y240 PolarHBondContact OG-OH 2.75Å
241	W	70.8	Confident	76.9	Confident	129 Å²	129	66.3 Å²	66.3	49%	0.489	31%	0.31	S	S	.	.	S	Bend	trans	-96.3	-19.7	-165.5	-60.8	102.7	0	0	0	114.6	F222 G239 F302	F222-W241 HydrophobicContact CB-CH2 4.3Å; F222-W241 HydrophobicContact CB-CZ3 4.17Å; F222-W241 HydrophobicContact CD1-CE3 4.26Å; F222-W241 HydrophobicContact CD1-CH2 4.13Å; F222-W241 AromaticContact CD1-CZ3 3.72Å; F222-W241 HydrophobicContact CD1-CZ3 3.72Å; F222-W241 HydrophobicContact CG-CZ3 4.44Å; G239-W241 PolarHBondContact O-N 3.48Å; W241-F302 VanDerWaalsContact O-CE2 3.3Å; W241-F302 WeakPolarHBondContact O-CE2 3.29Å
242	L	82.1	Confident	77.1	Confident	119 Å²	119	71 Å²	71	62%	0.623	34%	0.335	S	S	*	.			trans	-116.1	21.7	-172.9	-64.7	173.6	0	0	0	112.3	G244 Y245 R246 F302	L242-G244 PolarHBondContact O-N 2.92Å; L242-G244 VanDerWaalsContact O-N 3.17Å; L242-Y245 PolarHBondContact O-N 3.46Å; L242-R246 PolarHBondContact O-N 3.29Å; L242-R246 VanDerWaalsContact O-N 3.16Å; L242-F302 HydrophobicContact CD2-CZ 4.46Å
243	F	84.3	Confident	77.5	Confident	4 Å²	4	76.4 Å²	76.4	2%	0.018	36%	0.36	C	S	.	.	H	α-helix	trans	-53.8	-38.7	-178.8	78.2	-93	0	0	0	111.9	M228 Y229 L232 F234 Y245 R246 I247 F302	M228-F243 HydrophobicContact CB-CE1 4.33Å; M228-F243 HydrophobicContact CB-CZ 4Å; M228-F243 HydrophobicContact CE-CZ 4.25Å; Y229-F243 HydrophobicContact CD2-CB 4.39Å; Y229-F243 HydrophobicContact CD2-CD1 4.38Å; L232-F243 HydrophobicContact CD1-CE2 3.98Å; F234-F243 HydrophobicContact CD2-CB 4.24Å; F234-F243 HydrophobicContact CD2-CD2 4.07Å; F234-F243 HydrophobicContact CD2-CG 4.22Å; F234-F243 HydrophobicContact CE2-CB 4.34Å; F234-F243 AromaticContact CE2-CD2 3.54Å; F234-F243 HydrophobicContact CE2-CD2 3.54Å; F234-F243 HydrophobicContact CE2-CE2 4.14Å; F234-F243 HydrophobicContact CE2-CG 4.14Å; F234-F243 HydrophobicContact CZ-CD2 4.31Å; F243-Y245 PolarHBondContact O-N 3.37Å; F243-R246 PolarHBondContact O-N 3.38Å; F243-I247 HydrophobicContact CD2-CD1 3.68Å; F243-I247 HydrophobicContact CE2-CD1 4.24Å; F243-I247 VanDerWaalsContact O-CG1 3.29Å; F243-I247 WeakPolarHBondContact O-CG1 3.34Å; F243-I247 PolarHBondContact O-N 2.83Å; F243-F302 HydrophobicContact CD1-CD2 4.19Å; F243-F302 HydrophobicContact CD1-CE2 4.21Å; F243-F302 AromaticContact CE1-CD2 3.68Å; F243-F302 HydrophobicContact CE1-CD2 3.68Å; F243-F302 HydrophobicContact CE1-CE2 4.08Å; F243-F302 HydrophobicContact CE2-CD2 4.43Å; F243-F302 HydrophobicContact CZ-CB 4.43Å; F243-F302 AromaticContact CZ-CD2 3.8Å; F243-F302 HydrophobicContact CZ-CD2 3.8Å; F243-F302 HydrophobicContact CZ-CG 4.49Å
244	G	84.5	Confident	78	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-67.2	-33.7	179.6	0	0	0	0	0	113.8	L242 L248	L242-G244 PolarHBondContact O-N 2.92Å; L242-G244 VanDerWaalsContact O-N 3.17Å; G244-L248 VanDerWaalsContact O-CB 3.31Å; G244-L248 WeakPolarHBondContact O-CB 3.43Å; G244-L248 PolarHBondContact O-N 2.82Å
245	Y	86.5	Confident	78.7	Confident	147 Å²	147	76 Å²	76	58%	0.576	38%	0.377	S	S	*	.	H	α-helix	trans	-67.9	-40.2	172.7	-177.9	-95.6	0	0	0	111.1	L242 F243 L248 S249	L242-Y245 PolarHBondContact O-N 3.46Å; F243-Y245 PolarHBondContact O-N 3.37Å; Y245-L248 PolarHBondContact O-N 3.43Å; Y245-S249 WeakPolarHBondContact O-CB 3.36Å; Y245-S249 PolarHBondContact O-N 3.38Å
246	R	85.3	Confident	79.5	Confident	96 Å²	96	77.8 Å²	77.8	36%	0.362	38%	0.383	S	S	.	.	H	α-helix	trans	-63.5	-48.7	177.4	-176	167.6	-179.3	171.3	-13.2	111.9	Y237 E238 L242 F243 L248 S249 D250	Y237-R246 PolarHBondContact O-NH1 3.47Å; E238-R246 VanDerWaalsContact CD-NH2 3.26Å; E238-R246 WeakPolarHBondContact O-CD 3.46Å; E238-R246 PolarHBondContact O-NH1 2.7Å; E238-R246 IonicContact OE1-CZ 2.84Å; E238-R246 IonicContact OE1-NE 3.15Å; E238-R246 IonicContact OE1-NH1 3.45Å; E238-R246 IonicContact OE1-NH2 2.89Å; E238-R246 PolarHBondContact OE1-NH2 3.02Å; E238-R246 VanDerWaalsContact OE2-CD 3.24Å; E238-R246 WeakPolarHBondContact OE2-CD 3.19Å; E238-R246 IonicContact OE2-CZ 3.05Å; E238-R246 IonicContact OE2-NE 3.59Å; E238-R246 PolarHBondContact OE2-NE 3.43Å; E238-R246 IonicContact OE2-NH1 3.87Å; E238-R246 PolarHBondContact OE2-NH1 3.01Å; E238-R246 IonicContact OE2-NH2 2.81Å; E238-R246 PolarHBondContact OE2-NH2 3.36Å; E238-R246 VanDerWaalsContact OE2-NH2 3.15Å; L242-R246 PolarHBondContact O-N 3.29Å; L242-R246 VanDerWaalsContact O-N 3.16Å; F243-R246 PolarHBondContact O-N 3.38Å; R246-L248 VanDerWaalsContact C-N 3.31Å; R246-L248 PolarHBondContact O-N 2.85Å; R246-S249 WeakPolarHBondContact O-CB 3.42Å; R246-S249 PolarHBondContact O-N 3.04Å; R246-S249 VanDerWaalsContact O-N 3.14Å; R246-D250 PolarHBondContact O-N 3.34Å
247	I	85.4	Confident	80.4	Confident	15 Å²	15	76.6 Å²	76.6	8%	0.077	37%	0.367	C	S	.	.	H	α-helix	trans	-59	-45.1	175.8	-63.9	163.7	0	0	0	110.6	F234 F243 S249 D250 I251 F263 I299	F234-I247 HydrophobicContact CE1-CD1 4.38Å; F234-I247 HydrophobicContact CE2-CD1 4.03Å; F234-I247 HydrophobicContact CZ-CD1 3.51Å; F234-I247 HydrophobicContact CZ-CG1 4.19Å; F243-I247 HydrophobicContact CD2-CD1 3.68Å; F243-I247 HydrophobicContact CE2-CD1 4.24Å; F243-I247 VanDerWaalsContact O-CG1 3.29Å; F243-I247 WeakPolarHBondContact O-CG1 3.34Å; F243-I247 PolarHBondContact O-N 2.83Å; I247-S249 VanDerWaalsContact C-N 3.31Å; I247-S249 PolarHBondContact O-N 2.95Å; I247-D250 PolarHBondContact O-N 3.43Å; I247-I251 HydrophobicContact CG2-CD1 3.8Å; I247-I251 WeakPolarHBondContact O-CD1 3.49Å; I247-I251 VanDerWaalsContact O-CG1 3.25Å; I247-I251 WeakPolarHBondContact O-CG1 3.26Å; I247-I251 PolarHBondContact O-N 3.38Å; I247-F263 HydrophobicContact CD1-CE2 4.2Å; I247-I299 HydrophobicContact CG2-CD1 3.63Å; I247-I299 HydrophobicContact CG2-CG1 3.83Å
248	L	87.1	Confident	81	Confident	56 Å²	56	69.9 Å²	69.9	29%	0.293	34%	0.342	S	S	.	.	H	α-helix	trans	-61.6	-42.6	177.6	-178.8	64.3	0	0	0	111.3	G244 Y245 R246 I251 I252 F303	G244-L248 VanDerWaalsContact O-CB 3.31Å; G244-L248 WeakPolarHBondContact O-CB 3.43Å; G244-L248 PolarHBondContact O-N 2.82Å; Y245-L248 PolarHBondContact O-N 3.43Å; R246-L248 VanDerWaalsContact C-N 3.31Å; R246-L248 PolarHBondContact O-N 2.85Å; L248-I251 PolarHBondContact O-N 3.48Å; L248-I252 HydrophobicContact CD1-CD1 4.13Å; L248-I252 HydrophobicContact CD1-CG1 4.39Å; L248-I252 HydrophobicContact CD2-CD1 4.36Å; L248-I252 HydrophobicContact CG-CD1 3.81Å; L248-I252 HydrophobicContact CG-CG1 4.46Å; L248-I252 VanDerWaalsContact O-CG1 3.27Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 3.42Å; L248-F303 HydrophobicContact CB-CE2 4.25Å; L248-F303 HydrophobicContact CB-CZ 4.18Å; L248-F303 HydrophobicContact CD2-CE1 4.44Å; L248-F303 HydrophobicContact CD2-CE2 3.66Å; L248-F303 HydrophobicContact CD2-CZ 3.42Å; L248-F303 VanDerWaalsContact CD2-CZ 3.42Å; L248-F303 HydrophobicContact CG-CE2 4.44Å; L248-F303 HydrophobicContact CG-CZ 4.4Å
249	S	87.8	Confident	81.7	Confident	32 Å²	32	75.5 Å²	75.5	22%	0.224	37%	0.368	C	S	.	.	H	α-helix	trans	-61.9	-46.6	176.9	-168	0	0	0	0	111.5	Y245 R246 I247 I251 I252 H253	Y245-S249 WeakPolarHBondContact O-CB 3.36Å; Y245-S249 PolarHBondContact O-N 3.38Å; R246-S249 WeakPolarHBondContact O-CB 3.42Å; R246-S249 PolarHBondContact O-N 3.04Å; R246-S249 VanDerWaalsContact O-N 3.14Å; I247-S249 VanDerWaalsContact C-N 3.31Å; I247-S249 PolarHBondContact O-N 2.95Å; S249-I251 VanDerWaalsContact C-N 3.28Å; S249-I251 PolarHBondContact O-N 3.3Å; S249-I252 PolarHBondContact O-N 2.94Å; S249-H253 PolarHBondContact O-N 3.35Å; S249-H253 PolarHBondContact O-ND1 2.94Å; S249-H253 PolarHBondContact OG-CE1 2.95Å; S249-H253 VanDerWaalsContact OG-CE1 3.27Å; S249-H253 PolarHBondContact OG-ND1 3.44Å
250	D	85.8	Confident	82.4	Confident	23 Å²	23	76 Å²	76	12%	0.123	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-36.7	178.4	-72	-34	0	0	0	111.8	R246 I247 G254 K255 T260	R246-D250 PolarHBondContact O-N 3.34Å; I247-D250 PolarHBondContact O-N 3.43Å; D250-G254 PolarHBondContact O-N 3.39Å; D250-K255 HydrophobicContact CB-CB 4.38Å; D250-K255 HydrophobicContact CB-CD 4.37Å; D250-K255 PolarHBondContact O-N 2.84Å; D250-K255 WeakPolarHBondContact OD1-CD 3.29Å; D250-K255 IonicContact OD1-NZ 2.67Å; D250-K255 PolarHBondContact OD1-NZ 2.96Å; D250-T260 HydrophobicContact CB-CG2 4.49Å
251	I	86.3	Confident	82.8	Confident	63 Å²	63	74.1 Å²	74.1	32%	0.323	36%	0.36	S	S	.	.	H	α-helix	trans	-66.9	-43.7	174.2	-68.1	165.6	0	0	0	111.6	I247 L248 S249 H253 G254 E295 I299	I247-I251 HydrophobicContact CG2-CD1 3.8Å; I247-I251 WeakPolarHBondContact O-CD1 3.49Å; I247-I251 VanDerWaalsContact O-CG1 3.25Å; I247-I251 WeakPolarHBondContact O-CG1 3.26Å; I247-I251 PolarHBondContact O-N 3.38Å; L248-I251 PolarHBondContact O-N 3.48Å; S249-I251 VanDerWaalsContact C-N 3.28Å; S249-I251 PolarHBondContact O-N 3.3Å; I251-H253 VanDerWaalsContact C-N 3.31Å; I251-H253 PolarHBondContact O-N 2.9Å; I251-G254 PolarHBondContact O-N 3.39Å; I251-G254 VanDerWaalsContact O-N 3.09Å; I251-E295 WeakPolarHBondContact CD1-OE1 3.48Å; I251-I299 HydrophobicContact CD1-CD1 3.38Å
252	I	89.9	Confident	83	Confident	127 Å²	127	69.7 Å²	69.7	65%	0.651	35%	0.347	S	S	*	.	H	α-helix	trans	-64.9	-36.7	179.2	-70.1	167	0	0	0	111.1	L248 S249 G254	L248-I252 HydrophobicContact CD1-CD1 4.13Å; L248-I252 HydrophobicContact CD1-CG1 4.39Å; L248-I252 HydrophobicContact CD2-CD1 4.36Å; L248-I252 HydrophobicContact CG-CD1 3.81Å; L248-I252 HydrophobicContact CG-CG1 4.46Å; L248-I252 VanDerWaalsContact O-CG1 3.27Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 3.42Å; S249-I252 PolarHBondContact O-N 2.94Å; I252-G254 PolarHBondContact O-N 2.83Å
253	H	91.2	Very high	83	Confident	135 Å²	135	64.6 Å²	64.6	63%	0.625	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-2.7	175.5	-66.9	97	0	0	0	113.4	S249 I251 K255	S249-H253 PolarHBondContact O-N 3.35Å; S249-H253 PolarHBondContact O-ND1 2.94Å; S249-H253 PolarHBondContact OG-CE1 2.95Å; S249-H253 VanDerWaalsContact OG-CE1 3.27Å; S249-H253 PolarHBondContact OG-ND1 3.44Å; I251-H253 VanDerWaalsContact C-N 3.31Å; I251-H253 PolarHBondContact O-N 2.9Å; H253-K255 VanDerWaalsContact C-N 3.33Å; H253-K255 PolarHBondContact O-N 3.49Å
254	G	86.8	Confident	83.1	Confident	55 Å²	55	64.9 Å²	64.9	57%	0.567	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	18.4	177.9	0	0	0	0	0	114.6	D250 I251 I252 Q256	D250-G254 PolarHBondContact O-N 3.39Å; I251-G254 PolarHBondContact O-N 3.39Å; I251-G254 VanDerWaalsContact O-N 3.09Å; I252-G254 PolarHBondContact O-N 2.83Å; G254-Q256 PolarHBondContact O-N 2.83Å
255	K	83.7	Confident	83.3	Confident	102 Å²	102	69 Å²	69	44%	0.443	34%	0.338	S	S	.	.			trans	-67.4	127.3	174.3	-65.1	-172.6	-166.4	158.5	0	109.6	D250 H253 T260	D250-K255 HydrophobicContact CB-CB 4.38Å; D250-K255 HydrophobicContact CB-CD 4.37Å; D250-K255 PolarHBondContact O-N 2.84Å; D250-K255 WeakPolarHBondContact OD1-CD 3.29Å; D250-K255 IonicContact OD1-NZ 2.67Å; D250-K255 PolarHBondContact OD1-NZ 2.96Å; H253-K255 VanDerWaalsContact C-N 3.33Å; H253-K255 PolarHBondContact O-N 3.49Å; K255-T260 HydrophobicContact CB-CG2 4.36Å
256	Q	80.7	Confident	83.4	Confident	127 Å²	127	63.1 Å²	63.1	59%	0.593	32%	0.317	S	S	*	.			trans	-80.4	152.7	-178.5	-64.7	-176.9	-2.2	0	0	111	G254 T258 E259 T260	G254-Q256 PolarHBondContact O-N 2.83Å; Q256-T258 WeakPolarHBondContact CB-OG1 3.21Å; Q256-T258 PolarHBondContact O-N 2.87Å; Q256-E259 PolarHBondContact O-N 3.22Å; Q256-T260 PolarHBondContact O-N 3.21Å
257	W	79.9	Confident	83.6	Confident	52 Å²	52	58.6 Å²	58.6	20%	0.197	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-20.6	176	61.1	-91.8	0	0	0	113.2	E259 Q261 P264 R265 V266	W257-E259 VanDerWaalsContact C-N 3.27Å; W257-E259 PolarHBondContact O-N 3.46Å; W257-Q261 WeakPolarHBondContact O-CA 3.39Å; W257-Q261 PolarHBondContact O-N 3.42Å; W257-P264 HydrophobicContact CE3-CB 4Å; W257-P264 HydrophobicContact CZ3-CB 4.24Å; W257-R265 HydrophobicContact CD2-CB 4.42Å; W257-R265 HydrophobicContact CG-CG 4.33Å; W257-R265 HydrophobicContact CZ2-CB 4.32Å; W257-V266 HydrophobicContact CH2-CB 3.79Å; W257-V266 HydrophobicContact CH2-CG2 3.83Å; W257-V266 HydrophobicContact CZ2-CB 4.39Å; W257-V266 HydrophobicContact CZ2-CG2 3.92Å
258	T	75.1	Confident	83.8	Confident	16 Å²	16	58.9 Å²	58.9	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-63.7	-31.6	174.6	45.3	0	0	0	0	112.4	Q256 Q261	Q256-T258 WeakPolarHBondContact CB-OG1 3.21Å; Q256-T258 PolarHBondContact O-N 2.87Å; T258-Q261 PolarHBondContact O-NE2 2.88Å
259	E	73.9	Confident	84	Confident	145 Å²	145	56.5 Å²	56.5	68%	0.678	29%	0.289	S	S	*	.	H	α-helix	trans	-89.9	-43.6	178.7	-63.2	-177.4	175.9	0	0	111.9	Q256 W257	Q256-E259 PolarHBondContact O-N 3.22Å; W257-E259 VanDerWaalsContact C-N 3.27Å; W257-E259 PolarHBondContact O-N 3.46Å
260	T	77.2	Confident	84	Confident	43 Å²	43	58.4 Å²	58.4	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-75.9	-26.9	-177	62.4	0	0	0	0	112.2	D250 K255 Q256 V262	D250-T260 HydrophobicContact CB-CG2 4.49Å; K255-T260 HydrophobicContact CB-CG2 4.36Å; Q256-T260 PolarHBondContact O-N 3.21Å; T260-V262 PolarHBondContact O-N 3.4Å; T260-V262 PolarHBondContact OG1-N 2.88Å
261	Q	74.5	Confident	84	Confident	71 Å²	71	59.7 Å²	59.7	33%	0.332	30%	0.296	S	S	.	.			trans	55.9	11.1	-168.5	-63	-67.1	-39.6	0	0	113.5	W257 T258	W257-Q261 WeakPolarHBondContact O-CA 3.39Å; W257-Q261 PolarHBondContact O-N 3.42Å; T258-Q261 PolarHBondContact O-NE2 2.88Å
262	V	74.8	Confident	83.8	Confident	35 Å²	35	59.7 Å²	59.7	21%	0.212	30%	0.299	C	S	.	.	S	Bend	trans	-91.7	123.4	176.6	174.2	0	0	0	0	107.3	F234 T260	F234-V262 HydrophobicContact CD1-CG2 4.43Å; F234-V262 HydrophobicContact CE1-CB 4.27Å; F234-V262 HydrophobicContact CE1-CG1 3.46Å; F234-V262 VanDerWaalsContact CE1-CG1 3.46Å; F234-V262 HydrophobicContact CE1-CG2 3.75Å; F234-V262 HydrophobicContact CZ-CG1 3.67Å; T260-V262 PolarHBondContact O-N 3.4Å; T260-V262 PolarHBondContact OG1-N 2.88Å
263	F	82.9	Confident	83.5	Confident	13 Å²	13	55.1 Å²	55.1	6%	0.057	28%	0.276	C	S	.	.	S	Bend	trans	53.1	66.2	-174	-62.4	-70.1	0	0	0	113.1	Y107 L232 F234 I247 N291 N294 E295 Y298	Y107-F263 VanDerWaalsContact OH-CD1 3.28Å; Y107-F263 WeakPolarHBondContact OH-CD1 3.5Å; Y107-F263 WeakPolarHBondContact OH-CE1 3.41Å; L232-F263 HydrophobicContact CD1-CE2 4.4Å; L232-F263 HydrophobicContact CD1-CZ 3.7Å; L232-F263 HydrophobicContact CD2-CE1 3.45Å; L232-F263 VanDerWaalsContact CD2-CE1 3.45Å; L232-F263 HydrophobicContact CD2-CZ 3.36Å; L232-F263 HydrophobicContact CG-CZ 4.11Å; F234-F263 HydrophobicContact CZ-CE2 4.38Å; I247-F263 HydrophobicContact CD1-CE2 4.2Å; F263-N291 WeakPolarHBondContact CA-ND2 3.45Å; F263-N291 WeakPolarHBondContact CA-OD1 3.23Å; F263-N291 WeakPolarHBondContact CB-ND2 2.95Å; F263-N291 WeakPolarHBondContact CD1-OD1 3.48Å; F263-N291 PolarHBondContact O-ND2 2.7Å; F263-N294 HydrophobicContact CE1-CB 4.28Å; F263-E295 HydrophobicContact CB-CB 4.25Å; F263-E295 HydrophobicContact CB-CG 4.34Å; F263-E295 HydrophobicContact CD1-CB 4.49Å; F263-E295 HydrophobicContact CD2-CB 4.12Å; F263-E295 HydrophobicContact CD2-CG 3.95Å; F263-E295 HydrophobicContact CG-CB 4.07Å; F263-E295 HydrophobicContact CG-CG 4.27Å; F263-Y298 HydrophobicContact CZ-CD2 4.44Å
264	P	86.6	Confident	83	Confident	10 Å²	10	57.1 Å²	57.1	7%	0.065	29%	0.286	C	S	.	.			trans	-65	134.7	174.9	30.6	-39.1	0	0	0	112.8	P82 M105 W257 N291	P82-P264 HydrophobicContact CB-CB 4.21Å; P82-P264 HydrophobicContact CB-CG 4.05Å; M105-P264 HydrophobicContact CE-CB 3.89Å; M105-P264 HydrophobicContact CE-CG 3.24Å; M105-P264 HydrophobicContact SD-CG 3.72Å; W257-P264 HydrophobicContact CE3-CB 4Å; W257-P264 HydrophobicContact CZ3-CB 4.24Å; P264-N291 VanDerWaalsContact O-CG 3.27Å; P264-N291 PolarHBondContact O-ND2 3.32Å
265	R	88.4	Confident	82.5	Confident	87 Å²	87	59.7 Å²	59.7	33%	0.328	28%	0.283	S	S	.	.	S	Bend	trans	-94.2	-13	-179.4	-60	-179	-174.3	170.6	3.7	113.6	W257 L288 E295	W257-R265 HydrophobicContact CD2-CB 4.42Å; W257-R265 HydrophobicContact CG-CG 4.33Å; W257-R265 HydrophobicContact CZ2-CB 4.32Å; R265-L288 PolarHBondContact O-N 3.36Å; R265-E295 IonicContact CZ-OE2 3.15Å; R265-E295 IonicContact NE-OE2 3.54Å; R265-E295 IonicContact NH2-OE1 3.66Å; R265-E295 IonicContact NH2-OE2 3.87Å; R265-E295 PolarHBondContact NH2-OE2 3.22Å
266	V	89.1	Confident	82.2	Confident	23 Å²	23	62.7 Å²	62.7	14%	0.139	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	136.9	175.9	-170.5	0	0	0	0	108.2	L85 W257 Q285 C286 V287	L85-V266 HydrophobicContact CD1-CB 4.25Å; L85-V266 HydrophobicContact CD1-CG1 3.42Å; L85-V266 VanDerWaalsContact CD1-CG1 3.42Å; W257-V266 HydrophobicContact CH2-CB 3.79Å; W257-V266 HydrophobicContact CH2-CG2 3.83Å; W257-V266 HydrophobicContact CZ2-CB 4.39Å; W257-V266 HydrophobicContact CZ2-CG2 3.92Å; V266-Q285 HydrophobicContact CG1-CG 3.94Å; V266-C286 WeakPolarHBondContact CA-O 3.4Å; V266-C286 WeakPolarHBondContact CG1-O 3.37Å; V266-V287 HydrophobicContact CG2-CG1 4.39Å
267	G	89.1	Confident	81.9	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	158.2	177.3	0	0	0	0	0	111.4	F81 C286	F81-G267 CarbonylContact O-C 3.51Å; F81-G267 WeakPolarHBondContact O-CA 3.48Å; G267-C286 PolarHBondContact N-O 3.1Å; G267-C286 PolarHBondContact O-N 3.08Å
268	M	89.7	Confident	82	Confident	20 Å²	20	60.9 Å²	60.9	10%	0.099	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	140.9	175.3	-75.6	-69	177.4	0	0	110.3	F81 I83 L85 W97 Q285	F81-M268 WeakPolarHBondContact CD2-O 3.41Å; F81-M268 PolarHBondContact N-O 3.39Å; F81-M268 PolarHBondContact O-N 3.16Å; I83-M268 HydrophobicContact CB-CG 4.45Å; I83-M268 HydrophobicContact CD1-CB 3.82Å; I83-M268 HydrophobicContact CD1-CG 3.93Å; I83-M268 HydrophobicContact CG1-CB 4.4Å; I83-M268 HydrophobicContact CG1-CG 4.46Å; L85-M268 HydrophobicContact CD1-CE 4.35Å; L85-M268 HydrophobicContact CD2-CE 3.28Å; L85-M268 HydrophobicContact CG-CE 4.29Å; W97-M268 HydrophobicContact CH2-CB 4.12Å; W97-M268 HydrophobicContact CZ3-CB 4.47Å; M268-Q285 HydrophobicContact CE-CB 3.68Å; M268-Q285 HydrophobicContact CE-CG 3.76Å; M268-Q285 HydrophobicContact SD-CB 3.84Å; M268-Q285 HydrophobicContact SD-CG 4.3Å
269	C	90.3	Very high	82.3	Confident	6 Å²	6	64 Å²	64	4%	0.041	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	130	174.8	174	0	0	0	0	108.2	C75 T80 F283 A284	C75-C269 WeakPolarHBondContact CA-SG 3.36Å; C75-C269 HydrophobicContact CB-CB 3.7Å; C75-C269 WeakPolarHBondContact CB-SG 3.46Å; C75-C269 WeakPolarHBondContact SG-CB 3.39Å; C75-C269 CovalentContact SG-SG 2.04Å; C75-C269 PolarHBondContact SG-SG 2.98Å; T80-C269 HydrophobicContact CG2-CB 4.44Å; C269-F283 WeakPolarHBondContact O-CA 3.38Å; C269-A284 HydrophobicContact CB-CB 4.22Å; C269-A284 PolarHBondContact N-O 2.67Å; C269-A284 PolarHBondContact O-N 3.2Å
270	R	88.1	Confident	82.7	Confident	72 Å²	72	61.8 Å²	61.8	27%	0.272	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.5	179.8	-177.8	-179	78.5	110.4	-6.1	108.5	W97 F283	W97-R270 HydrophobicContact CE3-CB 4.44Å; W97-R270 HydrophobicContact CZ3-CB 4.38Å; R270-F283 HydrophobicContact CB-CD1 4.17Å; R270-F283 HydrophobicContact CB-CE1 4.13Å; R270-F283 HydrophobicContact CG-CD1 4.03Å; R270-F283 HydrophobicContact CG-CE1 3.59Å; R270-F283 HydrophobicContact CG-CZ 4.28Å
271	H	85.1	Confident	83	Confident	50 Å²	50	63.4 Å²	63.4	23%	0.231	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151.9	177.7	-167	74.3	0	0	0	111.8	L74 T281 L282	L74-H271 HydrophobicContact CD2-CB 4.28Å; L74-H271 WeakPolarHBondContact CD2-CD2 3.36Å; H271-T281 CarbonylContact O-C 3.57Å; H271-T281 WeakPolarHBondContact O-CA 3.42Å; H271-L282 PolarHBondContact N-O 2.97Å; H271-L282 PolarHBondContact O-N 3.33Å
272	T	83.6	Confident	83.6	Confident	63 Å²	63	60.9 Å²	60.9	39%	0.387	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	108.4	176.3	48.6	0	0	0	0	110.1	Q274 T281	T272-Q274 PolarHBondContact O-N 3.33Å; T272-T281 HydrophobicContact CG2-CG2 3.61Å
273	L	82.6	Confident	84.2	Confident	32 Å²	32	63 Å²	63	17%	0.168	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	120.5	173	-70.4	173.4	0	0	0	109.4	V62 Y70 H275 N280 L282	V62-L273 HydrophobicContact CG1-CD1 4.27Å; Y70-L273 HydrophobicContact CE1-CD2 4.11Å; L273-H275 PolarHBondContact O-N 2.92Å; L273-N280 PolarHBondContact N-O 3.45Å; L273-N280 PolarHBondContact O-N 2.94Å; L273-L282 HydrophobicContact CD1-CB 4.46Å; L273-L282 HydrophobicContact CD1-CD2 4.02Å
274	Q	80.4	Confident	84.5	Confident	176 Å²	176	62.4 Å²	62.4	82%	0.822	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	112.1	173.7	-65.6	-172.8	-10.4	0	0	109.4	T272	T272-Q274 PolarHBondContact O-N 3.33Å
275	H	77.7	Confident	84.7	Confident	110 Å²	110	65.3 Å²	65.3	51%	0.509	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	152.1	162.9	-63.9	71.3	0	0	0	107.5	L273 G277 A278	L273-H275 PolarHBondContact O-N 2.92Å; H275-G277 PolarHBondContact O-N 3.07Å; H275-A278 PolarHBondContact N-O 3.38Å; H275-A278 PolarHBondContact O-N 2.62Å
276	V	76.8	Confident	84.9	Confident	165 Å²	165	61.2 Å²	61.2	100%	1	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	103.7	-179.1	-174.1	0	0	0	0	108.9
277	G	75	Confident	85.1	Confident	86 Å²	86	63.2 Å²	63.2	89%	0.887	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.2	-11.1	179.5	0	0	0	0	0	117.4	H275	H275-G277 PolarHBondContact O-N 3.07Å
278	A	80.5	Confident	85.1	Confident	54 Å²	54	63.3 Å²	63.3	45%	0.446	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	140.6	177.6	0	0	0	0	0	113.2	H275	H275-A278 PolarHBondContact N-O 3.38Å; H275-A278 PolarHBondContact O-N 2.62Å
279	S	82.1	Confident	85.2	Confident	82 Å²	82	64.1 Å²	64.1	57%	0.573	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	116.3	172.5	58.7	0	0	0	0	110.4
280	N	82.5	Confident	85.2	Confident	98 Å²	98	63.9 Å²	63.9	52%	0.524	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123.4	175.3	-70.8	-32.1	0	0	0	109.7	L273 L282	L273-N280 PolarHBondContact N-O 3.45Å; L273-N280 PolarHBondContact O-N 2.94Å; N280-L282 PolarHBondContact O-N 2.95Å
281	T	83.8	Confident	85.3	Confident	77 Å²	77	60.4 Å²	60.4	47%	0.472	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	117.5	172.7	48.8	0	0	0	0	110	H271 T272	H271-T281 CarbonylContact O-C 3.57Å; H271-T281 WeakPolarHBondContact O-CA 3.42Å; T272-T281 HydrophobicContact CG2-CG2 3.61Å
282	L	85.7	Confident	85.5	Confident	18 Å²	18	62.7 Å²	62.7	9%	0.094	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	138.9	174.7	-175.6	77.1	0	0	0	109.9	L58 T60 V62 I71 H271 L273 N280	L58-L282 HydrophobicContact CD1-CD1 4.04Å; L58-L282 HydrophobicContact CD1-CD2 3.79Å; L58-L282 HydrophobicContact CD1-CG 3.93Å; L58-L282 HydrophobicContact CD2-CD1 3.74Å; L58-L282 HydrophobicContact CD2-CD2 3.9Å; L58-L282 HydrophobicContact CD2-CG 4.28Å; L58-L282 HydrophobicContact CG-CD1 3.91Å; L58-L282 HydrophobicContact CG-CD2 4.32Å; L58-L282 HydrophobicContact CG-CG 4.35Å; T60-L282 WeakPolarHBondContact OG1-CD1 3.37Å; V62-L282 HydrophobicContact CG1-CD1 4.18Å; I71-L282 HydrophobicContact CD1-CD2 3.54Å; I71-L282 HydrophobicContact CG1-CD2 3.9Å; I71-L282 HydrophobicContact CG2-CD2 4.21Å; H271-L282 PolarHBondContact N-O 2.97Å; H271-L282 PolarHBondContact O-N 3.33Å; L273-L282 HydrophobicContact CD1-CB 4.46Å; L273-L282 HydrophobicContact CD1-CD2 4.02Å; N280-L282 PolarHBondContact O-N 2.95Å
283	F	88.4	Confident	85.9	Confident	79 Å²	79	62.2 Å²	62.2	35%	0.346	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.1	171.3	-61.1	-84.3	0	0	0	109.5	W97 C269 R270	W97-F283 AromaticContact CE2-CE1 3.82Å; W97-F283 HydrophobicContact CH2-CD1 4.28Å; W97-F283 HydrophobicContact CH2-CE1 4.24Å; W97-F283 AromaticContact CZ2-CD1 3.92Å; W97-F283 HydrophobicContact CZ2-CD1 3.92Å; W97-F283 AromaticContact CZ2-CE1 3.51Å; W97-F283 HydrophobicContact CZ2-CE1 3.51Å; C269-F283 WeakPolarHBondContact O-CA 3.38Å; R270-F283 HydrophobicContact CB-CD1 4.17Å; R270-F283 HydrophobicContact CB-CE1 4.13Å; R270-F283 HydrophobicContact CG-CD1 4.03Å; R270-F283 HydrophobicContact CG-CE1 3.59Å; R270-F283 HydrophobicContact CG-CZ 4.28Å
284	A	89.6	Confident	86.3	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.008	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.8	176	0	0	0	0	0	110.1	C56 L58 I71 C269	C56-A284 HydrophobicContact CB-CB 4.16Å; L58-A284 HydrophobicContact CD1-CB 3.35Å; I71-A284 HydrophobicContact CG2-CB 4.07Å; C269-A284 HydrophobicContact CB-CB 4.22Å; C269-A284 PolarHBondContact N-O 2.67Å; C269-A284 PolarHBondContact O-N 3.2Å
285	Q	90.9	Very high	86.8	Confident	72 Å²	72	52.9 Å²	52.9	34%	0.336	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	115.7	172.8	-179.1	178.3	-21.8	0	0	108.7	C56 Y57 L85 V266 M268	C56-Q285 CarbonylContact C-O 3.57Å; C56-Q285 WeakPolarHBondContact CA-O 3.32Å; Y57-Q285 PolarHBondContact N-O 2.87Å; Y57-Q285 PolarHBondContact O-N 2.85Å; L85-Q285 HydrophobicContact CD1-CG 4.2Å; V266-Q285 HydrophobicContact CG1-CG 3.94Å; M268-Q285 HydrophobicContact CE-CB 3.68Å; M268-Q285 HydrophobicContact CE-CG 3.76Å; M268-Q285 HydrophobicContact SD-CB 3.84Å; M268-Q285 HydrophobicContact SD-CG 4.3Å
286	C	92.4	Very high	87.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.4	-175.9	-50.9	0	0	0	0	111.5	L54 V55 C56 T80 V266 G267 L288	L54-C286 HydrophobicContact CD1-CB 4.29Å; V55-C286 CarbonylContact O-C 3.49Å; V55-C286 VanDerWaalsContact O-CA 3.26Å; V55-C286 WeakPolarHBondContact O-CA 3.19Å; C56-C286 HydrophobicContact CB-CB 4.12Å; C56-C286 WeakPolarHBondContact CB-SG 3.38Å; C56-C286 WeakPolarHBondContact SG-CB 3.4Å; C56-C286 CovalentContact SG-SG 2.05Å; C56-C286 PolarHBondContact SG-SG 2.92Å; T80-C286 HydrophobicContact CG2-CB 4.36Å; V266-C286 WeakPolarHBondContact CA-O 3.4Å; V266-C286 WeakPolarHBondContact CG1-O 3.37Å; G267-C286 PolarHBondContact N-O 3.1Å; G267-C286 PolarHBondContact O-N 3.08Å; C286-L288 HydrophobicContact CB-CD1 4.42Å; C286-L288 WeakPolarHBondContact O-CD1 3.3Å
287	V	92	Very high	88.2	Confident	66 Å²	66	45 Å²	45	40%	0.4	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	137.8	168.3	-63.6	0	0	0	0	109.3	L54 V55 V266 P289	L54-V287 VanDerWaalsContact CA-O 3.3Å; L54-V287 WeakPolarHBondContact CA-O 3.26Å; L54-V287 WeakPolarHBondContact CB-O 3.36Å; V55-V287 HydrophobicContact CB-CG2 3.91Å; V55-V287 PolarHBondContact N-O 3.47Å; V55-V287 VanDerWaalsContact N-O 3.14Å; V55-V287 WeakPolarHBondContact O-CG2 3.27Å; V55-V287 PolarHBondContact O-N 3.42Å; V266-V287 HydrophobicContact CG2-CG1 4.39Å; V287-P289 VanDerWaalsContact C-CD 3.44Å; V287-P289 WeakPolarHBondContact O-CD 3.36Å
288	L	90.8	Very high	89.1	Confident	2 Å²	2	41 Å²	41	1%	0.01	23%	0.227	C	C	.	.			trans	-118.3	77.4	-172.3	-70.6	84.8	0	0	0	111.6	L54 M105 Y108 R265 C286 I290 N291	L54-L288 HydrophobicContact CB-CG 4.41Å; M105-L288 HydrophobicContact SD-CD2 3.54Å; M105-L288 VanDerWaalsContact SD-CD2 3.54Å; Y108-L288 HydrophobicContact CD1-CD2 4.45Å; Y108-L288 HydrophobicContact CE1-CD2 3.78Å; R265-L288 PolarHBondContact O-N 3.36Å; C286-L288 HydrophobicContact CB-CD1 4.42Å; C286-L288 WeakPolarHBondContact O-CD1 3.3Å; L288-I290 PolarHBondContact O-N 3.5Å; L288-N291 HydrophobicContact CB-CB 4.11Å; L288-N291 WeakPolarHBondContact O-CB 3.42Å; L288-N291 PolarHBondContact O-N 2.83Å; L288-N291 VanDerWaalsContact O-N 3.14Å
289	P	91.3	Very high	89.6	Confident	38 Å²	38	39.3 Å²	39.3	25%	0.247	21%	0.21	C	C	.	.	H	α-helix	trans	-57.3	-31.6	174.3	-26.1	34.3	0	0	0	114.1	R47 P53 V287 N291 M292 L293	R47-P289 VanDerWaalsContact NH2-CB 3.3Å; P53-P289 WeakPolarHBondContact O-CD 2.98Å; V287-P289 VanDerWaalsContact C-CD 3.44Å; V287-P289 WeakPolarHBondContact O-CD 3.36Å; P289-N291 PolarHBondContact O-N 3.39Å; P289-M292 WeakPolarHBondContact O-CB 3.46Å; P289-M292 PolarHBondContact O-N 3.17Å; P289-L293 PolarHBondContact O-N 3.43Å
290	I	91	Very high	90.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-33.6	178.1	-166.2	171.1	0	0	0	112.4	Q48 P53 W76 L288 L293 N294	Q48-I290 HydrophobicContact CB-CD1 4.48Å; P53-I290 HydrophobicContact CB-CD1 4.31Å; P53-I290 PolarHBondContact O-N 2.85Å; W76-I290 HydrophobicContact CH2-CD1 3.76Å; W76-I290 HydrophobicContact CZ3-CD1 4.3Å; W76-I290 HydrophobicContact CZ3-CG2 4.24Å; L288-I290 PolarHBondContact O-N 3.5Å; I290-L293 WeakPolarHBondContact O-CB 3.48Å; I290-L293 PolarHBondContact O-N 2.89Å; I290-N294 PolarHBondContact O-N 3.43Å
291	N	89.8	Confident	90.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-72.4	-31.7	-179	177.7	84.8	0	0	0	111.6	Y107 F263 P264 L288 P289 L293 N294 E295	Y107-N291 PolarHBondContact OH-OD1 3.07Å; F263-N291 WeakPolarHBondContact CA-ND2 3.45Å; F263-N291 WeakPolarHBondContact CA-OD1 3.23Å; F263-N291 WeakPolarHBondContact CB-ND2 2.95Å; F263-N291 WeakPolarHBondContact CD1-OD1 3.48Å; F263-N291 PolarHBondContact O-ND2 2.7Å; P264-N291 VanDerWaalsContact O-CG 3.27Å; P264-N291 PolarHBondContact O-ND2 3.32Å; L288-N291 HydrophobicContact CB-CB 4.11Å; L288-N291 WeakPolarHBondContact O-CB 3.42Å; L288-N291 PolarHBondContact O-N 2.83Å; L288-N291 VanDerWaalsContact O-N 3.14Å; P289-N291 PolarHBondContact O-N 3.39Å; N291-L293 VanDerWaalsContact C-N 3.33Å; N291-N294 PolarHBondContact O-N 3.49Å; N291-E295 WeakPolarHBondContact O-CB 3.33Å; N291-E295 PolarHBondContact O-N 3.3Å
292	M	89.3	Confident	91.2	Very high	98 Å²	98	32.9 Å²	32.9	48%	0.483	16%	0.161	S	C	.	.	H	α-helix	trans	-63.5	-38.9	170.2	-172.2	-179.1	76	0	0	111.7	P289 K296	P289-M292 WeakPolarHBondContact O-CB 3.46Å; P289-M292 PolarHBondContact O-N 3.17Å; M292-K296 PolarHBondContact O-N 3.14Å
293	L	91.6	Very high	91.6	Very high	52 Å²	52	36.1 Å²	36.1	27%	0.272	18%	0.175	S	C	.	.	H	α-helix	trans	-66.5	-46.4	174.9	-179.9	64.9	0	0	0	111.2	R47 P289 I290 N291 E295 K296 I297	R47-L293 HydrophobicContact CB-CD2 3.72Å; R47-L293 HydrophobicContact CG-CD2 3.9Å; P289-L293 PolarHBondContact O-N 3.43Å; I290-L293 WeakPolarHBondContact O-CB 3.48Å; I290-L293 PolarHBondContact O-N 2.89Å; N291-L293 VanDerWaalsContact C-N 3.33Å; L293-E295 PolarHBondContact O-N 3.49Å; L293-K296 PolarHBondContact O-N 3.27Å; L293-I297 HydrophobicContact CD1-CD1 3.9Å; L293-I297 HydrophobicContact CD1-CG1 4.26Å; L293-I297 HydrophobicContact CD2-CD1 4.28Å; L293-I297 HydrophobicContact CG-CD1 3.72Å; L293-I297 HydrophobicContact CG-CG1 4.39Å; L293-I297 WeakPolarHBondContact O-CG1 3.46Å; L293-I297 PolarHBondContact O-N 2.93Å
294	N	91.6	Very high	92	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-45.3	178.8	-71.5	-15.3	0	0	0	111.8	F263 I290 N291 K296 I297 Y298	F263-N294 HydrophobicContact CE1-CB 4.28Å; I290-N294 PolarHBondContact O-N 3.43Å; N291-N294 PolarHBondContact O-N 3.49Å; N294-K296 VanDerWaalsContact C-N 3.27Å; N294-K296 PolarHBondContact O-N 2.99Å; N294-I297 PolarHBondContact O-N 2.97Å; N294-Y298 HydrophobicContact CB-CD2 4.23Å; N294-Y298 HydrophobicContact CB-CE2 4.42Å; N294-Y298 VanDerWaalsContact O-CD2 3.29Å; N294-Y298 WeakPolarHBondContact O-CD2 2.88Å; N294-Y298 PolarHBondContact O-N 3.43Å
295	E	90	Very high	92.2	Very high	13 Å²	13	34.6 Å²	34.6	6%	0.061	17%	0.167	C	C	.	.	H	α-helix	trans	-49.7	-49.2	175.8	-171.5	-158.3	127.4	0	0	110.8	I251 F263 R265 N291 L293 I299	I251-E295 WeakPolarHBondContact CD1-OE1 3.48Å; F263-E295 HydrophobicContact CB-CB 4.25Å; F263-E295 HydrophobicContact CB-CG 4.34Å; F263-E295 HydrophobicContact CD1-CB 4.49Å; F263-E295 HydrophobicContact CD2-CB 4.12Å; F263-E295 HydrophobicContact CD2-CG 3.95Å; F263-E295 HydrophobicContact CG-CB 4.07Å; F263-E295 HydrophobicContact CG-CG 4.27Å; R265-E295 IonicContact CZ-OE2 3.15Å; R265-E295 IonicContact NE-OE2 3.54Å; R265-E295 IonicContact NH2-OE1 3.66Å; R265-E295 IonicContact NH2-OE2 3.87Å; R265-E295 PolarHBondContact NH2-OE2 3.22Å; N291-E295 WeakPolarHBondContact O-CB 3.33Å; N291-E295 PolarHBondContact O-N 3.3Å; L293-E295 PolarHBondContact O-N 3.49Å; E295-I299 HydrophobicContact CG-CD1 4.2Å; E295-I299 VanDerWaalsContact O-CD1 3.24Å; E295-I299 WeakPolarHBondContact O-CD1 3.2Å; E295-I299 WeakPolarHBondContact O-CG1 3.27Å; E295-I299 PolarHBondContact O-N 3.15Å
296	K	91.1	Very high	92.3	Very high	98 Å²	98	31.8 Å²	31.8	43%	0.426	16%	0.158	S	C	.	.	H	α-helix	trans	-70.9	-41.1	-179.1	-57.7	-45.9	-179.1	-162	0	113	M292 L293 N294 F300	M292-K296 PolarHBondContact O-N 3.14Å; L293-K296 PolarHBondContact O-N 3.27Å; N294-K296 VanDerWaalsContact C-N 3.27Å; N294-K296 PolarHBondContact O-N 2.99Å; K296-F300 WeakPolarHBondContact O-CB 3.36Å; K296-F300 PolarHBondContact O-N 3.02Å
297	I	93.4	Very high	92.4	Very high	12 Å²	12	34.3 Å²	34.3	6%	0.062	18%	0.176	C	C	.	.	H	α-helix	trans	-63.5	-48	179	-70.7	175.5	0	0	0	110.8	C40 V44 L293 N294 I299 F300 L301	C40-I297 HydrophobicContact CB-CG2 4.02Å; V44-I297 HydrophobicContact CG2-CD1 3.41Å; V44-I297 VanDerWaalsContact CG2-CD1 3.41Å; L293-I297 HydrophobicContact CD1-CD1 3.9Å; L293-I297 HydrophobicContact CD1-CG1 4.26Å; L293-I297 HydrophobicContact CD2-CD1 4.28Å; L293-I297 HydrophobicContact CG-CD1 3.72Å; L293-I297 HydrophobicContact CG-CG1 4.39Å; L293-I297 WeakPolarHBondContact O-CG1 3.46Å; L293-I297 PolarHBondContact O-N 2.93Å; N294-I297 PolarHBondContact O-N 2.97Å; I297-I299 PolarHBondContact O-N 3.42Å; I297-F300 PolarHBondContact O-N 3.17Å; I297-L301 HydrophobicContact CG2-CD1 3.7Å; I297-L301 HydrophobicContact CG2-CG 4.12Å; I297-L301 WeakPolarHBondContact O-CB 3.38Å; I297-L301 VanDerWaalsContact O-CG 3.31Å; I297-L301 WeakPolarHBondContact O-CG 3.34Å; I297-L301 PolarHBondContact O-N 2.9Å
298	Y	92.5	Very high	92.6	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-67.9	-34.4	-177.3	-82.9	-79.8	0	0	0	112.7	V111 M228 F231 L232 F263 N294 F302	V111-Y298 HydrophobicContact CG1-CE2 4.2Å; V111-Y298 HydrophobicContact CG2-CE2 4.49Å; M228-Y298 HydrophobicContact CB-CD1 4.47Å; M228-Y298 HydrophobicContact CB-CE1 4.46Å; M228-Y298 HydrophobicContact CE-CD1 3.56Å; M228-Y298 HydrophobicContact CE-CE1 4.24Å; M228-Y298 HydrophobicContact CG-CD1 4.36Å; M228-Y298 HydrophobicContact CG-CE1 4.21Å; F231-Y298 VanDerWaalsContact CD1-OH 3.27Å; F231-Y298 WeakPolarHBondContact CD1-OH 3.4Å; F231-Y298 WeakPolarHBondContact CE1-OH 3.28Å; L232-Y298 HydrophobicContact CD1-CD1 3.8Å; L232-Y298 HydrophobicContact CD1-CD2 4.46Å; L232-Y298 HydrophobicContact CD1-CE1 4.38Å; L232-Y298 HydrophobicContact CD1-CG 3.87Å; L232-Y298 HydrophobicContact CD2-CD1 4.48Å; L232-Y298 HydrophobicContact CD2-CD2 4.06Å; L232-Y298 HydrophobicContact CD2-CE2 4.08Å; L232-Y298 HydrophobicContact CD2-CG 4.3Å; L232-Y298 HydrophobicContact CG-CD1 4.32Å; L232-Y298 HydrophobicContact CG-CE1 4.43Å; L232-Y298 HydrophobicContact CG-CG 4.5Å; F263-Y298 HydrophobicContact CZ-CD2 4.44Å; N294-Y298 HydrophobicContact CB-CD2 4.23Å; N294-Y298 HydrophobicContact CB-CE2 4.42Å; N294-Y298 VanDerWaalsContact O-CD2 3.29Å; N294-Y298 WeakPolarHBondContact O-CD2 2.88Å; N294-Y298 PolarHBondContact O-N 3.43Å; Y298-F302 WeakPolarHBondContact O-CB 3.36Å; Y298-F302 PolarHBondContact O-N 3.49Å
299	I	91.5	Very high	92.8	Very high	19 Å²	19	32.4 Å²	32.4	10%	0.097	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-48.7	171.7	-67.2	164.7	0	0	0	110.2	I247 I251 E295 I297 F302 F303	I247-I299 HydrophobicContact CG2-CD1 3.63Å; I247-I299 HydrophobicContact CG2-CG1 3.83Å; I251-I299 HydrophobicContact CD1-CD1 3.38Å; E295-I299 HydrophobicContact CG-CD1 4.2Å; E295-I299 VanDerWaalsContact O-CD1 3.24Å; E295-I299 WeakPolarHBondContact O-CD1 3.2Å; E295-I299 WeakPolarHBondContact O-CG1 3.27Å; E295-I299 PolarHBondContact O-N 3.15Å; I297-I299 PolarHBondContact O-N 3.42Å; I299-F302 PolarHBondContact O-N 3.04Å; I299-F303 HydrophobicContact CG2-CD2 4.05Å; I299-F303 HydrophobicContact CG2-CE2 3.8Å; I299-F303 WeakPolarHBondContact O-CD2 3.22Å; I299-F303 PolarHBondContact O-N 3.1Å
300	F	94.3	Very high	92.9	Very high	103 Å²	103	35.4 Å²	35.4	45%	0.452	18%	0.176	S	C	.	.	H	α-helix	trans	-59.8	-48.1	177.9	168.4	-104.7	0	0	0	112	V36 K296 I297 F302 F303 F304	V36-F300 HydrophobicContact CG1-CE1 3.64Å; V36-F300 HydrophobicContact CG1-CZ 4.27Å; K296-F300 WeakPolarHBondContact O-CB 3.36Å; K296-F300 PolarHBondContact O-N 3.02Å; I297-F300 PolarHBondContact O-N 3.17Å; F300-F302 VanDerWaalsContact C-N 3.31Å; F300-F302 PolarHBondContact O-N 2.79Å; F300-F303 PolarHBondContact O-N 3.42Å; F300-F304 HydrophobicContact CE2-CB 4.44Å; F300-F304 HydrophobicContact CZ-CB 4.3Å; F300-F304 HydrophobicContact CZ-CD2 4.27Å; F300-F304 HydrophobicContact CZ-CG 4.33Å; F300-F304 VanDerWaalsContact O-CB 3.31Å; F300-F304 WeakPolarHBondContact O-CB 3.31Å; F300-F304 PolarHBondContact O-N 3.43Å
301	L	94.9	Very high	93.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-38.9	178.2	-73.4	177.5	0	0	0	112	V36 L37 L115 M228 I297 F303 F304 L305	V36-L301 HydrophobicContact CG1-CD2 3.83Å; L37-L301 HydrophobicContact CD2-CD1 4.23Å; L37-L301 HydrophobicContact CD2-CD2 3.98Å; L115-L301 HydrophobicContact CD2-CD1 3.65Å; M228-L301 HydrophobicContact CE-CB 3.59Å; M228-L301 HydrophobicContact CE-CD1 4.5Å; I297-L301 HydrophobicContact CG2-CD1 3.7Å; I297-L301 HydrophobicContact CG2-CG 4.12Å; I297-L301 WeakPolarHBondContact O-CB 3.38Å; I297-L301 VanDerWaalsContact O-CG 3.31Å; I297-L301 WeakPolarHBondContact O-CG 3.34Å; I297-L301 PolarHBondContact O-N 2.9Å; L301-F303 PolarHBondContact O-N 3Å; L301-F304 PolarHBondContact O-N 3.28Å; L301-L305 HydrophobicContact CB-CD1 4.38Å; L301-L305 WeakPolarHBondContact O-CB 3.34Å; L301-L305 WeakPolarHBondContact O-CG 3.48Å; L301-L305 PolarHBondContact O-N 3.37Å
302	F	93.6	Very high	93.4	Very high	18 Å²	18	38.9 Å²	38.9	8%	0.079	19%	0.193	C	C	.	.	H	α-helix	trans	-58.6	-50.5	177.8	174.9	-95.6	0	0	0	111.8	L225 W241 L242 F243 Y298 I299 F300 G306	L225-F302 HydrophobicContact CD2-CD2 4.18Å; W241-F302 VanDerWaalsContact O-CE2 3.3Å; W241-F302 WeakPolarHBondContact O-CE2 3.29Å; L242-F302 HydrophobicContact CD2-CZ 4.46Å; F243-F302 HydrophobicContact CD1-CD2 4.19Å; F243-F302 HydrophobicContact CD1-CE2 4.21Å; F243-F302 AromaticContact CE1-CD2 3.68Å; F243-F302 HydrophobicContact CE1-CD2 3.68Å; F243-F302 HydrophobicContact CE1-CE2 4.08Å; F243-F302 HydrophobicContact CE2-CD2 4.43Å; F243-F302 HydrophobicContact CZ-CB 4.43Å; F243-F302 AromaticContact CZ-CD2 3.8Å; F243-F302 HydrophobicContact CZ-CD2 3.8Å; F243-F302 HydrophobicContact CZ-CG 4.49Å; Y298-F302 WeakPolarHBondContact O-CB 3.36Å; Y298-F302 PolarHBondContact O-N 3.49Å; I299-F302 PolarHBondContact O-N 3.04Å; F300-F302 VanDerWaalsContact C-N 3.31Å; F300-F302 PolarHBondContact O-N 2.79Å; F302-G306 WeakPolarHBondContact O-CA 3.42Å; F302-G306 PolarHBondContact O-N 3.47Å
303	F	94.1	Very high	93.6	Very high	87 Å²	87	36.8 Å²	36.8	38%	0.382	18%	0.183	S	C	.	.	H	α-helix	trans	-69.8	-40.7	179.5	-70.1	-67.2	0	0	0	112.2	L248 I299 F300 L301 S307	L248-F303 HydrophobicContact CB-CE2 4.25Å; L248-F303 HydrophobicContact CB-CZ 4.18Å; L248-F303 HydrophobicContact CD2-CE1 4.44Å; L248-F303 HydrophobicContact CD2-CE2 3.66Å; L248-F303 HydrophobicContact CD2-CZ 3.42Å; L248-F303 VanDerWaalsContact CD2-CZ 3.42Å; L248-F303 HydrophobicContact CG-CE2 4.44Å; L248-F303 HydrophobicContact CG-CZ 4.4Å; I299-F303 HydrophobicContact CG2-CD2 4.05Å; I299-F303 HydrophobicContact CG2-CE2 3.8Å; I299-F303 WeakPolarHBondContact O-CD2 3.22Å; I299-F303 PolarHBondContact O-N 3.1Å; F300-F303 PolarHBondContact O-N 3.42Å; L301-F303 PolarHBondContact O-N 3Å; F303-S307 WeakPolarHBondContact O-CB 3.34Å; F303-S307 PolarHBondContact O-N 3.49Å; F303-S307 PolarHBondContact O-OG 2.96Å
304	F	95.6	Very high	93.8	Very high	47 Å²	47	39.3 Å²	39.3	21%	0.206	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-56.5	-179.8	-175.7	-94.1	0	0	0	111.8	W32 N33 V36 F300 L301 G306 S307 V308	W32-F304 HydrophobicContact CB-CZ 4.09Å; N33-F304 WeakPolarHBondContact OD1-CE1 3.29Å; V36-F304 HydrophobicContact CB-CD1 4.23Å; V36-F304 HydrophobicContact CB-CE1 3.85Å; V36-F304 HydrophobicContact CB-CZ 4.34Å; V36-F304 HydrophobicContact CG1-CD1 3.98Å; V36-F304 HydrophobicContact CG1-CE1 4.12Å; V36-F304 HydrophobicContact CG2-CD1 4.24Å; V36-F304 HydrophobicContact CG2-CE1 3.62Å; V36-F304 HydrophobicContact CG2-CE2 4.19Å; V36-F304 HydrophobicContact CG2-CZ 3.59Å; F300-F304 HydrophobicContact CE2-CB 4.44Å; F300-F304 HydrophobicContact CZ-CB 4.3Å; F300-F304 HydrophobicContact CZ-CD2 4.27Å; F300-F304 HydrophobicContact CZ-CG 4.33Å; F300-F304 VanDerWaalsContact O-CB 3.31Å; F300-F304 WeakPolarHBondContact O-CB 3.31Å; F300-F304 PolarHBondContact O-N 3.43Å; L301-F304 PolarHBondContact O-N 3.28Å; F304-G306 VanDerWaalsContact C-N 3.3Å; F304-G306 PolarHBondContact O-N 3.28Å; F304-S307 PolarHBondContact O-N 3.37Å; F304-S307 VanDerWaalsContact O-N 3.17Å; F304-S307 PolarHBondContact O-OG 3.49Å; F304-V308 HydrophobicContact CE1-CG2 4.35Å; F304-V308 HydrophobicContact CZ-CG2 4.48Å; F304-V308 PolarHBondContact O-N 2.97Å; F304-V308 VanDerWaalsContact O-N 3.14Å
305	L	94.8	Very high	94	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-37.1	179.1	-60.5	179.1	0	0	0	111.3	N33 L37 Y122 M228 L301 V308 M309	N33-L305 HydrophobicContact CB-CD2 3.76Å; N33-L305 VanDerWaalsContact CG-CD2 3.47Å; N33-L305 WeakPolarHBondContact OD1-CD2 3.47Å; L37-L305 HydrophobicContact CD2-CD1 4.45Å; Y122-L305 HydrophobicContact CE2-CD1 4.37Å; Y122-L305 HydrophobicContact CE2-CD2 3.93Å; M228-L305 HydrophobicContact SD-CD1 3.89Å; L301-L305 HydrophobicContact CB-CD1 4.38Å; L301-L305 WeakPolarHBondContact O-CB 3.34Å; L301-L305 WeakPolarHBondContact O-CG 3.48Å; L301-L305 PolarHBondContact O-N 3.37Å; L305-V308 PolarHBondContact O-N 3.35Å; L305-M309 WeakPolarHBondContact O-CB 3.27Å; L305-M309 PolarHBondContact O-N 3.37Å
306	G	93.6	Very high	94.2	Very high	13 Å²	13	40.1 Å²	40.1	13%	0.134	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-42.6	173.4	0	0	0	0	0	112.9	F302 F304 M309 I310	F302-G306 WeakPolarHBondContact O-CA 3.42Å; F302-G306 PolarHBondContact O-N 3.47Å; F304-G306 VanDerWaalsContact C-N 3.3Å; F304-G306 PolarHBondContact O-N 3.28Å; G306-M309 WeakPolarHBondContact O-CB 3.3Å; G306-M309 PolarHBondContact O-N 3.02Å; G306-I310 WeakPolarHBondContact O-CG1 3.4Å; G306-I310 PolarHBondContact O-N 3.38Å
307	S	94.2	Very high	94.3	Very high	54 Å²	54	38.6 Å²	38.6	38%	0.378	20%	0.201	S	C	.	.	H	α-helix	trans	-64.1	-43.3	177.1	75.3	0	0	0	0	112.4	F303 F304 M309 I310 M311	F303-S307 WeakPolarHBondContact O-CB 3.34Å; F303-S307 PolarHBondContact O-N 3.49Å; F303-S307 PolarHBondContact O-OG 2.96Å; F304-S307 PolarHBondContact O-N 3.37Å; F304-S307 VanDerWaalsContact O-N 3.17Å; F304-S307 PolarHBondContact O-OG 3.49Å; S307-M309 VanDerWaalsContact C-N 3.33Å; S307-M309 PolarHBondContact O-N 3.38Å; S307-I310 PolarHBondContact O-N 3.31Å; S307-M311 WeakPolarHBondContact O-CG 3.31Å; S307-M311 PolarHBondContact O-N 3.34Å
308	V	95.9	Very high	94.3	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.012	22%	0.22	C	C	.	.	H	α-helix	trans	-65	-40	175.7	174.6	0	0	0	0	110.5	A28 N33 F304 L305 I310 M311 T312	A28-V308 HydrophobicContact CB-CG1 3.75Å; A28-V308 HydrophobicContact CB-CG2 4.25Å; N33-V308 WeakPolarHBondContact ND2-CG1 3.43Å; N33-V308 WeakPolarHBondContact OD1-CG2 3.18Å; F304-V308 HydrophobicContact CE1-CG2 4.35Å; F304-V308 HydrophobicContact CZ-CG2 4.48Å; F304-V308 PolarHBondContact O-N 2.97Å; F304-V308 VanDerWaalsContact O-N 3.14Å; L305-V308 PolarHBondContact O-N 3.35Å; V308-I310 PolarHBondContact O-N 3.44Å; V308-M311 WeakPolarHBondContact O-CB 3.4Å; V308-M311 PolarHBondContact O-N 3.19Å; V308-T312 WeakPolarHBondContact O-CG2 3.36Å; V308-T312 PolarHBondContact O-N 3.5Å
309	M	94.5	Very high	94.2	Very high	25 Å²	25	42.1 Å²	42.1	12%	0.123	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-46.7	174.1	-173.8	-178.1	69.7	0	0	111.2	F222 L225 L305 G306 S307 M311 T312 M313	F222-M309 HydrophobicContact CD1-CE 4.42Å; F222-M309 HydrophobicContact CD1-SD 3.84Å; F222-M309 HydrophobicContact CD2-SD 4.47Å; F222-M309 HydrophobicContact CE1-CE 4.11Å; F222-M309 HydrophobicContact CE1-SD 3.95Å; F222-M309 HydrophobicContact CG-SD 4.11Å; F222-M309 HydrophobicContact CZ-SD 4.32Å; L225-M309 HydrophobicContact CD1-CE 3.48Å; L225-M309 VanDerWaalsContact CD1-CE 3.48Å; L225-M309 HydrophobicContact CD1-SD 3.68Å; L305-M309 WeakPolarHBondContact O-CB 3.27Å; L305-M309 PolarHBondContact O-N 3.37Å; G306-M309 WeakPolarHBondContact O-CB 3.3Å; G306-M309 PolarHBondContact O-N 3.02Å; S307-M309 VanDerWaalsContact C-N 3.33Å; S307-M309 PolarHBondContact O-N 3.38Å; M309-M311 VanDerWaalsContact C-N 3.31Å; M309-M311 PolarHBondContact O-N 3.23Å; M309-T312 PolarHBondContact O-N 3.25Å; M309-T312 PolarHBondContact O-OG1 3.44Å; M309-M313 HydrophobicContact CG-CE 3.54Å; M309-M313 WeakPolarHBondContact O-CG 3.38Å; M309-M313 PolarHBondContact O-N 2.96Å; M309-M313 HydrophobicContact SD-CE 4.23Å
310	I	94.7	Very high	94.2	Very high	102 Å²	102	45.6 Å²	45.6	52%	0.523	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-44.1	175.7	-67.2	164.8	0	0	0	110.8	G306 S307 V308 T312 M313 L314	G306-I310 WeakPolarHBondContact O-CG1 3.4Å; G306-I310 PolarHBondContact O-N 3.38Å; S307-I310 PolarHBondContact O-N 3.31Å; V308-I310 PolarHBondContact O-N 3.44Å; I310-T312 VanDerWaalsContact C-N 3.29Å; I310-T312 PolarHBondContact O-N 2.95Å; I310-M313 PolarHBondContact O-N 3.46Å; I310-L314 HydrophobicContact CG2-CD1 4.04Å; I310-L314 HydrophobicContact CG2-CG 4.4Å; I310-L314 WeakPolarHBondContact O-CG 3.45Å; I310-L314 PolarHBondContact O-N 3.22Å
311	M	95.5	Very high	94.1	Very high	71 Å²	71	46.7 Å²	46.7	35%	0.35	24%	0.24	S	C	.	.	H	α-helix	trans	-57.4	-40.8	174.7	-70.7	178.8	65.2	0	0	112.2	L24 S307 V308 M309 S315	L24-M311 HydrophobicContact CD2-CE 4.27Å; L24-M311 HydrophobicContact CG-CE 4.43Å; S307-M311 WeakPolarHBondContact O-CG 3.31Å; S307-M311 PolarHBondContact O-N 3.34Å; V308-M311 WeakPolarHBondContact O-CB 3.4Å; V308-M311 PolarHBondContact O-N 3.19Å; M309-M311 VanDerWaalsContact C-N 3.31Å; M309-M311 PolarHBondContact O-N 3.23Å; M311-S315 WeakPolarHBondContact O-CB 3.2Å; M311-S315 PolarHBondContact O-N 2.99Å
312	T	94.9	Very high	93.8	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.012	25%	0.251	C	S	.	.	H	α-helix	trans	-65.3	-44.6	175.1	62.6	0	0	0	0	113.1	N29 V308 M309 I310 L314 S315 I316	N29-T312 WeakPolarHBondContact ND2-CG2 3.41Å; V308-T312 WeakPolarHBondContact O-CG2 3.36Å; V308-T312 PolarHBondContact O-N 3.5Å; M309-T312 PolarHBondContact O-N 3.25Å; M309-T312 PolarHBondContact O-OG1 3.44Å; I310-T312 VanDerWaalsContact C-N 3.29Å; I310-T312 PolarHBondContact O-N 2.95Å; T312-L314 VanDerWaalsContact C-N 3.26Å; T312-L314 PolarHBondContact O-N 2.91Å; T312-S315 WeakPolarHBondContact O-CB 3.15Å; T312-S315 PolarHBondContact O-N 2.88Å; T312-S315 PolarHBondContact O-OG 3.46Å; T312-I316 PolarHBondContact O-N 2.83Å
313	M	94.4	Very high	93.6	Very high	54 Å²	54	49.1 Å²	49.1	27%	0.266	25%	0.249	S	C	.	.	H	α-helix	trans	-63.4	-35.9	-179.2	-62.5	-55.4	156.7	0	0	111.2	S218 F222 M309 I310 P317	S218-M313 WeakPolarHBondContact OG-CE 3.38Å; S218-M313 PolarHBondContact OG-SD 3.43Å; F222-M313 HydrophobicContact CD2-CE 3.77Å; F222-M313 HydrophobicContact CE2-CE 3.21Å; F222-M313 HydrophobicContact CE2-SD 3.99Å; F222-M313 HydrophobicContact CZ-CE 3.83Å; F222-M313 HydrophobicContact CZ-SD 4.47Å; M309-M313 HydrophobicContact CG-CE 3.54Å; M309-M313 WeakPolarHBondContact O-CG 3.38Å; M309-M313 PolarHBondContact O-N 2.96Å; M309-M313 HydrophobicContact SD-CE 4.23Å; I310-M313 PolarHBondContact O-N 3.46Å; M313-P317 WeakPolarHBondContact O-CD 3.41Å
314	L	95.6	Very high	93	Very high	105 Å²	105	47.8 Å²	47.8	55%	0.55	26%	0.259	S	S	.	.	H	α-helix	trans	-72.3	-31.4	173.4	-66.7	175.7	0	0	0	112.2	I310 T312 I316 P317 L318	I310-L314 HydrophobicContact CG2-CD1 4.04Å; I310-L314 HydrophobicContact CG2-CG 4.4Å; I310-L314 WeakPolarHBondContact O-CG 3.45Å; I310-L314 PolarHBondContact O-N 3.22Å; T312-L314 VanDerWaalsContact C-N 3.26Å; T312-L314 PolarHBondContact O-N 2.91Å; L314-I316 PolarHBondContact O-N 3.25Å; L314-P317 VanDerWaalsContact O-CD 3.29Å; L314-P317 WeakPolarHBondContact O-CD 3.27Å; L314-P317 WeakPolarHBondContact O-CG 3.34Å; L314-L318 WeakPolarHBondContact O-CD1 3.44Å; L314-L318 WeakPolarHBondContact O-CG 3.41Å; L314-L318 PolarHBondContact O-N 2.92Å
315	S	94.6	Very high	92.4	Very high	6 Å²	6	49.6 Å²	49.6	4%	0.042	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-35.9	179.4	82.7	0	0	0	0	113.1	M311 T312 L318 W319	M311-S315 WeakPolarHBondContact O-CB 3.2Å; M311-S315 PolarHBondContact O-N 2.99Å; T312-S315 WeakPolarHBondContact O-CB 3.15Å; T312-S315 PolarHBondContact O-N 2.88Å; T312-S315 PolarHBondContact O-OG 3.46Å; S315-L318 PolarHBondContact O-N 3.33Å; S315-W319 WeakPolarHBondContact O-CB 3.44Å; S315-W319 VanDerWaalsContact O-CD1 3.23Å; S315-W319 PolarHBondContact O-N 3.08Å
316	I	93.6	Very high	91.9	Very high	23 Å²	23	56.7 Å²	56.7	12%	0.118	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-57.5	-179.2	-65.3	161.2	0	0	0	112.3	K214 L215 T312 L314 L318 W319 L320	K214-I316 HydrophobicContact CB-CD1 4.45Å; K214-I316 HydrophobicContact CB-CG1 3.8Å; K214-I316 HydrophobicContact CD-CG1 4.27Å; L215-I316 HydrophobicContact CD2-CD1 4.12Å; T312-I316 PolarHBondContact O-N 2.83Å; L314-I316 PolarHBondContact O-N 3.25Å; I316-L318 VanDerWaalsContact C-N 3.29Å; I316-L318 PolarHBondContact O-N 3.2Å; I316-W319 PolarHBondContact O-N 3.06Å; I316-L320 HydrophobicContact CG2-CD1 4.12Å; I316-L320 WeakPolarHBondContact O-CG 3.42Å; I316-L320 PolarHBondContact O-N 3.06Å
317	P	93.7	Very high	91.5	Very high	67 Å²	67	63.9 Å²	63.9	44%	0.435	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-32.6	178.5	26.5	-34	0	0	0	112	M313 L314 W319 L320 Y321	M313-P317 WeakPolarHBondContact O-CD 3.41Å; L314-P317 VanDerWaalsContact O-CD 3.29Å; L314-P317 WeakPolarHBondContact O-CD 3.27Å; L314-P317 WeakPolarHBondContact O-CG 3.34Å; P317-W319 VanDerWaalsContact C-N 3.34Å; P317-W319 PolarHBondContact O-N 3.14Å; P317-L320 PolarHBondContact O-N 3.44Å; P317-Y321 VanDerWaalsContact O-CB 3.26Å; P317-Y321 WeakPolarHBondContact O-CB 3.34Å; P317-Y321 PolarHBondContact O-N 3.39Å
318	L	93	Very high	91.1	Very high	86 Å²	86	65 Å²	65	45%	0.45	33%	0.328	S	S	.	.	H	α-helix	trans	-61.4	-43	173.3	-72.1	173.8	0	0	0	111.5	L314 S315 I316 Y321 R322	L314-L318 WeakPolarHBondContact O-CD1 3.44Å; L314-L318 WeakPolarHBondContact O-CG 3.41Å; L314-L318 PolarHBondContact O-N 2.92Å; S315-L318 PolarHBondContact O-N 3.33Å; I316-L318 VanDerWaalsContact C-N 3.29Å; I316-L318 PolarHBondContact O-N 3.2Å; L318-Y321 PolarHBondContact O-N 3.3Å; L318-R322 WeakPolarHBondContact O-CB 3.38Å; L318-R322 WeakPolarHBondContact O-CG 3.3Å; L318-R322 PolarHBondContact O-N 2.89Å
319	W	92.2	Very high	90.8	Very high	1 Å²	1	66 Å²	66	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-69.3	-40.4	176.1	-87.5	98.3	0	0	0	112.9	D23 Y210 L211 K214 S315 I316 P317 Y321 R322 M323 F368 M372 M375	D23-W319 HydrophobicContact CB-CZ2 4.3Å; D23-W319 PolarHBondContact OD2-NE1 3.43Å; Y210-W319 AromaticContact CE1-CD2 3.59Å; Y210-W319 HydrophobicContact CE1-CD2 3.59Å; Y210-W319 AromaticContact CE1-CE2 3.59Å; Y210-W319 AromaticContact CE1-CE3 3.94Å; Y210-W319 HydrophobicContact CE1-CE3 3.94Å; Y210-W319 AromaticContact CE1-CG 3.96Å; Y210-W319 HydrophobicContact CE1-CG 3.96Å; Y210-W319 HydrophobicContact CE1-CH2 4.17Å; Y210-W319 AromaticContact CE1-CZ2 3.87Å; Y210-W319 HydrophobicContact CE1-CZ2 3.87Å; Y210-W319 HydrophobicContact CE1-CZ3 4.25Å; Y210-W319 AromaticContact CZ-CE2 3.88Å; Y210-W319 AromaticContact CZ-CZ2 3.92Å; Y210-W319 VanDerWaalsContact OH-CE2 3.26Å; Y210-W319 VanDerWaalsContact OH-CZ2 3.29Å; Y210-W319 WeakPolarHBondContact OH-CZ2 3.48Å; Y210-W319 PolarHBondContact OH-NE1 3.19Å; L211-W319 HydrophobicContact CD2-CB 4.24Å; K214-W319 HydrophobicContact CD-CG 4.5Å; S315-W319 WeakPolarHBondContact O-CB 3.44Å; S315-W319 VanDerWaalsContact O-CD1 3.23Å; S315-W319 PolarHBondContact O-N 3.08Å; I316-W319 PolarHBondContact O-N 3.06Å; P317-W319 VanDerWaalsContact C-N 3.34Å; P317-W319 PolarHBondContact O-N 3.14Å; W319-Y321 VanDerWaalsContact C-N 3.31Å; W319-Y321 PolarHBondContact O-N 3.11Å; W319-R322 PolarHBondContact O-N 2.85Å; W319-M323 HydrophobicContact CE3-CE 4.21Å; W319-M323 HydrophobicContact CE3-CG 4.01Å; W319-M323 HydrophobicContact CZ3-CE 3.94Å; W319-M323 HydrophobicContact CZ3-CG 4.47Å; W319-M323 HydrophobicContact CZ3-SD 4.42Å; W319-M323 VanDerWaalsContact O-CB 3.3Å; W319-M323 WeakPolarHBondContact O-CB 3.45Å; W319-M323 VanDerWaalsContact O-CG 3.32Å; W319-M323 WeakPolarHBondContact O-CG 3.22Å; W319-M323 PolarHBondContact O-N 3.25Å; W319-F368 HydrophobicContact CE3-CD2 4.19Å; W319-F368 AromaticContact CE3-CE2 3.98Å; W319-F368 HydrophobicContact CE3-CE2 3.98Å; W319-F368 HydrophobicContact CH2-CD2 4.06Å; W319-F368 AromaticContact CH2-CE2 3.62Å; W319-F368 HydrophobicContact CH2-CE2 3.62Å; W319-F368 HydrophobicContact CH2-CZ 4.5Å; W319-F368 AromaticContact CZ3-CD2 3.45Å; W319-F368 HydrophobicContact CZ3-CD2 3.45Å; W319-F368 VanDerWaalsContact CZ3-CD2 3.45Å; W319-F368 AromaticContact CZ3-CE2 3.34Å; W319-F368 HydrophobicContact CZ3-CE2 3.34Å; W319-M372 HydrophobicContact CH2-CE 3.62Å; W319-M372 HydrophobicContact CH2-CG 3.95Å; W319-M372 HydrophobicContact CH2-SD 3.58Å; W319-M372 VanDerWaalsContact CH2-SD 3.58Å; W319-M372 HydrophobicContact CZ2-CE 3.56Å; W319-M372 HydrophobicContact CZ2-SD 3.69Å; W319-M375 HydrophobicContact CH2-CE 3.34Å; W319-M375 HydrophobicContact CZ2-CE 3.23Å; W319-M375 HydrophobicContact CZ2-SD 4.34Å; W319-M375 HydrophobicContact CZ3-CE 4.48Å
320	L	91.6	Very high	90.4	Very high	92 Å²	92	69.4 Å²	69.4	48%	0.482	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-42.7	171.7	-69.8	172.5	0	0	0	111.4	L211 I316 P317 M323 G324	L211-L320 HydrophobicContact CD1-CD2 3.7Å; L211-L320 HydrophobicContact CD2-CD2 4.03Å; L211-L320 HydrophobicContact CD2-CG 4.3Å; I316-L320 HydrophobicContact CG2-CD1 4.12Å; I316-L320 WeakPolarHBondContact O-CG 3.42Å; I316-L320 PolarHBondContact O-N 3.06Å; P317-L320 PolarHBondContact O-N 3.44Å; L320-M323 PolarHBondContact O-N 3.46Å; L320-G324 WeakPolarHBondContact O-CA 3.31Å; L320-G324 PolarHBondContact O-N 3.26Å
321	Y	90.9	Very high	90.2	Very high	125 Å²	125	70.8 Å²	70.8	49%	0.49	35%	0.348	S	S	.	.	H	α-helix	trans	-69	-36.6	177.5	177.4	-125	0	0	0	113.1	P317 L318 W319 L325 R328	P317-Y321 VanDerWaalsContact O-CB 3.26Å; P317-Y321 WeakPolarHBondContact O-CB 3.34Å; P317-Y321 PolarHBondContact O-N 3.39Å; L318-Y321 PolarHBondContact O-N 3.3Å; W319-Y321 VanDerWaalsContact C-N 3.31Å; W319-Y321 PolarHBondContact O-N 3.11Å; Y321-L325 HydrophobicContact CD2-CD1 3.98Å; Y321-L325 HydrophobicContact CE2-CD1 3.57Å; Y321-R328 PolarHBondContact O-NH1 2.71Å; Y321-R328 VanDerWaalsContact O-NH1 3.07Å
322	R	89.6	Confident	90	Very high	62 Å²	62	68.4 Å²	68.4	23%	0.234	34%	0.336	C	S	.	.	H	α-helix	trans	-68.6	-38.1	175.2	-73.8	172.3	-175.2	178.8	2.7	111.8	L318 W319 R371 M375	L318-R322 WeakPolarHBondContact O-CB 3.38Å; L318-R322 WeakPolarHBondContact O-CG 3.3Å; L318-R322 PolarHBondContact O-N 2.89Å; W319-R322 PolarHBondContact O-N 2.85Å; R322-R371 PolarHBondContact O-NH1 3.49Å; R322-M375 PolarHBondContact NH1-SD 3.37Å
323	M	87.7	Confident	89.8	Confident	8 Å²	8	68.3 Å²	68.3	4%	0.039	34%	0.335	C	S	.	.	H	α-helix	trans	-93	-26.1	-175	-66.3	-62	106.1	0	0	114.1	V207 W319 L320 Q329 Q364 F368 R371	V207-M323 HydrophobicContact CG1-CB 4.18Å; V207-M323 HydrophobicContact CG1-CG 3.94Å; V207-M323 HydrophobicContact CG1-SD 4.48Å; V207-M323 HydrophobicContact CG2-SD 4.32Å; W319-M323 HydrophobicContact CE3-CE 4.21Å; W319-M323 HydrophobicContact CE3-CG 4.01Å; W319-M323 HydrophobicContact CZ3-CE 3.94Å; W319-M323 HydrophobicContact CZ3-CG 4.47Å; W319-M323 HydrophobicContact CZ3-SD 4.42Å; W319-M323 VanDerWaalsContact O-CB 3.3Å; W319-M323 WeakPolarHBondContact O-CB 3.45Å; W319-M323 VanDerWaalsContact O-CG 3.32Å; W319-M323 WeakPolarHBondContact O-CG 3.22Å; W319-M323 PolarHBondContact O-N 3.25Å; L320-M323 PolarHBondContact O-N 3.46Å; M323-Q329 PolarHBondContact O-NE2 3.08Å; M323-Q364 PolarHBondContact O-NE2 2.82Å; M323-F368 HydrophobicContact SD-CB 3.97Å; M323-F368 HydrophobicContact SD-CD2 3.93Å; M323-F368 HydrophobicContact SD-CG 4.46Å; M323-R371 HydrophobicContact CE-CB 4.45Å
324	G	82.3	Confident	89.6	Confident	58 Å²	58	69.4 Å²	69.4	60%	0.598	34%	0.336	S	S	*	.	H	α-helix	trans	-77.8	-32.8	-171.2	0	0	0	0	0	115.2	L320 K326	L320-G324 WeakPolarHBondContact O-CA 3.31Å; L320-G324 PolarHBondContact O-N 3.26Å; G324-K326 PolarHBondContact O-N 2.97Å
325	L	84	Confident	89.3	Confident	85 Å²	85	70.2 Å²	70.2	45%	0.445	33%	0.332	S	S	.	.			trans	-93.3	102.7	-173.9	-67.6	172.7	0	0	0	111.9	Y321 Q327 R328 Q329	Y321-L325 HydrophobicContact CD2-CD1 3.98Å; Y321-L325 HydrophobicContact CE2-CD1 3.57Å; L325-Q327 PolarHBondContact O-N 2.86Å; L325-Q327 VanDerWaalsContact O-N 3.11Å; L325-R328 HydrophobicContact CB-CB 4.15Å; L325-R328 HydrophobicContact CB-CG 3.9Å; L325-R328 HydrophobicContact CD1-CG 4.12Å; L325-R328 PolarHBondContact O-N 2.93Å; L325-Q329 PolarHBondContact O-N 3.19Å
326	K	83.5	Confident	89.2	Confident	150 Å²	150	70 Å²	70	65%	0.652	33%	0.33	S	S	*	.	H	α-helix	trans	-50.8	-37.3	176.2	-67.4	-172.4	178.9	-177.6	0	113.2	G324 R328 Q329 R330	G324-K326 PolarHBondContact O-N 2.97Å; K326-R328 VanDerWaalsContact C-N 3.34Å; K326-R328 PolarHBondContact O-N 3.42Å; K326-Q329 WeakPolarHBondContact O-CB 3.49Å; K326-Q329 PolarHBondContact O-N 3.25Å; K326-R330 WeakPolarHBondContact O-CG 3.29Å; K326-R330 PolarHBondContact O-N 2.98Å
327	Q	85.5	Confident	89	Confident	164 Å²	164	68.9 Å²	68.9	77%	0.766	33%	0.325	S	S	*	.	H	α-helix	trans	-61.4	-40.9	177.6	-171.7	176.3	6.8	0	0	112.4	L325 R330 H331	L325-Q327 PolarHBondContact O-N 2.86Å; L325-Q327 VanDerWaalsContact O-N 3.11Å; Q327-R330 PolarHBondContact O-N 3.06Å; Q327-H331 WeakPolarHBondContact O-CB 3.48Å; Q327-H331 PolarHBondContact O-N 3.28Å
328	R	86.2	Confident	88.8	Confident	77 Å²	77	72.9 Å²	72.9	29%	0.291	34%	0.335	S	S	.	.	H	α-helix	trans	-72.2	-34.8	178.9	-64.5	-174.1	74.4	-149.9	15.5	112.1	Y321 L325 K326 R330 H331 F332	Y321-R328 PolarHBondContact O-NH1 2.71Å; Y321-R328 VanDerWaalsContact O-NH1 3.07Å; L325-R328 HydrophobicContact CB-CB 4.15Å; L325-R328 HydrophobicContact CB-CG 3.9Å; L325-R328 HydrophobicContact CD1-CG 4.12Å; L325-R328 PolarHBondContact O-N 2.93Å; K326-R328 VanDerWaalsContact C-N 3.34Å; K326-R328 PolarHBondContact O-N 3.42Å; R328-R330 VanDerWaalsContact C-N 3.33Å; R328-H331 PolarHBondContact O-N 3.37Å; R328-F332 WeakPolarHBondContact O-CB 3.36Å; R328-F332 PolarHBondContact O-N 3Å
329	Q	88.2	Confident	88.6	Confident	23 Å²	23	73.6 Å²	73.6	11%	0.107	34%	0.338	C	S	.	.	H	α-helix	trans	-61	-46.4	173.3	-57.7	174.3	-9.5	0	0	111.1	M323 L325 K326 F332 V333 H367	M323-Q329 PolarHBondContact O-NE2 3.08Å; L325-Q329 PolarHBondContact O-N 3.19Å; K326-Q329 WeakPolarHBondContact O-CB 3.49Å; K326-Q329 PolarHBondContact O-N 3.25Å; Q329-F332 PolarHBondContact O-N 3.27Å; Q329-V333 PolarHBondContact O-N 3.33Å; Q329-H367 VanDerWaalsContact CA-CE1 3.49Å; Q329-H367 WeakPolarHBondContact CA-CE1 3.32Å
330	R	87.7	Confident	88.3	Confident	96 Å²	96	74.4 Å²	74.4	36%	0.362	35%	0.345	S	S	.	.	H	α-helix	trans	-61.8	-46	176.5	-68.3	-176.9	-173.4	-165.3	3.6	111.6	K326 Q327 R328 F332 V333 R334 D355 M358	K326-R330 WeakPolarHBondContact O-CG 3.29Å; K326-R330 PolarHBondContact O-N 2.98Å; Q327-R330 PolarHBondContact O-N 3.06Å; R328-R330 VanDerWaalsContact C-N 3.33Å; R330-F332 VanDerWaalsContact C-N 3.31Å; R330-F332 PolarHBondContact O-N 3.28Å; R330-V333 PolarHBondContact O-N 2.99Å; R330-R334 WeakPolarHBondContact O-CB 3.28Å; R330-R334 VanDerWaalsContact O-CG 3.27Å; R330-R334 WeakPolarHBondContact O-CG 3.36Å; R330-R334 PolarHBondContact O-N 3.02Å; R330-D355 IonicContact NH1-OD2 2.86Å; R330-D355 PolarHBondContact NH1-OD2 3.18Å; R330-M358 VanDerWaalsContact CA-SD 3.56Å; R330-M358 HydrophobicContact CB-CE 3.91Å; R330-M358 HydrophobicContact CB-SD 3.96Å; R330-M358 HydrophobicContact CG-CE 3.75Å; R330-M358 HydrophobicContact CG-SD 3.99Å
331	H	89.6	Confident	88	Confident	132 Å²	132	76.8 Å²	76.8	61%	0.611	36%	0.358	S	S	*	.	H	α-helix	trans	-58.7	-42.4	177.6	-179.1	77.6	0	0	0	112.3	Q327 R328 R334 R335	Q327-H331 WeakPolarHBondContact O-CB 3.48Å; Q327-H331 PolarHBondContact O-N 3.28Å; R328-H331 PolarHBondContact O-N 3.37Å; H331-R334 PolarHBondContact O-N 3.48Å; H331-R335 WeakPolarHBondContact O-CB 3.3Å; H331-R335 PolarHBondContact O-N 3.47Å
332	F	90.7	Very high	87.5	Confident	21 Å²	21	73.3 Å²	73.3	9%	0.092	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-47.5	178.6	177.6	-102.4	0	0	0	112.8	R328 Q329 R330 R335 F336 H367 R371	R328-F332 WeakPolarHBondContact O-CB 3.36Å; R328-F332 PolarHBondContact O-N 3Å; Q329-F332 PolarHBondContact O-N 3.27Å; R330-F332 VanDerWaalsContact C-N 3.31Å; R330-F332 PolarHBondContact O-N 3.28Å; F332-R335 WeakPolarHBondContact O-CB 3.41Å; F332-R335 PolarHBondContact O-N 3.35Å; F332-F336 HydrophobicContact CD1-CD2 4.44Å; F332-F336 AromaticContact CD1-CE2 3.99Å; F332-F336 HydrophobicContact CD1-CE2 3.99Å; F332-F336 HydrophobicContact CD2-CE2 4.29Å; F332-F336 HydrophobicContact CE1-CD2 4.19Å; F332-F336 AromaticContact CE1-CE2 3.38Å; F332-F336 HydrophobicContact CE1-CE2 3.38Å; F332-F336 HydrophobicContact CE1-CZ 4.21Å; F332-F336 AromaticContact CE2-CE2 3.7Å; F332-F336 HydrophobicContact CE2-CE2 3.7Å; F332-F336 AromaticContact CE2-CZ 3.75Å; F332-F336 HydrophobicContact CE2-CZ 3.75Å; F332-F336 HydrophobicContact CG-CE2 4.44Å; F332-F336 HydrophobicContact CZ-CD2 4.35Å; F332-F336 AromaticContact CZ-CE2 3.22Å; F332-F336 HydrophobicContact CZ-CE2 3.22Å; F332-F336 AromaticContact CZ-CZ 3.57Å; F332-F336 HydrophobicContact CZ-CZ 3.57Å; F332-F336 PolarHBondContact O-N 3.01Å; F332-H367 AromaticContact CD1-CE1 3.41Å; F332-H367 VanDerWaalsContact CD1-CE1 3.41Å; F332-H367 WeakPolarHBondContact CD1-CE1 3.5Å; F332-H367 AromaticContact CD1-ND1 3.9Å; F332-H367 AromaticContact CG-CE1 3.94Å; F332-R371 HydrophobicContact CE1-CB 4.2Å; F332-R371 HydrophobicContact CE1-CG 4.37Å; F332-R371 HydrophobicContact CZ-CB 4.24Å; F332-R371 HydrophobicContact CZ-CG 4.04Å
333	V	90.3	Very high	87	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-70	-42.2	179.2	178.6	0	0	0	0	111.2	Q329 R330 R335 F336 L337 F357 M358 L362	Q329-V333 PolarHBondContact O-N 3.33Å; R330-V333 PolarHBondContact O-N 2.99Å; V333-R335 PolarHBondContact O-N 3.46Å; V333-F336 PolarHBondContact O-N 2.78Å; V333-F336 VanDerWaalsContact O-N 3.16Å; V333-L337 HydrophobicContact CG1-CD1 4.27Å; V333-L337 PolarHBondContact O-N 3.17Å; V333-L337 VanDerWaalsContact O-N 3.15Å; V333-F357 HydrophobicContact CG1-CE1 4.16Å; V333-M358 HydrophobicContact CB-CG 4.18Å; V333-M358 HydrophobicContact CB-SD 3.76Å; V333-M358 HydrophobicContact CG1-CG 3.99Å; V333-M358 HydrophobicContact CG1-SD 4.05Å; V333-M358 HydrophobicContact CG2-SD 4.42Å; V333-L362 HydrophobicContact CG2-CD2 3.76Å
334	R	90.5	Very high	86.5	Confident	76 Å²	76	74.8 Å²	74.8	29%	0.287	36%	0.361	S	S	.	.	H	α-helix	trans	-59.8	-35.2	175	-72.1	179.3	-172.6	175	-1.7	112	R330 H331 F336 L337 K338 Y343 T354 D355 M358	R330-R334 WeakPolarHBondContact O-CB 3.28Å; R330-R334 VanDerWaalsContact O-CG 3.27Å; R330-R334 WeakPolarHBondContact O-CG 3.36Å; R330-R334 PolarHBondContact O-N 3.02Å; H331-R334 PolarHBondContact O-N 3.48Å; R334-F336 PolarHBondContact O-N 3.14Å; R334-L337 PolarHBondContact O-N 3.28Å; R334-K338 VanDerWaalsContact O-CB 3.28Å; R334-K338 WeakPolarHBondContact O-CB 3.21Å; R334-K338 PolarHBondContact O-N 2.94Å; R334-Y343 HydrophobicContact CG-CE2 4.33Å; R334-T354 HydrophobicContact CG-CG2 4.3Å; R334-D355 IonicContact CZ-OD1 2.68Å; R334-D355 IonicContact NE-OD1 2.78Å; R334-D355 VanDerWaalsContact NH2-CG 3.29Å; R334-D355 IonicContact NH2-OD1 3.74Å; R334-D355 PolarHBondContact NH2-OD1 2.87Å; R334-D355 IonicContact NH2-OD2 3.73Å; R334-D355 PolarHBondContact NH2-OD2 3.37Å; R334-D355 VanDerWaalsContact NH2-OD2 3.16Å; R334-M358 HydrophobicContact CG-CE 4.26Å; R334-M358 HydrophobicContact CG-SD 4.42Å
335	R	91	Very high	86.2	Confident	123 Å²	123	81.6 Å²	81.6	46%	0.464	37%	0.368	S	S	.	.	H	α-helix	trans	-58.9	-45.8	174.9	178.9	-179.4	172	-146.3	-7.7	111.3	H331 F332 V333 K338 I339 D379	H331-R335 WeakPolarHBondContact O-CB 3.3Å; H331-R335 PolarHBondContact O-N 3.47Å; F332-R335 WeakPolarHBondContact O-CB 3.41Å; F332-R335 PolarHBondContact O-N 3.35Å; V333-R335 PolarHBondContact O-N 3.46Å; R335-K338 PolarHBondContact O-N 3.22Å; R335-I339 HydrophobicContact CG-CD1 4.04Å; R335-I339 WeakPolarHBondContact O-CD1 3.24Å; R335-I339 VanDerWaalsContact O-CG1 3.25Å; R335-I339 WeakPolarHBondContact O-CG1 3.48Å; R335-I339 PolarHBondContact O-N 2.72Å; R335-D379 IonicContact NH2-OD2 3.81Å
336	F	91.5	Very high	85.9	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-66.8	-42.1	178.4	-68	-48.1	0	0	0	113.1	F332 V333 R334 K338 I339 A340 D379 V383 V386	F332-F336 HydrophobicContact CD1-CD2 4.44Å; F332-F336 AromaticContact CD1-CE2 3.99Å; F332-F336 HydrophobicContact CD1-CE2 3.99Å; F332-F336 HydrophobicContact CD2-CE2 4.29Å; F332-F336 HydrophobicContact CE1-CD2 4.19Å; F332-F336 AromaticContact CE1-CE2 3.38Å; F332-F336 HydrophobicContact CE1-CE2 3.38Å; F332-F336 HydrophobicContact CE1-CZ 4.21Å; F332-F336 AromaticContact CE2-CE2 3.7Å; F332-F336 HydrophobicContact CE2-CE2 3.7Å; F332-F336 AromaticContact CE2-CZ 3.75Å; F332-F336 HydrophobicContact CE2-CZ 3.75Å; F332-F336 HydrophobicContact CG-CE2 4.44Å; F332-F336 HydrophobicContact CZ-CD2 4.35Å; F332-F336 AromaticContact CZ-CE2 3.22Å; F332-F336 HydrophobicContact CZ-CE2 3.22Å; F332-F336 AromaticContact CZ-CZ 3.57Å; F332-F336 HydrophobicContact CZ-CZ 3.57Å; F332-F336 PolarHBondContact O-N 3.01Å; V333-F336 PolarHBondContact O-N 2.78Å; V333-F336 VanDerWaalsContact O-N 3.16Å; R334-F336 PolarHBondContact O-N 3.14Å; F336-K338 VanDerWaalsContact C-N 3.29Å; F336-K338 PolarHBondContact O-N 3.24Å; F336-I339 HydrophobicContact CD1-CD1 4.41Å; F336-I339 PolarHBondContact O-N 3.47Å; F336-A340 PolarHBondContact O-N 3.32Å; F336-D379 HydrophobicContact CE1-CB 4.12Å; F336-V383 HydrophobicContact CB-CG2 4.16Å; F336-V383 HydrophobicContact CD1-CG2 3.44Å; F336-V383 VanDerWaalsContact CD1-CG2 3.44Å; F336-V383 HydrophobicContact CE1-CG2 4.19Å; F336-V383 HydrophobicContact CG-CG2 4.17Å; F336-V386 HydrophobicContact CB-CG1 4.37Å; F336-V386 HydrophobicContact CD2-CG2 4.46Å
337	L	89.7	Confident	85.9	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-67.7	-30.9	177.7	-64.7	171.3	0	0	0	112.5	V333 R334 V342 Y343 T354 V386 F390	V333-L337 HydrophobicContact CG1-CD1 4.27Å; V333-L337 PolarHBondContact O-N 3.17Å; V333-L337 VanDerWaalsContact O-N 3.15Å; R334-L337 PolarHBondContact O-N 3.28Å; L337-V342 PolarHBondContact O-N 3.14Å; L337-Y343 HydrophobicContact CB-CG 4.42Å; L337-Y343 PolarHBondContact O-N 3.24Å; L337-T354 HydrophobicContact CD1-CG2 3.53Å; L337-V386 HydrophobicContact CD2-CG1 3.83Å; L337-V386 HydrophobicContact CG-CG1 4.18Å; L337-F390 HydrophobicContact CD1-CD2 4.38Å; L337-F390 HydrophobicContact CD2-CB 3.9Å; L337-F390 HydrophobicContact CD2-CD1 4.13Å; L337-F390 HydrophobicContact CD2-CG 3.96Å
338	K	89.7	Confident	85.8	Confident	151 Å²	151	77.2 Å²	77.2	66%	0.657	36%	0.363	S	S	*	.	H	α-helix	trans	-69.7	-38.8	173.2	-173.6	178.2	-179.6	-179.1	0	112	R334 R335 F336 A340 D341	R334-K338 VanDerWaalsContact O-CB 3.28Å; R334-K338 WeakPolarHBondContact O-CB 3.21Å; R334-K338 PolarHBondContact O-N 2.94Å; R335-K338 PolarHBondContact O-N 3.22Å; F336-K338 VanDerWaalsContact C-N 3.29Å; F336-K338 PolarHBondContact O-N 3.24Å; K338-A340 PolarHBondContact O-N 2.96Å; K338-D341 PolarHBondContact O-N 3.38Å; K338-D341 VanDerWaalsContact O-N 3.13Å
339	I	88.7	Confident	85.8	Confident	101 Å²	101	82.1 Å²	82.1	52%	0.518	39%	0.387	S	S	.	.	H	α-helix	trans	-61.3	-33.6	177.7	-71.6	162.7	0	0	0	111.3	R335 F336 D341 V383	R335-I339 HydrophobicContact CG-CD1 4.04Å; R335-I339 WeakPolarHBondContact O-CD1 3.24Å; R335-I339 VanDerWaalsContact O-CG1 3.25Å; R335-I339 WeakPolarHBondContact O-CG1 3.48Å; R335-I339 PolarHBondContact O-N 2.72Å; F336-I339 HydrophobicContact CD1-CD1 4.41Å; F336-I339 PolarHBondContact O-N 3.47Å; I339-D341 VanDerWaalsContact C-N 3.31Å; I339-V383 HydrophobicContact CB-CG2 4.33Å; I339-V383 HydrophobicContact CD1-CG2 4.42Å; I339-V383 HydrophobicContact CG2-CG1 4.27Å; I339-V383 HydrophobicContact CG2-CG2 4.08Å
340	A	85.8	Confident	85.6	Confident	17 Å²	17	83 Å²	83	14%	0.14	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	3.6	178.4	0	0	0	0	0	114.8	F336 K338 V342 V383 C387	F336-A340 PolarHBondContact O-N 3.32Å; K338-A340 PolarHBondContact O-N 2.96Å; A340-V342 HydrophobicContact CB-CG2 4.01Å; A340-V342 PolarHBondContact O-N 3.49Å; A340-V342 VanDerWaalsContact O-N 3.13Å; A340-V383 HydrophobicContact CB-CG1 3.84Å; A340-C387 WeakPolarHBondContact CB-SG 3.44Å
341	D	84.4	Confident	85.6	Confident	142 Å²	142	79.4 Å²	79.4	76%	0.759	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	21.9	-177.2	-150.8	30.9	0	0	0	114.4	K338 I339	K338-D341 PolarHBondContact O-N 3.38Å; K338-D341 VanDerWaalsContact O-N 3.13Å; I339-D341 VanDerWaalsContact C-N 3.31Å
342	V	80.8	Confident	85.4	Confident	53 Å²	53	77.8 Å²	77.8	32%	0.321	38%	0.378	S	S	.	.			trans	-91	-23.2	177.6	-179.2	0	0	0	0	111.4	L337 A340 F390	L337-V342 PolarHBondContact O-N 3.14Å; A340-V342 HydrophobicContact CB-CG2 4.01Å; A340-V342 PolarHBondContact O-N 3.49Å; A340-V342 VanDerWaalsContact O-N 3.13Å; V342-F390 HydrophobicContact CG1-CD1 3.92Å; V342-F390 HydrophobicContact CG1-CE1 4.04Å
343	Y	79.6	Confident	85.2	Confident	28 Å²	28	78.4 Å²	78.4	11%	0.11	38%	0.382	C	S	.	.			trans	-106.5	108.1	-178.6	179.8	-90.7	0	0	0	110.8	R334 L337 R345 I350 T354	R334-Y343 HydrophobicContact CG-CE2 4.33Å; L337-Y343 HydrophobicContact CB-CG 4.42Å; L337-Y343 PolarHBondContact O-N 3.24Å; Y343-R345 HydrophobicContact CE1-CB 4.13Å; Y343-I350 HydrophobicContact CD2-CG2 4.15Å; Y343-T354 HydrophobicContact CD2-CG2 4.01Å; Y343-T354 WeakPolarHBondContact CD2-OG1 3.26Å; Y343-T354 HydrophobicContact CE2-CG2 3.94Å
344	D	77.4	Confident	85.1	Confident	73 Å²	73	78.4 Å²	78.4	39%	0.39	38%	0.382	S	S	.	.			trans	-92.4	132.7	162.1	-161.7	-10.4	0	0	0	110	D346 D347	D344-D346 VanDerWaalsContact C-N 3.32Å; D344-D346 PolarHBondContact OD1-N 3.27Å; D344-D347 HydrophobicContact CB-CB 4.31Å
345	R	74.9	Confident	84.9	Confident	201 Å²	201	76.6 Å²	76.6	76%	0.758	38%	0.378	S	S	*	.	S	Bend	trans	-75.2	-29.6	174.8	175.4	-177.7	152.3	-170.8	-8.8	110.6	Y343 D347	Y343-R345 HydrophobicContact CE1-CB 4.13Å; R345-D347 VanDerWaalsContact C-N 3.27Å
346	D	77.6	Confident	84.6	Confident	130 Å²	130	76.1 Å²	76.1	70%	0.695	38%	0.376	S	S	*	.	S	Bend	trans	-77.5	-20.9	-172.5	-61.9	-25.2	0	0	0	111.3	D344 P348	D344-D346 VanDerWaalsContact C-N 3.32Å; D344-D346 PolarHBondContact OD1-N 3.27Å; D346-P348 WeakPolarHBondContact O-CD 3.45Å
347	D	84.5	Confident	84.5	Confident	77 Å²	77	76.1 Å²	76.1	41%	0.412	38%	0.376	S	S	.	.			trans	-81.5	104.7	172.2	-83.5	-26.8	0	0	0	112.7	D344 R345 K349 I350 A351	D344-D347 HydrophobicContact CB-CB 4.31Å; R345-D347 VanDerWaalsContact C-N 3.27Å; D347-K349 PolarHBondContact O-N 3.26Å; D347-K349 VanDerWaalsContact O-N 3.16Å; D347-I350 HydrophobicContact CB-CB 4.05Å; D347-I350 HydrophobicContact CB-CD1 3.88Å; D347-I350 HydrophobicContact CB-CG1 3.92Å; D347-I350 PolarHBondContact O-N 2.68Å; D347-I350 VanDerWaalsContact OD2-CD1 3.31Å; D347-I350 WeakPolarHBondContact OD2-CD1 3.16Å; D347-A351 PolarHBondContact O-N 3.1Å; D347-A351 VanDerWaalsContact O-N 3.08Å
348	P	84.1	Confident	84.4	Confident	100 Å²	100	76.8 Å²	76.8	65%	0.649	38%	0.379	S	S	*	.	H	α-helix	trans	-64.1	-28.3	-177.8	26.6	-35.6	0	0	0	112.5	D346 L352	D346-P348 WeakPolarHBondContact O-CD 3.45Å; P348-L352 WeakPolarHBondContact O-CB 3.33Å; P348-L352 PolarHBondContact O-N 2.72Å
349	K	85.2	Confident	84.1	Confident	179 Å²	179	72.4 Å²	72.4	78%	0.778	37%	0.372	S	S	*	.	H	α-helix	trans	-67.6	-44.6	178.1	-67.1	179.7	-178.4	173.8	0	111.5	D347 L352 L353	D347-K349 PolarHBondContact O-N 3.26Å; D347-K349 VanDerWaalsContact O-N 3.16Å; K349-L352 PolarHBondContact O-N 3Å; K349-L353 WeakPolarHBondContact O-CB 3.38Å; K349-L353 PolarHBondContact O-N 3.36Å
350	I	85.1	Confident	83.7	Confident	41 Å²	41	69.3 Å²	69.3	21%	0.21	36%	0.355	C	S	.	.	H	α-helix	trans	-70.6	-40.1	-179.9	-60.2	179.3	0	0	0	109.9	Y343 D347 L352 L353 T354	Y343-I350 HydrophobicContact CD2-CG2 4.15Å; D347-I350 HydrophobicContact CB-CB 4.05Å; D347-I350 HydrophobicContact CB-CD1 3.88Å; D347-I350 HydrophobicContact CB-CG1 3.92Å; D347-I350 PolarHBondContact O-N 2.68Å; D347-I350 VanDerWaalsContact OD2-CD1 3.31Å; D347-I350 WeakPolarHBondContact OD2-CD1 3.16Å; I350-L352 PolarHBondContact O-N 3.33Å; I350-L353 PolarHBondContact O-N 3.04Å; I350-T354 WeakPolarHBondContact O-CB 3.38Å; I350-T354 PolarHBondContact O-N 2.82Å; I350-T354 PolarHBondContact O-OG1 3.2Å
351	A	85.8	Confident	83.7	Confident	21 Å²	21	68.9 Å²	68.9	17%	0.174	35%	0.35	C	S	.	.	H	α-helix	trans	-58.2	-46.7	174.3	0	0	0	0	0	112.3	D347 T354 D355	D347-A351 PolarHBondContact O-N 3.1Å; D347-A351 VanDerWaalsContact O-N 3.08Å; A351-T354 PolarHBondContact O-N 2.74Å; A351-D355 PolarHBondContact O-N 3.22Å
352	L	85.9	Confident	83.8	Confident	98 Å²	98	62.2 Å²	62.2	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-42.3	177	-177.5	65.5	0	0	0	112.3	P348 K349 I350 T354 D355 R356	P348-L352 WeakPolarHBondContact O-CB 3.33Å; P348-L352 PolarHBondContact O-N 2.72Å; K349-L352 PolarHBondContact O-N 3Å; I350-L352 PolarHBondContact O-N 3.33Å; L352-T354 VanDerWaalsContact C-N 3.31Å; L352-T354 PolarHBondContact O-N 3.27Å; L352-D355 PolarHBondContact O-N 3.16Å; L352-R356 WeakPolarHBondContact O-CG 3.46Å; L352-R356 PolarHBondContact O-N 3.36Å
353	L	87.1	Confident	84	Confident	34 Å²	34	63.8 Å²	63.8	18%	0.178	31%	0.314	C	S	.	.	H	α-helix	trans	-62.2	-41.4	177.5	-175	67.7	0	0	0	111.3	K349 I350 R356 F357 F390 Y393 K394	K349-L353 WeakPolarHBondContact O-CB 3.38Å; K349-L353 PolarHBondContact O-N 3.36Å; I350-L353 PolarHBondContact O-N 3.04Å; L353-R356 PolarHBondContact O-N 2.04Å; L353-F357 WeakPolarHBondContact O-CB 3.03Å; L353-F357 PolarHBondContact O-N 2.99Å; L353-F390 HydrophobicContact CD2-CZ 4.02Å; L353-F390 HydrophobicContact CG-CE2 4.45Å; L353-F390 HydrophobicContact CG-CZ 4.28Å; L353-Y393 HydrophobicContact CD1-CE1 3.84Å; L353-Y393 HydrophobicContact CG-CE1 4.24Å; L353-K394 HydrophobicContact CD2-CB 4.49Å; L353-K394 HydrophobicContact CD2-CG 4.16Å
354	T	87.7	Confident	84.3	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-65.7	-40.8	177	-53.9	0	0	0	0	111.2	R334 L337 Y343 I350 A351 L352 F357 M358	R334-T354 HydrophobicContact CG-CG2 4.3Å; L337-T354 HydrophobicContact CD1-CG2 3.53Å; Y343-T354 HydrophobicContact CD2-CG2 4.01Å; Y343-T354 WeakPolarHBondContact CD2-OG1 3.26Å; Y343-T354 HydrophobicContact CE2-CG2 3.94Å; I350-T354 WeakPolarHBondContact O-CB 3.38Å; I350-T354 PolarHBondContact O-N 2.82Å; I350-T354 PolarHBondContact O-OG1 3.2Å; A351-T354 PolarHBondContact O-N 2.74Å; L352-T354 VanDerWaalsContact C-N 3.31Å; L352-T354 PolarHBondContact O-N 3.27Å; T354-F357 WeakPolarHBondContact O-CB 3.31Å; T354-F357 PolarHBondContact O-N 2.9Å; T354-M358 HydrophobicContact CG2-CE 4.03Å; T354-M358 HydrophobicContact CG2-SD 4.43Å; T354-M358 WeakPolarHBondContact O-CE 3.37Å; T354-M358 VanDerWaalsContact O-CG 3.3Å; T354-M358 WeakPolarHBondContact O-CG 3.5Å; T354-M358 PolarHBondContact O-N 3.19Å
355	D	86.5	Confident	84.8	Confident	39 Å²	39	60.3 Å²	60.3	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-65	-38.3	175.1	-85.7	-2.7	0	0	0	112.7	R330 R334 A351 L352 M358 A359	R330-D355 IonicContact NH1-OD2 2.86Å; R330-D355 PolarHBondContact NH1-OD2 3.18Å; R334-D355 IonicContact CZ-OD1 2.68Å; R334-D355 IonicContact NE-OD1 2.78Å; R334-D355 VanDerWaalsContact NH2-CG 3.29Å; R334-D355 IonicContact NH2-OD1 3.74Å; R334-D355 PolarHBondContact NH2-OD1 2.87Å; R334-D355 IonicContact NH2-OD2 3.73Å; R334-D355 PolarHBondContact NH2-OD2 3.37Å; R334-D355 VanDerWaalsContact NH2-OD2 3.16Å; A351-D355 PolarHBondContact O-N 3.22Å; L352-D355 PolarHBondContact O-N 3.16Å; D355-M358 HydrophobicContact CB-CE 4.49Å; D355-M358 PolarHBondContact O-N 3.49Å; D355-M358 WeakPolarHBondContact OD1-CE 3.4Å; D355-A359 VanDerWaalsContact O-CB 3.27Å; D355-A359 WeakPolarHBondContact O-CB 3.39Å; D355-A359 PolarHBondContact O-N 2.05Å
356	R	85.4	Confident	85.5	Confident	113 Å²	113	50.8 Å²	50.8	43%	0.426	26%	0.261	S	S	.	.	H	α-helix	trans	-65.5	-44.9	171.9	-71.9	-177.1	-178.4	-167.3	0.2	111.8	L352 L353 M358 A359 E360	L352-R356 WeakPolarHBondContact O-CG 3.46Å; L352-R356 PolarHBondContact O-N 3.36Å; L353-R356 PolarHBondContact O-N 2.04Å; R356-M358 VanDerWaalsContact C-N 3.3Å; R356-M358 PolarHBondContact O-N 2.92Å; R356-A359 PolarHBondContact O-N 3.27Å; R356-E360 WeakPolarHBondContact O-CB 3Å; R356-E360 PolarHBondContact O-N 3.17Å
357	F	88.2	Confident	86.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.229	C	C	.	.	I	π-helix	trans	-54.1	-47.9	174.8	170.6	-106.8	0	0	0	111.4	V333 L353 T354 F361 L362 L389 F390 Y393	V333-F357 HydrophobicContact CG1-CE1 4.16Å; L353-F357 WeakPolarHBondContact O-CB 3.03Å; L353-F357 PolarHBondContact O-N 2.99Å; T354-F357 WeakPolarHBondContact O-CB 3.31Å; T354-F357 PolarHBondContact O-N 2.9Å; F357-F361 HydrophobicContact CD2-CB 4.3Å; F357-F361 AromaticContact CD2-CD1 3.58Å; F357-F361 HydrophobicContact CD2-CD1 3.58Å; F357-F361 HydrophobicContact CD2-CE1 4.28Å; F357-F361 HydrophobicContact CD2-CG 4.23Å; F357-F361 AromaticContact CE2-CD1 3.28Å; F357-F361 HydrophobicContact CE2-CD1 3.28Å; F357-F361 AromaticContact CE2-CE1 3.57Å; F357-F361 HydrophobicContact CE2-CE1 3.57Å; F357-F361 HydrophobicContact CE2-CG 4.31Å; F357-F361 HydrophobicContact CZ-CD1 4.17Å; F357-F361 HydrophobicContact CZ-CE1 4.34Å; F357-F361 WeakPolarHBondContact O-CB 3.23Å; F357-F361 PolarHBondContact O-N 3.21Å; F357-L362 PolarHBondContact O-N 3.44Å; F357-L389 HydrophobicContact CE2-CD2 4.46Å; F357-L389 HydrophobicContact CE2-CG 4.25Å; F357-L389 HydrophobicContact CZ-CD2 4.04Å; F357-L389 HydrophobicContact CZ-CG 4.19Å; F357-F390 HydrophobicContact CB-CD2 4.19Å; F357-F390 HydrophobicContact CB-CE2 4.06Å; F357-F390 AromaticContact CD1-CD2 3.93Å; F357-F390 HydrophobicContact CD1-CD2 3.93Å; F357-F390 HydrophobicContact CD1-CE2 4.43Å; F357-F390 HydrophobicContact CD2-CD2 4.07Å; F357-F390 HydrophobicContact CE1-CD2 4.29Å; F357-F390 HydrophobicContact CE2-CD2 4.39Å; F357-F390 AromaticContact CG-CD2 3.8Å; F357-F390 HydrophobicContact CG-CD2 3.8Å; F357-F390 HydrophobicContact CG-CE2 4.18Å; F357-Y393 HydrophobicContact CB-CD1 3.99Å; F357-Y393 HydrophobicContact CB-CE1 3.68Å; F357-Y393 AromaticContact CD2-CD1 3.71Å; F357-Y393 HydrophobicContact CD2-CD1 3.71Å; F357-Y393 AromaticContact CD2-CD2 3.79Å; F357-Y393 HydrophobicContact CD2-CD2 3.79Å; F357-Y393 HydrophobicContact CD2-CE1 4.16Å; F357-Y393 HydrophobicContact CD2-CE2 4.2Å; F357-Y393 AromaticContact CD2-CG 3.51Å; F357-Y393 HydrophobicContact CD2-CG 3.51Å; F357-Y393 HydrophobicContact CE2-CD2 4.47Å; F357-Y393 HydrophobicContact CE2-CG 4.16Å; F357-Y393 HydrophobicContact CG-CD1 4.26Å; F357-Y393 HydrophobicContact CG-CE1 4.41Å; F357-Y393 HydrophobicContact CG-CG 4.47Å; F357-Y393 PolarHBondContact N-OH 3.14Å
358	M	88	Confident	86.5	Confident	14 Å²	14	41 Å²	41	7%	0.069	21%	0.209	C	C	.	.	I	π-helix	trans	-68	-43	179.5	-67.9	-178.4	-62.7	0	0	112.8	R330 V333 R334 T354 D355 R356 R363	R330-M358 VanDerWaalsContact CA-SD 3.56Å; R330-M358 HydrophobicContact CB-CE 3.91Å; R330-M358 HydrophobicContact CB-SD 3.96Å; R330-M358 HydrophobicContact CG-CE 3.75Å; R330-M358 HydrophobicContact CG-SD 3.99Å; V333-M358 HydrophobicContact CB-CG 4.18Å; V333-M358 HydrophobicContact CB-SD 3.76Å; V333-M358 HydrophobicContact CG1-CG 3.99Å; V333-M358 HydrophobicContact CG1-SD 4.05Å; V333-M358 HydrophobicContact CG2-SD 4.42Å; R334-M358 HydrophobicContact CG-CE 4.26Å; R334-M358 HydrophobicContact CG-SD 4.42Å; T354-M358 HydrophobicContact CG2-CE 4.03Å; T354-M358 HydrophobicContact CG2-SD 4.43Å; T354-M358 WeakPolarHBondContact O-CE 3.37Å; T354-M358 VanDerWaalsContact O-CG 3.3Å; T354-M358 WeakPolarHBondContact O-CG 3.5Å; T354-M358 PolarHBondContact O-N 3.19Å; D355-M358 HydrophobicContact CB-CE 4.49Å; D355-M358 PolarHBondContact O-N 3.49Å; D355-M358 WeakPolarHBondContact OD1-CE 3.4Å; R356-M358 VanDerWaalsContact C-N 3.3Å; R356-M358 PolarHBondContact O-N 2.92Å; M358-R363 PolarHBondContact O-N 3.03Å
359	A	83.3	Confident	86.9	Confident	60 Å²	60	36.6 Å²	36.6	50%	0.496	18%	0.18	S	C	.	.	I	π-helix	trans	-79.7	-40.2	-173.6	0	0	0	0	0	113.9	D355 R356	D355-A359 VanDerWaalsContact O-CB 3.27Å; D355-A359 WeakPolarHBondContact O-CB 3.39Å; D355-A359 PolarHBondContact O-N 2.05Å; R356-A359 PolarHBondContact O-N 3.27Å
360	E	80.9	Confident	87.2	Confident	35 Å²	35	28.1 Å²	28.1	16%	0.164	14%	0.143	C	C	.	.	I	π-helix	trans	-102.3	-37.8	-168.1	-61.5	-176.1	167.5	0	0	112.8	R356 R363 F402 R403	R356-E360 WeakPolarHBondContact O-CB 3Å; R356-E360 PolarHBondContact O-N 3.17Å; E360-R363 PolarHBondContact O-NE 2.83Å; E360-R363 VanDerWaalsContact O-NE 3.16Å; E360-F402 HydrophobicContact CB-CB 4.42Å; E360-F402 HydrophobicContact CB-CD2 3.83Å; E360-F402 WeakPolarHBondContact OE2-CD2 3.46Å; E360-R403 IonicContact OE1-NE 3.97Å; E360-R403 IonicContact OE1-NH2 3.21Å; E360-R403 PolarHBondContact OE1-NH2 2.93Å
361	F	85.6	Confident	87.6	Confident	8 Å²	8	27.6 Å²	27.6	4%	0.035	14%	0.138	C	C	.	.	I	π-helix	trans	-93.2	-60.8	-178.3	176.2	-97.4	0	0	0	112.3	E171 L174 F175 F357 L389 Y393	E171-F361 HydrophobicContact CB-CZ 4.45Å; E171-F361 HydrophobicContact CG-CE2 4.24Å; E171-F361 HydrophobicContact CG-CZ 4.07Å; L174-F361 HydrophobicContact CB-CZ 4.47Å; L174-F361 HydrophobicContact CD1-CD1 4.34Å; L174-F361 HydrophobicContact CD1-CE1 3.72Å; L174-F361 HydrophobicContact CD1-CZ 4.01Å; F175-F361 HydrophobicContact CD2-CE2 4.2Å; F175-F361 HydrophobicContact CE1-CD2 4.24Å; F175-F361 HydrophobicContact CE1-CE2 4.27Å; F175-F361 HydrophobicContact CE2-CD2 4.26Å; F175-F361 AromaticContact CE2-CE2 3.53Å; F175-F361 HydrophobicContact CE2-CE2 3.53Å; F175-F361 AromaticContact CZ-CD2 3.77Å; F175-F361 HydrophobicContact CZ-CD2 3.77Å; F175-F361 AromaticContact CZ-CE2 3.52Å; F175-F361 HydrophobicContact CZ-CE2 3.52Å; F357-F361 HydrophobicContact CD2-CB 4.3Å; F357-F361 AromaticContact CD2-CD1 3.58Å; F357-F361 HydrophobicContact CD2-CD1 3.58Å; F357-F361 HydrophobicContact CD2-CE1 4.28Å; F357-F361 HydrophobicContact CD2-CG 4.23Å; F357-F361 AromaticContact CE2-CD1 3.28Å; F357-F361 HydrophobicContact CE2-CD1 3.28Å; F357-F361 AromaticContact CE2-CE1 3.57Å; F357-F361 HydrophobicContact CE2-CE1 3.57Å; F357-F361 HydrophobicContact CE2-CG 4.31Å; F357-F361 HydrophobicContact CZ-CD1 4.17Å; F357-F361 HydrophobicContact CZ-CE1 4.34Å; F357-F361 WeakPolarHBondContact O-CB 3.23Å; F357-F361 PolarHBondContact O-N 3.21Å; F361-L389 HydrophobicContact CE1-CD1 3.84Å; F361-L389 HydrophobicContact CE1-CD2 4.01Å; F361-L389 HydrophobicContact CE1-CG 3.82Å; F361-L389 HydrophobicContact CZ-CD1 3.85Å; F361-L389 HydrophobicContact CZ-CG 4.33Å; F361-Y393 HydrophobicContact CB-CD2 3.91Å; F361-Y393 HydrophobicContact CB-CE2 3.6Å; F361-Y393 HydrophobicContact CD1-CD2 4.23Å; F361-Y393 HydrophobicContact CD2-CD2 4.01Å; F361-Y393 HydrophobicContact CD2-CE2 4.36Å; F361-Y393 AromaticContact CG-CD2 3.78Å; F361-Y393 HydrophobicContact CG-CD2 3.78Å; F361-Y393 HydrophobicContact CG-CE2 4.01Å
362	L	86.7	Confident	87.9	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	13%	0.13	C	C	.	.	I	π-helix	trans	-69.7	-42	-175.4	-170.8	69.8	0	0	0	112.1	L174 V333 F357 G366 H367 L370	L174-L362 HydrophobicContact CD1-CD1 4.03Å; V333-L362 HydrophobicContact CG2-CD2 3.76Å; F357-L362 PolarHBondContact O-N 3.44Å; L362-G366 VanDerWaalsContact CD1-C 3.42Å; L362-G366 WeakPolarHBondContact O-CA 3.35Å; L362-G366 PolarHBondContact O-N 3.16Å; L362-H367 HydrophobicContact CD2-CB 4.27Å; L362-L370 HydrophobicContact CD1-CD1 3.56Å; L362-L370 HydrophobicContact CD1-CG 4.08Å; L362-L370 HydrophobicContact CD2-CD1 3.75Å; L362-L370 HydrophobicContact CG-CD1 4.3Å
363	R	85.1	Confident	88.2	Confident	85 Å²	85	21.9 Å²	21.9	32%	0.321	11%	0.105	S	C	.	.	H	α-helix	trans	51.8	-162.6	-176.5	-57.9	178.6	178.7	-170.3	-6	111.4	M358 E360 H367	M358-R363 PolarHBondContact O-N 3.03Å; E360-R363 PolarHBondContact O-NE 2.83Å; E360-R363 VanDerWaalsContact O-NE 3.16Å; R363-H367 PolarHBondContact O-N 3.01Å
364	Q	85.9	Confident	88.5	Confident	25 Å²	25	20.8 Å²	20.8	12%	0.117	10%	0.1	C	C	.	.	H	α-helix	trans	-72.4	-47.3	179.8	-172.1	74.6	19.9	0	0	112.3	N204 V207 M323 G366 H367 F368	N204-Q364 HydrophobicContact CB-CB 4.41Å; N204-Q364 HydrophobicContact CB-CG 4.26Å; N204-Q364 WeakPolarHBondContact OD1-CB 3.37Å; N204-Q364 WeakPolarHBondContact OD1-CG 3.29Å; V207-Q364 HydrophobicContact CG2-CG 3.9Å; M323-Q364 PolarHBondContact O-NE2 2.82Å; Q364-G366 VanDerWaalsContact C-N 3.33Å; Q364-G366 PolarHBondContact O-N 3.39Å; Q364-H367 WeakPolarHBondContact O-CB 3.36Å; Q364-H367 PolarHBondContact O-N 3.45Å; Q364-F368 PolarHBondContact O-N 2.84Å
365	D	87.2	Confident	88.6	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-63.6	-38.2	-176.2	-74.5	-28.7	0	0	0	111.9	R177 G203 N204 N205 L206 V207 F368 I369	R177-D365 VanDerWaalsContact CD-OD2 3.31Å; R177-D365 WeakPolarHBondContact CD-OD2 3.13Å; R177-D365 IonicContact CZ-OD2 2.71Å; R177-D365 IonicContact NE-OD2 3.7Å; R177-D365 PolarHBondContact NE-OD2 3.04Å; R177-D365 VanDerWaalsContact NH1-CB 3.3Å; R177-D365 IonicContact NH1-OD1 3.36Å; R177-D365 IonicContact NH1-OD2 3.5Å; R177-D365 PolarHBondContact NH1-OD2 3.4Å; R177-D365 IonicContact NH2-OD2 3.71Å; G203-D365 WeakPolarHBondContact O-CB 3.32Å; G203-D365 PolarHBondContact O-N 2.94Å; N204-D365 WeakPolarHBondContact CA-OD1 2.93Å; N205-D365 PolarHBondContact N-OD1 3.19Å; N205-D365 PolarHBondContact N-OD2 3.46Å; L206-D365 WeakPolarHBondContact CB-OD1 3.33Å; L206-D365 PolarHBondContact N-OD1 2.78Å; L206-D365 VanDerWaalsContact N-OD1 3.07Å; V207-D365 PolarHBondContact N-OD1 3.02Å; D365-F368 WeakPolarHBondContact O-CB 3.14Å; D365-F368 PolarHBondContact O-N 2.86Å; D365-I369 WeakPolarHBondContact O-CG1 3.36Å; D365-I369 PolarHBondContact O-N 2.94Å
366	G	89.3	Confident	88.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-69.1	-37.3	174.6	0	0	0	0	0	112.8	L174 L362 Q364 F368 I369 L370	L174-G366 VanDerWaalsContact CD2-CA 3.42Å; L362-G366 VanDerWaalsContact CD1-C 3.42Å; L362-G366 WeakPolarHBondContact O-CA 3.35Å; L362-G366 PolarHBondContact O-N 3.16Å; Q364-G366 VanDerWaalsContact C-N 3.33Å; Q364-G366 PolarHBondContact O-N 3.39Å; G366-F368 VanDerWaalsContact C-N 3.28Å; G366-F368 PolarHBondContact O-N 3.14Å; G366-I369 PolarHBondContact O-N 3.34Å; G366-L370 WeakPolarHBondContact O-CG 3.14Å; G366-L370 PolarHBondContact O-N 3.34Å
367	H	91.3	Very high	89.1	Confident	3 Å²	3	17.9 Å²	17.9	1%	0.014	9%	0.093	C	C	.	.	H	α-helix	trans	-60.6	-41.4	172.4	177.7	71.5	0	0	0	111.2	Q329 F332 L362 R363 Q364 L370 R371	Q329-H367 VanDerWaalsContact CA-CE1 3.49Å; Q329-H367 WeakPolarHBondContact CA-CE1 3.32Å; F332-H367 AromaticContact CD1-CE1 3.41Å; F332-H367 VanDerWaalsContact CD1-CE1 3.41Å; F332-H367 WeakPolarHBondContact CD1-CE1 3.5Å; F332-H367 AromaticContact CD1-ND1 3.9Å; F332-H367 AromaticContact CG-CE1 3.94Å; L362-H367 HydrophobicContact CD2-CB 4.27Å; R363-H367 PolarHBondContact O-N 3.01Å; Q364-H367 WeakPolarHBondContact O-CB 3.36Å; Q364-H367 PolarHBondContact O-N 3.45Å; H367-L370 PolarHBondContact O-N 2.89Å; H367-R371 WeakPolarHBondContact O-CB 3.46Å; H367-R371 PolarHBondContact O-N 3.03Å
368	F	91.8	Very high	89.2	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.5	-46.6	175.2	173.7	-99.2	0	0	0	112.3	F21 W129 L206 V207 Y210 W319 M323 Q364 D365 G366 R371 M372	F21-F368 AromaticContact CE1-CE1 3.73Å; F21-F368 HydrophobicContact CE1-CE1 3.73Å; F21-F368 HydrophobicContact CE1-CZ 4.42Å; F21-F368 HydrophobicContact CZ-CD1 4.15Å; F21-F368 AromaticContact CZ-CE1 3.59Å; F21-F368 HydrophobicContact CZ-CE1 3.59Å; F21-F368 HydrophobicContact CZ-CZ 4.48Å; W129-F368 HydrophobicContact CH2-CE1 4.41Å; W129-F368 HydrophobicContact CH2-CZ 4.48Å; L206-F368 HydrophobicContact CD2-CD1 3.58Å; L206-F368 HydrophobicContact CD2-CE1 3.85Å; L206-F368 HydrophobicContact CG-CD1 3.79Å; L206-F368 HydrophobicContact CG-CE1 3.75Å; V207-F368 HydrophobicContact CG2-CB 3.58Å; V207-F368 HydrophobicContact CG2-CD2 4.07Å; V207-F368 HydrophobicContact CG2-CG 3.81Å; Y210-F368 AromaticContact CD1-CE2 3.34Å; Y210-F368 HydrophobicContact CD1-CE2 3.34Å; Y210-F368 AromaticContact CD1-CZ 3.53Å; Y210-F368 HydrophobicContact CD1-CZ 3.53Å; Y210-F368 HydrophobicContact CD2-CE2 4.48Å; Y210-F368 AromaticContact CD2-CZ 3.85Å; Y210-F368 HydrophobicContact CD2-CZ 3.85Å; Y210-F368 AromaticContact CE1-CE2 3.63Å; Y210-F368 HydrophobicContact CE1-CE2 3.63Å; Y210-F368 AromaticContact CE1-CZ 3.94Å; Y210-F368 HydrophobicContact CE1-CZ 3.94Å; Y210-F368 HydrophobicContact CE2-CZ 4.26Å; Y210-F368 HydrophobicContact CG-CE1 4.48Å; Y210-F368 AromaticContact CG-CE2 3.78Å; Y210-F368 HydrophobicContact CG-CE2 3.78Å; Y210-F368 AromaticContact CG-CZ 3.43Å; Y210-F368 HydrophobicContact CG-CZ 3.43Å; Y210-F368 VanDerWaalsContact CG-CZ 3.43Å; W319-F368 HydrophobicContact CE3-CD2 4.19Å; W319-F368 AromaticContact CE3-CE2 3.98Å; W319-F368 HydrophobicContact CE3-CE2 3.98Å; W319-F368 HydrophobicContact CH2-CD2 4.06Å; W319-F368 AromaticContact CH2-CE2 3.62Å; W319-F368 HydrophobicContact CH2-CE2 3.62Å; W319-F368 HydrophobicContact CH2-CZ 4.5Å; W319-F368 AromaticContact CZ3-CD2 3.45Å; W319-F368 HydrophobicContact CZ3-CD2 3.45Å; W319-F368 VanDerWaalsContact CZ3-CD2 3.45Å; W319-F368 AromaticContact CZ3-CE2 3.34Å; W319-F368 HydrophobicContact CZ3-CE2 3.34Å; M323-F368 HydrophobicContact SD-CB 3.97Å; M323-F368 HydrophobicContact SD-CD2 3.93Å; M323-F368 HydrophobicContact SD-CG 4.46Å; Q364-F368 PolarHBondContact O-N 2.84Å; D365-F368 WeakPolarHBondContact O-CB 3.14Å; D365-F368 PolarHBondContact O-N 2.86Å; G366-F368 VanDerWaalsContact C-N 3.28Å; G366-F368 PolarHBondContact O-N 3.14Å; F368-R371 PolarHBondContact O-N 2.98Å; F368-M372 HydrophobicContact CE1-CE 4.44Å; F368-M372 HydrophobicContact CE1-CG 4.08Å; F368-M372 HydrophobicContact CE2-CE 3.9Å; F368-M372 HydrophobicContact CE2-CG 4.17Å; F368-M372 HydrophobicContact CZ-CE 3.52Å; F368-M372 HydrophobicContact CZ-CG 3.87Å; F368-M372 PolarHBondContact O-N 3.03Å
369	I	92	Very high	89.4	Confident	7 Å²	7	21.9 Å²	21.9	4%	0.036	12%	0.122	C	C	.	.	H	α-helix	trans	-62	-46.7	177.7	-66.1	164.5	0	0	0	110.9	F21 L141 L170 L206 D365 G366 R371 M372 L373	F21-I369 HydrophobicContact CE2-CG1 4.42Å; F21-I369 HydrophobicContact CE2-CG2 4.49Å; F21-I369 HydrophobicContact CZ-CG1 4.21Å; L141-I369 HydrophobicContact CD2-CD1 4.32Å; L170-I369 HydrophobicContact CD1-CB 4.4Å; L170-I369 HydrophobicContact CD1-CD1 4.23Å; L170-I369 HydrophobicContact CD1-CG2 3.74Å; L206-I369 HydrophobicContact CD2-CD1 4.04Å; L206-I369 HydrophobicContact CD2-CG1 3.78Å; D365-I369 WeakPolarHBondContact O-CG1 3.36Å; D365-I369 PolarHBondContact O-N 2.94Å; G366-I369 PolarHBondContact O-N 3.34Å; I369-R371 VanDerWaalsContact C-N 3.25Å; I369-R371 PolarHBondContact O-N 3.43Å; I369-M372 WeakPolarHBondContact O-CB 3.46Å; I369-M372 PolarHBondContact O-N 2.89Å; I369-L373 WeakPolarHBondContact O-CB 3.4Å; I369-L373 PolarHBondContact O-N 3.11Å
370	L	93.1	Very high	89.8	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.3	-35.8	177.8	-73	-177.4	0	0	0	112.3	L170 L362 G366 H367 L373 S374 V386	L170-L370 HydrophobicContact CD2-CD2 3.79Å; L362-L370 HydrophobicContact CD1-CD1 3.56Å; L362-L370 HydrophobicContact CD1-CG 4.08Å; L362-L370 HydrophobicContact CD2-CD1 3.75Å; L362-L370 HydrophobicContact CG-CD1 4.3Å; G366-L370 WeakPolarHBondContact O-CG 3.14Å; G366-L370 PolarHBondContact O-N 3.34Å; H367-L370 PolarHBondContact O-N 2.89Å; L370-L373 HydrophobicContact CD2-CD2 4.38Å; L370-L373 WeakPolarHBondContact O-CB 3.29Å; L370-L373 PolarHBondContact O-N 3.32Å; L370-S374 PolarHBondContact O-N 2.82Å; L370-V386 HydrophobicContact CD1-CG2 3.84Å; L370-V386 HydrophobicContact CD2-CG2 3.7Å; L370-V386 HydrophobicContact CG-CG2 4.37Å
371	R	93.1	Very high	90.3	Very high	30 Å²	30	22.7 Å²	22.7	11%	0.113	12%	0.119	C	C	.	.	H	α-helix	trans	-71.9	-39.2	177	-161	160.4	-163.1	151.2	5	112.2	R322 M323 F332 H367 F368 I369 L373 S374 M375	R322-R371 PolarHBondContact O-NH1 3.49Å; M323-R371 HydrophobicContact CE-CB 4.45Å; F332-R371 HydrophobicContact CE1-CB 4.2Å; F332-R371 HydrophobicContact CE1-CG 4.37Å; F332-R371 HydrophobicContact CZ-CB 4.24Å; F332-R371 HydrophobicContact CZ-CG 4.04Å; H367-R371 WeakPolarHBondContact O-CB 3.46Å; H367-R371 PolarHBondContact O-N 3.03Å; F368-R371 PolarHBondContact O-N 2.98Å; I369-R371 VanDerWaalsContact C-N 3.25Å; I369-R371 PolarHBondContact O-N 3.43Å; R371-L373 VanDerWaalsContact C-N 3.3Å; R371-S374 PolarHBondContact O-N 2.85Å; R371-S374 PolarHBondContact O-OG 2.96Å; R371-M375 HydrophobicContact CG-CE 4.41Å; R371-M375 WeakPolarHBondContact O-CE 3.41Å; R371-M375 WeakPolarHBondContact O-CG 3.26Å; R371-M375 PolarHBondContact O-N 3.02Å; R371-M375 VanDerWaalsContact O-N 3.15Å
372	M	91.9	Very high	90.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.9	-40.1	171.2	-80.3	-61.6	-157.4	0	0	112	F21 I145 Y210 W319 F368 I369 M375 N376	F21-M372 HydrophobicContact CD2-CB 4.25Å; F21-M372 HydrophobicContact CE2-CB 3.74Å; F21-M372 HydrophobicContact CE2-CG 4.07Å; F21-M372 HydrophobicContact CZ-CB 4.19Å; F21-M372 HydrophobicContact CZ-CG 4.04Å; I145-M372 HydrophobicContact CD1-CB 3.97Å; Y210-M372 HydrophobicContact CD2-CE 4.08Å; Y210-M372 HydrophobicContact CE1-CE 3.86Å; Y210-M372 HydrophobicContact CE2-CE 3.31Å; Y210-M372 WeakPolarHBondContact OH-CE 3.48Å; W319-M372 HydrophobicContact CH2-CE 3.62Å; W319-M372 HydrophobicContact CH2-CG 3.95Å; W319-M372 HydrophobicContact CH2-SD 3.58Å; W319-M372 VanDerWaalsContact CH2-SD 3.58Å; W319-M372 HydrophobicContact CZ2-CE 3.56Å; W319-M372 HydrophobicContact CZ2-SD 3.69Å; F368-M372 HydrophobicContact CE1-CE 4.44Å; F368-M372 HydrophobicContact CE1-CG 4.08Å; F368-M372 HydrophobicContact CE2-CE 3.9Å; F368-M372 HydrophobicContact CE2-CG 4.17Å; F368-M372 HydrophobicContact CZ-CE 3.52Å; F368-M372 HydrophobicContact CZ-CG 3.87Å; F368-M372 PolarHBondContact O-N 3.03Å; I369-M372 WeakPolarHBondContact O-CB 3.46Å; I369-M372 PolarHBondContact O-N 2.89Å; M372-M375 HydrophobicContact SD-CE 3.75Å; M372-N376 WeakPolarHBondContact O-CB 3.38Å; M372-N376 PolarHBondContact O-N 3.02Å; M372-N376 PolarHBondContact O-ND2 2.67Å
373	L	92.9	Very high	91.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.8	-46.8	176.4	-172.5	64.2	0	0	0	111	I145 A148 I369 L370 R371 M375 N376 A377 T382 I385	I145-L373 HydrophobicContact CG1-CD1 4.16Å; A148-L373 HydrophobicContact CB-CD1 3.35Å; I369-L373 WeakPolarHBondContact O-CB 3.4Å; I369-L373 PolarHBondContact O-N 3.11Å; L370-L373 HydrophobicContact CD2-CD2 4.38Å; L370-L373 WeakPolarHBondContact O-CB 3.29Å; L370-L373 PolarHBondContact O-N 3.32Å; R371-L373 VanDerWaalsContact C-N 3.3Å; L373-M375 VanDerWaalsContact C-N 3.34Å; L373-M375 PolarHBondContact O-N 2.98Å; L373-N376 PolarHBondContact O-N 2.75Å; L373-A377 HydrophobicContact CD1-CB 4.28Å; L373-A377 WeakPolarHBondContact O-CB 3.31Å; L373-A377 PolarHBondContact O-N 3.22Å; L373-T382 HydrophobicContact CB-CG2 3.84Å; L373-T382 HydrophobicContact CD2-CG2 3.69Å; L373-T382 HydrophobicContact CG-CG2 3.64Å; L373-I385 HydrophobicContact CD2-CB 4.48Å; L373-I385 HydrophobicContact CD2-CD1 3.76Å; L373-I385 HydrophobicContact CD2-CG2 4.17Å; L373-I385 HydrophobicContact CG-CD1 4.5Å
374	S	92.8	Very high	91.4	Very high	10 Å²	10	21.1 Å²	21.1	7%	0.07	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-36.5	-179.3	85	0	0	0	0	112.8	L370 R371 N376 G378	L370-S374 PolarHBondContact O-N 2.82Å; R371-S374 PolarHBondContact O-N 2.85Å; R371-S374 PolarHBondContact O-OG 2.96Å; S374-N376 VanDerWaalsContact C-N 3.34Å; S374-G378 CarbonylContact O-C 3.48Å; S374-G378 WeakPolarHBondContact O-CA 3.49Å; S374-G378 PolarHBondContact O-N 3.47Å; S374-G378 VanDerWaalsContact O-N 3.11Å
375	M	90.4	Very high	91.8	Very high	63 Å²	63	19.9 Å²	19.9	31%	0.31	11%	0.11	S	C	.	.	H	α-helix	trans	-73.1	-26	178.8	-69.4	-177.9	-58.5	0	0	113.5	W319 R322 R371 M372 L373	W319-M375 HydrophobicContact CH2-CE 3.34Å; W319-M375 HydrophobicContact CZ2-CE 3.23Å; W319-M375 HydrophobicContact CZ2-SD 4.34Å; W319-M375 HydrophobicContact CZ3-CE 4.48Å; R322-M375 PolarHBondContact NH1-SD 3.37Å; R371-M375 HydrophobicContact CG-CE 4.41Å; R371-M375 WeakPolarHBondContact O-CE 3.41Å; R371-M375 WeakPolarHBondContact O-CG 3.26Å; R371-M375 PolarHBondContact O-N 3.02Å; R371-M375 VanDerWaalsContact O-N 3.15Å; M372-M375 HydrophobicContact SD-CE 3.75Å; L373-M375 VanDerWaalsContact C-N 3.34Å; L373-M375 PolarHBondContact O-N 2.98Å
376	N	90.3	Very high	92.1	Very high	19 Å²	19	19.7 Å²	19.7	10%	0.102	11%	0.109	C	C	.	.	H	α-helix	trans	-105.1	-32.4	-172.5	-71.3	-52.8	0	0	0	114.1	V19 G20 E22 R27 I145 M372 L373 S374	V19-N376 HydrophobicContact CG1-CB 4.1Å; G20-N376 VanDerWaalsContact O-CG 3.29Å; G20-N376 PolarHBondContact O-ND2 3.17Å; E22-N376 PolarHBondContact O-ND2 2.78Å; E22-N376 PolarHBondContact O-OD1 3.48Å; E22-N376 VanDerWaalsContact O-OD1 3.12Å; R27-N376 PolarHBondContact NH2-OD1 3.28Å; I145-N376 HydrophobicContact CD1-CB 4.39Å; I145-N376 HydrophobicContact CG2-CB 3.51Å; M372-N376 WeakPolarHBondContact O-CB 3.38Å; M372-N376 PolarHBondContact O-N 3.02Å; M372-N376 PolarHBondContact O-ND2 2.67Å; L373-N376 PolarHBondContact O-N 2.75Å; S374-N376 VanDerWaalsContact C-N 3.34Å
377	A	90.3	Very high	92.3	Very high	9 Å²	9	20.8 Å²	20.8	7%	0.074	12%	0.117	C	C	.	.	H	α-helix	trans	-107.1	-11.8	178.1	0	0	0	0	0	113	A148 L373 I381	A148-A377 HydrophobicContact CB-CB 3.78Å; L373-A377 HydrophobicContact CD1-CB 4.28Å; L373-A377 WeakPolarHBondContact O-CB 3.31Å; L373-A377 PolarHBondContact O-N 3.22Å; A377-I381 HydrophobicContact CB-CD1 4.5Å; A377-I381 WeakPolarHBondContact O-CD1 3.32Å
378	G	90.9	Very high	92.3	Very high	31 Å²	31	23.1 Å²	23.1	32%	0.32	13%	0.129	S	C	.	.			trans	91.5	156.9	-179.8	0	0	0	0	0	114.1	S374 L380 T382	S374-G378 CarbonylContact O-C 3.48Å; S374-G378 WeakPolarHBondContact O-CA 3.49Å; S374-G378 PolarHBondContact O-N 3.47Å; S374-G378 VanDerWaalsContact O-N 3.11Å; G378-L380 PolarHBondContact O-N 3.26Å; G378-T382 PolarHBondContact O-N 3.28Å; G378-T382 PolarHBondContact O-OG1 3.33Å
379	D	92.3	Very high	92.3	Very high	68 Å²	68	23.1 Å²	23.1	36%	0.364	13%	0.129	S	C	.	.	H	α-helix	trans	-61.7	-39.4	-170.9	-80.5	-6.4	0	0	0	113.1	R335 F336 I381 T382 V383	R335-D379 IonicContact NH2-OD2 3.81Å; F336-D379 HydrophobicContact CE1-CB 4.12Å; D379-I381 PolarHBondContact O-N 2.82Å; D379-T382 VanDerWaalsContact C-OG1 3.28Å; D379-T382 VanDerWaalsContact CA-OG1 3.23Å; D379-T382 WeakPolarHBondContact CA-OG1 3.25Å; D379-T382 WeakPolarHBondContact O-CB 3.27Å; D379-T382 PolarHBondContact O-N 3.01Å; D379-T382 PolarHBondContact O-OG1 2.84Å; D379-V383 WeakPolarHBondContact O-CG2 3.21Å; D379-V383 PolarHBondContact O-N 3.15Å
380	L	91.6	Very high	92.3	Very high	105 Å²	105	23.1 Å²	23.1	55%	0.55	13%	0.129	S	C	.	.	H	α-helix	trans	-59.1	-48.1	-176.2	-176.9	67	0	0	0	112.7	G378 T382 V383 E384	G378-L380 PolarHBondContact O-N 3.26Å; L380-T382 VanDerWaalsContact C-N 3.35Å; L380-V383 WeakPolarHBondContact O-CB 3.25Å; L380-V383 PolarHBondContact O-N 2.91Å; L380-E384 PolarHBondContact O-N 3.32Å
381	I	92.5	Very high	92.1	Very high	6 Å²	6	24.8 Å²	24.8	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-68.5	-38.5	-179.9	-67.5	159.6	0	0	0	110.4	A148 I151 S152 A377 D379 V383 E384 I385	A148-I381 HydrophobicContact CB-CG2 4.47Å; A148-I381 WeakPolarHBondContact O-CD1 3.31Å; I151-I381 HydrophobicContact CB-CD1 4.32Å; I151-I381 HydrophobicContact CB-CG2 4.36Å; I151-I381 HydrophobicContact CD1-CG2 4.22Å; I151-I381 HydrophobicContact CG2-CD1 4.49Å; I151-I381 HydrophobicContact CG2-CG1 4.21Å; I151-I381 HydrophobicContact CG2-CG2 4.3Å; S152-I381 WeakPolarHBondContact OG-CD1 3.33Å; A377-I381 HydrophobicContact CB-CD1 4.5Å; A377-I381 WeakPolarHBondContact O-CD1 3.32Å; D379-I381 PolarHBondContact O-N 2.82Å; I381-V383 VanDerWaalsContact C-N 3.28Å; I381-V383 PolarHBondContact O-N 2.87Å; I381-E384 PolarHBondContact O-N 2.81Å; I381-I385 HydrophobicContact CG2-CD1 3.63Å; I381-I385 HydrophobicContact CG2-CG1 4.35Å; I381-I385 WeakPolarHBondContact O-CG1 3.42Å; I381-I385 PolarHBondContact O-N 2.9Å
382	T	93.6	Very high	91.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.4	-37.9	173	10.6	0	0	0	0	112.8	L373 G378 D379 L380 I385 V386	L373-T382 HydrophobicContact CB-CG2 3.84Å; L373-T382 HydrophobicContact CD2-CG2 3.69Å; L373-T382 HydrophobicContact CG-CG2 3.64Å; G378-T382 PolarHBondContact O-N 3.28Å; G378-T382 PolarHBondContact O-OG1 3.33Å; D379-T382 VanDerWaalsContact C-OG1 3.28Å; D379-T382 VanDerWaalsContact CA-OG1 3.23Å; D379-T382 WeakPolarHBondContact CA-OG1 3.25Å; D379-T382 WeakPolarHBondContact O-CB 3.27Å; D379-T382 PolarHBondContact O-N 3.01Å; D379-T382 PolarHBondContact O-OG1 2.84Å; L380-T382 VanDerWaalsContact C-N 3.35Å; T382-I385 PolarHBondContact O-N 3.46Å; T382-V386 VanDerWaalsContact O-CB 3.29Å; T382-V386 WeakPolarHBondContact O-CB 3.15Å; T382-V386 WeakPolarHBondContact O-CG2 3.47Å; T382-V386 PolarHBondContact O-N 3.33Å
383	V	93.9	Very high	91.6	Very high	13 Å²	13	25.5 Å²	25.5	8%	0.079	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-49.4	176.9	172.6	0	0	0	0	110.3	F336 I339 A340 D379 L380 I381 I385 V386 C387	F336-V383 HydrophobicContact CB-CG2 4.16Å; F336-V383 HydrophobicContact CD1-CG2 3.44Å; F336-V383 VanDerWaalsContact CD1-CG2 3.44Å; F336-V383 HydrophobicContact CE1-CG2 4.19Å; F336-V383 HydrophobicContact CG-CG2 4.17Å; I339-V383 HydrophobicContact CB-CG2 4.33Å; I339-V383 HydrophobicContact CD1-CG2 4.42Å; I339-V383 HydrophobicContact CG2-CG1 4.27Å; I339-V383 HydrophobicContact CG2-CG2 4.08Å; A340-V383 HydrophobicContact CB-CG1 3.84Å; D379-V383 WeakPolarHBondContact O-CG2 3.21Å; D379-V383 PolarHBondContact O-N 3.15Å; L380-V383 WeakPolarHBondContact O-CB 3.25Å; L380-V383 PolarHBondContact O-N 2.91Å; I381-V383 VanDerWaalsContact C-N 3.28Å; I381-V383 PolarHBondContact O-N 2.87Å; V383-I385 VanDerWaalsContact C-N 3.35Å; V383-I385 PolarHBondContact O-N 2.81Å; V383-V386 PolarHBondContact O-N 3.09Å; V383-C387 WeakPolarHBondContact O-CB 3.11Å; V383-C387 PolarHBondContact O-N 3.36Å; V383-C387 PolarHBondContact O-SG 3.45Å
384	E	92.8	Very high	91.3	Very high	50 Å²	50	31.1 Å²	31.1	23%	0.234	17%	0.173	C	C	.	.	H	α-helix	trans	-60.2	-43.7	179.2	-67	-180	-176.1	0	0	112.2	R159 V163 L380 I381 C387 N388	R159-E384 IonicContact CZ-OE1 3.8Å; R159-E384 IonicContact CZ-OE2 2.67Å; R159-E384 IonicContact NE-OE1 3.36Å; R159-E384 IonicContact NE-OE2 3.16Å; R159-E384 PolarHBondContact NE-OE2 2.95Å; R159-E384 IonicContact NH2-OE1 3.38Å; R159-E384 PolarHBondContact NH2-OE1 3.38Å; R159-E384 IonicContact NH2-OE2 3.45Å; R159-E384 PolarHBondContact NH2-OE2 2.74Å; V163-E384 HydrophobicContact CG1-CB 4.02Å; V163-E384 HydrophobicContact CG2-CB 4.48Å; L380-E384 PolarHBondContact O-N 3.32Å; I381-E384 PolarHBondContact O-N 2.81Å; E384-C387 PolarHBondContact O-N 3.46Å; E384-N388 PolarHBondContact O-N 2.96Å; E384-N388 PolarHBondContact O-ND2 2.73Å; E384-N388 VanDerWaalsContact O-ND2 3.13Å
385	I	93.7	Very high	91	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-44.4	178.7	-66.6	167.8	0	0	0	110.8	A148 V163 I166 L373 I381 T382 V383 C387 N388 L389	A148-I385 HydrophobicContact CB-CD1 4.45Å; V163-I385 HydrophobicContact CG1-CG1 3.87Å; I166-I385 HydrophobicContact CB-CD1 4.43Å; I166-I385 HydrophobicContact CD1-CD1 4.48Å; I166-I385 HydrophobicContact CG2-CD1 3.85Å; I166-I385 HydrophobicContact CG2-CG1 4.41Å; I166-I385 HydrophobicContact CG2-CG2 4.27Å; L373-I385 HydrophobicContact CD2-CB 4.48Å; L373-I385 HydrophobicContact CD2-CD1 3.76Å; L373-I385 HydrophobicContact CD2-CG2 4.17Å; L373-I385 HydrophobicContact CG-CD1 4.5Å; I381-I385 HydrophobicContact CG2-CD1 3.63Å; I381-I385 HydrophobicContact CG2-CG1 4.35Å; I381-I385 WeakPolarHBondContact O-CG1 3.42Å; I381-I385 PolarHBondContact O-N 2.9Å; T382-I385 PolarHBondContact O-N 3.46Å; V383-I385 VanDerWaalsContact C-N 3.35Å; V383-I385 PolarHBondContact O-N 2.81Å; I385-C387 VanDerWaalsContact C-N 3.33Å; I385-C387 PolarHBondContact O-N 2.87Å; I385-N388 PolarHBondContact O-N 3.27Å; I385-L389 VanDerWaalsContact O-CB 3.27Å; I385-L389 WeakPolarHBondContact O-CB 3.1Å; I385-L389 PolarHBondContact O-N 2.67Å
386	V	93.7	Very high	90.6	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.8	-37.8	178.9	170	0	0	0	0	111.3	F336 L337 L370 T382 V383 L389 F390	F336-V386 HydrophobicContact CB-CG1 4.37Å; F336-V386 HydrophobicContact CD2-CG2 4.46Å; L337-V386 HydrophobicContact CD2-CG1 3.83Å; L337-V386 HydrophobicContact CG-CG1 4.18Å; L370-V386 HydrophobicContact CD1-CG2 3.84Å; L370-V386 HydrophobicContact CD2-CG2 3.7Å; L370-V386 HydrophobicContact CG-CG2 4.37Å; T382-V386 VanDerWaalsContact O-CB 3.29Å; T382-V386 WeakPolarHBondContact O-CB 3.15Å; T382-V386 WeakPolarHBondContact O-CG2 3.47Å; T382-V386 PolarHBondContact O-N 3.33Å; V383-V386 PolarHBondContact O-N 3.09Å; V386-L389 PolarHBondContact O-N 3.02Å; V386-F390 VanDerWaalsContact O-CB 3.32Å; V386-F390 WeakPolarHBondContact O-CB 3.48Å; V386-F390 PolarHBondContact O-N 3.26Å
387	C	92.5	Very high	89.8	Confident	23 Å²	23	41.1 Å²	41.1	16%	0.155	21%	0.209	C	C	.	.	H	α-helix	trans	-67.7	-44.9	178	-67.4	0	0	0	0	112.1	A340 V383 E384 I385 L389 F390 A391	A340-C387 WeakPolarHBondContact CB-SG 3.44Å; V383-C387 WeakPolarHBondContact O-CB 3.11Å; V383-C387 PolarHBondContact O-N 3.36Å; V383-C387 PolarHBondContact O-SG 3.45Å; E384-C387 PolarHBondContact O-N 3.46Å; I385-C387 VanDerWaalsContact C-N 3.33Å; I385-C387 PolarHBondContact O-N 2.87Å; C387-L389 VanDerWaalsContact C-N 3.34Å; C387-L389 PolarHBondContact O-N 3.31Å; C387-F390 PolarHBondContact O-N 3.48Å; C387-A391 WeakPolarHBondContact O-CB 3.41Å; C387-A391 PolarHBondContact O-N 3.28Å
388	N	92	Very high	88.6	Confident	51 Å²	51	43.8 Å²	43.8	27%	0.273	23%	0.231	S	C	.	.	H	α-helix	trans	-62	-43.1	174.2	-77.2	-45	0	0	0	111.5	V163 A167 E384 I385 F390 A391 D392	V163-N388 WeakPolarHBondContact CG1-ND2 3.34Å; A167-N388 HydrophobicContact CB-CB 3.92Å; E384-N388 PolarHBondContact O-N 2.96Å; E384-N388 PolarHBondContact O-ND2 2.73Å; E384-N388 VanDerWaalsContact O-ND2 3.13Å; I385-N388 PolarHBondContact O-N 3.27Å; N388-F390 VanDerWaalsContact C-N 3.33Å; N388-F390 PolarHBondContact O-N 3.18Å; N388-A391 PolarHBondContact O-N 3.35Å; N388-D392 WeakPolarHBondContact O-CB 3.43Å; N388-D392 PolarHBondContact O-N 2.98Å
389	L	92	Very high	87.3	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-61.6	-39.8	176.2	-170.8	67.9	0	0	0	112.2	L170 E171 L174 F357 F361 I385 V386 C387 Y393	L170-L389 HydrophobicContact CD2-CD2 3.9Å; L170-L389 HydrophobicContact CG-CD2 4.37Å; E171-L389 HydrophobicContact CB-CD1 4.01Å; L174-L389 HydrophobicContact CD1-CD2 4.4Å; F357-L389 HydrophobicContact CE2-CD2 4.46Å; F357-L389 HydrophobicContact CE2-CG 4.25Å; F357-L389 HydrophobicContact CZ-CD2 4.04Å; F357-L389 HydrophobicContact CZ-CG 4.19Å; F361-L389 HydrophobicContact CE1-CD1 3.84Å; F361-L389 HydrophobicContact CE1-CD2 4.01Å; F361-L389 HydrophobicContact CE1-CG 3.82Å; F361-L389 HydrophobicContact CZ-CD1 3.85Å; F361-L389 HydrophobicContact CZ-CG 4.33Å; I385-L389 VanDerWaalsContact O-CB 3.27Å; I385-L389 WeakPolarHBondContact O-CB 3.1Å; I385-L389 PolarHBondContact O-N 2.67Å; V386-L389 PolarHBondContact O-N 3.02Å; C387-L389 VanDerWaalsContact C-N 3.34Å; C387-L389 PolarHBondContact O-N 3.31Å; L389-Y393 VanDerWaalsContact O-CB 3.26Å; L389-Y393 WeakPolarHBondContact O-CB 3.43Å; L389-Y393 PolarHBondContact O-N 3.43Å
390	F	91.2	Very high	86.1	Confident	7 Å²	7	46.1 Å²	46.1	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-72.5	-37.1	177.1	-174	-108.3	0	0	0	112.4	L337 V342 L353 F357 V386 C387 N388 Y393 K394	L337-F390 HydrophobicContact CD1-CD2 4.38Å; L337-F390 HydrophobicContact CD2-CB 3.9Å; L337-F390 HydrophobicContact CD2-CD1 4.13Å; L337-F390 HydrophobicContact CD2-CG 3.96Å; V342-F390 HydrophobicContact CG1-CD1 3.92Å; V342-F390 HydrophobicContact CG1-CE1 4.04Å; L353-F390 HydrophobicContact CD2-CZ 4.02Å; L353-F390 HydrophobicContact CG-CE2 4.45Å; L353-F390 HydrophobicContact CG-CZ 4.28Å; F357-F390 HydrophobicContact CB-CD2 4.19Å; F357-F390 HydrophobicContact CB-CE2 4.06Å; F357-F390 AromaticContact CD1-CD2 3.93Å; F357-F390 HydrophobicContact CD1-CD2 3.93Å; F357-F390 HydrophobicContact CD1-CE2 4.43Å; F357-F390 HydrophobicContact CD2-CD2 4.07Å; F357-F390 HydrophobicContact CE1-CD2 4.29Å; F357-F390 HydrophobicContact CE2-CD2 4.39Å; F357-F390 AromaticContact CG-CD2 3.8Å; F357-F390 HydrophobicContact CG-CD2 3.8Å; F357-F390 HydrophobicContact CG-CE2 4.18Å; V386-F390 VanDerWaalsContact O-CB 3.32Å; V386-F390 WeakPolarHBondContact O-CB 3.48Å; V386-F390 PolarHBondContact O-N 3.26Å; C387-F390 PolarHBondContact O-N 3.48Å; N388-F390 VanDerWaalsContact C-N 3.33Å; N388-F390 PolarHBondContact O-N 3.18Å; F390-Y393 HydrophobicContact CD2-CD1 4.44Å; F390-Y393 HydrophobicContact CE2-CD1 4.46Å; F390-Y393 WeakPolarHBondContact O-CB 3.42Å; F390-Y393 PolarHBondContact O-N 3.24Å; F390-K394 WeakPolarHBondContact O-CB 3.42Å; F390-K394 PolarHBondContact O-N 3.2Å
391	A	89.9	Confident	84.7	Confident	35 Å²	35	45.3 Å²	45.3	29%	0.289	25%	0.248	S	C	.	.	H	α-helix	trans	-65.1	-45.2	175.1	0	0	0	0	0	111.3	C387 N388 Y393 K394 K395	C387-A391 WeakPolarHBondContact O-CB 3.41Å; C387-A391 PolarHBondContact O-N 3.28Å; N388-A391 PolarHBondContact O-N 3.35Å; A391-Y393 VanDerWaalsContact C-N 3.3Å; A391-Y393 PolarHBondContact O-N 2.99Å; A391-K394 PolarHBondContact O-N 3.42Å; A391-K395 WeakPolarHBondContact O-CB 3.34Å; A391-K395 VanDerWaalsContact O-CG 3.31Å; A391-K395 WeakPolarHBondContact O-CG 3.24Å; A391-K395 PolarHBondContact O-N 3.11Å
392	D	87.2	Confident	83.2	Confident	39 Å²	39	45.8 Å²	45.8	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-63	-39.5	173.9	-77.6	-19.7	0	0	0	111.4	N388 K395 R396	N388-D392 WeakPolarHBondContact O-CB 3.43Å; N388-D392 PolarHBondContact O-N 2.98Å; D392-K395 PolarHBondContact O-N 2.88Å; D392-R396 WeakPolarHBondContact O-CB 3.5Å; D392-R396 WeakPolarHBondContact O-CG 3.38Å; D392-R396 PolarHBondContact O-N 2.93Å
393	Y	87.4	Confident	81.4	Confident	5 Å²	5	54.7 Å²	54.7	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-61	-47.3	173.7	175.2	-96.2	0	0	0	112.2	L353 F357 F361 L389 F390 A391 R396 F397 F402	L353-Y393 HydrophobicContact CD1-CE1 3.84Å; L353-Y393 HydrophobicContact CG-CE1 4.24Å; F357-Y393 HydrophobicContact CB-CD1 3.99Å; F357-Y393 HydrophobicContact CB-CE1 3.68Å; F357-Y393 AromaticContact CD2-CD1 3.71Å; F357-Y393 HydrophobicContact CD2-CD1 3.71Å; F357-Y393 AromaticContact CD2-CD2 3.79Å; F357-Y393 HydrophobicContact CD2-CD2 3.79Å; F357-Y393 HydrophobicContact CD2-CE1 4.16Å; F357-Y393 HydrophobicContact CD2-CE2 4.2Å; F357-Y393 AromaticContact CD2-CG 3.51Å; F357-Y393 HydrophobicContact CD2-CG 3.51Å; F357-Y393 HydrophobicContact CE2-CD2 4.47Å; F357-Y393 HydrophobicContact CE2-CG 4.16Å; F357-Y393 HydrophobicContact CG-CD1 4.26Å; F357-Y393 HydrophobicContact CG-CE1 4.41Å; F357-Y393 HydrophobicContact CG-CG 4.47Å; F357-Y393 PolarHBondContact N-OH 3.14Å; F361-Y393 HydrophobicContact CB-CD2 3.91Å; F361-Y393 HydrophobicContact CB-CE2 3.6Å; F361-Y393 HydrophobicContact CD1-CD2 4.23Å; F361-Y393 HydrophobicContact CD2-CD2 4.01Å; F361-Y393 HydrophobicContact CD2-CE2 4.36Å; F361-Y393 AromaticContact CG-CD2 3.78Å; F361-Y393 HydrophobicContact CG-CD2 3.78Å; F361-Y393 HydrophobicContact CG-CE2 4.01Å; L389-Y393 VanDerWaalsContact O-CB 3.26Å; L389-Y393 WeakPolarHBondContact O-CB 3.43Å; L389-Y393 PolarHBondContact O-N 3.43Å; F390-Y393 HydrophobicContact CD2-CD1 4.44Å; F390-Y393 HydrophobicContact CE2-CD1 4.46Å; F390-Y393 WeakPolarHBondContact O-CB 3.42Å; F390-Y393 PolarHBondContact O-N 3.24Å; A391-Y393 VanDerWaalsContact C-N 3.3Å; A391-Y393 PolarHBondContact O-N 2.99Å; Y393-R396 PolarHBondContact O-N 2.99Å; Y393-F397 HydrophobicContact CD2-CB 4.19Å; Y393-F397 AromaticContact CD2-CD2 3.92Å; Y393-F397 HydrophobicContact CD2-CD2 3.92Å; Y393-F397 HydrophobicContact CD2-CG 4.43Å; Y393-F397 HydrophobicContact CE2-CB 4.11Å; Y393-F397 WeakPolarHBondContact O-CA 3.41Å; Y393-F397 WeakPolarHBondContact O-CB 3.48Å; Y393-F397 PolarHBondContact O-N 3.07Å; Y393-F402 HydrophobicContact CD2-CZ 4.32Å; Y393-F402 AromaticContact CE2-CE2 3.45Å; Y393-F402 HydrophobicContact CE2-CE2 3.45Å; Y393-F402 VanDerWaalsContact CE2-CE2 3.45Å; Y393-F402 AromaticContact CE2-CZ 3.6Å; Y393-F402 HydrophobicContact CE2-CZ 3.6Å; Y393-F402 AromaticContact CZ-CE2 3.9Å
394	K	87.1	Confident	79.4	Confident	119 Å²	119	56.2 Å²	56.2	52%	0.517	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-45.7	177.6	-176.3	-179.5	177.4	-176.1	0	111.1	L353 F390 A391 A398	L353-K394 HydrophobicContact CD2-CB 4.49Å; L353-K394 HydrophobicContact CD2-CG 4.16Å; F390-K394 WeakPolarHBondContact O-CB 3.42Å; F390-K394 PolarHBondContact O-N 3.2Å; A391-K394 PolarHBondContact O-N 3.42Å; K394-A398 WeakPolarHBondContact O-CB 3.19Å; K394-A398 PolarHBondContact O-N 3.36Å
395	K	86.4	Confident	77.2	Confident	171 Å²	171	59.4 Å²	59.4	74%	0.743	33%	0.327	S	S	*	.	H	α-helix	trans	-63.2	-42.4	179.8	-73.9	174.2	-177.9	178.5	0	112.7	A391 D392	A391-K395 WeakPolarHBondContact O-CB 3.34Å; A391-K395 VanDerWaalsContact O-CG 3.31Å; A391-K395 WeakPolarHBondContact O-CG 3.24Å; A391-K395 PolarHBondContact O-N 3.11Å; D392-K395 PolarHBondContact O-N 2.88Å
396	R	80.9	Confident	75.2	Confident	113 Å²	113	62.6 Å²	62.6	43%	0.426	35%	0.348	S	S	.	.	H	α-helix	trans	-91.9	-27.2	-171.8	-66.5	174.1	-175.5	-113	-6.9	113.8	K168 E171 D392 Y393 I400	K168-R396 VanDerWaalsContact NZ-NH2 3.17Å; E171-R396 WeakPolarHBondContact OE1-CD 3.45Å; E171-R396 IonicContact OE1-CZ 2.69Å; E171-R396 IonicContact OE1-NE 3.51Å; E171-R396 IonicContact OE1-NH1 3.66Å; D392-R396 WeakPolarHBondContact O-CB 3.5Å; D392-R396 WeakPolarHBondContact O-CG 3.38Å; D392-R396 PolarHBondContact O-N 2.93Å; Y393-R396 PolarHBondContact O-N 2.99Å; R396-I400 WeakPolarHBondContact O-CD1 3.26Å
397	F	73.5	Confident	73.3	Confident	17 Å²	17	65.7 Å²	65.7	8%	0.075	36%	0.364	C	S	.	.	H	α-helix	trans	-133.8	8	-165.4	-52.2	-73.2	0	0	0	114.9	F175 Y393 G399 I400 F402 I407	F175-F397 HydrophobicContact CE1-CE1 4.36Å; F175-F397 HydrophobicContact CE1-CZ 4.04Å; F175-F397 AromaticContact CE2-CE2 3.71Å; F175-F397 HydrophobicContact CE2-CE2 3.71Å; F175-F397 AromaticContact CE2-CZ 3.56Å; F175-F397 HydrophobicContact CE2-CZ 3.56Å; F175-F397 HydrophobicContact CZ-CD2 4.25Å; F175-F397 AromaticContact CZ-CE1 3.81Å; F175-F397 HydrophobicContact CZ-CE1 3.81Å; F175-F397 AromaticContact CZ-CE2 3.37Å; F175-F397 HydrophobicContact CZ-CE2 3.37Å; F175-F397 AromaticContact CZ-CZ 3.11Å; F175-F397 HydrophobicContact CZ-CZ 3.11Å; Y393-F397 HydrophobicContact CD2-CB 4.19Å; Y393-F397 AromaticContact CD2-CD2 3.92Å; Y393-F397 HydrophobicContact CD2-CD2 3.92Å; Y393-F397 HydrophobicContact CD2-CG 4.43Å; Y393-F397 HydrophobicContact CE2-CB 4.11Å; Y393-F397 WeakPolarHBondContact O-CA 3.41Å; Y393-F397 WeakPolarHBondContact O-CB 3.48Å; Y393-F397 PolarHBondContact O-N 3.07Å; F397-G399 VanDerWaalsContact C-N 3.31Å; F397-G399 PolarHBondContact O-N 3.36Å; F397-I400 HydrophobicContact CD1-CD1 4.23Å; F397-I400 PolarHBondContact O-N 3.46Å; F397-F402 HydrophobicContact CB-CE1 4.14Å; F397-F402 HydrophobicContact CB-CE2 4.16Å; F397-F402 HydrophobicContact CB-CZ 3.43Å; F397-F402 VanDerWaalsContact CB-CZ 3.43Å; F397-F402 AromaticContact CD1-CE1 3.37Å; F397-F402 HydrophobicContact CD1-CE1 3.37Å; F397-F402 AromaticContact CD1-CZ 3.56Å; F397-F402 HydrophobicContact CD1-CZ 3.56Å; F397-F402 HydrophobicContact CD2-CZ 4.06Å; F397-F402 AromaticContact CE1-CE1 3.88Å; F397-F402 HydrophobicContact CE1-CE1 3.88Å; F397-F402 HydrophobicContact CE1-CZ 4.35Å; F397-F402 AromaticContact CG-CE1 3.75Å; F397-F402 HydrophobicContact CG-CE1 3.75Å; F397-F402 AromaticContact CG-CZ 3.4Å; F397-F402 HydrophobicContact CG-CZ 3.4Å; F397-F402 VanDerWaalsContact CG-CZ 3.4Å; F397-I407 HydrophobicContact CD1-CD1 3.95Å; F397-I407 HydrophobicContact CE1-CD1 3.84Å
398	A	65.6	Low	71.3	Confident	65 Å²	65	71.4 Å²	71.4	54%	0.537	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	93.3	169.3	0	0	0	0	0	110	K394	K394-A398 WeakPolarHBondContact O-CB 3.19Å; K394-A398 PolarHBondContact O-N 3.36Å
399	G	64	Low	69.4	Low	70 Å²	70	71.6 Å²	71.6	72%	0.722	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.5	-8.6	177.2	0	0	0	0	0	115.6	F397	F397-G399 VanDerWaalsContact C-N 3.31Å; F397-G399 PolarHBondContact O-N 3.36Å
400	I	67	Low	67	Low	79 Å²	79	81.3 Å²	81.3	41%	0.405	44%	0.438	S	S	.	.			trans	-94.3	119	-179.4	-48.1	176	0	0	0	109.8	R396 F397 F402 I407	R396-I400 WeakPolarHBondContact O-CD1 3.26Å; F397-I400 HydrophobicContact CD1-CD1 4.23Å; F397-I400 PolarHBondContact O-N 3.46Å; I400-F402 PolarHBondContact O-N 3.27Å; I400-I407 HydrophobicContact CB-CD1 4.26Å; I400-I407 HydrophobicContact CD1-CD1 4.17Å; I400-I407 HydrophobicContact CG2-CD1 3.5Å; I400-I407 VanDerWaalsContact CG2-CD1 3.5Å; I400-I407 HydrophobicContact CG2-CG1 4.41Å
401	D	61.5	Low	64.5	Low	87 Å²	87	89.5 Å²	89.5	47%	0.465	48%	0.478	S	S	.	.			trans	-75.4	117.9	173.4	-167.6	-12.2	0	0	0	109.8	R403 G404	D401-R403 PolarHBondContact O-N 3.42Å; D401-R403 VanDerWaalsContact O-N 3.15Å; D401-R403 WeakPolarHBondContact OD1-CB 3.32Å; D401-R403 WeakPolarHBondContact OD1-CD 3.48Å; D401-R403 WeakPolarHBondContact OD1-CG 3.49Å; D401-R403 PolarHBondContact OD1-N 3.19Å; D401-R403 VanDerWaalsContact OD1-N 3.1Å; D401-R403 IonicContact OD1-NE 3.55Å; D401-G404 PolarHBondContact O-N 3.31Å
402	F	60.9	Low	62.1	Low	17 Å²	17	96.7 Å²	96.7	8%	0.075	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	2.9	-178.9	-66.1	-61.9	0	0	0	114.6	F175 R178 E360 Y393 F397 I400 G404 I407	F175-F402 HydrophobicContact CE1-CE1 4.28Å; R178-F402 VanDerWaalsContact CZ-CD1 3.45Å; R178-F402 VanDerWaalsContact NH2-CB 3.28Å; E360-F402 HydrophobicContact CB-CB 4.42Å; E360-F402 HydrophobicContact CB-CD2 3.83Å; E360-F402 WeakPolarHBondContact OE2-CD2 3.46Å; Y393-F402 HydrophobicContact CD2-CZ 4.32Å; Y393-F402 AromaticContact CE2-CE2 3.45Å; Y393-F402 HydrophobicContact CE2-CE2 3.45Å; Y393-F402 VanDerWaalsContact CE2-CE2 3.45Å; Y393-F402 AromaticContact CE2-CZ 3.6Å; Y393-F402 HydrophobicContact CE2-CZ 3.6Å; Y393-F402 AromaticContact CZ-CE2 3.9Å; F397-F402 HydrophobicContact CB-CE1 4.14Å; F397-F402 HydrophobicContact CB-CE2 4.16Å; F397-F402 HydrophobicContact CB-CZ 3.43Å; F397-F402 VanDerWaalsContact CB-CZ 3.43Å; F397-F402 AromaticContact CD1-CE1 3.37Å; F397-F402 HydrophobicContact CD1-CE1 3.37Å; F397-F402 AromaticContact CD1-CZ 3.56Å; F397-F402 HydrophobicContact CD1-CZ 3.56Å; F397-F402 HydrophobicContact CD2-CZ 4.06Å; F397-F402 AromaticContact CE1-CE1 3.88Å; F397-F402 HydrophobicContact CE1-CE1 3.88Å; F397-F402 HydrophobicContact CE1-CZ 4.35Å; F397-F402 AromaticContact CG-CE1 3.75Å; F397-F402 HydrophobicContact CG-CE1 3.75Å; F397-F402 AromaticContact CG-CZ 3.4Å; F397-F402 HydrophobicContact CG-CZ 3.4Å; F397-F402 VanDerWaalsContact CG-CZ 3.4Å; I400-F402 PolarHBondContact O-N 3.27Å; F402-G404 VanDerWaalsContact C-N 3.26Å; F402-I407 HydrophobicContact CD1-CD1 4.19Å; F402-I407 HydrophobicContact CE1-CD1 4.16Å
403	R	57.3	Low	59.5	Low	187 Å²	187	102.4 Å²	102.4	71%	0.706	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.3	174.6	-63.6	169.9	-164.1	-166.5	5.4	113.2	E360 D401	E360-R403 IonicContact OE1-NE 3.97Å; E360-R403 IonicContact OE1-NH2 3.21Å; E360-R403 PolarHBondContact OE1-NH2 2.93Å; D401-R403 PolarHBondContact O-N 3.42Å; D401-R403 VanDerWaalsContact O-N 3.15Å; D401-R403 WeakPolarHBondContact OD1-CB 3.32Å; D401-R403 WeakPolarHBondContact OD1-CD 3.48Å; D401-R403 WeakPolarHBondContact OD1-CG 3.49Å; D401-R403 PolarHBondContact OD1-N 3.19Å; D401-R403 VanDerWaalsContact OD1-N 3.1Å; D401-R403 IonicContact OD1-NE 3.55Å
404	G	50.9	Low	57	Low	45 Å²	45	113 Å²	113	46%	0.464	57%	0.57	S	S	.	*	S	Bend	trans	-81.6	178.6	173.4	0	0	0	0	0	114.6	D401 F402	D401-G404 PolarHBondContact O-N 3.31Å; F402-G404 VanDerWaalsContact C-N 3.26Å
405	P	47.6	Very low	54.6	Low	116 Å²	116	115.6 Å²	115.6	75%	0.753	58%	0.584	S	S	*	*	S	Bend	trans	-56.1	154.3	175.2	21.9	-30.6	0	0	0	112.1	I407	P405-I407 PolarHBondContact O-N 3.09Å
406	P	50.4	Low	52.2	Low	68 Å²	68	112.8 Å²	112.8	44%	0.442	58%	0.577	S	S	.	*			trans	-59	129.2	-170.9	23.9	-33.4	0	0	0	111.8	Y180 I408	Y180-P406 HydrophobicContact CE2-CG 4.3Å; P406-I408 PolarHBondContact O-N 3.4Å
407	I	53.6	Low	50.2	Low	64 Å²	64	114.8 Å²	114.8	33%	0.328	60%	0.595	S	S	.	*			trans	-74.8	105.2	168.2	-51.4	162.4	0	0	0	106	F397 I400 F402 P405 P409	F397-I407 HydrophobicContact CD1-CD1 3.95Å; F397-I407 HydrophobicContact CE1-CD1 3.84Å; I400-I407 HydrophobicContact CB-CD1 4.26Å; I400-I407 HydrophobicContact CD1-CD1 4.17Å; I400-I407 HydrophobicContact CG2-CD1 3.5Å; I400-I407 VanDerWaalsContact CG2-CD1 3.5Å; I400-I407 HydrophobicContact CG2-CG1 4.41Å; F402-I407 HydrophobicContact CD1-CD1 4.19Å; F402-I407 HydrophobicContact CE1-CD1 4.16Å; P405-I407 PolarHBondContact O-N 3.09Å; I407-P409 WeakPolarHBondContact O-CD 3.48Å
408	I	51.9	Low	48.6	Very low	143 Å²	143	121 Å²	121	73%	0.733	63%	0.629	S	S	*	*			trans	-66.1	120.9	170.2	-58	172	0	0	0	106.2	P406 K410	P406-I408 PolarHBondContact O-N 3.4Å; I408-K410 PolarHBondContact O-N 2.82Å; I408-K410 VanDerWaalsContact O-N 3.15Å
409	P	50.4	Low	47.4	Very low	56 Å²	56	120.7 Å²	120.7	36%	0.364	63%	0.632	S	S	.	*			trans	-58.5	124.9	172.6	22.9	-29.4	0	0	0	107.6	I407 M411	I407-P409 WeakPolarHBondContact O-CD 3.48Å; P409-M411 PolarHBondContact O-N 3.25Å
410	K	42.7	Very low	46.1	Very low	205 Å²	205	127.6 Å²	127.6	89%	0.891	64%	0.638	S	S	*	*			trans	-56.7	105.3	171.6	-69.3	-176.8	179	-178.9	0	107.2	I408 H412	I408-K410 PolarHBondContact O-N 2.82Å; I408-K410 VanDerWaalsContact O-N 3.15Å; K410-H412 PolarHBondContact O-N 3.07Å
411	M	39.2	Very low	44.7	Very low	179 Å²	179	131.2 Å²	131.2	88%	0.882	66%	0.658	S	S	*	*			trans	-61.7	134.3	160.8	-81.2	-169.7	155.8	0	0	106.3	P409 K413	P409-M411 PolarHBondContact O-N 3.25Å; M411-K413 PolarHBondContact O-N 3.34Å
412	H	38.3	Very low	43.8	Very low	185 Å²	185	132.3 Å²	132.3	86%	0.856	67%	0.672	S	S	*	*			trans	-58.4	112.7	164.5	-83.6	-49.5	0	0	0	106.7	K410 Y414	K410-H412 PolarHBondContact O-N 3.07Å; H412-Y414 PolarHBondContact O-N 2.69Å
413	K	33.1	Very low	42.7	Very low	159 Å²	159	139.3 Å²	139.3	69%	0.691	71%	0.705	S	S	*	*			trans	-53.3	111	164.5	-98.4	-170.7	167.7	-155.2	0	106.1	M411 H415 D416	M411-K413 PolarHBondContact O-N 3.34Å; K413-H415 PolarHBondContact O-N 3.23Å; K413-D416 IonicContact NZ-OD1 3.64Å; K413-D416 PolarHBondContact NZ-OD1 3.44Å; K413-D416 IonicContact NZ-OD2 3.65Å; K413-D416 PolarHBondContact NZ-OD2 3.35Å
414	Y	33.9	Very low	41.7	Very low	227 Å²	227	138.9 Å²	138.9	89%	0.89	71%	0.71	S	S	*	*			trans	-58.3	131.4	149.6	-93.1	-92.4	0	0	0	106.3	H412	H412-Y414 PolarHBondContact O-N 2.69Å
415	H	38.3	Very low	41.1	Very low	175 Å²	175	142.1 Å²	142.1	81%	0.81	73%	0.726	S	S	*	*			trans	-41.6	136.7	-171.1	-124.8	-94.5	0	0	0	113.1	K413 L417	K413-H415 PolarHBondContact O-N 3.23Å; H415-L417 PolarHBondContact O-N 3.13Å
416	D	35.5	Very low	40.6	Very low	111 Å²	111	144.4 Å²	144.4	59%	0.594	73%	0.726	S	S	*	*			trans	-49.7	108.5	169.7	-63.3	-54.3	0	0	0	109.7	K413	K413-D416 IonicContact NZ-OD1 3.64Å; K413-D416 PolarHBondContact NZ-OD1 3.44Å; K413-D416 IonicContact NZ-OD2 3.65Å; K413-D416 PolarHBondContact NZ-OD2 3.35Å
417	L	39.5	Very low	39.9	Very low	156 Å²	156	147.8 Å²	147.8	82%	0.817	74%	0.741	S	S	*	*			trans	-107.9	9.8	167	-151.9	81.7	0	0	0	112	H415	H415-L417 PolarHBondContact O-N 3.13Å
418	D	39.6	Very low	39.1	Very low	146 Å²	146	153.1 Å²	153.1	78%	0.781	77%	0.768	S	S	*	*	S	Bend	trans	-97.7	2.5	178.7	-69.6	-27.4	0	0	0	113.2
419	G	40	Very low	38.3	Very low	59 Å²	59	152.2 Å²	152.2	61%	0.608	78%	0.775	S	S	*	*	S	Bend	trans	-81.9	-12.5	179.1	0	0	0	0	0	115.6
420	Y	36.1	Very low	37.6	Very low	216 Å²	216	153.3 Å²	153.3	85%	0.847	80%	0.796	S	S	*	*	S	Bend	trans	-99.1	-5.9	-172.8	-100.6	-89.7	0	0	0	115
421	L	38.6	Very low	37.1	Very low	155 Å²	155	151 Å²	151	81%	0.812	79%	0.793	S	S	*	*	S	Bend	trans	-101.6	-2.4	-178.6	-92.8	153.8	0	0	0	114.7
422	S	42.1	Very low	37	Very low	110 Å²	110	150.7 Å²	150.7	77%	0.769	79%	0.794	S	S	*	*	S	Bend	trans	-102.3	11.2	-175.7	-61.6	0	0	0	0	114.9
423	Q	37.4	Very low	36.7	Very low	164 Å²	164	146.8 Å²	146.8	77%	0.766	79%	0.787	S	S	*	*	S	Bend	trans	-101.9	7.8	-176.1	-112.2	174	0.3	0	0	115.9
424	H	36.7	Very low	36.7	Very low	177 Å²	177	150.9 Å²	150.9	82%	0.819	80%	0.798	S	S	*	*			trans	-144	90.3	174.9	-90.2	-75.2	0	0	0	112.4
425	S	37.3	Very low	36.7	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	79%	0.794	S	S	*	*			trans	-167.5	94.5	141.4	44.7	0	0	0	0	111.3
426	H	38.4	Very low	36.4	Very low	164 Å²	164	144 Å²	144	76%	0.759	79%	0.792	S	S	*	*			trans	33.4	115.3	140.3	-67.5	-78.6	0	0	0	121
427	N	34.9	Very low	36.4	Very low	140 Å²	140	146.6 Å²	146.6	75%	0.749	81%	0.806	S	S	*	*				26.9	121.7	119	-66.2	-8.8	0	0	0	117.8
428	I	38.1	Very low	36.2	Very low	175 Å²	175	146.2 Å²	146.2	90%	0.897	80%	0.803	S	S	*	*				-174.6	133.9	112.9	-87.5	150.4	0	0	0	109.2
429	S	33.7	Very low	36	Very low	125 Å²	125	147.3 Å²	147.3	87%	0.874	81%	0.808	S	S	*	*			trans	-73.8	162.2	-172.7	-47.7	0	0	0	0	115.4
430	G	36.6	Very low	35.8	Very low	79 Å²	79	153.2 Å²	153.2	81%	0.814	82%	0.817	S	S	*	*			trans	159	102.1	155.5	0	0	0	0	0	115.1
431	D	31.7	Very low	35.7	Very low	156 Å²	156	150.5 Å²	150.5	83%	0.834	82%	0.818	S	S	*	*			trans	-59.4	154.4	175.2	-66.2	-56.7	0	0	0	114.6
432	I	36.6	Very low	35.7	Very low	173 Å²	173	148.9 Å²	148.9	89%	0.887	82%	0.817	S	S	*	*				175.9	143.7	124.3	-84.2	153.6	0	0	0	111.4
433	S	33.4	Very low	35.6	Very low	102 Å²	102	149.8 Å²	149.8	71%	0.713	82%	0.82	S	S	*	*			trans	-85.2	161.3	-160.2	-22.5	0	0	0	0	117.5
434	R	32.3	Very low	35.6	Very low	245 Å²	245	145 Å²	145	93%	0.925	82%	0.815	S	S	*	*			trans	71.4	119	140.6	-102	176.7	173.2	174.7	-1.2	120.3
435	S	34.7	Very low	35.4	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	82%	0.819	S	S	*	*				158	145.1	100.3	-171	0	0	0	0	112.5
436	N	31.2	Very low	35.6	Very low	144 Å²	144	148.6 Å²	148.6	77%	0.77	82%	0.82	S	S	*	*			trans	-65.6	148.1	-176.7	-61.5	-38	0	0	0	114.1
437	N	35.8	Very low	35.4	Very low	166 Å²	166	151.5 Å²	151.5	89%	0.888	82%	0.824	S	S	*	*				-164.9	143.7	125.4	-101.2	-23.4	0	0	0	112.9
438	I	34.6	Very low	35.7	Very low	147 Å²	147	153 Å²	153	75%	0.754	83%	0.831	S	S	*	*			trans	-81.7	135.6	-175.9	-67.6	160.3	0	0	0	108.9
439	D	35.4	Very low	35.8	Very low	169 Å²	169	153.8 Å²	153.8	90%	0.904	83%	0.831	S	S	*	*			trans	-154.9	136.3	147.3	-100.8	-31	0	0	0	112.6
440	K	35.2	Very low	35.9	Very low	183 Å²	183	157 Å²	157	80%	0.796	83%	0.832	S	S	*	*			trans	-92.2	133.3	-179.1	-70.7	172.4	174.7	173.5	0	109.9
441	N	35.3	Very low	35.8	Very low	160 Å²	160	157.3 Å²	157.3	86%	0.856	84%	0.836	S	S	*	*			trans	178.5	134.5	137.8	-90.6	-25	0	0	0	110.3
442	P	37.7	Very low	36	Very low	121 Å²	121	153.7 Å²	153.7	79%	0.786	84%	0.836	S	S	*	*			trans	-97.2	151	176.3	37.3	-29.6	0	0	0	111.3
443	P	40.7	Very low	36	Very low	128 Å²	128	152.4 Å²	152.4	83%	0.831	84%	0.836	S	S	*	*			trans	-151.1	163.6	138.3	33.1	-14.3	0	0	0	115.1
444	G	36.6	Very low	36.2	Very low	65 Å²	65	151.9 Å²	151.9	67%	0.67	84%	0.838	S	S	*	*				89.1	103.7	123	0	0	0	0	0	118.9
445	F	33.9	Very low	36.5	Very low	207 Å²	207	148 Å²	148	91%	0.908	84%	0.835	S	S	*	*			trans	11.2	117	130.7	-132.7	-97.5	0	0	0	117.3
446	I	41.7	Very low	36.4	Very low	158 Å²	158	149.4 Å²	149.4	81%	0.81	84%	0.839	S	S	*	*			trans	-113.9	124.4	161.1	-66.5	174.2	0	0	0	109.1
447	R	33	Very low	36.8	Very low	225 Å²	225	154.1 Å²	154.1	85%	0.849	85%	0.846	S	S	*	*			trans	-82.1	137.8	174.6	-167.7	-178.2	-170.1	173.9	0.7	108.1
448	L	41.1	Very low	36.8	Very low	171 Å²	171	155.2 Å²	155.2	90%	0.895	85%	0.846	S	S	*	*			trans	-129.3	142.5	159.1	-83.5	171.5	0	0	0	110.2
449	E	41.1	Very low	37.1	Very low	192 Å²	192	159.9 Å²	159.9	90%	0.897	85%	0.854	S	S	*	*			trans	-90.3	175.3	-156.8	-141.4	175.3	156.1	0	0	113
450	E	36.4	Very low	37.4	Very low	191 Å²	191	157.7 Å²	157.7	89%	0.893	85%	0.849	S	S	*	*			trans	-79.4	156.4	-169.3	-64	176.8	150	0	0	115.3
451	G	33.5	Very low	37.6	Very low	86 Å²	86	155.5 Å²	155.5	89%	0.887	85%	0.851	S	S	*	*			trans	98.8	115.7	145.3	0	0	0	0	0	117.6
452	G	35.6	Very low	38.3	Very low	81 Å²	81	153.7 Å²	153.7	84%	0.835	85%	0.848	S	S	*	*			trans	167.1	92.2	165	0	0	0	0	0	114.4
453	T	36	Very low	38.7	Very low	146 Å²	146	153.7 Å²	153.7	90%	0.896	85%	0.85	S	S	*	*			trans	-71.6	128.4	173.8	47.9	0	0	0	0	112.3
454	A	38.9	Very low	38.7	Very low	91 Å²	91	152.3 Å²	152.3	75%	0.752	85%	0.85	S	S	*	*			trans	-164.3	113.1	155.1	0	0	0	0	0	114.1
455	N	37.9	Very low	39.2	Very low	162 Å²	162	155.2 Å²	155.2	87%	0.866	86%	0.857	S	S	*	*			trans	50.5	111.7	141.4	-59.6	-20	0	0	0	121.8
456	V	33.2	Very low	39.5	Very low	145 Å²	145	152.2 Å²	152.2	88%	0.879	86%	0.856	S	S	*	*			trans	-63.5	122.1	162.8	177.3	0	0	0	0	110.6
457	R	38.5	Very low	39.1	Very low	242 Å²	242	154.3 Å²	154.3	91%	0.913	86%	0.859	S	S	*	*			trans	-124.1	121.3	161	-97.9	-177.2	172.6	174.9	-1.8	109.7
458	Q	37.6	Very low	39.5	Very low	190 Å²	190	149 Å²	149	89%	0.888	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-56	137.4	171.2	-72.8	166.4	-36.3	0	0	110.8
459	R	40.1	Very low	39.2	Very low	245 Å²	245	147.8 Å²	147.8	93%	0.925	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-95.9	134.8	164.9	-79.2	-170.1	-161.3	-166	4.5	110.5
460	P	41.6	Very low	39	Very low	122 Å²	122	146.5 Å²	146.5	79%	0.792	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-79.4	160.1	178.1	32.3	-33	0	0	0	112.9
461	V	39.9	Very low	39	Very low	138 Å²	138	142.5 Å²	142.5	84%	0.836	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-76.8	135.8	179.5	-163.9	0	0	0	0	110.5
462	P	49.9	Very low	39.3	Very low	122 Å²	122	146.2 Å²	146.2	79%	0.792	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-96.4	129.7	174.9	29.8	-21.7	0	0	0	112.9
463	S	46.1	Very low	39.2	Very low	120 Å²	120	147.6 Å²	147.6	84%	0.839	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-70.9	149	169.3	-47.4	0	0	0	0	112
464	A	40.7	Very low	39.2	Very low	100 Å²	100	146.4 Å²	146.4	83%	0.826	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-81.5	144.9	-179.9	0	0	0	0	0	113.2
465	P	46.2	Very low	38.9	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-101.8	155.2	166	15.9	3.1	0	0	0	113.8
466	T	40.8	Very low	38.6	Very low	145 Å²	145	149.1 Å²	149.1	89%	0.89	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-77.7	150.1	-172.1	43.3	0	0	0	0	115.5
467	F	33.2	Very low	38.5	Very low	202 Å²	202	151.1 Å²	151.1	89%	0.886	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-73.6	146.7	176.1	-91.5	-97.8	0	0	0	113.7
468	S	40.6	Very low	38.2	Very low	114 Å²	114	150.6 Å²	150.6	80%	0.797	82%	0.824	S	S	*	*			trans	-133.7	127	153.3	76.2	0	0	0	0	110.2
469	D	36.4	Very low	37.8	Very low	145 Å²	145	145.7 Å²	145.7	78%	0.775	82%	0.816	S	S	*	*			trans	-71.8	141.9	179.4	-67.3	-48	0	0	0	113
470	N	36	Very low	37.5	Very low	164 Å²	164	140.9 Å²	140.9	88%	0.877	81%	0.814	S	S	*	*			trans	-155	139.6	146.7	-90.7	-34.6	0	0	0	109.9
471	P	37.3	Very low	36.8	Very low	108 Å²	108	138.7 Å²	138.7	70%	0.701	81%	0.814	S	S	*	*			trans	-98.3	176.8	-166.7	39	-33.3	0	0	0	113.2
472	I	38.9	Very low	36.3	Very low	163 Å²	163	139.7 Å²	139.7	84%	0.836	81%	0.812	S	S	*	*			trans	138.6	144	161.9	-73.1	153.2	0	0	0	110
473	P	33.3	Very low	35.4	Very low	110 Å²	110	143.4 Å²	143.4	71%	0.714	82%	0.816	S	S	*	*			cis	-132.8	-172	-39.4	39	-17	0	0	0	111.4
474	P	36	Very low	34.6	Very low	122 Å²	122	145.7 Å²	145.7	79%	0.792	82%	0.819	S	S	*	*			trans	-99	170.8	-163.4	38.4	-32.4	0	0	0	116.3
475	A	32.1	Very low	34.4	Very low	75 Å²	75	145.4 Å²	145.4	62%	0.62	81%	0.811	S	S	*	*			trans	89.4	108.1	152	0	0	0	0	0	119.5
476	Y	32	Very low	33.8	Very low	234 Å²	234	148.2 Å²	148.2	92%	0.918	81%	0.813	S	S	*	*				-138.8	105.6	127.7	-68.6	-75.8	0	0	0	108.8
477	Q	31.6	Very low	33.6	Very low	188 Å²	188	147.7 Å²	147.7	88%	0.879	80%	0.804	S	S	*	*			trans	-77.3	127.3	166.4	-84.7	171.2	-28.1	0	0	109.1
478	Y	31.1	Very low	33.7	Very low	231 Å²	231	145.7 Å²	145.7	91%	0.906	79%	0.792	S	S	*	*			trans	-111.6	113.8	145.5	-85.5	-82.4	0	0	0	107.7
479	A	30.3	Very low	33.5	Very low	87 Å²	87	143.5 Å²	143.5	72%	0.719	78%	0.775	S	S	*	*			trans	-72.9	135.3	169.2	0	0	0	0	0	109.6
480	T	33.2	Very low	33.4	Very low	143 Å²	143	143 Å²	143	88%	0.877	77%	0.771	S	S	*	*				-177.5	127.8	123.8	40	0	0	0	0	107.6
481	G	27	Very low	33.7	Very low	77 Å²	77	139.3 Å²	139.3	79%	0.794	76%	0.758	S	S	*	*			trans	-80.1	140.2	-158.2	0	0	0	0	0	115.2
482	I	30.2	Very low	34	Very low	158 Å²	158	138.8 Å²	138.8	81%	0.81	75%	0.753	S	S	*	*			trans	-135.1	117.2	145	-62.6	-179.2	0	0	0	103.8	D484	I482-D484 PolarHBondContact O-N 3.31Å
483	K	30	Very low	34.1	Very low	200 Å²	200	136.8 Å²	136.8	87%	0.87	75%	0.748	S	S	*	*			trans	-49.5	122.7	176.2	-81.9	176.8	171.4	179	0	109.1	S485	K483-S485 PolarHBondContact O-N 2.81Å
484	D	29.6	Very low	33.9	Very low	168 Å²	168	141.7 Å²	141.7	90%	0.898	75%	0.752	S	S	*	*			trans	-59.7	99	165	-69.1	-49.2	0	0	0	108.1	I482	I482-D484 PolarHBondContact O-N 3.31Å
485	S	37.5	Very low	33.8	Very low	95 Å²	95	143.9 Å²	143.9	66%	0.664	76%	0.757	S	S	*	*			trans	-86.1	116.2	160.6	58.5	0	0	0	0	107	K483 I487	K483-S485 PolarHBondContact O-N 2.81Å; S485-I487 WeakPolarHBondContact O-CG1 3.27Å; S485-I487 PolarHBondContact O-N 3.26Å
486	E	32.5	Very low	33.9	Very low	183 Å²	183	148.7 Å²	148.7	86%	0.855	77%	0.769	S	S	*	*			trans	-38.2	109.8	172.5	-65.6	172.9	149	0	0	110.9	Y488	E486-Y488 PolarHBondContact O-N 3.16Å
487	I	36.3	Very low	34.1	Very low	135 Å²	135	143.4 Å²	143.4	69%	0.692	76%	0.763	S	S	*	*			trans	-86.1	70.1	178.2	-52.3	178.6	0	0	0	107.8	S485	S485-I487 WeakPolarHBondContact O-CG1 3.27Å; S485-I487 PolarHBondContact O-N 3.26Å
488	Y	36.3	Very low	34.3	Very low	160 Å²	160	145.4 Å²	145.4	63%	0.627	76%	0.763	S	S	*	*			trans	-146	116.9	157.3	-76	-74.6	0	0	0	108.3	E486 L490	E486-Y488 PolarHBondContact O-N 3.16Å; Y488-L490 PolarHBondContact O-N 3.34Å; Y488-L490 VanDerWaalsContact O-N 3.17Å
489	P	35.3	Very low	34.6	Very low	68 Å²	68	141.4 Å²	141.4	44%	0.442	76%	0.757	S	S	.	*			trans	-69.3	117.7	169.6	28.2	-30.7	0	0	0	108.5	S491	P489-S491 PolarHBondContact O-N 3.09Å
490	L	35.8	Very low	34.8	Very low	134 Å²	134	143.6 Å²	143.6	70%	0.702	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-58.7	10.6	170.3	-98.3	155.1	0	0	0	114	Y488	Y488-L490 PolarHBondContact O-N 3.34Å; Y488-L490 VanDerWaalsContact O-N 3.17Å
491	S	40.8	Very low	34.7	Very low	86 Å²	86	142.8 Å²	142.8	60%	0.601	76%	0.759	S	S	*	*	G	3₁₀ helix	trans	-88	-1.8	-178.2	57.6	0	0	0	0	114.5	P489	P489-S491 PolarHBondContact O-N 3.09Å
492	V	44.7	Very low	35.1	Very low	98 Å²	98	146 Å²	146	59%	0.594	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-101.2	0.2	176.2	-172.6	0	0	0	0	112.7
493	V	39.6	Very low	35.2	Very low	120 Å²	120	147.3 Å²	147.3	73%	0.727	77%	0.766	S	S	*	*			trans	-123.7	49.3	179.4	-165.9	0	0	0	0	111.2
494	R	30.9	Very low	35.2	Very low	213 Å²	213	143.1 Å²	143.1	80%	0.804	76%	0.761	S	S	*	*			trans	-115.9	85.2	165.8	-79.7	-171.9	-156.7	166	6.6	109.7
495	N	33.6	Very low	35.4	Very low	168 Å²	168	140.8 Å²	140.8	90%	0.898	76%	0.758	S	S	*	*			trans	-161.6	65.4	153.1	-89.7	-17.8	0	0	0	107.4
496	M	33.7	Very low	35.1	Very low	176 Å²	176	143.4 Å²	143.4	87%	0.867	77%	0.765	S	S	*	*	S	Bend	trans	-155.8	132.5	164.5	-115.7	176.4	-179	0	0	108.5
497	P	35.2	Very low	35.1	Very low	124 Å²	124	141.7 Å²	141.7	81%	0.805	76%	0.762	S	S	*	*			trans	-73.5	131.2	-179	23.8	-19.5	0	0	0	109.9
498	R	36.2	Very low	35	Very low	229 Å²	229	140.9 Å²	140.9	86%	0.864	76%	0.763	S	S	*	*			trans	-108.1	113	172.9	-80.1	-175.3	-178.3	173.9	-0.1	108.6
499	D	37.2	Very low	34.9	Very low	147 Å²	147	138.5 Å²	138.5	79%	0.786	77%	0.765	S	S	*	*			trans	-111.9	139.9	164.5	-80.7	-38	0	0	0	111
500	T	34.8	Very low	34.7	Very low	134 Å²	134	142.2 Å²	142.2	82%	0.822	78%	0.781	S	S	*	*			trans	86.4	123.4	163.9	64.6	0	0	0	0	120.5
501	P	32.1	Very low	34.6	Very low	125 Å²	125	140.9 Å²	140.9	81%	0.812	78%	0.783	S	S	*	*			trans	-95.6	151.9	176.5	37.5	-30.1	0	0	0	111.7
502	V	34.4	Very low	34.3	Very low	146 Å²	146	143.9 Å²	143.9	89%	0.885	79%	0.791	S	S	*	*			trans	-128.6	125.2	169.9	179	0	0	0	0	110.6
503	E	33.4	Very low	33.9	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	80%	0.797	S	S	*	*			trans	-62.5	151.1	174.6	-91.4	169.7	136.8	0	0	114.1
504	S	28.7	Very low	33.7	Very low	112 Å²	112	146.2 Å²	146.2	78%	0.783	80%	0.801	S	S	*	*			trans	-60.6	131.7	167.5	52.2	0	0	0	0	113.4
505	S	33.5	Very low	33.7	Very low	119 Å²	119	142 Å²	142	83%	0.832	80%	0.801	S	S	*	*			trans	-167.9	142.6	136.8	42.8	0	0	0	0	111.8
506	N	31.8	Very low	33.7	Very low	150 Å²	150	143.8 Å²	143.8	80%	0.802	80%	0.801	S	S	*	*			trans	-72.7	161.5	-173.8	-69.9	-40.2	0	0	0	113.3
507	N	32.9	Very low	33.4	Very low	148 Å²	148	144.9 Å²	144.9	79%	0.791	80%	0.801	S	S	*	*			trans	91.3	114.5	146.8	-72.4	-9.3	0	0	0	119.9
508	V	34.4	Very low	33.6	Very low	117 Å²	117	146.5 Å²	146.5	71%	0.709	80%	0.801	S	S	*	*				96.2	103.5	125.1	175.2	0	0	0	0	117.8
509	T	33.1	Very low	33.4	Very low	110 Å²	110	142.3 Å²	142.3	68%	0.675	80%	0.795	S	S	*	*			trans	66.2	121.6	140.7	53.6	0	0	0	0	122.9
510	N	31.7	Very low	33.5	Very low	147 Å²	147	143 Å²	143	79%	0.786	80%	0.8	S	S	*	*				85.6	132.3	126.6	-70.1	-9.8	0	0	0	122.1
511	S	34.2	Very low	33.5	Very low	106 Å²	106	143.5 Å²	143.5	74%	0.741	80%	0.797	S	S	*	*			trans	80.6	103.8	155.3	77.2	0	0	0	0	116.4
512	I	35	Very low	33.6	Very low	148 Å²	148	145.6 Å²	145.6	76%	0.759	80%	0.799	S	S	*	*				89	121.6	78.3	-75.1	165.4	0	0	0	112.4
513	N	35.1	Very low	33.4	Very low	137 Å²	137	145.8 Å²	145.8	73%	0.733	79%	0.794	S	S	*	*			trans	97.6	109.6	152.6	-71.3	-14.8	0	0	0	123.2
514	T	35.4	Very low	33.5	Very low	131 Å²	131	143 Å²	143	80%	0.804	79%	0.79	S	S	*	*			trans	86.2	135.8	131.3	55.9	0	0	0	0	121.9
515	P	31.1	Very low	33.9	Very low	124 Å²	124	146.1 Å²	146.1	81%	0.805	79%	0.791	S	S	*	*			trans	-101.9	152.5	-171	39.4	-31.9	0	0	0	114.4
516	K	32.9	Very low	33.9	Very low	205 Å²	205	148.9 Å²	148.9	89%	0.891	79%	0.791	S	S	*	*			trans	-133.8	130.9	165.4	-90.3	-176	176.6	178.4	0	111.6
517	K	29.2	Very low	34.1	Very low	200 Å²	200	150.9 Å²	150.9	87%	0.87	79%	0.793	S	S	*	*			trans	-63.2	148.6	161.1	-82.6	177.1	166.1	-176.2	0	110.8
518	I	38.2	Very low	34.3	Very low	158 Å²	158	152.3 Å²	152.3	81%	0.81	80%	0.795	S	S	*	*			trans	-154.4	132.9	146.5	-87.2	136.4	0	0	0	108
519	D	32	Very low	34.2	Very low	140 Å²	140	152 Å²	152	75%	0.749	80%	0.795	S	S	*	*			trans	-72.7	162.3	173.2	-63.8	-55.1	0	0	0	112.1
520	D	40.2	Very low	34.3	Very low	163 Å²	163	154 Å²	154	87%	0.872	80%	0.801	S	S	*	*			trans	-163.7	140.8	140.5	-94.6	-28.1	0	0	0	113.7
521	N	33.4	Very low	34.5	Very low	144 Å²	144	152.6 Å²	152.6	77%	0.77	79%	0.793	S	S	*	*			trans	-83	153	-170.9	-69.9	-58	0	0	0	114.4
522	I	35.6	Very low	34.7	Very low	168 Å²	168	156.8 Å²	156.8	86%	0.862	80%	0.798	S	S	*	*			trans	-138.8	125.6	151.2	-61	-177.9	0	0	0	110.6
523	I	29.7	Very low	34.6	Very low	151 Å²	151	156.1 Å²	156.1	77%	0.774	80%	0.801	S	S	*	*			trans	-104.4	138.3	174.3	-65.4	168.2	0	0	0	108.5
524	V	36.4	Very low	34.7	Very low	126 Å²	126	154.4 Å²	154.4	76%	0.764	80%	0.797	S	S	*	*			trans	-140.6	107.7	158.2	179.3	0	0	0	0	111.6
525	H	36.6	Very low	34.9	Very low	176 Å²	176	157.2 Å²	157.2	82%	0.815	80%	0.798	S	S	*	*			trans	48.2	114.8	140.4	-70.6	-75.2	0	0	0	124.4
526	E	32	Very low	35.1	Very low	177 Å²	177	162.6 Å²	162.6	83%	0.827	80%	0.804	S	S	*	*			trans	-65.6	144.6	158.1	177.5	179.2	-174.2	0	0	114.2
527	K	37.3	Very low	36	Very low	193 Å²	193	158.3 Å²	158.3	84%	0.839	80%	0.795	S	S	*	*			trans	-165	129.5	136.9	-110.2	177.6	-175.3	-175.4	0	114.3
528	E	36.4	Very low	36.4	Very low	178 Å²	178	154.6 Å²	154.6	83%	0.832	79%	0.792	S	S	*	*			trans	88.4	110.9	152.7	-78.8	179.7	157	0	0	122.2
529	P	32.8	Very low	37.1	Very low	111 Å²	111	152.9 Å²	152.9	72%	0.721	79%	0.789	S	S	*	*			trans	-108.5	151.5	160.7	37.9	-26.6	0	0	0	112.5
530	L	35.5	Very low	37.6	Very low	151 Å²	151	155.2 Å²	155.2	79%	0.791	80%	0.795	S	S	*	*			trans	167.4	131.6	151.8	-112.3	80.8	0	0	0	105.2
531	N	36.3	Very low	37.8	Very low	118 Å²	118	157.9 Å²	157.9	63%	0.631	82%	0.817	S	S	*	*			cis	-171.5	134.3	45.9	-118.4	-23.5	0	0	0	110.8
532	K	37.7	Very low	38	Very low	193 Å²	193	158.6 Å²	158.6	84%	0.839	82%	0.819	S	S	*	*			trans	46	114.6	134.2	-63.7	178.2	-178.6	179.2	0	122.4
533	V	33.4	Very low	38.1	Very low	135 Å²	135	158.1 Å²	158.1	82%	0.818	82%	0.817	S	S	*	*			trans	-80.5	177.2	151.5	172.6	0	0	0	0	108.9
534	P	37.4	Very low	38.6	Very low	100 Å²	100	158.5 Å²	158.5	65%	0.649	82%	0.819	S	S	*	*			cis	-131.6	176.1	-11.3	20.6	4.3	0	0	0	115.5
535	K	38.2	Very low	38.7	Very low	190 Å²	190	160.4 Å²	160.4	83%	0.826	82%	0.822	S	S	*	*				148.2	124.7	121.7	-81.7	179.3	179.9	179.4	0	112.2
536	Y	36.6	Very low	38.8	Very low	237 Å²	237	159.4 Å²	159.4	93%	0.929	82%	0.823	S	S	*	*			trans	-108.9	132.9	157	-109	-90.2	0	0	0	107.6
537	T	50.7	Low	39.3	Very low	115 Å²	115	158.3 Å²	158.3	71%	0.706	82%	0.823	S	S	*	*			trans	-122.4	139.2	168.5	43.1	0	0	0	0	108.6
538	P	38.1	Very low	39.4	Very low	123 Å²	123	155.8 Å²	155.8	80%	0.799	82%	0.821	S	S	*	*			trans	-101.8	135.8	170.2	35.1	-25.1	0	0	0	111.4
539	T	52.9	Low	39.6	Very low	122 Å²	122	154.1 Å²	154.1	75%	0.748	82%	0.821	S	S	*	*			trans	-148.1	109.8	164.3	44.4	0	0	0	0	107.4
540	E	41.4	Very low	40.2	Very low	188 Å²	188	157.7 Å²	157.7	88%	0.879	83%	0.829	S	S	*	*				65.4	99.8	108.1	-73.5	-171.1	167.4	0	0	114.8
541	V	44.3	Very low	40.6	Very low	220 Å²	220	158.3 Å²	158.3	100%	1.333	83%	0.833	S	S	*	*				-145.6	0	124.4	178.6	0	0	0	0	107.3

Retrieved 541 of 541 residues in 624.9 ms (Link to these results)

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