A0A096NIQ6_PAPAN Loading...

Membrane bound O-acyltransferase domain containing 2

AlphaFold DB , UniProt , Accession A0A096NIQ6, Species PAPAN (Papio anubis, Olive baboon), Gene MBOAT2, Length 520 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	66.3	Low	244 Å²	244	93.7 Å²	93.7	100%	1.202	57%	0.572	S	S	*	*				0	94.9	0	-77.1	175.6	-176.4	0	0	107.6
2	A	28.8	Very low	68.7	Low	95 Å²	95	88.6 Å²	88.6	79%	0.785	54%	0.538	S	S	*	.			trans	-78.3	120.6	165.6	0	0	0	0	0	106.3	T4	A2-T4 VanDerWaalsContact C-N 3.33Å; A2-T4 PolarHBondContact O-N 2.91Å
3	T	35.6	Very low	70.6	Confident	140 Å²	140	86.8 Å²	86.8	86%	0.859	52%	0.52	S	S	*	.			trans	-67.9	92.2	173.7	44.3	0	0	0	0	108	S5	T3-S5 PolarHBondContact O-N 3.3Å; T3-S5 VanDerWaalsContact O-N 3.09Å
4	T	49.9	Very low	72.4	Confident	94 Å²	94	87.4 Å²	87.4	58%	0.577	53%	0.527	S	S	*	.			trans	-63	110.7	164	41.6	0	0	0	0	106.8	A2 T6	A2-T4 VanDerWaalsContact C-N 3.33Å; A2-T4 PolarHBondContact O-N 2.91Å; T4-T6 PolarHBondContact O-N 3.35Å
5	S	61.7	Low	73.8	Confident	104 Å²	104	86.5 Å²	86.5	73%	0.727	52%	0.518	S	S	*	.			trans	-65	104.8	175.5	56.1	0	0	0	0	107.9	T3	T3-S5 PolarHBondContact O-N 3.3Å; T3-S5 VanDerWaalsContact O-N 3.09Å
6	T	71.6	Confident	74.9	Confident	34 Å²	34	81.5 Å²	81.5	21%	0.209	49%	0.488	C	S	.	.			trans	-60.9	138.8	170	-178.1	0	0	0	0	109.3	T4 G8 T10 I23	T4-T6 PolarHBondContact O-N 3.35Å; T6-G8 VanDerWaalsContact C-N 3.29Å; T6-G8 PolarHBondContact OG1-N 2.92Å; T6-T10 HydrophobicContact CG2-CG2 3.74Å; T6-I23 HydrophobicContact CG2-CG1 4.44Å; T6-I23 HydrophobicContact CG2-CG2 3.63Å
7	T	81.9	Confident	76	Confident	53 Å²	53	83 Å²	83	33%	0.325	49%	0.493	S	S	.	.	S	Bend	trans	-81.7	-15.9	175.4	67.4	0	0	0	0	111.9	F72 G73 Y75	T7-F72 CarbonylContact C-O 3.52Å; T7-F72 WeakPolarHBondContact CB-O 3.5Å; T7-F72 CarbonylContact O-C 3.57Å; T7-F72 PolarHBondContact OG1-O 3.21Å; T7-G73 VanDerWaalsContact O-CA 3.23Å; T7-G73 WeakPolarHBondContact O-CA 3.48Å; T7-G73 PolarHBondContact O-N 3Å; T7-Y75 VanDerWaalsContact CB-CD2 3.45Å; T7-Y75 HydrophobicContact CG2-CD2 3.56Å; T7-Y75 HydrophobicContact CG2-CE2 3.31Å; T7-Y75 HydrophobicContact CG2-CG 4.44Å
8	G	87.8	Confident	76.9	Confident	13 Å²	13	82.8 Å²	82.8	13%	0.134	50%	0.502	C	S	.	.	S	Bend	trans	-94.8	-163.7	-179.5	0	0	0	0	0	114.5	T6 C71	T6-G8 VanDerWaalsContact C-N 3.29Å; T6-G8 PolarHBondContact OG1-N 2.92Å; G8-C71 WeakPolarHBondContact CA-O 3.43Å
9	S	91.9	Very high	77.5	Confident	31 Å²	31	82.3 Å²	82.3	22%	0.217	50%	0.499	C	S	.	.			trans	-63.1	138.4	179.3	-176.9	0	0	0	0	112.4	L11 N27 F70	S9-L11 VanDerWaalsContact OG-CB 3.28Å; S9-L11 WeakPolarHBondContact OG-CB 3.48Å; S9-L11 PolarHBondContact OG-N 3.21Å; S9-N27 PolarHBondContact O-ND2 3.32Å; S9-F70 WeakPolarHBondContact CB-O 3.22Å; S9-F70 PolarHBondContact N-O 3.48Å; S9-F70 WeakPolarHBondContact OG-CE2 3.32Å
10	T	93.4	Very high	78.1	Confident	95 Å²	95	87 Å²	87	58%	0.583	52%	0.515	S	S	*	.			trans	-97.2	3.9	171.3	55.4	0	0	0	0	112.6	T6 L12 Q13	T6-T10 HydrophobicContact CG2-CG2 3.74Å; T10-L12 PolarHBondContact O-N 3.36Å; T10-L12 VanDerWaalsContact O-N 3.15Å; T10-Q13 VanDerWaalsContact O-CB 3.26Å; T10-Q13 WeakPolarHBondContact O-CB 3.44Å; T10-Q13 PolarHBondContact O-N 3.39Å
11	L	94.3	Very high	78.5	Confident	128 Å²	128	85.4 Å²	85.4	67%	0.67	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-34.3	-177.3	-172.7	73.7	0	0	0	112.6	S9 Q13 F70	S9-L11 VanDerWaalsContact OG-CB 3.28Å; S9-L11 WeakPolarHBondContact OG-CB 3.48Å; S9-L11 PolarHBondContact OG-N 3.21Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-Q13 PolarHBondContact O-N 3.18Å; L11-F70 HydrophobicContact CD2-CE2 4.2Å; L11-F70 HydrophobicContact CD2-CZ 4.49Å
12	L	94.7	Very high	81.2	Confident	32 Å²	32	76.6 Å²	76.6	17%	0.168	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	13.3	-178.3	-57.6	179.8	0	0	0	113.4	T10 P14 L15 S16 I23 V26 N27 V30 F70	T10-L12 PolarHBondContact O-N 3.36Å; T10-L12 VanDerWaalsContact O-N 3.15Å; L12-P14 VanDerWaalsContact C-CD 3.44Å; L12-P14 VanDerWaalsContact C-N 3.34Å; L12-L15 WeakPolarHBondContact O-CB 3.45Å; L12-L15 PolarHBondContact O-N 3.01Å; L12-S16 PolarHBondContact O-N 3.46Å; L12-I23 HydrophobicContact CB-CD1 3.82Å; L12-V26 HydrophobicContact CB-CG1 4.12Å; L12-V26 HydrophobicContact CD1-CG1 4.3Å; L12-N27 WeakPolarHBondContact CD1-OD1 2.94Å; L12-V30 HydrophobicContact CD1-CB 3.72Å; L12-V30 HydrophobicContact CD1-CG1 3.74Å; L12-V30 HydrophobicContact CD1-CG2 3.9Å; L12-F70 HydrophobicContact CD1-CE1 3.96Å; L12-F70 HydrophobicContact CD1-CZ 4.03Å; L12-F70 HydrophobicContact CG-CE1 4.45Å; L12-F70 HydrophobicContact CG-CZ 4.1Å
13	Q	93.8	Very high	84.1	Confident	65 Å²	65	72.7 Å²	72.7	30%	0.304	43%	0.431	S	S	.	.	H	α-helix	trans	-55.5	-40.4	178.3	-165.8	63	53.7	0	0	113.7	T10 L11 L15 S16 N17	T10-Q13 VanDerWaalsContact O-CB 3.26Å; T10-Q13 WeakPolarHBondContact O-CB 3.44Å; T10-Q13 PolarHBondContact O-N 3.39Å; L11-Q13 VanDerWaalsContact C-N 3.32Å; L11-Q13 PolarHBondContact O-N 3.18Å; Q13-L15 VanDerWaalsContact C-N 3.29Å; Q13-L15 PolarHBondContact O-N 3.47Å; Q13-S16 PolarHBondContact O-N 2.97Å; Q13-N17 PolarHBondContact NE2-OD1 2.81Å; Q13-N17 PolarHBondContact O-N 2.96Å; Q13-N17 PolarHBondContact O-OD1 3.5Å
14	P	95.4	Very high	86.6	Confident	96 Å²	96	67.2 Å²	67.2	62%	0.623	40%	0.396	S	S	*	.	H	α-helix	trans	-59.7	-39.7	175.4	-24.7	35.6	0	0	0	112.8	L12 A18	L12-P14 VanDerWaalsContact C-CD 3.44Å; L12-P14 VanDerWaalsContact C-N 3.34Å; P14-A18 WeakPolarHBondContact O-CB 3.5Å; P14-A18 PolarHBondContact O-N 2.91Å; P14-A18 VanDerWaalsContact O-N 3.07Å
15	L	93.3	Very high	88.5	Confident	74 Å²	74	65.9 Å²	65.9	39%	0.387	38%	0.384	S	S	.	.	H	α-helix	trans	-69.4	-44.2	177.3	-179.4	62	0	0	0	111.1	L12 Q13 N17 A18 V19 V26 V30	L12-L15 WeakPolarHBondContact O-CB 3.45Å; L12-L15 PolarHBondContact O-N 3.01Å; Q13-L15 VanDerWaalsContact C-N 3.29Å; Q13-L15 PolarHBondContact O-N 3.47Å; L15-N17 VanDerWaalsContact C-N 3.31Å; L15-N17 PolarHBondContact O-N 2.74Å; L15-A18 WeakPolarHBondContact O-CB 3.39Å; L15-A18 PolarHBondContact O-N 3.34Å; L15-A18 VanDerWaalsContact O-N 3.09Å; L15-V19 HydrophobicContact CD1-CG1 4.05Å; L15-V19 WeakPolarHBondContact O-CG2 3.27Å; L15-V19 PolarHBondContact O-N 2.9Å; L15-V26 HydrophobicContact CB-CG1 4.44Å; L15-V26 HydrophobicContact CD2-CG1 3.83Å; L15-V26 HydrophobicContact CG-CG1 4.07Å; L15-V30 HydrophobicContact CD2-CG2 4.03Å
16	S	92.4	Very high	90	Very high	6 Å²	6	61.3 Å²	61.3	4%	0.042	35%	0.351	C	S	.	.	H	α-helix	trans	-55	-45	174.4	165.3	0	0	0	0	112.3	L12 Q13 Q20 L21 I23	L12-S16 PolarHBondContact O-N 3.46Å; Q13-S16 PolarHBondContact O-N 2.97Å; S16-Q20 WeakPolarHBondContact O-CA 3.41Å; S16-Q20 PolarHBondContact O-N 3.48Å; S16-L21 WeakPolarHBondContact CB-O 3.47Å; S16-L21 PolarHBondContact O-N 3.09Å; S16-L21 PolarHBondContact OG-O 2.99Å; S16-I23 PolarHBondContact OG-N 3.17Å
17	N	92.9	Very high	91	Very high	107 Å²	107	59.7 Å²	59.7	57%	0.572	34%	0.341	S	S	*	.	H	α-helix	trans	-64.9	-39.7	175.6	-65.4	-10.9	0	0	0	112	Q13 L15	Q13-N17 PolarHBondContact NE2-OD1 2.81Å; Q13-N17 PolarHBondContact O-N 2.96Å; Q13-N17 PolarHBondContact O-OD1 3.5Å; L15-N17 VanDerWaalsContact C-N 3.31Å; L15-N17 PolarHBondContact O-N 2.74Å
18	A	92.4	Very high	91.5	Very high	79 Å²	79	58.7 Å²	58.7	65%	0.653	33%	0.333	S	S	*	.	H	α-helix	trans	-67.3	-39.3	-179.6	0	0	0	0	0	113.2	P14 L15	P14-A18 WeakPolarHBondContact O-CB 3.5Å; P14-A18 PolarHBondContact O-N 2.91Å; P14-A18 VanDerWaalsContact O-N 3.07Å; L15-A18 WeakPolarHBondContact O-CB 3.39Å; L15-A18 PolarHBondContact O-N 3.34Å; L15-A18 VanDerWaalsContact O-N 3.09Å
19	V	88.8	Confident	91.8	Very high	73 Å²	73	60 Å²	60	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-92.5	-2.9	180	-54.4	0	0	0	0	113.7	L15 L21 V26	L15-V19 HydrophobicContact CD1-CG1 4.05Å; L15-V19 WeakPolarHBondContact O-CG2 3.27Å; L15-V19 PolarHBondContact O-N 2.9Å; V19-L21 VanDerWaalsContact C-N 3.26Å; V19-L21 HydrophobicContact CG2-CB 3.85Å; V19-L21 HydrophobicContact CG2-CD1 3.98Å; V19-L21 HydrophobicContact CG2-CG 3.94Å; V19-L21 PolarHBondContact O-N 3.31Å; V19-V26 HydrophobicContact CG2-CG2 3.94Å
20	Q	88.7	Confident	92	Very high	177 Å²	177	60.9 Å²	60.9	83%	0.827	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	36.7	-177.4	-55.4	-177.3	13.1	0	0	113.9	S16	S16-Q20 WeakPolarHBondContact O-CA 3.41Å; S16-Q20 PolarHBondContact O-N 3.48Å
21	L	86.9	Confident	92.2	Very high	53 Å²	53	56.6 Å²	56.6	28%	0.277	32%	0.315	S	S	.	.			trans	-113.4	148.2	175.2	-66.3	174.2	0	0	0	110.9	S16 V19 I23 V26 L248	S16-L21 WeakPolarHBondContact CB-O 3.47Å; S16-L21 PolarHBondContact O-N 3.09Å; S16-L21 PolarHBondContact OG-O 2.99Å; V19-L21 VanDerWaalsContact C-N 3.26Å; V19-L21 HydrophobicContact CG2-CB 3.85Å; V19-L21 HydrophobicContact CG2-CD1 3.98Å; V19-L21 HydrophobicContact CG2-CG 3.94Å; V19-L21 PolarHBondContact O-N 3.31Å; L21-I23 PolarHBondContact O-N 3.27Å; L21-V26 HydrophobicContact CB-CG2 3.87Å; L21-L248 HydrophobicContact CD2-CD2 4.21Å
22	P	88.7	Confident	92.3	Very high	59 Å²	59	50.7 Å²	50.7	38%	0.383	29%	0.285	S	S	.	.			trans	-51.3	138.5	170.9	-27.5	36.4	0	0	0	112.6	D24 Q25 V26	P22-D24 VanDerWaalsContact C-N 3.25Å; P22-D24 WeakPolarHBondContact CB-OD1 3.41Å; P22-D24 PolarHBondContact O-N 3.09Å; P22-Q25 HydrophobicContact CB-CG 4.22Å; P22-Q25 HydrophobicContact CG-CG 4.5Å; P22-Q25 WeakPolarHBondContact O-CB 3.44Å; P22-Q25 PolarHBondContact O-N 3.37Å; P22-Q25 VanDerWaalsContact O-N 3.07Å; P22-V26 PolarHBondContact O-N 3.37Å; P22-V26 VanDerWaalsContact O-N 3.07Å
23	I	89.8	Confident	92.4	Very high	13 Å²	13	53.2 Å²	53.2	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-31.8	-174.9	-178.3	58.5	0	0	0	112.9	T6 L12 S16 L21 V26 N27	T6-I23 HydrophobicContact CG2-CG1 4.44Å; T6-I23 HydrophobicContact CG2-CG2 3.63Å; L12-I23 HydrophobicContact CB-CD1 3.82Å; S16-I23 PolarHBondContact OG-N 3.17Å; L21-I23 PolarHBondContact O-N 3.27Å; I23-V26 PolarHBondContact O-N 3.02Å; I23-N27 WeakPolarHBondContact O-CB 3.25Å; I23-N27 PolarHBondContact O-N 3.12Å
24	D	88.3	Confident	92.6	Very high	26 Å²	26	54.5 Å²	54.5	14%	0.139	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-41.9	174.1	61.5	-50	0	0	0	111.9	P22 N27 F28 S127 A128	P22-D24 VanDerWaalsContact C-N 3.25Å; P22-D24 WeakPolarHBondContact CB-OD1 3.41Å; P22-D24 PolarHBondContact O-N 3.09Å; D24-N27 PolarHBondContact O-N 3.02Å; D24-F28 WeakPolarHBondContact O-CB 3.45Å; D24-F28 PolarHBondContact O-N 3.29Å; D24-S127 WeakPolarHBondContact OD2-CA 3.44Å; D24-S127 WeakPolarHBondContact OD2-CB 3.31Å; D24-A128 PolarHBondContact OD2-N 2.7Å
25	Q	89.9	Confident	92.7	Very high	66 Å²	66	50 Å²	50	31%	0.308	27%	0.273	S	S	.	.	H	α-helix	trans	-67.1	-40.7	175.4	-63.2	-176.8	1	0	0	111.5	P22 F28 V29	P22-Q25 HydrophobicContact CB-CG 4.22Å; P22-Q25 HydrophobicContact CG-CG 4.5Å; P22-Q25 WeakPolarHBondContact O-CB 3.44Å; P22-Q25 PolarHBondContact O-N 3.37Å; P22-Q25 VanDerWaalsContact O-N 3.07Å; Q25-F28 PolarHBondContact O-N 3.45Å; Q25-V29 WeakPolarHBondContact O-CG2 3.08Å; Q25-V29 PolarHBondContact O-N 3.02Å
26	V	92.4	Very high	93	Very high	7 Å²	7	47.2 Å²	47.2	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-64.3	-46.4	176.1	175.4	0	0	0	0	111.1	L12 L15 V19 L21 P22 I23 F28 V29 V30	L12-V26 HydrophobicContact CB-CG1 4.12Å; L12-V26 HydrophobicContact CD1-CG1 4.3Å; L15-V26 HydrophobicContact CB-CG1 4.44Å; L15-V26 HydrophobicContact CD2-CG1 3.83Å; L15-V26 HydrophobicContact CG-CG1 4.07Å; V19-V26 HydrophobicContact CG2-CG2 3.94Å; L21-V26 HydrophobicContact CB-CG2 3.87Å; P22-V26 PolarHBondContact O-N 3.37Å; P22-V26 VanDerWaalsContact O-N 3.07Å; I23-V26 PolarHBondContact O-N 3.02Å; V26-F28 VanDerWaalsContact C-N 3.32Å; V26-F28 PolarHBondContact O-N 3.37Å; V26-V29 PolarHBondContact O-N 2.87Å; V26-V30 HydrophobicContact CG1-CG2 4.22Å; V26-V30 WeakPolarHBondContact O-CB 3.37Å; V26-V30 WeakPolarHBondContact O-CG2 3.14Å; V26-V30 PolarHBondContact O-N 2.83Å
27	N	93.9	Very high	93.3	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-56.8	-47.3	174.9	-74.7	-13.2	0	0	0	111	S9 L12 I23 D24 C31 F70	S9-N27 PolarHBondContact O-ND2 3.32Å; L12-N27 WeakPolarHBondContact CD1-OD1 2.94Å; I23-N27 WeakPolarHBondContact O-CB 3.25Å; I23-N27 PolarHBondContact O-N 3.12Å; D24-N27 PolarHBondContact O-N 3.02Å; N27-C31 VanDerWaalsContact O-CB 3.24Å; N27-C31 WeakPolarHBondContact O-CB 3.39Å; N27-C31 PolarHBondContact O-N 3.38Å; N27-C31 PolarHBondContact O-SG 2.88Å; N27-C31 VanDerWaalsContact O-SG 3.35Å; N27-F70 HydrophobicContact CB-CE1 4.31Å
28	F	92.9	Very high	93.5	Very high	33 Å²	33	47.9 Å²	47.9	15%	0.145	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-50.3	178.2	179	-91.4	0	0	0	112	D24 Q25 V26 C31 Q32 A128 L188 A189 A291	D24-F28 WeakPolarHBondContact O-CB 3.45Å; D24-F28 PolarHBondContact O-N 3.29Å; Q25-F28 PolarHBondContact O-N 3.45Å; V26-F28 VanDerWaalsContact C-N 3.32Å; V26-F28 PolarHBondContact O-N 3.37Å; F28-C31 PolarHBondContact O-N 3.09Å; F28-Q32 HydrophobicContact CD1-CG 4.32Å; F28-Q32 HydrophobicContact CE1-CG 4.07Å; F28-Q32 HydrophobicContact CZ-CG 4.25Å; F28-Q32 WeakPolarHBondContact O-CG 3.35Å; F28-Q32 PolarHBondContact O-N 3.15Å; F28-A128 HydrophobicContact CB-CB 4.19Å; F28-A128 HydrophobicContact CG-CB 4.41Å; F28-L188 HydrophobicContact CD2-CB 4.46Å; F28-L188 HydrophobicContact CE2-CB 4.03Å; F28-A189 HydrophobicContact CE2-CB 4.24Å; F28-A189 HydrophobicContact CZ-CB 3.85Å; F28-A291 HydrophobicContact CE1-CB 4.38Å; F28-A291 HydrophobicContact CZ-CB 4.48Å
29	V	93.9	Very high	93.8	Very high	41 Å²	41	44.1 Å²	44.1	25%	0.248	23%	0.231	C	C	.	.	H	α-helix	trans	-64.5	-47.1	-179	173.3	0	0	0	0	111.3	Q25 V26 C31 Q32 L33 F290	Q25-V29 WeakPolarHBondContact O-CG2 3.08Å; Q25-V29 PolarHBondContact O-N 3.02Å; V26-V29 PolarHBondContact O-N 2.87Å; V29-C31 VanDerWaalsContact C-N 3.35Å; V29-C31 PolarHBondContact O-N 2.99Å; V29-Q32 PolarHBondContact O-N 3.01Å; V29-L33 HydrophobicContact CG1-CD1 4.16Å; V29-L33 HydrophobicContact CG1-CG 4.47Å; V29-L33 WeakPolarHBondContact O-CG 3.35Å; V29-L33 PolarHBondContact O-N 2.87Å; V29-F290 HydrophobicContact CG1-CZ 4.29Å; V29-F290 HydrophobicContact CG2-CE1 3.96Å; V29-F290 HydrophobicContact CG2-CZ 4.1Å
30	V	95.6	Very high	94.2	Very high	48 Å²	48	44.7 Å²	44.7	29%	0.291	23%	0.231	S	C	.	.	H	α-helix	trans	-64.4	-40.1	-179.4	172.2	0	0	0	0	111.2	L12 L15 V26 Q32 L33 F34	L12-V30 HydrophobicContact CD1-CB 3.72Å; L12-V30 HydrophobicContact CD1-CG1 3.74Å; L12-V30 HydrophobicContact CD1-CG2 3.9Å; L15-V30 HydrophobicContact CD2-CG2 4.03Å; V26-V30 HydrophobicContact CG1-CG2 4.22Å; V26-V30 WeakPolarHBondContact O-CB 3.37Å; V26-V30 WeakPolarHBondContact O-CG2 3.14Å; V26-V30 PolarHBondContact O-N 2.83Å; V30-Q32 PolarHBondContact O-N 3.49Å; V30-L33 PolarHBondContact O-N 2.91Å; V30-F34 WeakPolarHBondContact O-CB 3.27Å; V30-F34 PolarHBondContact O-N 2.88Å
31	C	96.8	Very high	94.6	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.034	21%	0.212	C	C	.	.	H	α-helix	trans	-65.8	-35.7	175.2	-76.3	0	0	0	0	113.1	N27 F28 V29 F34 A35 L67 F70 C71 L188	N27-C31 VanDerWaalsContact O-CB 3.24Å; N27-C31 WeakPolarHBondContact O-CB 3.39Å; N27-C31 PolarHBondContact O-N 3.38Å; N27-C31 PolarHBondContact O-SG 2.88Å; N27-C31 VanDerWaalsContact O-SG 3.35Å; F28-C31 PolarHBondContact O-N 3.09Å; V29-C31 VanDerWaalsContact C-N 3.35Å; V29-C31 PolarHBondContact O-N 2.99Å; C31-F34 PolarHBondContact O-N 2.8Å; C31-A35 VanDerWaalsContact O-CB 3.29Å; C31-A35 WeakPolarHBondContact O-CB 3.46Å; C31-A35 PolarHBondContact O-N 3.35Å; C31-L67 HydrophobicContact CB-CD2 4.03Å; C31-F70 WeakPolarHBondContact SG-CD1 3.24Å; C31-C71 PolarHBondContact SG-SG 3.21Å; C31-L188 HydrophobicContact CB-CD1 3.65Å
32	Q	96.8	Very high	95.1	Very high	5 Å²	5	39.2 Å²	39.2	2%	0.023	20%	0.199	C	C	.	.	H	α-helix	trans	-67	-41.4	173.4	-67.8	-81.5	9.4	0	0	111.6	F28 V29 V30 A35 L36 L188 A189 L294 I298	F28-Q32 HydrophobicContact CD1-CG 4.32Å; F28-Q32 HydrophobicContact CE1-CG 4.07Å; F28-Q32 HydrophobicContact CZ-CG 4.25Å; F28-Q32 WeakPolarHBondContact O-CG 3.35Å; F28-Q32 PolarHBondContact O-N 3.15Å; V29-Q32 PolarHBondContact O-N 3.01Å; V30-Q32 PolarHBondContact O-N 3.49Å; Q32-A35 WeakPolarHBondContact O-CB 3.23Å; Q32-A35 PolarHBondContact O-N 3.02Å; Q32-L36 PolarHBondContact O-N 2.97Å; Q32-L188 HydrophobicContact CG-CD1 4.17Å; Q32-A189 VanDerWaalsContact NE2-CB 3.3Å; Q32-L294 HydrophobicContact CB-CD2 3.54Å; Q32-L294 HydrophobicContact CB-CG 4.14Å; Q32-L294 HydrophobicContact CG-CD2 4.29Å; Q32-I298 HydrophobicContact CB-CD1 4.11Å; Q32-I298 VanDerWaalsContact O-CD1 3.28Å; Q32-I298 WeakPolarHBondContact O-CD1 3.49Å
33	L	96.9	Very high	95.4	Very high	85 Å²	85	37.9 Å²	37.9	45%	0.445	19%	0.187	S	C	.	.	H	α-helix	trans	-64	-41.4	174.4	-67.3	175.3	0	0	0	111.6	V29 V30 L36 L37	V29-L33 HydrophobicContact CG1-CD1 4.16Å; V29-L33 HydrophobicContact CG1-CG 4.47Å; V29-L33 WeakPolarHBondContact O-CG 3.35Å; V29-L33 PolarHBondContact O-N 2.87Å; V30-L33 PolarHBondContact O-N 2.91Å; L33-L36 WeakPolarHBondContact O-CB 3.13Å; L33-L36 PolarHBondContact O-N 3.24Å; L33-L37 PolarHBondContact O-N 3.49Å; L33-L37 VanDerWaalsContact O-N 3.16Å
34	F	98	Very high	95.6	Very high	91 Å²	91	40.9 Å²	40.9	40%	0.399	21%	0.206	S	C	.	.	H	α-helix	trans	-63	-42.7	172.2	174.4	-88	0	0	0	111.5	V30 C31 L36 L37 A38 L63 L67	V30-F34 WeakPolarHBondContact O-CB 3.27Å; V30-F34 PolarHBondContact O-N 2.88Å; C31-F34 PolarHBondContact O-N 2.8Å; F34-L36 PolarHBondContact O-N 2.89Å; F34-L37 PolarHBondContact O-N 3.44Å; F34-L37 VanDerWaalsContact O-N 3.17Å; F34-A38 HydrophobicContact CE1-CB 4.22Å; F34-A38 WeakPolarHBondContact O-CB 3.41Å; F34-A38 PolarHBondContact O-N 3.43Å; F34-L63 HydrophobicContact CE1-CD1 3.72Å; F34-L63 HydrophobicContact CE1-CD2 4.49Å; F34-L63 HydrophobicContact CE1-CG 4.42Å; F34-L63 HydrophobicContact CZ-CD1 4.16Å; F34-L67 HydrophobicContact CD1-CD2 3.64Å; F34-L67 HydrophobicContact CE1-CD2 4.03Å
35	A	98.3	Very high	96	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-60.7	-34.7	176.2	0	0	0	0	0	111.8	C31 Q32 A38 A39 L67 F184 I298	C31-A35 VanDerWaalsContact O-CB 3.29Å; C31-A35 WeakPolarHBondContact O-CB 3.46Å; C31-A35 PolarHBondContact O-N 3.35Å; Q32-A35 WeakPolarHBondContact O-CB 3.23Å; Q32-A35 PolarHBondContact O-N 3.02Å; A35-A38 PolarHBondContact O-N 3.09Å; A35-A39 WeakPolarHBondContact O-CB 3.49Å; A35-A39 PolarHBondContact O-N 3.46Å; A35-L67 HydrophobicContact CB-CD1 3.9Å; A35-F184 HydrophobicContact CB-CD2 4.19Å; A35-I298 HydrophobicContact CB-CD1 4.07Å; A35-I298 HydrophobicContact CB-CG2 4.08Å
36	L	98.4	Very high	96.2	Very high	16 Å²	16	44.7 Å²	44.7	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-47.1	173.4	-178.7	67.2	0	0	0	111.8	Q32 L33 F34 A38 A39 I40 V233 L237 I298 A301	Q32-L36 PolarHBondContact O-N 2.97Å; L33-L36 WeakPolarHBondContact O-CB 3.13Å; L33-L36 PolarHBondContact O-N 3.24Å; F34-L36 PolarHBondContact O-N 2.89Å; L36-A38 VanDerWaalsContact C-N 3.33Å; L36-A39 WeakPolarHBondContact O-CB 3.41Å; L36-A39 PolarHBondContact O-N 2.85Å; L36-I40 WeakPolarHBondContact O-CG1 3.32Å; L36-I40 PolarHBondContact O-N 3.11Å; L36-I40 VanDerWaalsContact O-N 3.13Å; L36-V233 HydrophobicContact CD1-CG1 4.28Å; L36-L237 HydrophobicContact CD2-CD1 4.09Å; L36-L237 HydrophobicContact CD2-CD2 3.76Å; L36-I298 HydrophobicContact CB-CG1 3.83Å; L36-I298 HydrophobicContact CD1-CG1 4.13Å; L36-A301 HydrophobicContact CD1-CB 3.72Å
37	L	98.1	Very high	96.3	Very high	118 Å²	118	46 Å²	46	62%	0.618	22%	0.223	S	C	*	.	H	α-helix	trans	-63	-43.1	175.8	-64	177	0	0	0	111.2	L33 F34 A39 I40 W41	L33-L37 PolarHBondContact O-N 3.49Å; L33-L37 VanDerWaalsContact O-N 3.16Å; F34-L37 PolarHBondContact O-N 3.44Å; F34-L37 VanDerWaalsContact O-N 3.17Å; L37-A39 VanDerWaalsContact C-N 3.28Å; L37-A39 PolarHBondContact O-N 2.95Å; L37-I40 PolarHBondContact O-N 3.46Å; L37-W41 PolarHBondContact O-N 2.81Å
38	A	98.3	Very high	96.1	Very high	9 Å²	9	47.6 Å²	47.6	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-65	-32.2	176.3	0	0	0	0	0	112.3	F34 A35 L36 W41 F42 L63 F184	F34-A38 HydrophobicContact CE1-CB 4.22Å; F34-A38 WeakPolarHBondContact O-CB 3.41Å; F34-A38 PolarHBondContact O-N 3.43Å; A35-A38 PolarHBondContact O-N 3.09Å; L36-A38 VanDerWaalsContact C-N 3.33Å; A38-W41 PolarHBondContact O-N 3.36Å; A38-F42 WeakPolarHBondContact O-CB 3.46Å; A38-F42 PolarHBondContact O-N 3.09Å; A38-L63 HydrophobicContact CB-CD2 3.58Å; A38-F184 HydrophobicContact CB-CD2 4.33Å; A38-F184 HydrophobicContact CB-CE2 4.01Å
39	A	98.1	Very high	95.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-43.1	175.1	0	0	0	0	0	111.9	A35 L36 L37 F42 R43 F184 I298 A301 A302	A35-A39 WeakPolarHBondContact O-CB 3.49Å; A35-A39 PolarHBondContact O-N 3.46Å; L36-A39 WeakPolarHBondContact O-CB 3.41Å; L36-A39 PolarHBondContact O-N 2.85Å; L37-A39 VanDerWaalsContact C-N 3.28Å; L37-A39 PolarHBondContact O-N 2.95Å; A39-F42 PolarHBondContact O-N 3.24Å; A39-R43 PolarHBondContact O-N 3.26Å; A39-F184 HydrophobicContact CB-CE2 4.03Å; A39-F184 HydrophobicContact CB-CZ 4.37Å; A39-I298 HydrophobicContact CB-CG2 4.1Å; A39-I298 VanDerWaalsContact CB-O 3.24Å; A39-I298 WeakPolarHBondContact CB-O 3.42Å; A39-A301 HydrophobicContact CB-CB 3.97Å; A39-A302 HydrophobicContact CB-CB 3.85Å; A39-A302 WeakPolarHBondContact O-CA 3.32Å
40	I	97.5	Very high	95.8	Very high	85 Å²	85	56.1 Å²	56.1	44%	0.436	28%	0.28	S	S	.	.	H	α-helix	trans	-61	-49.5	173.2	-62.7	167.8	0	0	0	109.6	L36 L37 F42 R43 T44 A301	L36-I40 WeakPolarHBondContact O-CG1 3.32Å; L36-I40 PolarHBondContact O-N 3.11Å; L36-I40 VanDerWaalsContact O-N 3.13Å; L37-I40 PolarHBondContact O-N 3.46Å; I40-F42 VanDerWaalsContact C-N 3.35Å; I40-F42 PolarHBondContact O-N 2.97Å; I40-R43 PolarHBondContact O-N 2.83Å; I40-T44 PolarHBondContact O-N 3.44Å; I40-T44 PolarHBondContact O-OG1 3.2Å; I40-T44 VanDerWaalsContact O-OG1 3.06Å; I40-A301 HydrophobicContact CG1-CB 4.06Å
41	W	97.8	Very high	95.7	Very high	114 Å²	114	55 Å²	55	43%	0.432	27%	0.273	S	S	.	.	H	α-helix	trans	-58.4	-45	176.6	174.7	88.3	0	0	0	112.3	L37 A38 R43 T44 Y45 L46 V59	L37-W41 PolarHBondContact O-N 2.81Å; A38-W41 PolarHBondContact O-N 3.36Å; W41-R43 VanDerWaalsContact C-N 3.34Å; W41-R43 PolarHBondContact O-N 2.76Å; W41-T44 PolarHBondContact O-N 3.17Å; W41-Y45 AromaticContact CD1-CD2 3.23Å; W41-Y45 AromaticContact CD1-CE2 3.62Å; W41-Y45 HydrophobicContact CD2-CD2 4.5Å; W41-Y45 AromaticContact CG-CD2 3.89Å; W41-Y45 HydrophobicContact CG-CD2 3.89Å; W41-Y45 AromaticContact NE1-CD2 3.47Å; W41-Y45 AromaticContact NE1-CG 3.96Å; W41-Y45 WeakPolarHBondContact O-CD2 3.34Å; W41-Y45 PolarHBondContact O-N 2.89Å; W41-L46 HydrophobicContact CH2-CD1 3.68Å; W41-L46 HydrophobicContact CH2-CD2 4.49Å; W41-L46 HydrophobicContact CH2-CG 4.03Å; W41-L46 HydrophobicContact CZ3-CD1 3.56Å; W41-L46 HydrophobicContact CZ3-CG 4.12Å; W41-V59 HydrophobicContact CH2-CG1 4.47Å; W41-V59 HydrophobicContact CZ3-CG1 4.04Å
42	F	97.4	Very high	95.7	Very high	1 Å²	1	57.8 Å²	57.8	0%	0.004	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-44.9	178.9	-176.2	-89.1	0	0	0	111	A38 A39 I40 L46 R56 V59 A60 F184 F201 I202	A38-F42 WeakPolarHBondContact O-CB 3.46Å; A38-F42 PolarHBondContact O-N 3.09Å; A39-F42 PolarHBondContact O-N 3.24Å; I40-F42 VanDerWaalsContact C-N 3.35Å; I40-F42 PolarHBondContact O-N 2.97Å; F42-L46 HydrophobicContact CD2-CB 4.23Å; F42-L46 HydrophobicContact CD2-CD1 3.7Å; F42-L46 HydrophobicContact CE2-CB 4.32Å; F42-L46 HydrophobicContact CE2-CD1 3.89Å; F42-L46 CarbonylContact O-C 3.26Å; F42-L46 VanDerWaalsContact O-C 3.29Å; F42-L46 VanDerWaalsContact O-CA 3.27Å; F42-L46 WeakPolarHBondContact O-CA 3.28Å; F42-L46 VanDerWaalsContact O-CB 3.31Å; F42-L46 WeakPolarHBondContact O-CB 3.26Å; F42-L46 PolarHBondContact O-N 3.22Å; F42-R56 HydrophobicContact CE2-CB 4.46Å; F42-R56 HydrophobicContact CZ-CB 3.94Å; F42-R56 HydrophobicContact CZ-CG 4.02Å; F42-V59 HydrophobicContact CD2-CG1 4.34Å; F42-V59 HydrophobicContact CE2-CG1 4.45Å; F42-A60 HydrophobicContact CE2-CB 4.38Å; F42-F184 HydrophobicContact CB-CE1 4.47Å; F42-F184 HydrophobicContact CB-CZ 3.99Å; F42-F184 HydrophobicContact CD2-CE1 4.01Å; F42-F184 HydrophobicContact CD2-CZ 4.37Å; F42-F184 HydrophobicContact CE2-CE1 4.49Å; F42-F184 HydrophobicContact CG-CE1 4.18Å; F42-F184 HydrophobicContact CG-CZ 4.14Å; F42-F201 HydrophobicContact CE1-CE1 4.49Å; F42-F201 HydrophobicContact CE1-CZ 4.15Å; F42-I202 HydrophobicContact CE1-CD1 4.21Å; F42-I202 HydrophobicContact CZ-CD1 3.64Å
43	R	94.9	Very high	95.6	Very high	32 Å²	32	59.4 Å²	59.4	12%	0.121	30%	0.304	C	S	.	.	H	α-helix	trans	-65.8	-42.3	176.9	-175.9	173.7	176.9	171.1	-10.9	112.6	A39 I40 W41 H47 E226 P227 P229 A301	A39-R43 PolarHBondContact O-N 3.26Å; I40-R43 PolarHBondContact O-N 2.83Å; W41-R43 VanDerWaalsContact C-N 3.34Å; W41-R43 PolarHBondContact O-N 2.76Å; R43-H47 WeakPolarHBondContact O-CB 3.39Å; R43-E226 IonicContact CZ-OE1 2.79Å; R43-E226 IonicContact NE-OE1 3.76Å; R43-E226 PolarHBondContact NE-OE1 3.35Å; R43-E226 IonicContact NE-OE2 3.37Å; R43-E226 IonicContact NH1-OE1 3.18Å; R43-E226 IonicContact NH2-OE1 2.7Å; R43-E226 PolarHBondContact NH2-OE1 2.75Å; R43-E226 IonicContact NH2-OE2 2.81Å; R43-P227 PolarHBondContact NH2-O 3.11Å; R43-P229 VanDerWaalsContact NH1-CB 3.35Å; R43-A301 VanDerWaalsContact CD-O 3.28Å; R43-A301 WeakPolarHBondContact CD-O 3.46Å
44	T	93.8	Very high	95.6	Very high	76 Å²	76	61.7 Å²	61.7	47%	0.466	31%	0.311	S	S	.	.	H	α-helix	trans	-73	-45.8	-175.7	-58.6	0	0	0	0	112.9	I40 W41	I40-T44 PolarHBondContact O-N 3.44Å; I40-T44 PolarHBondContact O-OG1 3.2Å; I40-T44 VanDerWaalsContact O-OG1 3.06Å; W41-T44 PolarHBondContact O-N 3.17Å
45	Y	95.6	Very high	95.6	Very high	152 Å²	152	61 Å²	61	60%	0.596	31%	0.311	S	S	*	.	H	α-helix	trans	-100.9	-32.1	-170.5	-65.9	-78.4	0	0	0	113.5	W41	W41-Y45 AromaticContact CD1-CD2 3.23Å; W41-Y45 AromaticContact CD1-CE2 3.62Å; W41-Y45 HydrophobicContact CD2-CD2 4.5Å; W41-Y45 AromaticContact CG-CD2 3.89Å; W41-Y45 HydrophobicContact CG-CD2 3.89Å; W41-Y45 AromaticContact NE1-CD2 3.47Å; W41-Y45 AromaticContact NE1-CG 3.96Å; W41-Y45 WeakPolarHBondContact O-CD2 3.34Å; W41-Y45 PolarHBondContact O-N 2.89Å
46	L	95.9	Very high	95.6	Very high	20 Å²	20	61.4 Å²	61.4	11%	0.105	31%	0.312	C	S	.	.	S	Bend	trans	-103.9	30.4	177.6	-55.9	-179.3	0	0	0	111.9	W41 F42 T51 I55 R56 V59	W41-L46 HydrophobicContact CH2-CD1 3.68Å; W41-L46 HydrophobicContact CH2-CD2 4.49Å; W41-L46 HydrophobicContact CH2-CG 4.03Å; W41-L46 HydrophobicContact CZ3-CD1 3.56Å; W41-L46 HydrophobicContact CZ3-CG 4.12Å; F42-L46 HydrophobicContact CD2-CB 4.23Å; F42-L46 HydrophobicContact CD2-CD1 3.7Å; F42-L46 HydrophobicContact CE2-CB 4.32Å; F42-L46 HydrophobicContact CE2-CD1 3.89Å; F42-L46 CarbonylContact O-C 3.26Å; F42-L46 VanDerWaalsContact O-C 3.29Å; F42-L46 VanDerWaalsContact O-CA 3.27Å; F42-L46 WeakPolarHBondContact O-CA 3.28Å; F42-L46 VanDerWaalsContact O-CB 3.31Å; F42-L46 WeakPolarHBondContact O-CB 3.26Å; F42-L46 PolarHBondContact O-N 3.22Å; L46-T51 HydrophobicContact CD2-CG2 4.01Å; L46-I55 HydrophobicContact CD2-CG2 4.4Å; L46-R56 HydrophobicContact CB-CG 4.33Å; L46-R56 VanDerWaalsContact O-CD 3.29Å; L46-R56 WeakPolarHBondContact O-CD 3.32Å; L46-R56 WeakPolarHBondContact O-CG 3.2Å; L46-R56 PolarHBondContact O-NH1 2.88Å; L46-V59 HydrophobicContact CD1-CB 3.89Å; L46-V59 HydrophobicContact CD1-CG1 3.63Å; L46-V59 HydrophobicContact CD1-CG2 3.91Å
47	H	93.2	Very high	95.6	Very high	35 Å²	35	60.9 Å²	60.9	16%	0.162	31%	0.309	C	S	.	.			trans	-54	142.6	175.7	-170.9	-94.6	0	0	0	111.4	R43 S49 K50 T51 E226	R43-H47 WeakPolarHBondContact O-CB 3.39Å; H47-S49 PolarHBondContact CE1-OG 3.19Å; H47-S49 WeakPolarHBondContact ND1-CB 3.48Å; H47-S49 PolarHBondContact ND1-N 3.35Å; H47-S49 VanDerWaalsContact ND1-N 3.17Å; H47-S49 PolarHBondContact ND1-OG 3.42Å; H47-S49 PolarHBondContact O-N 3.45Å; H47-S49 VanDerWaalsContact O-N 3.17Å; H47-K50 PolarHBondContact O-N 3.3Å; H47-T51 PolarHBondContact O-N 3Å; H47-E226 IonicContact CD2-OE2 2.64Å; H47-E226 IonicContact NE2-OE2 3.68Å; H47-E226 PolarHBondContact NE2-OE2 3.02Å
48	S	89.9	Confident	95.7	Very high	33 Å²	33	57.3 Å²	57.3	23%	0.231	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-24	-171.5	52.4	0	0	0	0	113.4	K50 G204	S48-K50 VanDerWaalsContact C-N 3.28Å; S48-K50 PolarHBondContact O-N 2.69Å; S48-G204 VanDerWaalsContact CB-CA 3.48Å
49	S	88.3	Confident	95.7	Very high	93 Å²	93	58.6 Å²	58.6	65%	0.65	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-16.1	172.9	70	0	0	0	0	114.1	H47	H47-S49 PolarHBondContact CE1-OG 3.19Å; H47-S49 WeakPolarHBondContact ND1-CB 3.48Å; H47-S49 PolarHBondContact ND1-N 3.35Å; H47-S49 VanDerWaalsContact ND1-N 3.17Å; H47-S49 PolarHBondContact ND1-OG 3.42Å; H47-S49 PolarHBondContact O-N 3.45Å; H47-S49 VanDerWaalsContact O-N 3.17Å
50	K	91.6	Very high	95.7	Very high	160 Å²	160	58.6 Å²	58.6	70%	0.696	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-16.7	-175.5	-61.4	-177.6	-176.8	175.2	0	113.3	H47 S48	H47-K50 PolarHBondContact O-N 3.3Å; S48-K50 VanDerWaalsContact C-N 3.28Å; S48-K50 PolarHBondContact O-N 2.69Å
51	T	94.6	Very high	95.7	Very high	24 Å²	24	55.1 Å²	55.1	15%	0.147	28%	0.282	C	S	.	.	S	Bend	trans	-139	137.5	-170.1	-53.7	0	0	0	0	111	L46 H47 I55 R56	L46-T51 HydrophobicContact CD2-CG2 4.01Å; H47-T51 PolarHBondContact O-N 3Å; T51-I55 HydrophobicContact CG2-CB 3.64Å; T51-I55 HydrophobicContact CG2-CD1 4.15Å; T51-I55 HydrophobicContact CG2-CG1 4.48Å; T51-I55 HydrophobicContact CG2-CG2 3.57Å; T51-R56 HydrophobicContact CG2-CG 4.26Å
52	S	95.7	Very high	95.7	Very high	64 Å²	64	54.9 Å²	54.9	45%	0.448	29%	0.288	S	S	.	.			trans	-62.9	148.9	-179.9	68.2	0	0	0	0	112.2	F54 I55 R56	S52-F54 PolarHBondContact O-N 3.48Å; S52-I55 PolarHBondContact O-N 3.26Å; S52-I55 VanDerWaalsContact O-N 3.15Å; S52-I55 WeakPolarHBondContact OG-CG1 3.38Å; S52-I55 PolarHBondContact OG-N 2.8Å; S52-R56 PolarHBondContact O-N 2.98Å; S52-R56 VanDerWaalsContact O-N 3.15Å
53	S	96	Very high	95.8	Very high	38 Å²	38	56.3 Å²	56.3	27%	0.266	30%	0.296	S	S	.	.	H	α-helix	trans	-54.1	-38.1	175.1	-54.8	0	0	0	0	112.1	I55 R56 H57 E203	S53-I55 PolarHBondContact O-N 2.8Å; S53-R56 PolarHBondContact O-N 3.4Å; S53-H57 WeakPolarHBondContact O-CB 3.48Å; S53-H57 PolarHBondContact O-CD2 3.44Å; S53-H57 PolarHBondContact O-N 3.3Å; S53-E203 WeakPolarHBondContact OG-CA 3.38Å
54	F	97.4	Very high	95.9	Very high	133 Å²	133	54.8 Å²	54.8	58%	0.583	29%	0.29	S	S	*	.	H	α-helix	trans	-56.9	-51	177	179.5	-94	0	0	0	112.2	S52 R56 H57 V58 L175	S52-F54 PolarHBondContact O-N 3.48Å; F54-R56 PolarHBondContact O-N 3.23Å; F54-H57 PolarHBondContact O-N 2.91Å; F54-V58 HydrophobicContact CD1-CG2 4.27Å; F54-V58 HydrophobicContact CE1-CG2 3.88Å; F54-V58 HydrophobicContact CE2-CG2 4.31Å; F54-V58 HydrophobicContact CZ-CG2 3.89Å; F54-V58 WeakPolarHBondContact O-CG2 3.34Å; F54-V58 PolarHBondContact O-N 2.75Å; F54-L175 HydrophobicContact CD2-CD2 3.42Å; F54-L175 VanDerWaalsContact CD2-CD2 3.42Å; F54-L175 HydrophobicContact CE2-CD2 3.58Å; F54-L175 HydrophobicContact CG-CD2 4.31Å
55	I	97.8	Very high	96.1	Very high	77 Å²	77	52.9 Å²	52.9	40%	0.395	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-43.6	-179.9	-67.4	170.3	0	0	0	110.3	L46 T51 S52 S53 H57 V58 V59	L46-I55 HydrophobicContact CD2-CG2 4.4Å; T51-I55 HydrophobicContact CG2-CB 3.64Å; T51-I55 HydrophobicContact CG2-CD1 4.15Å; T51-I55 HydrophobicContact CG2-CG1 4.48Å; T51-I55 HydrophobicContact CG2-CG2 3.57Å; S52-I55 PolarHBondContact O-N 3.26Å; S52-I55 VanDerWaalsContact O-N 3.15Å; S52-I55 WeakPolarHBondContact OG-CG1 3.38Å; S52-I55 PolarHBondContact OG-N 2.8Å; S53-I55 PolarHBondContact O-N 2.8Å; I55-H57 VanDerWaalsContact C-N 3.33Å; I55-H57 PolarHBondContact O-N 3.44Å; I55-V58 PolarHBondContact O-N 3.03Å; I55-V59 HydrophobicContact CG2-CG2 4.12Å; I55-V59 WeakPolarHBondContact O-CB 3.4Å; I55-V59 WeakPolarHBondContact O-CG2 3.5Å; I55-V59 PolarHBondContact O-N 3.49Å
56	R	98.2	Very high	96.2	Very high	9 Å²	9	51.9 Å²	51.9	3%	0.034	27%	0.273	C	S	.	.	H	α-helix	trans	-57.8	-45	177.3	-75.7	172.5	58.7	110.8	-7.7	111.6	F42 L46 T51 S52 S53 F54 A60 F201 I202	F42-R56 HydrophobicContact CE2-CB 4.46Å; F42-R56 HydrophobicContact CZ-CB 3.94Å; F42-R56 HydrophobicContact CZ-CG 4.02Å; L46-R56 HydrophobicContact CB-CG 4.33Å; L46-R56 VanDerWaalsContact O-CD 3.29Å; L46-R56 WeakPolarHBondContact O-CD 3.32Å; L46-R56 WeakPolarHBondContact O-CG 3.2Å; L46-R56 PolarHBondContact O-NH1 2.88Å; T51-R56 HydrophobicContact CG2-CG 4.26Å; S52-R56 PolarHBondContact O-N 2.98Å; S52-R56 VanDerWaalsContact O-N 3.15Å; S53-R56 PolarHBondContact O-N 3.4Å; F54-R56 PolarHBondContact O-N 3.23Å; R56-A60 VanDerWaalsContact O-CB 3.23Å; R56-A60 WeakPolarHBondContact O-CB 3.22Å; R56-A60 PolarHBondContact O-N 2.86Å; R56-F201 PolarHBondContact NH2-O 2.96Å; R56-I202 HydrophobicContact CB-CD1 4.06Å; R56-I202 HydrophobicContact CB-CG1 4.27Å; R56-I202 PolarHBondContact NE-O 2.91Å; R56-I202 PolarHBondContact NH2-O 3.45Å
57	H	98.5	Very high	96.3	Very high	5 Å²	5	51 Å²	51	2%	0.023	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-49.3	175.1	-83.6	-66.2	0	0	0	112.9	S53 F54 I55 A60 T61 L175 S179 I202	S53-H57 WeakPolarHBondContact O-CB 3.48Å; S53-H57 PolarHBondContact O-CD2 3.44Å; S53-H57 PolarHBondContact O-N 3.3Å; F54-H57 PolarHBondContact O-N 2.91Å; I55-H57 VanDerWaalsContact C-N 3.33Å; I55-H57 PolarHBondContact O-N 3.44Å; H57-A60 PolarHBondContact O-N 3.02Å; H57-T61 WeakPolarHBondContact O-CB 3.32Å; H57-T61 PolarHBondContact O-N 3.43Å; H57-T61 PolarHBondContact O-OG1 3.15Å; H57-L175 HydrophobicContact CB-CD1 4.04Å; H57-L175 HydrophobicContact CB-CD2 3.96Å; H57-L175 HydrophobicContact CB-CG 3.83Å; H57-S179 WeakPolarHBondContact CA-OG 3.35Å; H57-S179 WeakPolarHBondContact ND1-CB 3.48Å; H57-S179 PolarHBondContact ND1-OG 2.96Å; H57-S179 PolarHBondContact O-OG 2.99Å; H57-S179 VanDerWaalsContact O-OG 3.06Å; H57-I202 WeakPolarHBondContact CE1-CG2 3.37Å; H57-I202 WeakPolarHBondContact NE2-CG2 3.47Å
58	V	98.6	Very high	96.4	Very high	43 Å²	43	49.3 Å²	49.3	26%	0.261	26%	0.261	S	S	.	.	H	α-helix	trans	-60.5	-50.5	-179.1	169.4	0	0	0	0	110.4	F54 I55 A60 T61 L62 L175	F54-V58 HydrophobicContact CD1-CG2 4.27Å; F54-V58 HydrophobicContact CE1-CG2 3.88Å; F54-V58 HydrophobicContact CE2-CG2 4.31Å; F54-V58 HydrophobicContact CZ-CG2 3.89Å; F54-V58 WeakPolarHBondContact O-CG2 3.34Å; F54-V58 PolarHBondContact O-N 2.75Å; I55-V58 PolarHBondContact O-N 3.03Å; V58-A60 PolarHBondContact O-N 3.38Å; V58-T61 PolarHBondContact O-N 2.88Å; V58-L62 HydrophobicContact CG1-CD1 3.65Å; V58-L62 HydrophobicContact CG1-CG 4.15Å; V58-L62 WeakPolarHBondContact O-CB 3.46Å; V58-L62 WeakPolarHBondContact O-CG 3.35Å; V58-L62 PolarHBondContact O-N 2.9Å; V58-L175 HydrophobicContact CG2-CD1 3.93Å; V58-L175 HydrophobicContact CG2-CD2 4.17Å
59	V	98.3	Very high	96.7	Very high	37 Å²	37	52.1 Å²	52.1	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-45.3	179.8	173.5	0	0	0	0	111.1	W41 F42 L46 I55 T61 L62 L63	W41-V59 HydrophobicContact CH2-CG1 4.47Å; W41-V59 HydrophobicContact CZ3-CG1 4.04Å; F42-V59 HydrophobicContact CD2-CG1 4.34Å; F42-V59 HydrophobicContact CE2-CG1 4.45Å; L46-V59 HydrophobicContact CD1-CB 3.89Å; L46-V59 HydrophobicContact CD1-CG1 3.63Å; L46-V59 HydrophobicContact CD1-CG2 3.91Å; I55-V59 HydrophobicContact CG2-CG2 4.12Å; I55-V59 WeakPolarHBondContact O-CB 3.4Å; I55-V59 WeakPolarHBondContact O-CG2 3.5Å; I55-V59 PolarHBondContact O-N 3.49Å; V59-T61 VanDerWaalsContact C-N 3.26Å; V59-T61 PolarHBondContact O-N 3.04Å; V59-L62 PolarHBondContact O-N 3.32Å; V59-L63 VanDerWaalsContact O-CB 3.23Å; V59-L63 WeakPolarHBondContact O-CB 3.43Å; V59-L63 PolarHBondContact O-N 3.25Å
60	A	98.3	Very high	97.1	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-39.1	179.6	0	0	0	0	0	112.2	F42 R56 H57 V58 G64 N183 F184 I202	F42-A60 HydrophobicContact CE2-CB 4.38Å; R56-A60 VanDerWaalsContact O-CB 3.23Å; R56-A60 WeakPolarHBondContact O-CB 3.22Å; R56-A60 PolarHBondContact O-N 2.86Å; H57-A60 PolarHBondContact O-N 3.02Å; V58-A60 PolarHBondContact O-N 3.38Å; A60-G64 PolarHBondContact O-N 3Å; A60-N183 HydrophobicContact CB-CB 4.25Å; A60-N183 WeakPolarHBondContact O-CA 3.44Å; A60-F184 HydrophobicContact CB-CD1 4.23Å; A60-F184 HydrophobicContact CB-CE1 4.41Å; A60-F184 PolarHBondContact O-N 2.79Å; A60-I202 HydrophobicContact CB-CD1 4.19Å
61	T	98.4	Very high	97.1	Very high	12 Å²	12	41.8 Å²	41.8	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-70.9	-52.4	179.2	-48.7	0	0	0	0	111.5	H57 V58 V59 L63 G64 L65 L178 S179 C182	H57-T61 WeakPolarHBondContact O-CB 3.32Å; H57-T61 PolarHBondContact O-N 3.43Å; H57-T61 PolarHBondContact O-OG1 3.15Å; V58-T61 PolarHBondContact O-N 2.88Å; V59-T61 VanDerWaalsContact C-N 3.26Å; V59-T61 PolarHBondContact O-N 3.04Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 3.37Å; T61-G64 PolarHBondContact O-N 3.25Å; T61-G64 VanDerWaalsContact O-N 3.15Å; T61-L65 HydrophobicContact CG2-CD1 4.18Å; T61-L65 HydrophobicContact CG2-CG 4.5Å; T61-L65 WeakPolarHBondContact O-CG 3.48Å; T61-L65 PolarHBondContact O-N 2.64Å; T61-L178 HydrophobicContact CG2-CB 4.22Å; T61-S179 WeakPolarHBondContact OG1-CA 3.22Å; T61-S179 VanDerWaalsContact OG1-CB 3.27Å; T61-S179 WeakPolarHBondContact OG1-CB 3.41Å; T61-S179 PolarHBondContact OG1-OG 3.41Å; T61-C182 HydrophobicContact CG2-CB 4.26Å
62	L	98.3	Very high	97	Very high	108 Å²	108	40.9 Å²	40.9	57%	0.565	21%	0.21	S	C	*	.	H	α-helix	trans	-62.5	-41.5	-177.1	-69.7	179.9	0	0	0	111.4	V58 V59 G64 L65 Y66	V58-L62 HydrophobicContact CG1-CD1 3.65Å; V58-L62 HydrophobicContact CG1-CG 4.15Å; V58-L62 WeakPolarHBondContact O-CB 3.46Å; V58-L62 WeakPolarHBondContact O-CG 3.35Å; V58-L62 PolarHBondContact O-N 2.9Å; V59-L62 PolarHBondContact O-N 3.32Å; L62-G64 VanDerWaalsContact C-N 3.33Å; L62-G64 PolarHBondContact O-N 3.27Å; L62-L65 PolarHBondContact O-N 2.97Å; L62-Y66 WeakPolarHBondContact O-CB 3.33Å; L62-Y66 PolarHBondContact O-N 3.32Å
63	L	98.3	Very high	96.8	Very high	31 Å²	31	38.5 Å²	38.5	16%	0.162	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-39.2	176.4	-168.8	62.3	0	0	0	111.6	F34 A38 V59 T61 Y66 L67 F184	F34-L63 HydrophobicContact CE1-CD1 3.72Å; F34-L63 HydrophobicContact CE1-CD2 4.49Å; F34-L63 HydrophobicContact CE1-CG 4.42Å; F34-L63 HydrophobicContact CZ-CD1 4.16Å; A38-L63 HydrophobicContact CB-CD2 3.58Å; V59-L63 VanDerWaalsContact O-CB 3.23Å; V59-L63 WeakPolarHBondContact O-CB 3.43Å; V59-L63 PolarHBondContact O-N 3.25Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 3.37Å; L63-Y66 WeakPolarHBondContact O-CB 3.28Å; L63-Y66 PolarHBondContact O-N 2.91Å; L63-L67 WeakPolarHBondContact O-CG 3.3Å; L63-L67 PolarHBondContact O-N 3.49Å; L63-F184 HydrophobicContact CB-CB 3.92Å; L63-F184 HydrophobicContact CB-CD1 4.34Å; L63-F184 HydrophobicContact CB-CG 4.25Å; L63-F184 HydrophobicContact CD2-CB 3.96Å; L63-F184 HydrophobicContact CD2-CD1 3.93Å; L63-F184 HydrophobicContact CD2-CD2 3.76Å; L63-F184 HydrophobicContact CD2-CE1 4.35Å; L63-F184 HydrophobicContact CD2-CE2 4.21Å; L63-F184 HydrophobicContact CD2-CG 3.6Å; L63-F184 HydrophobicContact CD2-CZ 4.47Å; L63-F184 HydrophobicContact CG-CB 3.81Å; L63-F184 HydrophobicContact CG-CD2 4.5Å; L63-F184 HydrophobicContact CG-CG 4.04Å
64	G	98	Very high	96.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.8	-44.3	177.5	0	0	0	0	0	112.2	A60 T61 L62 Y66 L67 A68 C182 F184 I187	A60-G64 PolarHBondContact O-N 3Å; T61-G64 PolarHBondContact O-N 3.25Å; T61-G64 VanDerWaalsContact O-N 3.15Å; L62-G64 VanDerWaalsContact C-N 3.33Å; L62-G64 PolarHBondContact O-N 3.27Å; G64-Y66 VanDerWaalsContact C-N 3.3Å; G64-Y66 PolarHBondContact O-N 3.41Å; G64-L67 PolarHBondContact O-N 3.15Å; G64-A68 WeakPolarHBondContact O-CB 3.26Å; G64-A68 PolarHBondContact O-N 3.48Å; G64-C182 WeakPolarHBondContact CA-O 3.29Å; G64-F184 VanDerWaalsContact CA-CA 3.49Å; G64-I187 WeakPolarHBondContact O-CD1 3.5Å
65	L	97.5	Very high	96.2	Very high	37 Å²	37	43.6 Å²	43.6	19%	0.194	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-38.7	174.1	-67.1	177.4	0	0	0	112.1	T61 L62 A68 L69 L80 C182	T61-L65 HydrophobicContact CG2-CD1 4.18Å; T61-L65 HydrophobicContact CG2-CG 4.5Å; T61-L65 WeakPolarHBondContact O-CG 3.48Å; T61-L65 PolarHBondContact O-N 2.64Å; L62-L65 PolarHBondContact O-N 2.97Å; L65-A68 PolarHBondContact O-N 3.06Å; L65-L69 WeakPolarHBondContact O-CB 3.49Å; L65-L69 VanDerWaalsContact O-CG 3.32Å; L65-L69 WeakPolarHBondContact O-CG 3.14Å; L65-L69 PolarHBondContact O-N 3.41Å; L65-L80 HydrophobicContact CD1-CD2 4.33Å; L65-L80 HydrophobicContact CD2-CD2 3.68Å; L65-L80 HydrophobicContact CD2-CG 4.22Å; L65-C182 HydrophobicContact CD2-CB 3.9Å; L65-C182 HydrophobicContact CG-CB 4.26Å
66	Y	97.6	Very high	95.9	Very high	131 Å²	131	40.2 Å²	40.2	51%	0.514	19%	0.19	S	C	.	.	H	α-helix	trans	-60	-48.4	173.2	172.9	-97.6	0	0	0	111.9	L62 L63 G64 A68 L69 F70	L62-Y66 WeakPolarHBondContact O-CB 3.33Å; L62-Y66 PolarHBondContact O-N 3.32Å; L63-Y66 WeakPolarHBondContact O-CB 3.28Å; L63-Y66 PolarHBondContact O-N 2.91Å; G64-Y66 VanDerWaalsContact C-N 3.3Å; G64-Y66 PolarHBondContact O-N 3.41Å; Y66-A68 VanDerWaalsContact C-N 3.33Å; Y66-A68 PolarHBondContact O-N 3.22Å; Y66-L69 PolarHBondContact O-N 2.88Å; Y66-F70 WeakPolarHBondContact O-CB 3.47Å; Y66-F70 PolarHBondContact O-N 3.39Å
67	L	97.6	Very high	95.7	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-40.1	177.6	-65.1	179.7	0	0	0	112.3	C31 F34 A35 L63 G64 F70 C71 F184	C31-L67 HydrophobicContact CB-CD2 4.03Å; F34-L67 HydrophobicContact CD1-CD2 3.64Å; F34-L67 HydrophobicContact CE1-CD2 4.03Å; A35-L67 HydrophobicContact CB-CD1 3.9Å; L63-L67 WeakPolarHBondContact O-CG 3.3Å; L63-L67 PolarHBondContact O-N 3.49Å; G64-L67 PolarHBondContact O-N 3.15Å; L67-F70 PolarHBondContact O-N 2.95Å; L67-C71 WeakPolarHBondContact O-CB 3.27Å; L67-C71 PolarHBondContact O-N 3.45Å; L67-C71 PolarHBondContact O-SG 3.47Å; L67-F184 HydrophobicContact CD1-CB 4.01Å
68	A	95.9	Very high	95.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-47.7	174.9	0	0	0	0	0	112	G64 L65 Y66 F70 C71 F72 A76 F79 I187	G64-A68 WeakPolarHBondContact O-CB 3.26Å; G64-A68 PolarHBondContact O-N 3.48Å; L65-A68 PolarHBondContact O-N 3.06Å; Y66-A68 VanDerWaalsContact C-N 3.33Å; Y66-A68 PolarHBondContact O-N 3.22Å; A68-F70 VanDerWaalsContact C-N 3.31Å; A68-F70 PolarHBondContact O-N 3.32Å; A68-C71 PolarHBondContact O-N 2.9Å; A68-F72 HydrophobicContact CB-CD2 4.49Å; A68-F72 WeakPolarHBondContact O-CB 3.23Å; A68-F72 VanDerWaalsContact O-CD2 3.23Å; A68-F72 WeakPolarHBondContact O-CD2 3.39Å; A68-F72 PolarHBondContact O-N 3.45Å; A68-A76 HydrophobicContact CB-CB 3.91Å; A68-F79 HydrophobicContact CB-CD2 3.8Å; A68-F79 HydrophobicContact CB-CE2 3.62Å; A68-I187 HydrophobicContact CB-CD1 3.73Å; A68-I187 HydrophobicContact CB-CG1 4.42Å
69	L	95.8	Very high	95.3	Very high	91 Å²	91	44.6 Å²	44.6	48%	0.476	21%	0.21	S	C	.	.	H	α-helix	trans	-62.9	-38.5	176.7	-74.7	166.1	0	0	0	111.6	L65 Y66 G73 A76	L65-L69 WeakPolarHBondContact O-CB 3.49Å; L65-L69 VanDerWaalsContact O-CG 3.32Å; L65-L69 WeakPolarHBondContact O-CG 3.14Å; L65-L69 PolarHBondContact O-N 3.41Å; Y66-L69 PolarHBondContact O-N 2.88Å; L69-G73 WeakPolarHBondContact O-CA 3.42Å; L69-G73 PolarHBondContact O-N 3.42Å; L69-A76 HydrophobicContact CD2-CB 3.98Å; L69-A76 HydrophobicContact CG-CB 4.22Å
70	F	96	Very high	95.2	Very high	31 Å²	31	46 Å²	46	14%	0.136	22%	0.216	C	C	.	.	H	α-helix	trans	-65.3	-46.1	177.1	-172.1	-83.7	0	0	0	111.8	S9 L11 L12 N27 C31 Y66 L67 A68	S9-F70 WeakPolarHBondContact CB-O 3.22Å; S9-F70 PolarHBondContact N-O 3.48Å; S9-F70 WeakPolarHBondContact OG-CE2 3.32Å; L11-F70 HydrophobicContact CD2-CE2 4.2Å; L11-F70 HydrophobicContact CD2-CZ 4.49Å; L12-F70 HydrophobicContact CD1-CE1 3.96Å; L12-F70 HydrophobicContact CD1-CZ 4.03Å; L12-F70 HydrophobicContact CG-CE1 4.45Å; L12-F70 HydrophobicContact CG-CZ 4.1Å; N27-F70 HydrophobicContact CB-CE1 4.31Å; C31-F70 WeakPolarHBondContact SG-CD1 3.24Å; Y66-F70 WeakPolarHBondContact O-CB 3.47Å; Y66-F70 PolarHBondContact O-N 3.39Å; L67-F70 PolarHBondContact O-N 2.95Å; A68-F70 VanDerWaalsContact C-N 3.31Å; A68-F70 PolarHBondContact O-N 3.32Å
71	C	93.5	Very high	95.2	Very high	6 Å²	6	48.2 Å²	48.2	4%	0.041	23%	0.23	C	C	.	.	H	α-helix	trans	-72.3	-38.5	-178.9	-72.1	0	0	0	0	113.3	G8 C31 L67 A68 L188	G8-C71 WeakPolarHBondContact CA-O 3.43Å; C31-C71 PolarHBondContact SG-SG 3.21Å; L67-C71 WeakPolarHBondContact O-CB 3.27Å; L67-C71 PolarHBondContact O-N 3.45Å; L67-C71 PolarHBondContact O-SG 3.47Å; A68-C71 PolarHBondContact O-N 2.9Å; C71-L188 HydrophobicContact CB-CD2 4.27Å
72	F	91.8	Very high	95.2	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.018	23%	0.226	C	C	.	.	H	α-helix	trans	-123.1	-6.2	-165.5	-49.3	-65.9	0	0	0	114.6	T7 A68 Y75 F79 A128 D129 F130 P133 L188	T7-F72 CarbonylContact C-O 3.52Å; T7-F72 WeakPolarHBondContact CB-O 3.5Å; T7-F72 CarbonylContact O-C 3.57Å; T7-F72 PolarHBondContact OG1-O 3.21Å; A68-F72 HydrophobicContact CB-CD2 4.49Å; A68-F72 WeakPolarHBondContact O-CB 3.23Å; A68-F72 VanDerWaalsContact O-CD2 3.23Å; A68-F72 WeakPolarHBondContact O-CD2 3.39Å; A68-F72 PolarHBondContact O-N 3.45Å; F72-Y75 PolarHBondContact O-N 2.92Å; F72-F79 AromaticContact CD2-CE2 3.73Å; F72-F79 HydrophobicContact CD2-CE2 3.73Å; F72-F79 AromaticContact CD2-CZ 3.62Å; F72-F79 HydrophobicContact CD2-CZ 3.62Å; F72-F79 HydrophobicContact CE2-CE2 4.08Å; F72-F79 HydrophobicContact CE2-CZ 4.01Å; F72-F79 HydrophobicContact CG-CZ 4.22Å; F72-A128 WeakPolarHBondContact CE1-O 3.41Å; F72-D129 WeakPolarHBondContact CE1-O 3.46Å; F72-F130 HydrophobicContact CB-CB 4.04Å; F72-F130 HydrophobicContact CD1-CB 3.91Å; F72-F130 HydrophobicContact CG-CB 3.96Å; F72-P133 HydrophobicContact CD2-CG 4.47Å; F72-P133 HydrophobicContact CE1-CG 4.49Å; F72-P133 HydrophobicContact CE2-CG 3.53Å; F72-P133 HydrophobicContact CZ-CG 3.53Å; F72-L188 HydrophobicContact CE2-CD2 3.66Å; F72-L188 HydrophobicContact CZ-CD2 4.14Å
73	G	91.6	Very high	95.1	Very high	14 Å²	14	42.5 Å²	42.5	14%	0.144	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	58.2	-137.1	-177.1	0	0	0	0	0	112.2	T7 L69 Y75 A76	T7-G73 VanDerWaalsContact O-CA 3.23Å; T7-G73 WeakPolarHBondContact O-CA 3.48Å; T7-G73 PolarHBondContact O-N 3Å; L69-G73 WeakPolarHBondContact O-CA 3.42Å; L69-G73 PolarHBondContact O-N 3.42Å; G73-Y75 PolarHBondContact O-N 3.45Å; G73-Y75 VanDerWaalsContact O-N 3.09Å; G73-A76 VanDerWaalsContact O-CB 3.27Å; G73-A76 WeakPolarHBondContact O-CB 3.42Å; G73-A76 PolarHBondContact O-N 3.2Å
74	W	89.6	Confident	95.1	Very high	221 Å²	221	42.4 Å²	42.4	84%	0.837	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-60.5	-21.2	-177.5	-68.5	111.2	0	0	0	114.1	A76 L77	W74-A76 PolarHBondContact O-N 2.99Å; W74-L77 WeakPolarHBondContact O-CB 3.15Å; W74-L77 PolarHBondContact O-N 3.37Å
75	Y	89.8	Confident	95.1	Very high	57 Å²	57	45.9 Å²	45.9	22%	0.224	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-67.9	-19.9	176.1	-70.8	-97.3	0	0	0	112.9	T7 F72 G73 L77 H78 F121 F130	T7-Y75 VanDerWaalsContact CB-CD2 3.45Å; T7-Y75 HydrophobicContact CG2-CD2 3.56Å; T7-Y75 HydrophobicContact CG2-CE2 3.31Å; T7-Y75 HydrophobicContact CG2-CG 4.44Å; F72-Y75 PolarHBondContact O-N 2.92Å; G73-Y75 PolarHBondContact O-N 3.45Å; G73-Y75 VanDerWaalsContact O-N 3.09Å; Y75-L77 PolarHBondContact O-N 3.49Å; Y75-L77 VanDerWaalsContact O-N 3.12Å; Y75-H78 AromaticContact CD1-CD2 3.88Å; Y75-H78 AromaticContact CD1-NE2 3.86Å; Y75-H78 WeakPolarHBondContact O-CB 3.3Å; Y75-H78 PolarHBondContact O-CD2 3.45Å; Y75-H78 PolarHBondContact O-N 2.87Å; Y75-F121 HydrophobicContact CE1-CE2 4.47Å; Y75-F121 WeakPolarHBondContact OH-CE1 3.27Å; Y75-F121 WeakPolarHBondContact OH-CZ 3.19Å; Y75-F130 AromaticContact CD1-CD1 3.7Å; Y75-F130 HydrophobicContact CD1-CD1 3.7Å; Y75-F130 HydrophobicContact CD1-CD2 4.3Å; Y75-F130 AromaticContact CD1-CE1 3.42Å; Y75-F130 HydrophobicContact CD1-CE1 3.42Å; Y75-F130 VanDerWaalsContact CD1-CE1 3.42Å; Y75-F130 HydrophobicContact CD1-CE2 4.05Å; Y75-F130 HydrophobicContact CD1-CG 4.15Å; Y75-F130 AromaticContact CD1-CZ 3.62Å; Y75-F130 HydrophobicContact CD1-CZ 3.62Å; Y75-F130 HydrophobicContact CE1-CD1 4.5Å; Y75-F130 AromaticContact CE1-CE1 3.89Å; Y75-F130 HydrophobicContact CE1-CE1 3.89Å; Y75-F130 HydrophobicContact CE1-CZ 4.12Å; Y75-F130 AromaticContact CG-CD1 3.98Å; Y75-F130 HydrophobicContact CG-CD1 3.98Å; Y75-F130 HydrophobicContact CG-CE1 4.17Å; Y75-F130 HydrophobicContact CG-CG 4.29Å
76	A	92.4	Very high	95.2	Very high	6 Å²	6	44.1 Å²	44.1	5%	0.05	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-59.4	-20.7	170	0	0	0	0	0	112.4	A68 L69 G73 W74 H78 F79	A68-A76 HydrophobicContact CB-CB 3.91Å; L69-A76 HydrophobicContact CD2-CB 3.98Å; L69-A76 HydrophobicContact CG-CB 4.22Å; G73-A76 VanDerWaalsContact O-CB 3.27Å; G73-A76 WeakPolarHBondContact O-CB 3.42Å; G73-A76 PolarHBondContact O-N 3.2Å; W74-A76 PolarHBondContact O-N 2.99Å; A76-H78 PolarHBondContact O-N 3.02Å; A76-F79 HydrophobicContact CB-CD2 4.25Å; A76-F79 HydrophobicContact CB-CE2 4.2Å; A76-F79 VanDerWaalsContact O-CB 3.22Å; A76-F79 WeakPolarHBondContact O-CB 3.28Å; A76-F79 WeakPolarHBondContact O-CG 3.22Å; A76-F79 PolarHBondContact O-N 2.98Å
77	L	93.1	Very high	95.2	Very high	95 Å²	95	39.7 Å²	39.7	50%	0.497	20%	0.196	S	C	.	.	H	α-helix	trans	-61.4	-30	173.3	-172.3	62.5	0	0	0	112.1	W74 Y75 F79 L80 V81	W74-L77 WeakPolarHBondContact O-CB 3.15Å; W74-L77 PolarHBondContact O-N 3.37Å; Y75-L77 PolarHBondContact O-N 3.49Å; Y75-L77 VanDerWaalsContact O-N 3.12Å; L77-F79 PolarHBondContact O-N 3.48Å; L77-L80 HydrophobicContact CD1-CB 4.38Å; L77-L80 HydrophobicContact CD1-CD1 4.19Å; L77-L80 PolarHBondContact O-N 2.96Å; L77-L80 VanDerWaalsContact O-N 3.09Å; L77-V81 HydrophobicContact CG-CG2 4.31Å; L77-V81 WeakPolarHBondContact O-CG2 3.36Å; L77-V81 PolarHBondContact O-N 2.84Å
78	H	94.8	Very high	95.2	Very high	54 Å²	54	42.8 Å²	42.8	25%	0.25	22%	0.218	C	C	.	.	H	α-helix	trans	-59	-29.2	174.3	-70	-73.8	0	0	0	111.9	Y75 A76 V81 Q82 Y109 F130 M134	Y75-H78 AromaticContact CD1-CD2 3.88Å; Y75-H78 AromaticContact CD1-NE2 3.86Å; Y75-H78 WeakPolarHBondContact O-CB 3.3Å; Y75-H78 PolarHBondContact O-CD2 3.45Å; Y75-H78 PolarHBondContact O-N 2.87Å; A76-H78 PolarHBondContact O-N 3.02Å; H78-V81 PolarHBondContact O-N 3.48Å; H78-Q82 VanDerWaalsContact O-CB 3.26Å; H78-Q82 WeakPolarHBondContact O-CB 3.07Å; H78-Q82 PolarHBondContact O-N 3.44Å; H78-Y109 HydrophobicContact CB-CE1 4.24Å; H78-Y109 AromaticContact ND1-CZ 3.63Å; H78-Y109 PolarHBondContact ND1-OH 3.34Å; H78-F130 AromaticContact CD2-CE2 3.85Å; H78-M134 HydrophobicContact CB-CE 4.1Å; H78-M134 HydrophobicContact CB-SD 3.8Å
79	F	95.8	Very high	95.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.7	-40.4	179	-51.9	-9.1	0	0	0	110.5	A68 F72 A76 L77 S83 F130 P133 M134 I137 I187	A68-F79 HydrophobicContact CB-CD2 3.8Å; A68-F79 HydrophobicContact CB-CE2 3.62Å; F72-F79 AromaticContact CD2-CE2 3.73Å; F72-F79 HydrophobicContact CD2-CE2 3.73Å; F72-F79 AromaticContact CD2-CZ 3.62Å; F72-F79 HydrophobicContact CD2-CZ 3.62Å; F72-F79 HydrophobicContact CE2-CE2 4.08Å; F72-F79 HydrophobicContact CE2-CZ 4.01Å; F72-F79 HydrophobicContact CG-CZ 4.22Å; A76-F79 HydrophobicContact CB-CD2 4.25Å; A76-F79 HydrophobicContact CB-CE2 4.2Å; A76-F79 VanDerWaalsContact O-CB 3.22Å; A76-F79 WeakPolarHBondContact O-CB 3.28Å; A76-F79 WeakPolarHBondContact O-CG 3.22Å; A76-F79 PolarHBondContact O-N 2.98Å; L77-F79 PolarHBondContact O-N 3.48Å; F79-S83 VanDerWaalsContact O-CB 3.24Å; F79-S83 WeakPolarHBondContact O-CB 3.15Å; F79-S83 PolarHBondContact O-N 3.36Å; F79-S83 PolarHBondContact O-OG 2.88Å; F79-F130 HydrophobicContact CE1-CB 3.97Å; F79-F130 HydrophobicContact CE1-CD2 4.47Å; F79-F130 WeakPolarHBondContact CE1-O 3.46Å; F79-F130 HydrophobicContact CZ-CB 4.01Å; F79-P133 HydrophobicContact CE1-CB 4.01Å; F79-P133 HydrophobicContact CE2-CB 3.81Å; F79-P133 HydrophobicContact CE2-CG 4.26Å; F79-P133 HydrophobicContact CZ-CB 3.55Å; F79-P133 HydrophobicContact CZ-CG 3.88Å; F79-M134 HydrophobicContact CD1-CG 3.53Å; F79-M134 HydrophobicContact CD1-SD 4.46Å; F79-M134 HydrophobicContact CE1-CG 3.59Å; F79-M134 HydrophobicContact CE1-SD 4.44Å; F79-I137 HydrophobicContact CB-CD1 3.64Å; F79-I137 HydrophobicContact CD1-CD1 4.4Å; F79-I137 HydrophobicContact CD2-CD1 4.45Å; F79-I137 HydrophobicContact CG-CD1 3.92Å; F79-I187 HydrophobicContact CD2-CD1 4.31Å
80	L	96.3	Very high	95.4	Very high	67 Å²	67	40 Å²	40	35%	0.351	20%	0.203	S	C	.	.	H	α-helix	trans	-72.3	-40.5	176.4	-66.3	178.4	0	0	0	111.8	L65 L77 S83 G84	L65-L80 HydrophobicContact CD1-CD2 4.33Å; L65-L80 HydrophobicContact CD2-CD2 3.68Å; L65-L80 HydrophobicContact CD2-CG 4.22Å; L77-L80 HydrophobicContact CD1-CB 4.38Å; L77-L80 HydrophobicContact CD1-CD1 4.19Å; L77-L80 PolarHBondContact O-N 2.96Å; L77-L80 VanDerWaalsContact O-N 3.09Å; L80-S83 PolarHBondContact O-N 3.37Å; L80-G84 WeakPolarHBondContact O-CA 3.2Å; L80-G84 PolarHBondContact O-N 3.06Å
81	V	97.3	Very high	95.4	Very high	47 Å²	47	42.9 Å²	42.9	29%	0.285	22%	0.219	S	C	.	.	H	α-helix	trans	-63	-48.8	176.3	172.9	0	0	0	0	110.5	L77 H78 G84 I85 Y109	L77-V81 HydrophobicContact CG-CG2 4.31Å; L77-V81 WeakPolarHBondContact O-CG2 3.36Å; L77-V81 PolarHBondContact O-N 2.84Å; H78-V81 PolarHBondContact O-N 3.48Å; V81-G84 PolarHBondContact O-N 3.35Å; V81-I85 HydrophobicContact CG1-CD1 3.73Å; V81-I85 HydrophobicContact CG1-CG1 4.49Å; V81-I85 WeakPolarHBondContact O-CB 3.5Å; V81-I85 WeakPolarHBondContact O-CG1 3.35Å; V81-I85 PolarHBondContact O-N 2.89Å; V81-Y109 HydrophobicContact CB-CE1 4.47Å; V81-Y109 WeakPolarHBondContact CB-OH 3.45Å; V81-Y109 HydrophobicContact CG1-CE1 4.27Å; V81-Y109 HydrophobicContact CG1-CE2 4.09Å; V81-Y109 VanDerWaalsContact CG1-OH 3.27Å; V81-Y109 WeakPolarHBondContact CG1-OH 3.46Å
82	Q	97.7	Very high	95.5	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.7	-48.7	178.2	-171.2	176.9	-11	0	0	111	H78 S86 A106 Y109 I137 T138 I141	H78-Q82 VanDerWaalsContact O-CB 3.26Å; H78-Q82 WeakPolarHBondContact O-CB 3.07Å; H78-Q82 PolarHBondContact O-N 3.44Å; Q82-S86 VanDerWaalsContact O-CB 3.3Å; Q82-S86 WeakPolarHBondContact O-CB 3.41Å; Q82-S86 PolarHBondContact O-N 3.02Å; Q82-S86 PolarHBondContact O-OG 3.45Å; Q82-S86 VanDerWaalsContact O-OG 3.11Å; Q82-A106 PolarHBondContact NE2-O 3.36Å; Q82-Y109 HydrophobicContact CB-CD1 3.72Å; Q82-Y109 HydrophobicContact CB-CE1 3.86Å; Q82-Y109 HydrophobicContact CG-CD1 3.95Å; Q82-I137 HydrophobicContact CG-CG2 4.47Å; Q82-T138 PolarHBondContact NE2-OG1 3.42Å; Q82-I141 HydrophobicContact CG-CD1 4.05Å
83	S	97.3	Very high	95.7	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.3	-46.3	179.9	-57.9	0	0	0	0	111.6	F79 L80 S86 Y87 Y177	F79-S83 VanDerWaalsContact O-CB 3.24Å; F79-S83 WeakPolarHBondContact O-CB 3.15Å; F79-S83 PolarHBondContact O-N 3.36Å; F79-S83 PolarHBondContact O-OG 2.88Å; L80-S83 PolarHBondContact O-N 3.37Å; S83-S86 PolarHBondContact O-N 3.02Å; S83-Y87 PolarHBondContact O-N 3.49Å; S83-Y177 WeakPolarHBondContact O-CE1 3.27Å; S83-Y177 VanDerWaalsContact O-CZ 3.31Å; S83-Y177 PolarHBondContact O-OH 3.1Å
84	G	97.8	Very high	95.8	Very high	28 Å²	28	53 Å²	53	29%	0.289	28%	0.279	S	S	.	.	H	α-helix	trans	-64.4	-50	-175.7	0	0	0	0	0	112.8	L80 V81 S86 Y87 C88	L80-G84 WeakPolarHBondContact O-CA 3.2Å; L80-G84 PolarHBondContact O-N 3.06Å; V81-G84 PolarHBondContact O-N 3.35Å; G84-S86 VanDerWaalsContact C-N 3.34Å; G84-S86 PolarHBondContact O-N 3.07Å; G84-Y87 WeakPolarHBondContact O-CB 3.48Å; G84-Y87 PolarHBondContact O-N 2.93Å; G84-C88 PolarHBondContact O-N 3.29Å; G84-C88 PolarHBondContact O-SG 3.19Å; G84-C88 VanDerWaalsContact O-SG 3.36Å
85	I	98.3	Very high	96	Very high	73 Å²	73	44.3 Å²	44.3	37%	0.374	25%	0.251	S	S	.	.	H	α-helix	trans	-64.6	-41.2	178.6	-64.9	173.6	0	0	0	110.5	V81 Y87 C88 I89 F105	V81-I85 HydrophobicContact CG1-CD1 3.73Å; V81-I85 HydrophobicContact CG1-CG1 4.49Å; V81-I85 WeakPolarHBondContact O-CB 3.5Å; V81-I85 WeakPolarHBondContact O-CG1 3.35Å; V81-I85 PolarHBondContact O-N 2.89Å; I85-Y87 VanDerWaalsContact C-N 3.31Å; I85-Y87 PolarHBondContact O-N 2.92Å; I85-C88 WeakPolarHBondContact O-CB 3.23Å; I85-C88 PolarHBondContact O-N 3.11Å; I85-I89 HydrophobicContact CG2-CD1 4.1Å; I85-I89 HydrophobicContact CG2-CG1 4.48Å; I85-I89 WeakPolarHBondContact O-CG1 3.36Å; I85-I89 PolarHBondContact O-N 3.05Å; I85-F105 HydrophobicContact CB-CD1 4.44Å; I85-F105 HydrophobicContact CB-CE1 3.6Å; I85-F105 HydrophobicContact CB-CE2 4.07Å; I85-F105 HydrophobicContact CB-CZ 3.4Å; I85-F105 HydrophobicContact CD1-CE2 4.02Å; I85-F105 HydrophobicContact CD1-CZ 3.71Å; I85-F105 HydrophobicContact CG1-CZ 4.11Å; I85-F105 HydrophobicContact CG2-CD1 4.02Å; I85-F105 HydrophobicContact CG2-CD2 3.94Å; I85-F105 HydrophobicContact CG2-CE1 3.6Å; I85-F105 HydrophobicContact CG2-CE2 3.51Å; I85-F105 HydrophobicContact CG2-CG 4.19Å; I85-F105 HydrophobicContact CG2-CZ 3.35Å
86	S	98.4	Very high	96.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-37.8	174.4	-72.4	0	0	0	0	113.1	Q82 S83 G84 I89 M90 F105 I141 Y177	Q82-S86 VanDerWaalsContact O-CB 3.3Å; Q82-S86 WeakPolarHBondContact O-CB 3.41Å; Q82-S86 PolarHBondContact O-N 3.02Å; Q82-S86 PolarHBondContact O-OG 3.45Å; Q82-S86 VanDerWaalsContact O-OG 3.11Å; S83-S86 PolarHBondContact O-N 3.02Å; G84-S86 VanDerWaalsContact C-N 3.34Å; G84-S86 PolarHBondContact O-N 3.07Å; S86-I89 WeakPolarHBondContact O-CB 3.45Å; S86-I89 PolarHBondContact O-N 3.3Å; S86-M90 WeakPolarHBondContact O-CG 3.33Å; S86-M90 PolarHBondContact O-N 3.26Å; S86-F105 VanDerWaalsContact OG-CD1 3.32Å; S86-F105 WeakPolarHBondContact OG-CD1 3.19Å; S86-I141 WeakPolarHBondContact OG-CG2 3.43Å; S86-Y177 WeakPolarHBondContact CB-OH 3.48Å
87	Y	98.2	Very high	96.4	Very high	38 Å²	38	49.5 Å²	49.5	15%	0.149	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-43.4	174.5	-169.6	-108.5	0	0	0	111.6	S83 G84 I85 I89 M90 I91 P172 L174 Y177	S83-Y87 PolarHBondContact O-N 3.49Å; G84-Y87 WeakPolarHBondContact O-CB 3.48Å; G84-Y87 PolarHBondContact O-N 2.93Å; I85-Y87 VanDerWaalsContact C-N 3.31Å; I85-Y87 PolarHBondContact O-N 2.92Å; Y87-I89 VanDerWaalsContact C-N 3.27Å; Y87-I89 PolarHBondContact O-N 3Å; Y87-M90 WeakPolarHBondContact O-CB 3.46Å; Y87-M90 PolarHBondContact O-N 2.89Å; Y87-M90 VanDerWaalsContact O-N 3.09Å; Y87-I91 HydrophobicContact CD1-CG1 4.16Å; Y87-I91 HydrophobicContact CE1-CD1 4.29Å; Y87-I91 HydrophobicContact CE1-CG1 3.82Å; Y87-I91 HydrophobicContact CE2-CD1 4.33Å; Y87-I91 HydrophobicContact CE2-CG1 4.4Å; Y87-I91 WeakPolarHBondContact O-CG1 3.35Å; Y87-I91 PolarHBondContact O-N 2.93Å; Y87-P172 PolarHBondContact OH-O 3.38Å; Y87-L174 HydrophobicContact CD1-CD1 3.71Å; Y87-L174 HydrophobicContact CE1-CB 4.06Å; Y87-L174 HydrophobicContact CE1-CD1 3.82Å; Y87-L174 HydrophobicContact CG-CD1 4.26Å; Y87-L174 PolarHBondContact OH-N 2.99Å; Y87-L174 VanDerWaalsContact OH-N 3.17Å; Y87-Y177 AromaticContact CD2-CD1 3.65Å; Y87-Y177 HydrophobicContact CD2-CD1 3.65Å; Y87-Y177 AromaticContact CD2-CD2 3.84Å; Y87-Y177 HydrophobicContact CD2-CD2 3.84Å; Y87-Y177 HydrophobicContact CD2-CE1 4.08Å; Y87-Y177 HydrophobicContact CD2-CE2 4.24Å; Y87-Y177 AromaticContact CD2-CG 3.5Å; Y87-Y177 HydrophobicContact CD2-CG 3.5Å; Y87-Y177 HydrophobicContact CE2-CD1 4.44Å; Y87-Y177 HydrophobicContact CE2-CD2 4.47Å; Y87-Y177 HydrophobicContact CE2-CG 4.02Å; Y87-Y177 AromaticContact CG-CD1 3.97Å; Y87-Y177 HydrophobicContact CG-CD1 3.97Å; Y87-Y177 HydrophobicContact CG-CE1 4.15Å; Y87-Y177 HydrophobicContact CG-CG 4.29Å
88	C	98	Very high	96.5	Very high	67 Å²	67	45 Å²	45	45%	0.453	26%	0.255	S	S	.	.	H	α-helix	trans	-57.4	-42	173.3	-66.2	0	0	0	0	111.6	G84 I85 I91 I92	G84-C88 PolarHBondContact O-N 3.29Å; G84-C88 PolarHBondContact O-SG 3.19Å; G84-C88 VanDerWaalsContact O-SG 3.36Å; I85-C88 WeakPolarHBondContact O-CB 3.23Å; I85-C88 PolarHBondContact O-N 3.11Å; C88-I91 PolarHBondContact O-N 3.46Å; C88-I92 HydrophobicContact CB-CD1 4.34Å; C88-I92 VanDerWaalsContact O-CB 3.32Å; C88-I92 WeakPolarHBondContact O-CB 3.23Å; C88-I92 WeakPolarHBondContact O-CD1 3.46Å; C88-I92 VanDerWaalsContact O-CG1 3.22Å; C88-I92 WeakPolarHBondContact O-CG1 3.34Å; C88-I92 PolarHBondContact O-N 2.95Å
89	I	98.1	Very high	96.6	Very high	30 Å²	30	43.6 Å²	43.6	15%	0.154	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-45.5	174.1	-67.5	168.1	0	0	0	110.7	I85 S86 Y87 I91 I92 I93 C102 F105	I85-I89 HydrophobicContact CG2-CD1 4.1Å; I85-I89 HydrophobicContact CG2-CG1 4.48Å; I85-I89 WeakPolarHBondContact O-CG1 3.36Å; I85-I89 PolarHBondContact O-N 3.05Å; S86-I89 WeakPolarHBondContact O-CB 3.45Å; S86-I89 PolarHBondContact O-N 3.3Å; Y87-I89 VanDerWaalsContact C-N 3.27Å; Y87-I89 PolarHBondContact O-N 3Å; I89-I91 VanDerWaalsContact C-N 3.28Å; I89-I91 PolarHBondContact O-N 3.26Å; I89-I92 PolarHBondContact O-N 3.38Å; I89-I93 HydrophobicContact CG2-CB 4.38Å; I89-I93 HydrophobicContact CG2-CG1 3.83Å; I89-I93 WeakPolarHBondContact O-CB 3.35Å; I89-I93 WeakPolarHBondContact O-CG1 3.3Å; I89-I93 PolarHBondContact O-N 3.16Å; I89-C102 VanDerWaalsContact CG2-SG 3.57Å; I89-F105 HydrophobicContact CD1-CB 3.63Å; I89-F105 HydrophobicContact CD1-CD1 4.02Å; I89-F105 HydrophobicContact CD1-CD2 4.47Å; I89-F105 HydrophobicContact CD1-CG 3.76Å
90	M	96.9	Very high	96.7	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-32.9	178.9	-69.3	172.4	179.4	0	0	113.5	S86 Y87 M98 C102 I141 L144 A145 M171 Y177	S86-M90 WeakPolarHBondContact O-CG 3.33Å; S86-M90 PolarHBondContact O-N 3.26Å; Y87-M90 WeakPolarHBondContact O-CB 3.46Å; Y87-M90 PolarHBondContact O-N 2.89Å; Y87-M90 VanDerWaalsContact O-N 3.09Å; M90-M98 HydrophobicContact CB-SD 4.13Å; M90-M98 HydrophobicContact CG-SD 4.26Å; M90-C102 VanDerWaalsContact CG-SG 3.55Å; M90-I141 HydrophobicContact CE-CG2 4.01Å; M90-I141 WeakPolarHBondContact CE-O 3.23Å; M90-L144 HydrophobicContact CE-CB 4.48Å; M90-L144 HydrophobicContact CE-CD2 4.41Å; M90-L144 HydrophobicContact CE-CG 4.33Å; M90-A145 HydrophobicContact CE-CB 3.77Å; M90-M171 WeakPolarHBondContact O-CE 3.41Å; M90-Y177 HydrophobicContact CE-CE2 4.15Å; M90-Y177 HydrophobicContact SD-CD2 4.42Å; M90-Y177 HydrophobicContact SD-CE2 3.95Å
91	I	96.2	Very high	96.8	Very high	92 Å²	92	50.8 Å²	50.8	47%	0.472	28%	0.278	S	S	.	.	H	α-helix	trans	-84	-37.5	-179.1	-62.3	-59.5	0	0	0	112	Y87 C88 I89	Y87-I91 HydrophobicContact CD1-CG1 4.16Å; Y87-I91 HydrophobicContact CE1-CD1 4.29Å; Y87-I91 HydrophobicContact CE1-CG1 3.82Å; Y87-I91 HydrophobicContact CE2-CD1 4.33Å; Y87-I91 HydrophobicContact CE2-CG1 4.4Å; Y87-I91 WeakPolarHBondContact O-CG1 3.35Å; Y87-I91 PolarHBondContact O-N 2.93Å; C88-I91 PolarHBondContact O-N 3.46Å; I89-I91 VanDerWaalsContact C-N 3.28Å; I89-I91 PolarHBondContact O-N 3.26Å
92	I	96.8	Very high	96.8	Very high	134 Å²	134	48.5 Å²	48.5	69%	0.687	26%	0.264	S	S	*	.	H	α-helix	trans	-86.3	-42.2	-174.7	-63.4	167.7	0	0	0	111.4	C88 I89	C88-I92 HydrophobicContact CB-CD1 4.34Å; C88-I92 VanDerWaalsContact O-CB 3.32Å; C88-I92 WeakPolarHBondContact O-CB 3.23Å; C88-I92 WeakPolarHBondContact O-CD1 3.46Å; C88-I92 VanDerWaalsContact O-CG1 3.22Å; C88-I92 WeakPolarHBondContact O-CG1 3.34Å; C88-I92 PolarHBondContact O-N 2.95Å; I89-I92 PolarHBondContact O-N 3.38Å
93	I	95.8	Very high	96.8	Very high	50 Å²	50	51 Å²	51	26%	0.256	28%	0.275	S	S	.	.	S	Bend	trans	-82.6	128.8	-179.7	-53.4	-57	0	0	0	108.5	I89 N97 M98 Y101	I89-I93 HydrophobicContact CG2-CB 4.38Å; I89-I93 HydrophobicContact CG2-CG1 3.83Å; I89-I93 WeakPolarHBondContact O-CB 3.35Å; I89-I93 WeakPolarHBondContact O-CG1 3.3Å; I89-I93 PolarHBondContact O-N 3.16Å; I93-N97 HydrophobicContact CG2-CB 4.09Å; I93-M98 HydrophobicContact CB-CB 4.03Å; I93-M98 HydrophobicContact CG2-CB 4.09Å; I93-Y101 HydrophobicContact CG1-CD2 4.49Å; I93-Y101 HydrophobicContact CG1-CG 4.44Å; I93-Y101 HydrophobicContact CG2-CD2 3.78Å; I93-Y101 HydrophobicContact CG2-CE2 4.14Å; I93-Y101 HydrophobicContact CG2-CG 4.49Å
94	G	92.6	Very high	96.8	Very high	51 Å²	51	56 Å²	56	53%	0.526	31%	0.305	S	S	.	.			trans	-54.5	151.6	177.7	0	0	0	0	0	113.1	E96 N97 M98	G94-E96 PolarHBondContact O-N 3.46Å; G94-N97 PolarHBondContact O-N 3.14Å; G94-M98 PolarHBondContact O-N 3.02Å; G94-M98 VanDerWaalsContact O-N 3.11Å
95	V	94.9	Very high	96.8	Very high	39 Å²	39	56.9 Å²	56.9	24%	0.236	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-28.5	-175	-68.8	0	0	0	0	114.1	N97 H149 M152 F153 M171	V95-N97 PolarHBondContact O-N 3.35Å; V95-H149 PolarHBondContact O-CD2 2.82Å; V95-H149 VanDerWaalsContact O-CD2 3.26Å; V95-M152 HydrophobicContact CB-CB 4.4Å; V95-M152 HydrophobicContact CG1-CB 4.08Å; V95-M152 HydrophobicContact CG1-CE 4.33Å; V95-M152 HydrophobicContact CG1-SD 4.39Å; V95-F153 HydrophobicContact CB-CB 4.44Å; V95-F153 HydrophobicContact CG2-CB 4.06Å; V95-F153 HydrophobicContact CG2-CD2 4.21Å; V95-M171 HydrophobicContact CG1-CE 3.81Å
96	E	94.8	Very high	96.8	Very high	103 Å²	103	53.4 Å²	53.4	48%	0.481	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-44.6	175.8	-179.3	175.1	-171.4	0	0	112.5	G94 H99 H149 F153	G94-E96 PolarHBondContact O-N 3.46Å; E96-H99 PolarHBondContact O-CE1 3.36Å; E96-H99 PolarHBondContact O-ND1 3.03Å; E96-H149 PolarHBondContact O-CD2 2.9Å; E96-H149 PolarHBondContact O-NE2 3.02Å; E96-F153 HydrophobicContact CB-CD2 3.87Å; E96-F153 HydrophobicContact CB-CE1 4.37Å; E96-F153 HydrophobicContact CB-CE2 3.59Å; E96-F153 HydrophobicContact CB-CG 4.36Å; E96-F153 HydrophobicContact CB-CZ 3.87Å; E96-F153 HydrophobicContact CG-CD2 4.41Å; E96-F153 HydrophobicContact CG-CE1 3.95Å; E96-F153 HydrophobicContact CG-CE2 3.74Å; E96-F153 HydrophobicContact CG-CZ 3.47Å; E96-F153 VanDerWaalsContact CG-CZ 3.47Å
97	N	95.7	Very high	96.8	Very high	70 Å²	70	54.2 Å²	54.2	37%	0.374	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	-15.2	-167.3	-73.3	-56	0	0	0	114.4	I93 G94 V95 H99 N100 Y101	I93-N97 HydrophobicContact CG2-CB 4.09Å; G94-N97 PolarHBondContact O-N 3.14Å; V95-N97 PolarHBondContact O-N 3.35Å; N97-H99 PolarHBondContact O-N 3.02Å; N97-N100 PolarHBondContact O-N 2.92Å; N97-Y101 HydrophobicContact CB-CD2 4.19Å; N97-Y101 HydrophobicContact CB-CE2 3.95Å; N97-Y101 WeakPolarHBondContact O-CD2 3.49Å; N97-Y101 PolarHBondContact O-N 3.35Å
98	M	95.9	Very high	96.8	Very high	0 Å²	0	54 Å²	54	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-55.9	-30.3	-171.7	66.1	170.2	-170.5	0	0	114.5	M90 I93 G94 N100 Y101 C102 I148 M171	M90-M98 HydrophobicContact CB-SD 4.13Å; M90-M98 HydrophobicContact CG-SD 4.26Å; I93-M98 HydrophobicContact CB-CB 4.03Å; I93-M98 HydrophobicContact CG2-CB 4.09Å; G94-M98 PolarHBondContact O-N 3.02Å; G94-M98 VanDerWaalsContact O-N 3.11Å; M98-N100 VanDerWaalsContact C-N 3.33Å; M98-N100 PolarHBondContact O-N 3.48Å; M98-Y101 PolarHBondContact O-N 3.41Å; M98-C102 VanDerWaalsContact O-CB 3.26Å; M98-C102 WeakPolarHBondContact O-CB 3.46Å; M98-C102 PolarHBondContact O-N 3.15Å; M98-C102 PolarHBondContact O-SG 3.34Å; M98-I148 HydrophobicContact CE-CB 3.3Å; M98-I148 HydrophobicContact CE-CD1 4.11Å; M98-I148 HydrophobicContact CE-CG1 4.32Å; M98-I148 HydrophobicContact CE-CG2 3.22Å; M98-M171 HydrophobicContact CE-CE 4.04Å; M98-M171 HydrophobicContact SD-CE 3.69Å
99	H	96.6	Very high	96.8	Very high	24 Å²	24	53 Å²	53	11%	0.111	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-37.7	-179.9	64.7	-82.2	0	0	0	111.9	E96 N97 F103 A145 H149	E96-H99 PolarHBondContact O-CE1 3.36Å; E96-H99 PolarHBondContact O-ND1 3.03Å; N97-H99 PolarHBondContact O-N 3.02Å; H99-F103 WeakPolarHBondContact O-CB 3.47Å; H99-F103 PolarHBondContact O-N 2.88Å; H99-A145 HydrophobicContact CB-CB 4.02Å; H99-H149 HydrophobicContact CB-CB 4.26Å; H99-H149 AromaticContact CE1-CD2 3.25Å; H99-H149 PolarHBondContact CE1-CD2 2.79Å; H99-H149 AromaticContact CE1-CE1 3.84Å; H99-H149 AromaticContact CE1-CG 3.65Å; H99-H149 AromaticContact CE1-NE2 3.38Å; H99-H149 PolarHBondContact CE1-NE2 2.69Å; H99-H149 AromaticContact ND1-CD2 3.22Å; H99-H149 PolarHBondContact ND1-CD2 3.37Å; H99-H149 AromaticContact ND1-CG 3.39Å; H99-H149 AromaticContact ND1-NE2 3.87Å
100	N	96.8	Very high	96.7	Very high	83 Å²	83	51.5 Å²	51.5	44%	0.444	28%	0.276	S	S	.	.	H	α-helix	trans	-68.1	-46.1	176.1	-66.8	-38.9	0	0	0	111.2	N97 M98 F103 V104	N97-N100 PolarHBondContact O-N 2.92Å; M98-N100 VanDerWaalsContact C-N 3.33Å; M98-N100 PolarHBondContact O-N 3.48Å; N100-F103 WeakPolarHBondContact O-CB 3.37Å; N100-F103 PolarHBondContact O-N 2.95Å; N100-V104 WeakPolarHBondContact O-CG2 3.48Å; N100-V104 PolarHBondContact O-N 2.64Å
101	Y	98	Very high	96.6	Very high	135 Å²	135	53.1 Å²	53.1	53%	0.529	29%	0.286	S	S	.	.	H	α-helix	trans	-65.7	-42.6	178.2	-72.5	-87.5	0	0	0	112.1	I93 N97 M98 F103 V104 F105	I93-Y101 HydrophobicContact CG1-CD2 4.49Å; I93-Y101 HydrophobicContact CG1-CG 4.44Å; I93-Y101 HydrophobicContact CG2-CD2 3.78Å; I93-Y101 HydrophobicContact CG2-CE2 4.14Å; I93-Y101 HydrophobicContact CG2-CG 4.49Å; N97-Y101 HydrophobicContact CB-CD2 4.19Å; N97-Y101 HydrophobicContact CB-CE2 3.95Å; N97-Y101 WeakPolarHBondContact O-CD2 3.49Å; N97-Y101 PolarHBondContact O-N 3.35Å; M98-Y101 PolarHBondContact O-N 3.41Å; Y101-F103 VanDerWaalsContact C-N 3.29Å; Y101-F103 PolarHBondContact O-N 2.84Å; Y101-V104 PolarHBondContact O-N 2.88Å; Y101-F105 WeakPolarHBondContact O-CB 3.49Å; Y101-F105 PolarHBondContact O-N 3Å
102	C	97.9	Very high	96.5	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-40.7	173.9	-72.5	0	0	0	0	111.3	I89 M90 M98 A106 I141 A145	I89-C102 VanDerWaalsContact CG2-SG 3.57Å; M90-C102 VanDerWaalsContact CG-SG 3.55Å; M98-C102 VanDerWaalsContact O-CB 3.26Å; M98-C102 WeakPolarHBondContact O-CB 3.46Å; M98-C102 PolarHBondContact O-N 3.15Å; M98-C102 PolarHBondContact O-SG 3.34Å; C102-A106 WeakPolarHBondContact O-CB 3.26Å; C102-A106 PolarHBondContact O-N 3.2Å; C102-I141 HydrophobicContact CB-CG2 4.35Å; C102-A145 HydrophobicContact CB-CB 3.77Å
103	F	97.6	Very high	96.3	Very high	51 Å²	51	46.7 Å²	46.7	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-63.6	-51.6	177.7	-168.2	-82.8	0	0	0	112.1	H99 N100 Y101 F105 L107 T142 V352 L368	H99-F103 WeakPolarHBondContact O-CB 3.47Å; H99-F103 PolarHBondContact O-N 2.88Å; N100-F103 WeakPolarHBondContact O-CB 3.37Å; N100-F103 PolarHBondContact O-N 2.95Å; Y101-F103 VanDerWaalsContact C-N 3.29Å; Y101-F103 PolarHBondContact O-N 2.84Å; F103-F105 PolarHBondContact O-N 3.31Å; F103-L107 HydrophobicContact CE1-CD2 3.8Å; F103-L107 HydrophobicContact CZ-CD2 4.25Å; F103-L107 WeakPolarHBondContact O-CB 3.49Å; F103-L107 PolarHBondContact O-N 3.33Å; F103-T142 HydrophobicContact CB-CG2 4.24Å; F103-T142 HydrophobicContact CD2-CG2 3.75Å; F103-T142 HydrophobicContact CG-CG2 4.25Å; F103-V352 HydrophobicContact CE2-CB 4.35Å; F103-V352 HydrophobicContact CE2-CG2 3.94Å; F103-L368 HydrophobicContact CE1-CD1 4.13Å; F103-L368 HydrophobicContact CE2-CD1 4.39Å; F103-L368 HydrophobicContact CE2-CD2 4.16Å; F103-L368 HydrophobicContact CZ-CD1 3.47Å; F103-L368 VanDerWaalsContact CZ-CD1 3.47Å; F103-L368 HydrophobicContact CZ-CD2 3.74Å; F103-L368 HydrophobicContact CZ-CG 4.25Å
104	V	98	Very high	96	Very high	105 Å²	105	44.4 Å²	44.4	64%	0.636	25%	0.246	S	C	*	.	H	α-helix	trans	-60.3	-47.2	178.8	172	0	0	0	0	110.9	N100 Y101 G108	N100-V104 WeakPolarHBondContact O-CG2 3.48Å; N100-V104 PolarHBondContact O-N 2.64Å; Y101-V104 PolarHBondContact O-N 2.88Å; V104-G108 WeakPolarHBondContact O-CA 3.4Å; V104-G108 PolarHBondContact O-N 2.99Å
105	F	98.4	Very high	95.8	Very high	47 Å²	47	44.5 Å²	44.5	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-51.7	-180	172.2	-96.5	0	0	0	112.2	I85 S86 I89 Y101 F103 L107 G108 Y109	I85-F105 HydrophobicContact CB-CD1 4.44Å; I85-F105 HydrophobicContact CB-CE1 3.6Å; I85-F105 HydrophobicContact CB-CE2 4.07Å; I85-F105 HydrophobicContact CB-CZ 3.4Å; I85-F105 HydrophobicContact CD1-CE2 4.02Å; I85-F105 HydrophobicContact CD1-CZ 3.71Å; I85-F105 HydrophobicContact CG1-CZ 4.11Å; I85-F105 HydrophobicContact CG2-CD1 4.02Å; I85-F105 HydrophobicContact CG2-CD2 3.94Å; I85-F105 HydrophobicContact CG2-CE1 3.6Å; I85-F105 HydrophobicContact CG2-CE2 3.51Å; I85-F105 HydrophobicContact CG2-CG 4.19Å; I85-F105 HydrophobicContact CG2-CZ 3.35Å; S86-F105 VanDerWaalsContact OG-CD1 3.32Å; S86-F105 WeakPolarHBondContact OG-CD1 3.19Å; I89-F105 HydrophobicContact CD1-CB 3.63Å; I89-F105 HydrophobicContact CD1-CD1 4.02Å; I89-F105 HydrophobicContact CD1-CD2 4.47Å; I89-F105 HydrophobicContact CD1-CG 3.76Å; Y101-F105 WeakPolarHBondContact O-CB 3.49Å; Y101-F105 PolarHBondContact O-N 3Å; F103-F105 PolarHBondContact O-N 3.31Å; F105-L107 PolarHBondContact O-N 2.54Å; F105-G108 PolarHBondContact O-N 2.87Å; F105-Y109 HydrophobicContact CZ-CD2 4.5Å; F105-Y109 HydrophobicContact CZ-CG 4.27Å; F105-Y109 WeakPolarHBondContact O-CB 3.08Å; F105-Y109 PolarHBondContact O-N 3.12Å
106	A	98.1	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-43.3	-174.6	0	0	0	0	0	111.7	Q82 C102 L110 T138 I141 T142	Q82-A106 PolarHBondContact NE2-O 3.36Å; C102-A106 WeakPolarHBondContact O-CB 3.26Å; C102-A106 PolarHBondContact O-N 3.2Å; A106-L110 WeakPolarHBondContact O-CB 3.45Å; A106-L110 PolarHBondContact O-N 3.2Å; A106-L110 VanDerWaalsContact O-N 3.14Å; A106-T138 HydrophobicContact CB-CG2 4.11Å; A106-I141 HydrophobicContact CB-CG2 4.13Å; A106-T142 HydrophobicContact CB-CG2 4.2Å
107	L	97.7	Very high	94.5	Very high	18 Å²	18	41.2 Å²	41.2	9%	0.094	22%	0.221	C	C	.	.	H	α-helix	trans	-70.5	-43	176.8	-168.4	66.5	0	0	0	111.2	F103 F105 L110 T111 T138 L368 I371 W372	F103-L107 HydrophobicContact CE1-CD2 3.8Å; F103-L107 HydrophobicContact CZ-CD2 4.25Å; F103-L107 WeakPolarHBondContact O-CB 3.49Å; F103-L107 PolarHBondContact O-N 3.33Å; F105-L107 PolarHBondContact O-N 2.54Å; L107-L110 HydrophobicContact CD1-CD2 4.46Å; L107-L110 WeakPolarHBondContact O-CB 3.22Å; L107-L110 PolarHBondContact O-N 2.96Å; L107-T111 PolarHBondContact O-N 3.44Å; L107-T111 PolarHBondContact O-OG1 3.46Å; L107-T138 HydrophobicContact CD1-CG2 4.37Å; L107-L368 HydrophobicContact CD1-CD1 4.41Å; L107-L368 HydrophobicContact CD2-CD1 3.61Å; L107-I371 HydrophobicContact CD1-CG2 4.13Å; L107-I371 HydrophobicContact CD2-CG2 3.84Å; L107-I371 HydrophobicContact CG-CG2 3.94Å; L107-W372 HydrophobicContact CD1-CB 4.36Å
108	G	97.6	Very high	93.6	Very high	33 Å²	33	38.2 Å²	38.2	34%	0.34	20%	0.204	S	C	.	.	H	α-helix	trans	-62.5	-43.4	178.4	0	0	0	0	0	112.8	V104 F105 T111 V112	V104-G108 WeakPolarHBondContact O-CA 3.4Å; V104-G108 PolarHBondContact O-N 2.99Å; F105-G108 PolarHBondContact O-N 2.87Å; G108-T111 WeakPolarHBondContact O-CB 3.38Å; G108-T111 PolarHBondContact O-N 3.4Å; G108-V112 WeakPolarHBondContact O-CG2 3.14Å; G108-V112 PolarHBondContact O-N 3.43Å
109	Y	97.6	Very high	92.5	Very high	45 Å²	45	46.7 Å²	46.7	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-66.3	-40.6	177	-172.8	-106.8	0	0	0	112.3	H78 V81 Q82 F105 T111 V112 C113 M134	H78-Y109 HydrophobicContact CB-CE1 4.24Å; H78-Y109 AromaticContact ND1-CZ 3.63Å; H78-Y109 PolarHBondContact ND1-OH 3.34Å; V81-Y109 HydrophobicContact CB-CE1 4.47Å; V81-Y109 WeakPolarHBondContact CB-OH 3.45Å; V81-Y109 HydrophobicContact CG1-CE1 4.27Å; V81-Y109 HydrophobicContact CG1-CE2 4.09Å; V81-Y109 VanDerWaalsContact CG1-OH 3.27Å; V81-Y109 WeakPolarHBondContact CG1-OH 3.46Å; Q82-Y109 HydrophobicContact CB-CD1 3.72Å; Q82-Y109 HydrophobicContact CB-CE1 3.86Å; Q82-Y109 HydrophobicContact CG-CD1 3.95Å; F105-Y109 HydrophobicContact CZ-CD2 4.5Å; F105-Y109 HydrophobicContact CZ-CG 4.27Å; F105-Y109 WeakPolarHBondContact O-CB 3.08Å; F105-Y109 PolarHBondContact O-N 3.12Å; Y109-T111 VanDerWaalsContact C-N 3.34Å; Y109-V112 PolarHBondContact O-N 2.91Å; Y109-C113 PolarHBondContact O-N 2.88Å; Y109-C113 PolarHBondContact O-SG 2.59Å; Y109-M134 HydrophobicContact CD1-CE 3.63Å; Y109-M134 HydrophobicContact CE1-CE 3.62Å
110	L	96.8	Very high	91.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.6	-47.9	170.4	172.3	66.2	0	0	0	110.9	A106 L107 V112 C113 Q114 M134 M135 T138	A106-L110 WeakPolarHBondContact O-CB 3.45Å; A106-L110 PolarHBondContact O-N 3.2Å; A106-L110 VanDerWaalsContact O-N 3.14Å; L107-L110 HydrophobicContact CD1-CD2 4.46Å; L107-L110 WeakPolarHBondContact O-CB 3.22Å; L107-L110 PolarHBondContact O-N 2.96Å; L110-V112 PolarHBondContact O-N 2.79Å; L110-C113 PolarHBondContact O-N 2.93Å; L110-Q114 HydrophobicContact CD1-CG 4.14Å; L110-Q114 HydrophobicContact CG-CG 4.41Å; L110-Q114 WeakPolarHBondContact O-CG 3.29Å; L110-Q114 PolarHBondContact O-N 3.14Å; L110-M134 HydrophobicContact CD1-CB 3.73Å; L110-M135 HydrophobicContact CD1-CG 3.93Å; L110-M135 HydrophobicContact CD2-CG 3.94Å; L110-T138 HydrophobicContact CD2-CG2 4.31Å
111	T	95.4	Very high	89.3	Confident	35 Å²	35	51.1 Å²	51.1	22%	0.215	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-44	178.1	-60.1	0	0	0	0	111.5	L107 G108 Y109 C113 Q114 V115 V375	L107-T111 PolarHBondContact O-N 3.44Å; L107-T111 PolarHBondContact O-OG1 3.46Å; G108-T111 WeakPolarHBondContact O-CB 3.38Å; G108-T111 PolarHBondContact O-N 3.4Å; Y109-T111 VanDerWaalsContact C-N 3.34Å; T111-C113 VanDerWaalsContact C-N 3.33Å; T111-C113 PolarHBondContact O-N 2.68Å; T111-Q114 PolarHBondContact O-N 3.19Å; T111-V115 HydrophobicContact CG2-CG2 4.31Å; T111-V115 VanDerWaalsContact O-CG2 3.28Å; T111-V115 WeakPolarHBondContact O-CG2 3.34Å; T111-V115 PolarHBondContact O-N 3.37Å; T111-V375 HydrophobicContact CG2-CG1 3.97Å
112	V	93.9	Very high	87.4	Confident	87 Å²	87	49.8 Å²	49.8	53%	0.527	26%	0.259	S	S	.	.	H	α-helix	trans	-57.5	-46.7	175.1	169.7	0	0	0	0	110.7	G108 Y109 L110 Q114 V115 T116	G108-V112 WeakPolarHBondContact O-CG2 3.14Å; G108-V112 PolarHBondContact O-N 3.43Å; Y109-V112 PolarHBondContact O-N 2.91Å; L110-V112 PolarHBondContact O-N 2.79Å; V112-Q114 VanDerWaalsContact C-N 3.35Å; V112-Q114 PolarHBondContact O-N 3.08Å; V112-V115 PolarHBondContact O-N 3.15Å; V112-T116 WeakPolarHBondContact O-CB 3.44Å; V112-T116 PolarHBondContact O-N 3.17Å; V112-T116 PolarHBondContact O-OG1 3.2Å
113	C	91.6	Very high	85.2	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.034	28%	0.282	C	S	.	.	H	α-helix	trans	-64.2	-39	178.4	-66.8	0	0	0	0	112.5	Y109 L110 T111 R117 F130 M134	Y109-C113 PolarHBondContact O-N 2.88Å; Y109-C113 PolarHBondContact O-SG 2.59Å; L110-C113 PolarHBondContact O-N 2.93Å; T111-C113 VanDerWaalsContact C-N 3.33Å; T111-C113 PolarHBondContact O-N 2.68Å; C113-R117 WeakPolarHBondContact O-CB 3.43Å; C113-R117 PolarHBondContact O-N 3.05Å; C113-F130 HydrophobicContact CB-CE2 4.01Å; C113-F130 HydrophobicContact CB-CZ 4.47Å; C113-M134 HydrophobicContact CB-CE 3.98Å; C113-M134 HydrophobicContact CB-SD 3.98Å; C113-M134 VanDerWaalsContact SG-CE 3.59Å
114	Q	90.1	Very high	83	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-66.9	-38.6	175.2	-71.7	168.5	-25.8	0	0	112.1	L110 T111 V112 R117 V118 W372 H373	L110-Q114 HydrophobicContact CD1-CG 4.14Å; L110-Q114 HydrophobicContact CG-CG 4.41Å; L110-Q114 WeakPolarHBondContact O-CG 3.29Å; L110-Q114 PolarHBondContact O-N 3.14Å; T111-Q114 PolarHBondContact O-N 3.19Å; V112-Q114 VanDerWaalsContact C-N 3.35Å; V112-Q114 PolarHBondContact O-N 3.08Å; Q114-R117 PolarHBondContact O-N 3.11Å; Q114-V118 VanDerWaalsContact O-CG2 3.27Å; Q114-V118 WeakPolarHBondContact O-CG2 3.28Å; Q114-V118 PolarHBondContact O-N 3.33Å; Q114-W372 PolarHBondContact NE2-O 2.84Å; Q114-H373 PolarHBondContact NE2-O 3.49Å
115	V	88.7	Confident	80.9	Confident	53 Å²	53	55.3 Å²	55.3	32%	0.321	28%	0.282	S	S	.	.	H	α-helix	trans	-62.9	-52.6	173.4	169.3	0	0	0	0	110.1	T111 V112 R117 V118 Y119 V375	T111-V115 HydrophobicContact CG2-CG2 4.31Å; T111-V115 VanDerWaalsContact O-CG2 3.28Å; T111-V115 WeakPolarHBondContact O-CG2 3.34Å; T111-V115 PolarHBondContact O-N 3.37Å; V112-V115 PolarHBondContact O-N 3.15Å; V115-R117 PolarHBondContact O-N 3.34Å; V115-V118 PolarHBondContact O-N 2.99Å; V115-V118 VanDerWaalsContact O-N 3.09Å; V115-Y119 HydrophobicContact CG1-CD2 3.73Å; V115-Y119 HydrophobicContact CG1-CE2 4.14Å; V115-Y119 WeakPolarHBondContact O-CD2 3.46Å; V115-Y119 PolarHBondContact O-N 3.26Å; V115-V375 HydrophobicContact CG2-CB 4.34Å; V115-V375 HydrophobicContact CG2-CG1 3.57Å; V115-V375 HydrophobicContact CG2-CG2 4.12Å
116	T	83.1	Confident	78.6	Confident	49 Å²	49	57 Å²	57	30%	0.301	29%	0.288	S	S	.	.	H	α-helix	trans	-51.4	-46.2	176.3	-61.3	0	0	0	0	110.3	V112 I120 F121	V112-T116 WeakPolarHBondContact O-CB 3.44Å; V112-T116 PolarHBondContact O-N 3.17Å; V112-T116 PolarHBondContact O-OG1 3.2Å; T116-I120 HydrophobicContact CG2-CD1 3.63Å; T116-I120 HydrophobicContact CG2-CG1 4.34Å; T116-I120 WeakPolarHBondContact O-CA 3.5Å; T116-I120 WeakPolarHBondContact O-CB 3.43Å; T116-I120 VanDerWaalsContact O-CG1 3.25Å; T116-I120 WeakPolarHBondContact O-CG1 3.22Å; T116-I120 PolarHBondContact O-N 2.87Å; T116-F121 HydrophobicContact CG2-CE2 4.16Å
117	R	78.9	Confident	76.7	Confident	25 Å²	25	59.7 Å²	59.7	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-51.9	176.4	-174.5	-169.8	63.9	106	3.1	113.1	C113 Q114 V115 Y119 F121 D129	C113-R117 WeakPolarHBondContact O-CB 3.43Å; C113-R117 PolarHBondContact O-N 3.05Å; Q114-R117 PolarHBondContact O-N 3.11Å; V115-R117 PolarHBondContact O-N 3.34Å; R117-Y119 PolarHBondContact O-N 3.15Å; R117-F121 WeakPolarHBondContact O-CA 3.41Å; R117-F121 PolarHBondContact O-N 2.76Å; R117-D129 WeakPolarHBondContact CD-OD2 3.46Å; R117-D129 IonicContact CZ-OD2 3.93Å; R117-D129 IonicContact NE-OD2 2.95Å; R117-D129 PolarHBondContact NE-OD2 3.49Å; R117-D129 IonicContact NH1-OD2 3.26Å; R117-D129 PolarHBondContact NH1-OD2 2.75Å; R117-D129 VanDerWaalsContact NH1-OD2 3.08Å
118	V	77.8	Confident	74.7	Confident	6 Å²	6	60.3 Å²	60.3	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-38.6	-174.8	172.3	0	0	0	0	112.4	Q114 V115 Y123 V375 Y376	Q114-V118 VanDerWaalsContact O-CG2 3.27Å; Q114-V118 WeakPolarHBondContact O-CG2 3.28Å; Q114-V118 PolarHBondContact O-N 3.33Å; V115-V118 PolarHBondContact O-N 2.99Å; V115-V118 VanDerWaalsContact O-N 3.09Å; V118-Y123 HydrophobicContact CG1-CD2 3.83Å; V118-Y123 HydrophobicContact CG1-CE2 4.32Å; V118-V375 HydrophobicContact CB-CG2 4.17Å; V118-V375 HydrophobicContact CG1-CG2 4.49Å; V118-V375 HydrophobicContact CG2-CG2 3.85Å; V118-Y376 HydrophobicContact CG1-CD1 4.48Å; V118-Y376 HydrophobicContact CG1-CE1 3.88Å; V118-Y376 HydrophobicContact CG2-CD2 4.32Å; V118-Y376 HydrophobicContact CG2-CE1 3.98Å; V118-Y376 HydrophobicContact CG2-CE2 3.79Å
119	Y	72.3	Confident	73.8	Confident	178 Å²	178	60 Å²	60	70%	0.698	31%	0.305	S	S	*	.	H	α-helix	trans	-96.9	-16.1	-173.6	-68.5	-77.8	0	0	0	114.3	V115 R117	V115-Y119 HydrophobicContact CG1-CD2 3.73Å; V115-Y119 HydrophobicContact CG1-CE2 4.14Å; V115-Y119 WeakPolarHBondContact O-CD2 3.46Å; V115-Y119 PolarHBondContact O-N 3.26Å; R117-Y119 PolarHBondContact O-N 3.15Å
120	I	68.2	Low	73.4	Confident	113 Å²	113	58.4 Å²	58.4	58%	0.579	30%	0.299	S	S	*	.	H	α-helix	trans	-111.6	-30.2	-178.1	-50	-175.6	0	0	0	112.5	T116	T116-I120 HydrophobicContact CG2-CD1 3.63Å; T116-I120 HydrophobicContact CG2-CG1 4.34Å; T116-I120 WeakPolarHBondContact O-CA 3.5Å; T116-I120 WeakPolarHBondContact O-CB 3.43Å; T116-I120 VanDerWaalsContact O-CG1 3.25Å; T116-I120 WeakPolarHBondContact O-CG1 3.22Å; T116-I120 PolarHBondContact O-N 2.87Å
121	F	58.3	Low	73	Confident	87 Å²	87	58.8 Å²	58.8	38%	0.382	30%	0.302	S	S	.	.	S	Bend	trans	-122.3	32.4	-166.7	-64.9	-76	0	0	0	114.8	Y75 T116 R117	Y75-F121 HydrophobicContact CE1-CE2 4.47Å; Y75-F121 WeakPolarHBondContact OH-CE1 3.27Å; Y75-F121 WeakPolarHBondContact OH-CZ 3.19Å; T116-F121 HydrophobicContact CG2-CE2 4.16Å; R117-F121 WeakPolarHBondContact O-CA 3.41Å; R117-F121 PolarHBondContact O-N 2.76Å
122	D	56.8	Low	72.7	Confident	108 Å²	108	58.6 Å²	58.6	58%	0.578	31%	0.307	S	S	*	.			trans	85	119.9	178.3	-59	-45.4	0	0	0	116.8
123	Y	53.1	Low	72.7	Confident	121 Å²	121	54.6 Å²	54.6	48%	0.475	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	130.4	173.8	-173.7	-86.3	0	0	0	111	V118 Y376 S437	V118-Y123 HydrophobicContact CG1-CD2 3.83Å; V118-Y123 HydrophobicContact CG1-CE2 4.32Å; Y123-Y376 HydrophobicContact CD2-CD1 4.46Å; Y123-Y376 AromaticContact CD2-CE1 3.75Å; Y123-Y376 HydrophobicContact CD2-CE1 3.75Å; Y123-Y376 HydrophobicContact CE1-CE1 4.47Å; Y123-Y376 AromaticContact CE2-CD1 3.88Å; Y123-Y376 HydrophobicContact CE2-CD1 3.88Å; Y123-Y376 AromaticContact CE2-CE1 3.6Å; Y123-Y376 HydrophobicContact CE2-CE1 3.6Å; Y123-Y376 HydrophobicContact CG-CE1 4.25Å; Y123-Y376 AromaticContact CZ-CE1 3.98Å; Y123-S437 WeakPolarHBondContact OH-CB 3.5Å
124	G	51.9	Low	72.9	Confident	30 Å²	30	54.3 Å²	54.3	31%	0.309	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	6.2	165.8	0	0	0	0	0	117	Y376	G124-Y376 PolarHBondContact N-OH 3.26Å
125	Q	53.1	Low	73.2	Confident	120 Å²	120	55.5 Å²	55.5	56%	0.561	29%	0.287	S	S	*	.			trans	-87.7	127	172	-66.3	-62.3	-35.5	0	0	111.5	S127	Q125-S127 VanDerWaalsContact C-N 3.29Å; Q125-S127 PolarHBondContact O-N 2.89Å
126	Y	50.8	Low	73.6	Confident	84 Å²	84	53.6 Å²	53.6	33%	0.329	28%	0.275	S	S	.	.			trans	-83.3	72.3	167.7	-76.9	-81.1	0	0	0	109.3	F433 V434 L436	Y126-F433 PolarHBondContact OH-O 3.12Å; Y126-V434 VanDerWaalsContact OH-CA 3.26Å; Y126-V434 WeakPolarHBondContact OH-CA 3.39Å; Y126-V434 PolarHBondContact OH-O 2.86Å; Y126-L436 HydrophobicContact CE1-CD1 4.47Å; Y126-L436 HydrophobicContact CE2-CD1 3.94Å; Y126-L436 HydrophobicContact CE2-CG 4.42Å; Y126-L436 WeakPolarHBondContact OH-CD2 3.21Å; Y126-L436 WeakPolarHBondContact OH-CG 3.49Å
127	S	56.9	Low	74.2	Confident	55 Å²	55	51.4 Å²	51.4	39%	0.385	26%	0.261	S	S	.	.			trans	-84.5	151.2	171.2	50.4	0	0	0	0	110.9	D24 Q125 D129	D24-S127 WeakPolarHBondContact OD2-CA 3.44Å; D24-S127 WeakPolarHBondContact OD2-CB 3.31Å; Q125-S127 VanDerWaalsContact C-N 3.29Å; Q125-S127 PolarHBondContact O-N 2.89Å; S127-D129 PolarHBondContact O-N 3.03Å
128	A	56.8	Low	75.2	Confident	32 Å²	32	50.2 Å²	50.2	26%	0.264	26%	0.256	S	S	.	.			trans	-74.8	71.7	167.7	0	0	0	0	0	107.9	D24 F28 F72	D24-A128 PolarHBondContact OD2-N 2.7Å; F28-A128 HydrophobicContact CB-CB 4.19Å; F28-A128 HydrophobicContact CG-CB 4.41Å; F72-A128 WeakPolarHBondContact CE1-O 3.41Å
129	D	78.7	Confident	76.1	Confident	26 Å²	26	49.9 Å²	49.9	14%	0.139	26%	0.255	C	S	.	.			trans	-89.1	169.3	-171.2	69.6	43.9	0	0	0	113.4	F72 R117 S127 S131 G132 P133	F72-D129 WeakPolarHBondContact CE1-O 3.46Å; R117-D129 WeakPolarHBondContact CD-OD2 3.46Å; R117-D129 IonicContact CZ-OD2 3.93Å; R117-D129 IonicContact NE-OD2 2.95Å; R117-D129 PolarHBondContact NE-OD2 3.49Å; R117-D129 IonicContact NH1-OD2 3.26Å; R117-D129 PolarHBondContact NH1-OD2 2.75Å; R117-D129 VanDerWaalsContact NH1-OD2 3.08Å; S127-D129 PolarHBondContact O-N 3.03Å; D129-S131 PolarHBondContact O-N 2.9Å; D129-S131 VanDerWaalsContact O-N 3.15Å; D129-S131 WeakPolarHBondContact OD1-CA 3.48Å; D129-S131 WeakPolarHBondContact OD1-CB 3.45Å; D129-S131 PolarHBondContact OD1-N 3.49Å; D129-S131 PolarHBondContact OD1-OG 3.07Å; D129-G132 PolarHBondContact O-N 3.26Å; D129-P133 WeakPolarHBondContact O-CD 3.14Å
130	F	87.3	Confident	77.4	Confident	11 Å²	11	41.5 Å²	41.5	5%	0.048	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.5	-178	71.1	-84.8	0	0	0	113.6	F72 Y75 H78 F79 C113 G132 P133 M134	F72-F130 HydrophobicContact CB-CB 4.04Å; F72-F130 HydrophobicContact CD1-CB 3.91Å; F72-F130 HydrophobicContact CG-CB 3.96Å; Y75-F130 AromaticContact CD1-CD1 3.7Å; Y75-F130 HydrophobicContact CD1-CD1 3.7Å; Y75-F130 HydrophobicContact CD1-CD2 4.3Å; Y75-F130 AromaticContact CD1-CE1 3.42Å; Y75-F130 HydrophobicContact CD1-CE1 3.42Å; Y75-F130 VanDerWaalsContact CD1-CE1 3.42Å; Y75-F130 HydrophobicContact CD1-CE2 4.05Å; Y75-F130 HydrophobicContact CD1-CG 4.15Å; Y75-F130 AromaticContact CD1-CZ 3.62Å; Y75-F130 HydrophobicContact CD1-CZ 3.62Å; Y75-F130 HydrophobicContact CE1-CD1 4.5Å; Y75-F130 AromaticContact CE1-CE1 3.89Å; Y75-F130 HydrophobicContact CE1-CE1 3.89Å; Y75-F130 HydrophobicContact CE1-CZ 4.12Å; Y75-F130 AromaticContact CG-CD1 3.98Å; Y75-F130 HydrophobicContact CG-CD1 3.98Å; Y75-F130 HydrophobicContact CG-CE1 4.17Å; Y75-F130 HydrophobicContact CG-CG 4.29Å; H78-F130 AromaticContact CD2-CE2 3.85Å; F79-F130 HydrophobicContact CE1-CB 3.97Å; F79-F130 HydrophobicContact CE1-CD2 4.47Å; F79-F130 WeakPolarHBondContact CE1-O 3.46Å; F79-F130 HydrophobicContact CZ-CB 4.01Å; C113-F130 HydrophobicContact CB-CE2 4.01Å; C113-F130 HydrophobicContact CB-CZ 4.47Å; F130-G132 VanDerWaalsContact C-N 3.34Å; F130-G132 PolarHBondContact O-N 3.37Å; F130-P133 WeakPolarHBondContact O-CD 3.27Å; F130-M134 HydrophobicContact CD2-SD 3.67Å; F130-M134 HydrophobicContact CE2-SD 3.81Å; F130-M134 WeakPolarHBondContact O-CG 3.1Å; F130-M134 PolarHBondContact O-N 3.49Å
131	S	89	Confident	78.8	Confident	8 Å²	8	36.1 Å²	36.1	6%	0.056	19%	0.194	C	C	.	.	H	α-helix	trans	-72.4	-27.3	-178.9	78.3	0	0	0	0	112.6	D129 M134 M135	D129-S131 PolarHBondContact O-N 2.9Å; D129-S131 VanDerWaalsContact O-N 3.15Å; D129-S131 WeakPolarHBondContact OD1-CA 3.48Å; D129-S131 WeakPolarHBondContact OD1-CB 3.45Å; D129-S131 PolarHBondContact OD1-N 3.49Å; D129-S131 PolarHBondContact OD1-OG 3.07Å; S131-M134 WeakPolarHBondContact O-CB 3.43Å; S131-M134 PolarHBondContact O-N 3.07Å; S131-M135 VanDerWaalsContact O-CG 3.31Å; S131-M135 WeakPolarHBondContact O-CG 3.3Å; S131-M135 PolarHBondContact O-N 3.23Å
132	G	90.6	Very high	80.7	Confident	31 Å²	31	32 Å²	32	32%	0.32	18%	0.176	S	C	.	.	H	α-helix	trans	-58	-55.2	175.3	0	0	0	0	0	113.2	D129 F130 M134 M135 I136	D129-G132 PolarHBondContact O-N 3.26Å; F130-G132 VanDerWaalsContact C-N 3.34Å; F130-G132 PolarHBondContact O-N 3.37Å; G132-M134 VanDerWaalsContact C-N 3.32Å; G132-M134 PolarHBondContact O-N 2.97Å; G132-M135 WeakPolarHBondContact O-CB 3.34Å; G132-M135 PolarHBondContact O-N 3.49Å; G132-I136 PolarHBondContact O-N 2.94Å
133	P	93.6	Very high	82.7	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.019	15%	0.15	C	C	.	.	H	α-helix	trans	-53.7	-43.1	169.3	-31.6	36.9	0	0	0	114.1	F72 F79 D129 F130 M135 I136 I137 I187	F72-P133 HydrophobicContact CD2-CG 4.47Å; F72-P133 HydrophobicContact CE1-CG 4.49Å; F72-P133 HydrophobicContact CE2-CG 3.53Å; F72-P133 HydrophobicContact CZ-CG 3.53Å; F79-P133 HydrophobicContact CE1-CB 4.01Å; F79-P133 HydrophobicContact CE2-CB 3.81Å; F79-P133 HydrophobicContact CE2-CG 4.26Å; F79-P133 HydrophobicContact CZ-CB 3.55Å; F79-P133 HydrophobicContact CZ-CG 3.88Å; D129-P133 WeakPolarHBondContact O-CD 3.14Å; F130-P133 WeakPolarHBondContact O-CD 3.27Å; P133-M135 VanDerWaalsContact C-N 3.28Å; P133-M135 PolarHBondContact O-N 3.48Å; P133-I136 PolarHBondContact O-N 3.42Å; P133-I136 VanDerWaalsContact O-N 3.12Å; P133-I137 WeakPolarHBondContact O-CG1 3.49Å; P133-I137 PolarHBondContact O-N 2.9Å; P133-I187 VanDerWaalsContact CB-O 3.26Å; P133-I187 WeakPolarHBondContact CB-O 3.49Å
134	M	95.3	Very high	84.9	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.7	-36.5	178.1	-68.5	-176.2	69.4	0	0	112.2	H78 F79 Y109 L110 C113 F130 S131 G132 I136 I137 T138	H78-M134 HydrophobicContact CB-CE 4.1Å; H78-M134 HydrophobicContact CB-SD 3.8Å; F79-M134 HydrophobicContact CD1-CG 3.53Å; F79-M134 HydrophobicContact CD1-SD 4.46Å; F79-M134 HydrophobicContact CE1-CG 3.59Å; F79-M134 HydrophobicContact CE1-SD 4.44Å; Y109-M134 HydrophobicContact CD1-CE 3.63Å; Y109-M134 HydrophobicContact CE1-CE 3.62Å; L110-M134 HydrophobicContact CD1-CB 3.73Å; C113-M134 HydrophobicContact CB-CE 3.98Å; C113-M134 HydrophobicContact CB-SD 3.98Å; C113-M134 VanDerWaalsContact SG-CE 3.59Å; F130-M134 HydrophobicContact CD2-SD 3.67Å; F130-M134 HydrophobicContact CE2-SD 3.81Å; F130-M134 WeakPolarHBondContact O-CG 3.1Å; F130-M134 PolarHBondContact O-N 3.49Å; S131-M134 WeakPolarHBondContact O-CB 3.43Å; S131-M134 PolarHBondContact O-N 3.07Å; G132-M134 VanDerWaalsContact C-N 3.32Å; G132-M134 PolarHBondContact O-N 2.97Å; M134-I136 VanDerWaalsContact C-N 3.31Å; M134-I136 PolarHBondContact O-N 3.03Å; M134-I137 PolarHBondContact O-N 3.45Å; M134-T138 WeakPolarHBondContact O-CB 3.49Å; M134-T138 PolarHBondContact O-N 3.46Å; M134-T138 PolarHBondContact O-OG1 3.43Å
135	M	96.1	Very high	87.1	Confident	25 Å²	25	20 Å²	20	12%	0.123	11%	0.113	C	C	.	.	H	α-helix	trans	-58.8	-43.7	174.5	-74.2	173	68.1	0	0	110.9	L110 S131 G132 P133 T138 Q139 W372	L110-M135 HydrophobicContact CD1-CG 3.93Å; L110-M135 HydrophobicContact CD2-CG 3.94Å; S131-M135 VanDerWaalsContact O-CG 3.31Å; S131-M135 WeakPolarHBondContact O-CG 3.3Å; S131-M135 PolarHBondContact O-N 3.23Å; G132-M135 WeakPolarHBondContact O-CB 3.34Å; G132-M135 PolarHBondContact O-N 3.49Å; P133-M135 VanDerWaalsContact C-N 3.28Å; P133-M135 PolarHBondContact O-N 3.48Å; M135-T138 WeakPolarHBondContact O-CB 3.26Å; M135-T138 PolarHBondContact O-N 2.75Å; M135-Q139 WeakPolarHBondContact O-CG 3.2Å; M135-Q139 PolarHBondContact O-N 3.26Å; M135-W372 HydrophobicContact CB-CZ2 3.68Å; M135-W372 HydrophobicContact CE-CD2 3.5Å; M135-W372 VanDerWaalsContact CE-CE2 3.49Å; M135-W372 HydrophobicContact CE-CE3 3.45Å; M135-W372 VanDerWaalsContact CE-CE3 3.45Å; M135-W372 HydrophobicContact CE-CG 4.32Å; M135-W372 HydrophobicContact CE-CH2 3.42Å; M135-W372 VanDerWaalsContact CE-CH2 3.42Å; M135-W372 HydrophobicContact CE-CZ2 3.48Å; M135-W372 VanDerWaalsContact CE-CZ2 3.48Å; M135-W372 HydrophobicContact CE-CZ3 3.4Å; M135-W372 WeakPolarHBondContact CE-O 3.28Å; M135-W372 HydrophobicContact CG-CZ2 4.44Å; M135-W372 PolarHBondContact O-NE1 3.02Å
136	I	96.2	Very high	89.2	Confident	14 Å²	14	14.6 Å²	14.6	7%	0.072	9%	0.089	C	C	.	.	H	α-helix	trans	-68.7	-42.9	176.9	-57.4	-58.4	0	0	0	111.6	G132 P133 M134 T138 Q139 K140	G132-I136 PolarHBondContact O-N 2.94Å; P133-I136 PolarHBondContact O-N 3.42Å; P133-I136 VanDerWaalsContact O-N 3.12Å; M134-I136 VanDerWaalsContact C-N 3.31Å; M134-I136 PolarHBondContact O-N 3.03Å; I136-T138 VanDerWaalsContact C-N 3.29Å; I136-T138 PolarHBondContact O-N 3.37Å; I136-Q139 WeakPolarHBondContact O-CB 3.3Å; I136-Q139 PolarHBondContact O-N 2.89Å; I136-Q139 VanDerWaalsContact O-N 3.12Å; I136-K140 HydrophobicContact CG2-CD 4.49Å; I136-K140 WeakPolarHBondContact O-CG 2.87Å; I136-K140 PolarHBondContact O-N 2.97Å
137	I	97.5	Very high	91.4	Very high	2 Å²	2	11.1 Å²	11.1	1%	0.01	8%	0.075	C	C	.	.	H	α-helix	trans	-60.3	-41.8	176.6	-69.6	170.8	0	0	0	110.6	F79 Q82 P133 M134 Q139 K140 I141	F79-I137 HydrophobicContact CB-CD1 3.64Å; F79-I137 HydrophobicContact CD1-CD1 4.4Å; F79-I137 HydrophobicContact CD2-CD1 4.45Å; F79-I137 HydrophobicContact CG-CD1 3.92Å; Q82-I137 HydrophobicContact CG-CG2 4.47Å; P133-I137 WeakPolarHBondContact O-CG1 3.49Å; P133-I137 PolarHBondContact O-N 2.9Å; M134-I137 PolarHBondContact O-N 3.45Å; I137-Q139 VanDerWaalsContact C-N 3.29Å; I137-Q139 PolarHBondContact O-N 2.81Å; I137-K140 WeakPolarHBondContact O-CB 3.42Å; I137-K140 PolarHBondContact O-N 3.24Å; I137-K140 VanDerWaalsContact O-N 3.15Å; I137-I141 HydrophobicContact CG2-CD1 3.51Å; I137-I141 HydrophobicContact CG2-CG1 4.13Å; I137-I141 WeakPolarHBondContact O-CB 3.37Å; I137-I141 VanDerWaalsContact O-CG1 3.28Å; I137-I141 WeakPolarHBondContact O-CG1 3.49Å; I137-I141 PolarHBondContact O-N 3.26Å
138	T	98.2	Very high	93.4	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-55.8	-45.2	174	-54.5	0	0	0	0	111.2	Q82 A106 L107 L110 M134 M135 I136 T142	Q82-T138 PolarHBondContact NE2-OG1 3.42Å; A106-T138 HydrophobicContact CB-CG2 4.11Å; L107-T138 HydrophobicContact CD1-CG2 4.37Å; L110-T138 HydrophobicContact CD2-CG2 4.31Å; M134-T138 WeakPolarHBondContact O-CB 3.49Å; M134-T138 PolarHBondContact O-N 3.46Å; M134-T138 PolarHBondContact O-OG1 3.43Å; M135-T138 WeakPolarHBondContact O-CB 3.26Å; M135-T138 PolarHBondContact O-N 2.75Å; I136-T138 VanDerWaalsContact C-N 3.29Å; I136-T138 PolarHBondContact O-N 3.37Å; T138-T142 HydrophobicContact CG2-CG2 4.49Å; T138-T142 WeakPolarHBondContact O-CB 3.34Å; T138-T142 VanDerWaalsContact O-CG2 3.3Å; T138-T142 WeakPolarHBondContact O-CG2 3.42Å; T138-T142 PolarHBondContact O-N 2.62Å; T138-T142 PolarHBondContact O-OG1 2.9Å
139	Q	98.3	Very high	95.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-64.7	-43.2	177.8	-64.1	177	-45.7	0	0	111.9	M135 I136 I137 T142 S143 L192 T345 W348 W372	M135-Q139 WeakPolarHBondContact O-CG 3.2Å; M135-Q139 PolarHBondContact O-N 3.26Å; I136-Q139 WeakPolarHBondContact O-CB 3.3Å; I136-Q139 PolarHBondContact O-N 2.89Å; I136-Q139 VanDerWaalsContact O-N 3.12Å; I137-Q139 VanDerWaalsContact C-N 3.29Å; I137-Q139 PolarHBondContact O-N 2.81Å; Q139-T142 PolarHBondContact O-OG1 2.86Å; Q139-S143 WeakPolarHBondContact O-CB 3.42Å; Q139-S143 PolarHBondContact O-N 3.17Å; Q139-S143 PolarHBondContact O-OG 2.81Å; Q139-L192 HydrophobicContact CB-CD1 3.83Å; Q139-L192 HydrophobicContact CB-CD2 3.88Å; Q139-L192 HydrophobicContact CB-CG 4.37Å; Q139-T345 VanDerWaalsContact NE2-CG2 3.28Å; Q139-T345 PolarHBondContact NE2-OG1 3.45Å; Q139-W348 HydrophobicContact CB-CD2 4.12Å; Q139-W348 HydrophobicContact CB-CG 4.08Å; Q139-W348 HydrophobicContact CG-CD2 3.57Å; Q139-W348 HydrophobicContact CG-CE3 3.73Å; Q139-W348 HydrophobicContact CG-CG 4.02Å; Q139-W348 HydrophobicContact CG-CH2 4.23Å; Q139-W348 HydrophobicContact CG-CZ2 4.08Å; Q139-W348 HydrophobicContact CG-CZ3 4.05Å; Q139-W372 VanDerWaalsContact CD-CZ2 3.46Å; Q139-W372 HydrophobicContact CG-CZ2 4.14Å
140	K	98.3	Very high	96.2	Very high	2 Å²	2	6.8 Å²	6.8	1%	0.009	4%	0.043	C	C	.	.	H	α-helix	trans	-61.4	-49.6	178.5	-76.3	-176.8	178.5	178.9	0	111.9	I136 I137 L144 Y180 N181 N183 L192	I136-K140 HydrophobicContact CG2-CD 4.49Å; I136-K140 WeakPolarHBondContact O-CG 2.87Å; I136-K140 PolarHBondContact O-N 2.97Å; I137-K140 WeakPolarHBondContact O-CB 3.42Å; I137-K140 PolarHBondContact O-N 3.24Å; I137-K140 VanDerWaalsContact O-N 3.15Å; K140-L144 VanDerWaalsContact O-CB 3.28Å; K140-L144 WeakPolarHBondContact O-CB 3.48Å; K140-L144 PolarHBondContact O-N 2.97Å; K140-Y180 HydrophobicContact CB-CD1 4.33Å; K140-Y180 HydrophobicContact CB-CE1 3.55Å; K140-Y180 HydrophobicContact CD-CE1 4.3Å; K140-Y180 HydrophobicContact CD-CE2 4.23Å; K140-Y180 WeakPolarHBondContact CD-O 3.34Å; K140-Y180 WeakPolarHBondContact CE-O 3.41Å; K140-Y180 HydrophobicContact CG-CE1 4.01Å; K140-Y180 HydrophobicContact CG-CE2 4.2Å; K140-Y180 PolarHBondContact NZ-O 2.83Å; K140-N181 WeakPolarHBondContact CB-OD1 3.22Å; K140-N181 PolarHBondContact NZ-O 2.92Å; K140-N183 PolarHBondContact NZ-ND2 3.31Å; K140-L192 HydrophobicContact CB-CD1 4.36Å; K140-L192 HydrophobicContact CG-CD1 3.59Å
141	I	98.5	Very high	96.6	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-60.7	-51.8	179.5	-69.4	172.3	0	0	0	110.8	Q82 S86 M90 C102 A106 I137 L144 A145 Y177	Q82-I141 HydrophobicContact CG-CD1 4.05Å; S86-I141 WeakPolarHBondContact OG-CG2 3.43Å; M90-I141 HydrophobicContact CE-CG2 4.01Å; M90-I141 WeakPolarHBondContact CE-O 3.23Å; C102-I141 HydrophobicContact CB-CG2 4.35Å; A106-I141 HydrophobicContact CB-CG2 4.13Å; I137-I141 HydrophobicContact CG2-CD1 3.51Å; I137-I141 HydrophobicContact CG2-CG1 4.13Å; I137-I141 WeakPolarHBondContact O-CB 3.37Å; I137-I141 VanDerWaalsContact O-CG1 3.28Å; I137-I141 WeakPolarHBondContact O-CG1 3.49Å; I137-I141 PolarHBondContact O-N 3.26Å; I141-L144 PolarHBondContact O-N 3.5Å; I141-A145 WeakPolarHBondContact O-CB 2.99Å; I141-A145 PolarHBondContact O-N 3.46Å; I141-Y177 WeakPolarHBondContact CG1-OH 3.44Å
142	T	98.4	Very high	97	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.006	6%	0.061	C	C	.	.	H	α-helix	trans	-68.4	-37	-176.4	53.9	0	0	0	0	112.3	F103 A106 T138 Q139 C146 W348	F103-T142 HydrophobicContact CB-CG2 4.24Å; F103-T142 HydrophobicContact CD2-CG2 3.75Å; F103-T142 HydrophobicContact CG-CG2 4.25Å; A106-T142 HydrophobicContact CB-CG2 4.2Å; T138-T142 HydrophobicContact CG2-CG2 4.49Å; T138-T142 WeakPolarHBondContact O-CB 3.34Å; T138-T142 VanDerWaalsContact O-CG2 3.3Å; T138-T142 WeakPolarHBondContact O-CG2 3.42Å; T138-T142 PolarHBondContact O-N 2.62Å; T138-T142 PolarHBondContact O-OG1 2.9Å; Q139-T142 PolarHBondContact O-OG1 2.86Å; T142-C146 WeakPolarHBondContact O-CB 3.46Å; T142-C146 PolarHBondContact O-N 3.09Å; T142-C146 VanDerWaalsContact O-N 3.13Å; T142-C146 PolarHBondContact O-SG 3.25Å; T142-W348 PolarHBondContact OG1-NE1 3.2Å
143	S	98.1	Very high	97.3	Very high	5 Å²	5	13.4 Å²	13.4	4%	0.035	7%	0.067	C	C	.	.	H	α-helix	trans	-61.3	-51.1	172.3	-57.2	0	0	0	0	110.9	Q139 A145 C146 E147 W348	Q139-S143 WeakPolarHBondContact O-CB 3.42Å; Q139-S143 PolarHBondContact O-N 3.17Å; Q139-S143 PolarHBondContact O-OG 2.81Å; S143-A145 VanDerWaalsContact C-N 3.35Å; S143-A145 PolarHBondContact O-N 2.96Å; S143-C146 WeakPolarHBondContact O-CB 3.37Å; S143-C146 PolarHBondContact O-N 3.41Å; S143-E147 WeakPolarHBondContact O-CB 3.24Å; S143-E147 WeakPolarHBondContact O-CG 3.29Å; S143-E147 PolarHBondContact O-N 3.22Å; S143-W348 VanDerWaalsContact OG-CD1 3.3Å
144	L	98.5	Very high	97.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.8	-43.1	-179	175.6	57.5	0	0	0	112	M90 K140 I141 C146 E147 I148 V168 P172 Y177 Y180 Y195	M90-L144 HydrophobicContact CE-CB 4.48Å; M90-L144 HydrophobicContact CE-CD2 4.41Å; M90-L144 HydrophobicContact CE-CG 4.33Å; K140-L144 VanDerWaalsContact O-CB 3.28Å; K140-L144 WeakPolarHBondContact O-CB 3.48Å; K140-L144 PolarHBondContact O-N 2.97Å; I141-L144 PolarHBondContact O-N 3.5Å; L144-C146 VanDerWaalsContact C-N 3.31Å; L144-C146 PolarHBondContact O-N 3.38Å; L144-E147 PolarHBondContact O-N 3.29Å; L144-I148 HydrophobicContact CD1-CD1 3.68Å; L144-I148 HydrophobicContact CD1-CG1 3.82Å; L144-I148 HydrophobicContact CG-CD1 3.78Å; L144-I148 HydrophobicContact CG-CG1 4.38Å; L144-I148 VanDerWaalsContact O-CG1 3.29Å; L144-I148 WeakPolarHBondContact O-CG1 3.18Å; L144-I148 PolarHBondContact O-N 3.37Å; L144-V168 HydrophobicContact CD1-CG2 4.24Å; L144-P172 HydrophobicContact CD1-CG 4.17Å; L144-P172 HydrophobicContact CD2-CG 4.18Å; L144-Y177 HydrophobicContact CD2-CD2 3.69Å; L144-Y177 HydrophobicContact CD2-CE2 4.01Å; L144-Y180 HydrophobicContact CB-CE1 4.27Å; L144-Y180 HydrophobicContact CD2-CD1 4.22Å; L144-Y180 HydrophobicContact CD2-CE1 4.29Å; L144-Y195 HydrophobicContact CD1-CD1 3.82Å; L144-Y195 HydrophobicContact CD1-CD2 3.93Å; L144-Y195 HydrophobicContact CD1-CE1 4.41Å; L144-Y195 HydrophobicContact CD1-CG 3.54Å; L144-Y195 HydrophobicContact CD2-CD2 4.05Å; L144-Y195 HydrophobicContact CD2-CE2 4.43Å; L144-Y195 HydrophobicContact CD2-CG 4.5Å
145	A	98.3	Very high	97.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-60.7	-43.1	177.8	0	0	0	0	0	111.5	M90 H99 C102 I141 S143 H149	M90-A145 HydrophobicContact CE-CB 3.77Å; H99-A145 HydrophobicContact CB-CB 4.02Å; C102-A145 HydrophobicContact CB-CB 3.77Å; I141-A145 WeakPolarHBondContact O-CB 2.99Å; I141-A145 PolarHBondContact O-N 3.46Å; S143-A145 VanDerWaalsContact C-N 3.35Å; S143-A145 PolarHBondContact O-N 2.96Å; A145-H149 WeakPolarHBondContact O-CB 3.29Å; A145-H149 PolarHBondContact O-N 3.44Å
146	C	97.8	Very high	97.1	Very high	7 Å²	7	23.9 Å²	23.9	5%	0.047	11%	0.112	C	C	.	.	H	α-helix	trans	-64.5	-41.8	174	-80	0	0	0	0	112.8	T142 S143 L144 H149 D150	T142-C146 WeakPolarHBondContact O-CB 3.46Å; T142-C146 PolarHBondContact O-N 3.09Å; T142-C146 VanDerWaalsContact O-N 3.13Å; T142-C146 PolarHBondContact O-SG 3.25Å; S143-C146 WeakPolarHBondContact O-CB 3.37Å; S143-C146 PolarHBondContact O-N 3.41Å; L144-C146 VanDerWaalsContact C-N 3.31Å; L144-C146 PolarHBondContact O-N 3.38Å; C146-H149 PolarHBondContact O-N 2.94Å; C146-D150 WeakPolarHBondContact O-CB 3.36Å; C146-D150 VanDerWaalsContact O-CG 3.24Å; C146-D150 PolarHBondContact O-N 3.44Å
147	E	97.9	Very high	96.9	Very high	11 Å²	11	30.6 Å²	30.6	5%	0.051	14%	0.143	C	C	.	.	H	α-helix	trans	-67.1	-37.4	179.8	-73.5	167.4	-179	0	0	112.1	S143 L144 G151 L166 V168	S143-E147 WeakPolarHBondContact O-CB 3.24Å; S143-E147 WeakPolarHBondContact O-CG 3.29Å; S143-E147 PolarHBondContact O-N 3.22Å; L144-E147 PolarHBondContact O-N 3.29Å; E147-G151 PolarHBondContact O-N 2.88Å; E147-L166 HydrophobicContact CG-CB 4.19Å; E147-V168 HydrophobicContact CB-CB 4.45Å; E147-V168 HydrophobicContact CB-CG2 3.93Å; E147-V168 PolarHBondContact O-N 3.03Å
148	I	98.1	Very high	96.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-72.1	-42.6	174.1	-61.7	160	0	0	0	110.8	M98 L144 D150 G151 M152 V168 M171 P172	M98-I148 HydrophobicContact CE-CB 3.3Å; M98-I148 HydrophobicContact CE-CD1 4.11Å; M98-I148 HydrophobicContact CE-CG1 4.32Å; M98-I148 HydrophobicContact CE-CG2 3.22Å; L144-I148 HydrophobicContact CD1-CD1 3.68Å; L144-I148 HydrophobicContact CD1-CG1 3.82Å; L144-I148 HydrophobicContact CG-CD1 3.78Å; L144-I148 HydrophobicContact CG-CG1 4.38Å; L144-I148 VanDerWaalsContact O-CG1 3.29Å; L144-I148 WeakPolarHBondContact O-CG1 3.18Å; L144-I148 PolarHBondContact O-N 3.37Å; I148-D150 VanDerWaalsContact C-N 3.3Å; I148-D150 PolarHBondContact O-N 3.03Å; I148-G151 PolarHBondContact O-N 3.41Å; I148-G151 VanDerWaalsContact O-N 3.13Å; I148-M152 HydrophobicContact CG2-CB 4.4Å; I148-M152 HydrophobicContact CG2-CG 4.01Å; I148-M152 HydrophobicContact CG2-SD 3.6Å; I148-M152 VanDerWaalsContact CG2-SD 3.6Å; I148-M152 WeakPolarHBondContact O-CB 3.48Å; I148-M152 PolarHBondContact O-N 3.13Å; I148-V168 HydrophobicContact CB-CB 4.49Å; I148-V168 HydrophobicContact CG1-CB 3.81Å; I148-V168 HydrophobicContact CG1-CG1 3.69Å; I148-M171 HydrophobicContact CD1-SD 4.06Å; I148-M171 HydrophobicContact CG2-CE 4Å; I148-M171 HydrophobicContact CG2-SD 4.04Å; I148-P172 HydrophobicContact CD1-CG 4.27Å
149	H	97.2	Very high	96.3	Very high	18 Å²	18	35.8 Å²	35.8	8%	0.083	17%	0.168	C	C	.	.	H	α-helix	trans	-56.9	-46.6	174.1	167.1	-89.5	0	0	0	111	V95 E96 H99 A145 C146 G151 F153 R154	V95-H149 PolarHBondContact O-CD2 2.82Å; V95-H149 VanDerWaalsContact O-CD2 3.26Å; E96-H149 PolarHBondContact O-CD2 2.9Å; E96-H149 PolarHBondContact O-NE2 3.02Å; H99-H149 HydrophobicContact CB-CB 4.26Å; H99-H149 AromaticContact CE1-CD2 3.25Å; H99-H149 PolarHBondContact CE1-CD2 2.79Å; H99-H149 AromaticContact CE1-CE1 3.84Å; H99-H149 AromaticContact CE1-CG 3.65Å; H99-H149 AromaticContact CE1-NE2 3.38Å; H99-H149 PolarHBondContact CE1-NE2 2.69Å; H99-H149 AromaticContact ND1-CD2 3.22Å; H99-H149 PolarHBondContact ND1-CD2 3.37Å; H99-H149 AromaticContact ND1-CG 3.39Å; H99-H149 AromaticContact ND1-NE2 3.87Å; A145-H149 WeakPolarHBondContact O-CB 3.29Å; A145-H149 PolarHBondContact O-N 3.44Å; C146-H149 PolarHBondContact O-N 2.94Å; H149-G151 VanDerWaalsContact C-N 3.27Å; H149-G151 PolarHBondContact O-N 3.41Å; H149-F153 AromaticContact CD2-CD1 3.89Å; H149-F153 AromaticContact NE2-CD1 3.41Å; H149-F153 WeakPolarHBondContact NE2-CD1 3.13Å; H149-F153 VanDerWaalsContact O-CB 3.3Å; H149-F153 WeakPolarHBondContact O-CB 3.35Å; H149-F153 PolarHBondContact O-N 2.79Å; H149-R154 PolarHBondContact O-N 3.13Å
150	D	97	Very high	96	Very high	4 Å²	4	38.5 Å²	38.5	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-64.2	-33.5	177.8	-71.1	-0.2	0	0	0	112.3	C146 I148 R154 L159 R356	C146-D150 WeakPolarHBondContact O-CB 3.36Å; C146-D150 VanDerWaalsContact O-CG 3.24Å; C146-D150 PolarHBondContact O-N 3.44Å; I148-D150 VanDerWaalsContact C-N 3.3Å; I148-D150 PolarHBondContact O-N 3.03Å; D150-R154 VanDerWaalsContact OD1-CD 3.3Å; D150-R154 WeakPolarHBondContact OD1-CD 3.44Å; D150-R154 IonicContact OD1-NH1 2.99Å; D150-L159 HydrophobicContact CB-CD2 3.93Å; D150-R356 IonicContact OD1-CZ 3.31Å; D150-R356 IonicContact OD1-NH1 3.08Å; D150-R356 PolarHBondContact OD1-NH1 2.79Å; D150-R356 IonicContact OD1-NH2 3.02Å; D150-R356 PolarHBondContact OD1-NH2 2.99Å; D150-R356 VanDerWaalsContact OD1-NH2 3.16Å; D150-R356 IonicContact OD2-CZ 3.44Å; D150-R356 IonicContact OD2-NH1 2.59Å; D150-R356 IonicContact OD2-NH2 2.68Å; D150-R356 PolarHBondContact OD2-NH2 3Å
151	G	96.7	Very high	95.6	Very high	7 Å²	7	42.8 Å²	42.8	7%	0.072	21%	0.214	C	C	.	.	H	α-helix	trans	-84.7	-33.3	-178.8	0	0	0	0	0	116	E147 I148 H149 V168 R169	E147-G151 PolarHBondContact O-N 2.88Å; I148-G151 PolarHBondContact O-N 3.41Å; I148-G151 VanDerWaalsContact O-N 3.13Å; H149-G151 VanDerWaalsContact C-N 3.27Å; H149-G151 PolarHBondContact O-N 3.41Å; G151-V168 WeakPolarHBondContact CA-O 3.42Å; G151-R169 WeakPolarHBondContact O-CD 3.4Å; G151-R169 PolarHBondContact O-NH1 3.19Å
152	M	96.9	Very high	95.1	Very high	83 Å²	83	44.6 Å²	44.6	41%	0.409	23%	0.227	S	C	.	.	H	α-helix	trans	-106.7	-17.7	-173.1	-65.1	-173.5	65.4	0	0	113.6	V95 I148 M171	V95-M152 HydrophobicContact CB-CB 4.4Å; V95-M152 HydrophobicContact CG1-CB 4.08Å; V95-M152 HydrophobicContact CG1-CE 4.33Å; V95-M152 HydrophobicContact CG1-SD 4.39Å; I148-M152 HydrophobicContact CG2-CB 4.4Å; I148-M152 HydrophobicContact CG2-CG 4.01Å; I148-M152 HydrophobicContact CG2-SD 3.6Å; I148-M152 VanDerWaalsContact CG2-SD 3.6Å; I148-M152 WeakPolarHBondContact O-CB 3.48Å; I148-M152 PolarHBondContact O-N 3.13Å; M152-M171 HydrophobicContact SD-CG 4.25Å
153	F	96.6	Very high	94.9	Very high	100 Å²	100	45.4 Å²	45.4	44%	0.439	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114	-43.8	-178.1	-176.5	-103.9	0	0	0	113.3	V95 E96 H149	V95-F153 HydrophobicContact CB-CB 4.44Å; V95-F153 HydrophobicContact CG2-CB 4.06Å; V95-F153 HydrophobicContact CG2-CD2 4.21Å; E96-F153 HydrophobicContact CB-CD2 3.87Å; E96-F153 HydrophobicContact CB-CE1 4.37Å; E96-F153 HydrophobicContact CB-CE2 3.59Å; E96-F153 HydrophobicContact CB-CG 4.36Å; E96-F153 HydrophobicContact CB-CZ 3.87Å; E96-F153 HydrophobicContact CG-CD2 4.41Å; E96-F153 HydrophobicContact CG-CE1 3.95Å; E96-F153 HydrophobicContact CG-CE2 3.74Å; E96-F153 HydrophobicContact CG-CZ 3.47Å; E96-F153 VanDerWaalsContact CG-CZ 3.47Å; H149-F153 AromaticContact CD2-CD1 3.89Å; H149-F153 AromaticContact NE2-CD1 3.41Å; H149-F153 WeakPolarHBondContact NE2-CD1 3.13Å; H149-F153 VanDerWaalsContact O-CB 3.3Å; H149-F153 WeakPolarHBondContact O-CB 3.35Å; H149-F153 PolarHBondContact O-N 2.79Å
154	R	95.3	Very high	94.7	Very high	54 Å²	54	50.1 Å²	50.1	20%	0.204	25%	0.248	C	C	.	.	S	Bend	trans	-82.6	151	-177.1	-60.2	-176.8	70.3	-153.1	-7.9	112.2	H149 D150 E158 L159 Q163	H149-R154 PolarHBondContact O-N 3.13Å; D150-R154 VanDerWaalsContact OD1-CD 3.3Å; D150-R154 WeakPolarHBondContact OD1-CD 3.44Å; D150-R154 IonicContact OD1-NH1 2.99Å; R154-E158 PolarHBondContact NH2-O 2.9Å; R154-L159 HydrophobicContact CB-CD2 3.85Å; R154-L159 VanDerWaalsContact NH1-CD2 3.32Å; R154-Q163 VanDerWaalsContact NH1-OE1 3.1Å
155	K	93.4	Very high	94.4	Very high	138 Å²	138	55 Å²	55	60%	0.6	27%	0.274	S	S	*	.			trans	-80.3	146.2	173.7	-62	179.6	-177.8	172.5	0	111.1	E157 E158	K155-E157 VanDerWaalsContact C-N 3.26Å; K155-E157 WeakPolarHBondContact CB-OE2 3.31Å; K155-E157 PolarHBondContact O-N 3.03Å; K155-E158 HydrophobicContact CB-CG 4.28Å; K155-E158 WeakPolarHBondContact O-CB 3.27Å; K155-E158 PolarHBondContact O-N 2.95Å
156	D	91.1	Very high	94.3	Very high	56 Å²	56	56 Å²	56	30%	0.299	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-59.3	-37.1	-175.6	-80.6	30.6	0	0	0	112.4	E158 L159 R164 R169	D156-E158 PolarHBondContact O-N 3.36Å; D156-L159 WeakPolarHBondContact O-CB 3.36Å; D156-L159 PolarHBondContact O-N 2.72Å; D156-L159 VanDerWaalsContact O-N 3.09Å; D156-R164 PolarHBondContact O-NH2 2.76Å; D156-R169 IonicContact OD1-CZ 3.74Å; D156-R169 IonicContact OD1-NH1 3.4Å; D156-R169 PolarHBondContact OD1-NH1 3.2Å; D156-R169 IonicContact OD1-NH2 3.7Å; D156-R169 PolarHBondContact OD1-NH2 3.01Å; D156-R169 IonicContact OD2-NH2 3.75Å; D156-R169 PolarHBondContact OD2-NH2 3.38Å; D156-R169 VanDerWaalsContact OD2-NH2 3.12Å
157	E	92.1	Very high	94.2	Very high	154 Å²	154	56.2 Å²	56.2	72%	0.72	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-63.3	-24	179.4	-56.5	75.4	-155.6	0	0	112.8	K155	K155-E157 VanDerWaalsContact C-N 3.26Å; K155-E157 WeakPolarHBondContact CB-OE2 3.31Å; K155-E157 PolarHBondContact O-N 3.03Å
158	E	90.5	Very high	94.1	Very high	102 Å²	102	56.1 Å²	56.1	48%	0.477	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-87	-14.7	178.9	-58.1	175	-170.6	0	0	112.8	R154 K155 D156	R154-E158 PolarHBondContact NH2-O 2.9Å; K155-E158 HydrophobicContact CB-CG 4.28Å; K155-E158 WeakPolarHBondContact O-CB 3.27Å; K155-E158 PolarHBondContact O-N 2.95Å; D156-E158 PolarHBondContact O-N 3.36Å
159	L	93.3	Very high	94	Very high	10 Å²	10	61.5 Å²	61.5	5%	0.052	30%	0.302	C	S	.	.	S	Bend	trans	-83.2	137.2	-178.1	-57.9	-176	0	0	0	110.6	D150 R154 D156 Q163 R164 A167	D150-L159 HydrophobicContact CB-CD2 3.93Å; R154-L159 HydrophobicContact CB-CD2 3.85Å; R154-L159 VanDerWaalsContact NH1-CD2 3.32Å; D156-L159 WeakPolarHBondContact O-CB 3.36Å; D156-L159 PolarHBondContact O-N 2.72Å; D156-L159 VanDerWaalsContact O-N 3.09Å; L159-Q163 HydrophobicContact CB-CB 4.04Å; L159-Q163 HydrophobicContact CD2-CB 4.26Å; L159-R164 HydrophobicContact CB-CB 4.18Å; L159-R164 HydrophobicContact CD1-CB 4.33Å; L159-A167 HydrophobicContact CD1-CB 4.35Å
160	T	91.3	Very high	93.9	Very high	56 Å²	56	66.2 Å²	66.2	34%	0.344	32%	0.319	S	S	.	.			trans	-63.4	159.9	163.3	73.6	0	0	0	0	109.8	S162 Q163 R164	T160-S162 VanDerWaalsContact C-N 3.29Å; T160-S162 PolarHBondContact O-N 3.3Å; T160-Q163 PolarHBondContact O-N 3.21Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.41Å; T160-Q163 PolarHBondContact OG1-N 2.82Å; T160-R164 PolarHBondContact O-N 3.13Å
161	S	90.2	Very high	93.9	Very high	92 Å²	92	68.7 Å²	68.7	64%	0.643	33%	0.331	S	S	*	.	H	α-helix	trans	-51.1	-49.8	176.5	49.9	0	0	0	0	111.9	Q163 R164 D165	S161-Q163 VanDerWaalsContact C-N 3.32Å; S161-Q163 PolarHBondContact O-N 3.4Å; S161-R164 WeakPolarHBondContact O-CB 3.43Å; S161-R164 PolarHBondContact O-N 3.25Å; S161-D165 PolarHBondContact O-N 3.06Å
162	S	89.3	Confident	94	Very high	39 Å²	39	68.5 Å²	68.5	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-33.5	178.2	-177.5	0	0	0	0	113.9	T160 L166	T160-S162 VanDerWaalsContact C-N 3.29Å; T160-S162 PolarHBondContact O-N 3.3Å; S162-L166 WeakPolarHBondContact O-CD1 3.49Å; S162-L166 WeakPolarHBondContact O-CG 3.38Å; S162-L166 PolarHBondContact O-N 2.93Å
163	Q	93.7	Very high	94	Very high	18 Å²	18	67.1 Å²	67.1	8%	0.084	33%	0.327	C	S	.	.	H	α-helix	trans	-70.3	-41.7	176.2	-77.3	174.3	-25.7	0	0	110.7	R154 L159 T160 S161 D165 L166 A167	R154-Q163 VanDerWaalsContact NH1-OE1 3.1Å; L159-Q163 HydrophobicContact CB-CB 4.04Å; L159-Q163 HydrophobicContact CD2-CB 4.26Å; T160-Q163 PolarHBondContact O-N 3.21Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.41Å; T160-Q163 PolarHBondContact OG1-N 2.82Å; S161-Q163 VanDerWaalsContact C-N 3.32Å; S161-Q163 PolarHBondContact O-N 3.4Å; Q163-D165 VanDerWaalsContact C-N 3.35Å; Q163-D165 PolarHBondContact O-N 2.96Å; Q163-L166 PolarHBondContact O-N 3.33Å; Q163-A167 WeakPolarHBondContact O-CB 3.41Å; Q163-A167 PolarHBondContact O-N 3.05Å
164	R	94.3	Very high	94.1	Very high	104 Å²	104	66.7 Å²	66.7	39%	0.392	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-41.2	177.4	-164	-176.2	-51.1	-139.1	3.7	111.9	D156 L159 T160 S161 L166 A167	D156-R164 PolarHBondContact O-NH2 2.76Å; L159-R164 HydrophobicContact CB-CB 4.18Å; L159-R164 HydrophobicContact CD1-CB 4.33Å; T160-R164 PolarHBondContact O-N 3.13Å; S161-R164 WeakPolarHBondContact O-CB 3.43Å; S161-R164 PolarHBondContact O-N 3.25Å; R164-L166 VanDerWaalsContact C-N 3.26Å; R164-L166 PolarHBondContact O-N 3.5Å; R164-A167 WeakPolarHBondContact O-CB 3.3Å; R164-A167 PolarHBondContact O-N 3.22Å
165	D	92.1	Very high	94.2	Very high	103 Å²	103	66.3 Å²	66.3	55%	0.551	33%	0.331	S	S	*	.	H	α-helix	trans	-63.4	-33.7	179.2	-66.5	-22.3	0	0	0	112.5	S161 Q163 K196	S161-D165 PolarHBondContact O-N 3.06Å; Q163-D165 VanDerWaalsContact C-N 3.35Å; Q163-D165 PolarHBondContact O-N 2.96Å; D165-K196 WeakPolarHBondContact O-CD 3.45Å; D165-K196 PolarHBondContact O-NZ 2.96Å
166	L	94.9	Very high	94.4	Very high	21 Å²	21	60.3 Å²	60.3	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-96.8	-7.5	-177.4	-62.2	172.5	0	0	0	113.6	E147 S162 Q163 R164 V168	E147-L166 HydrophobicContact CG-CB 4.19Å; S162-L166 WeakPolarHBondContact O-CD1 3.49Å; S162-L166 WeakPolarHBondContact O-CG 3.38Å; S162-L166 PolarHBondContact O-N 2.93Å; Q163-L166 PolarHBondContact O-N 3.33Å; R164-L166 VanDerWaalsContact C-N 3.26Å; R164-L166 PolarHBondContact O-N 3.5Å; L166-V168 PolarHBondContact O-N 3.09Å
167	A	96	Very high	94.8	Very high	10 Å²	10	57.7 Å²	57.7	8%	0.083	29%	0.291	C	S	.	.			trans	-57.7	128	-175.8	0	0	0	0	0	111.6	L159 Q163 R164	L159-A167 HydrophobicContact CD1-CB 4.35Å; Q163-A167 WeakPolarHBondContact O-CB 3.41Å; Q163-A167 PolarHBondContact O-N 3.05Å; R164-A167 WeakPolarHBondContact O-CB 3.3Å; R164-A167 PolarHBondContact O-N 3.22Å
168	V	97.1	Very high	95.1	Very high	10 Å²	10	52.4 Å²	52.4	6%	0.061	27%	0.267	C	S	.	.			trans	-99.5	113.1	178.5	175.1	0	0	0	0	108.5	L144 E147 I148 G151 L166 R170 Y195	L144-V168 HydrophobicContact CD1-CG2 4.24Å; E147-V168 HydrophobicContact CB-CB 4.45Å; E147-V168 HydrophobicContact CB-CG2 3.93Å; E147-V168 PolarHBondContact O-N 3.03Å; I148-V168 HydrophobicContact CB-CB 4.49Å; I148-V168 HydrophobicContact CG1-CB 3.81Å; I148-V168 HydrophobicContact CG1-CG1 3.69Å; G151-V168 WeakPolarHBondContact CA-O 3.42Å; L166-V168 PolarHBondContact O-N 3.09Å; V168-R170 WeakPolarHBondContact CG1-O 3.44Å; V168-Y195 HydrophobicContact CG1-CD1 4.28Å; V168-Y195 HydrophobicContact CG1-CE1 4.22Å; V168-Y195 HydrophobicContact CG2-CD1 3.74Å; V168-Y195 HydrophobicContact CG2-CE1 4.47Å
169	R	95.8	Very high	95.5	Very high	112 Å²	112	47.6 Å²	47.6	42%	0.423	25%	0.245	S	C	.	.			trans	-92.7	2.3	-172.5	-55.2	-61.1	-179.9	160.7	8.2	114.5	G151 D156	G151-R169 WeakPolarHBondContact O-CD 3.4Å; G151-R169 PolarHBondContact O-NH1 3.19Å; D156-R169 IonicContact OD1-CZ 3.74Å; D156-R169 IonicContact OD1-NH1 3.4Å; D156-R169 PolarHBondContact OD1-NH1 3.2Å; D156-R169 IonicContact OD1-NH2 3.7Å; D156-R169 PolarHBondContact OD1-NH2 3.01Å; D156-R169 IonicContact OD2-NH2 3.75Å; D156-R169 PolarHBondContact OD2-NH2 3.38Å; D156-R169 VanDerWaalsContact OD2-NH2 3.12Å
170	R	95.6	Very high	95.7	Very high	117 Å²	117	47.1 Å²	47.1	44%	0.442	24%	0.242	S	C	.	.	S	Bend	trans	-143.5	149.4	176.1	68.9	171.9	177.3	95.7	-5.6	111.1	V168 E176	V168-R170 WeakPolarHBondContact CG1-O 3.44Å; R170-E176 IonicContact CZ-OE1 3.67Å; R170-E176 VanDerWaalsContact CZ-OE1 3.26Å; R170-E176 IonicContact CZ-OE2 3.33Å; R170-E176 IonicContact NH1-OE1 3.69Å; R170-E176 PolarHBondContact NH1-OE1 2.94Å; R170-E176 IonicContact NH1-OE2 3.92Å; R170-E176 PolarHBondContact NH1-OE2 3.46Å; R170-E176 IonicContact NH2-OE1 2.67Å; R170-E176 PolarHBondContact NH2-OE1 3.41Å
171	M	97	Very high	96	Very high	56 Å²	56	44.4 Å²	44.4	28%	0.276	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-65.2	131.8	171.2	-78.2	-64	-174.9	0	0	110.9	M90 V95 M98 I148 M152	M90-M171 WeakPolarHBondContact O-CE 3.41Å; V95-M171 HydrophobicContact CG1-CE 3.81Å; M98-M171 HydrophobicContact CE-CE 4.04Å; M98-M171 HydrophobicContact SD-CE 3.69Å; I148-M171 HydrophobicContact CD1-SD 4.06Å; I148-M171 HydrophobicContact CG2-CE 4Å; I148-M171 HydrophobicContact CG2-SD 4.04Å; M152-M171 HydrophobicContact SD-CG 4.25Å
172	P	97.3	Very high	96.3	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.019	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-61	139.6	169.3	-26.3	37.6	0	0	0	111.7	Y87 L144 I148 E176 Y195	Y87-P172 PolarHBondContact OH-O 3.38Å; L144-P172 HydrophobicContact CD1-CG 4.17Å; L144-P172 HydrophobicContact CD2-CG 4.18Å; I148-P172 HydrophobicContact CD1-CG 4.27Å; P172-E176 HydrophobicContact CB-CB 4.41Å; P172-Y195 HydrophobicContact CB-CE2 4.08Å; P172-Y195 WeakPolarHBondContact CB-OH 3.28Å; P172-Y195 HydrophobicContact CG-CE1 3.95Å; P172-Y195 HydrophobicContact CG-CE2 3.92Å; P172-Y195 VanDerWaalsContact CG-CZ 3.48Å; P172-Y195 WeakPolarHBondContact CG-OH 3.44Å
173	S	97.7	Very high	96.7	Very high	55 Å²	55	38.3 Å²	38.3	39%	0.385	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-64.5	159.6	162.2	66.2	0	0	0	0	110.6	L175 E176 Y177	S173-L175 PolarHBondContact O-N 3.22Å; S173-E176 WeakPolarHBondContact CB-OE2 3.49Å; S173-E176 PolarHBondContact N-OE2 3Å; S173-E176 PolarHBondContact O-N 3.12Å; S173-E176 VanDerWaalsContact OG-CD 3.31Å; S173-E176 VanDerWaalsContact OG-CG 3.23Å; S173-E176 WeakPolarHBondContact OG-CG 2.93Å; S173-E176 PolarHBondContact OG-N 2.66Å; S173-E176 PolarHBondContact OG-OE2 2.95Å; S173-Y177 WeakPolarHBondContact O-CB 3.23Å; S173-Y177 PolarHBondContact O-N 2.89Å
174	L	97.6	Very high	96.9	Very high	91 Å²	91	37.6 Å²	37.6	48%	0.476	18%	0.18	S	C	.	.	H	α-helix	trans	-57.5	-38.7	178.4	179.9	62.1	0	0	0	111.8	Y87 Y177 L178	Y87-L174 HydrophobicContact CD1-CD1 3.71Å; Y87-L174 HydrophobicContact CE1-CB 4.06Å; Y87-L174 HydrophobicContact CE1-CD1 3.82Å; Y87-L174 HydrophobicContact CG-CD1 4.26Å; Y87-L174 PolarHBondContact OH-N 2.99Å; Y87-L174 VanDerWaalsContact OH-N 3.17Å; L174-Y177 PolarHBondContact O-N 3.27Å; L174-L178 HydrophobicContact CD1-CD1 3.91Å; L174-L178 HydrophobicContact CD1-CG 3.94Å; L174-L178 HydrophobicContact CG-CD1 3.89Å; L174-L178 HydrophobicContact CG-CG 4.3Å; L174-L178 WeakPolarHBondContact O-CB 3.3Å; L174-L178 VanDerWaalsContact O-CG 3.3Å; L174-L178 WeakPolarHBondContact O-CG 3.28Å; L174-L178 PolarHBondContact O-N 2.84Å
175	L	98.2	Very high	97.1	Very high	46 Å²	46	32.8 Å²	32.8	24%	0.241	16%	0.162	C	C	.	.	H	α-helix	trans	-65.7	-47.9	178.4	178.7	61.3	0	0	0	111.7	F54 H57 V58 S173 Y177 L178 S179	F54-L175 HydrophobicContact CD2-CD2 3.42Å; F54-L175 VanDerWaalsContact CD2-CD2 3.42Å; F54-L175 HydrophobicContact CE2-CD2 3.58Å; F54-L175 HydrophobicContact CG-CD2 4.31Å; H57-L175 HydrophobicContact CB-CD1 4.04Å; H57-L175 HydrophobicContact CB-CD2 3.96Å; H57-L175 HydrophobicContact CB-CG 3.83Å; V58-L175 HydrophobicContact CG2-CD1 3.93Å; V58-L175 HydrophobicContact CG2-CD2 4.17Å; S173-L175 PolarHBondContact O-N 3.22Å; L175-Y177 VanDerWaalsContact C-N 3.29Å; L175-Y177 PolarHBondContact O-N 3.39Å; L175-L178 PolarHBondContact O-N 3.23Å; L175-S179 WeakPolarHBondContact O-CB 3.46Å; L175-S179 PolarHBondContact O-N 2.95Å
176	E	98.4	Very high	97.1	Very high	12 Å²	12	28 Å²	28	6%	0.056	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-43.1	177.4	-71.3	166.8	128.5	0	0	111.4	R170 P172 S173 Y180 Y195 I199	R170-E176 IonicContact CZ-OE1 3.67Å; R170-E176 VanDerWaalsContact CZ-OE1 3.26Å; R170-E176 IonicContact CZ-OE2 3.33Å; R170-E176 IonicContact NH1-OE1 3.69Å; R170-E176 PolarHBondContact NH1-OE1 2.94Å; R170-E176 IonicContact NH1-OE2 3.92Å; R170-E176 PolarHBondContact NH1-OE2 3.46Å; R170-E176 IonicContact NH2-OE1 2.67Å; R170-E176 PolarHBondContact NH2-OE1 3.41Å; P172-E176 HydrophobicContact CB-CB 4.41Å; S173-E176 WeakPolarHBondContact CB-OE2 3.49Å; S173-E176 PolarHBondContact N-OE2 3Å; S173-E176 PolarHBondContact O-N 3.12Å; S173-E176 VanDerWaalsContact OG-CD 3.31Å; S173-E176 VanDerWaalsContact OG-CG 3.23Å; S173-E176 WeakPolarHBondContact OG-CG 2.93Å; S173-E176 PolarHBondContact OG-N 2.66Å; S173-E176 PolarHBondContact OG-OE2 2.95Å; E176-Y180 VanDerWaalsContact O-CB 3.3Å; E176-Y180 WeakPolarHBondContact O-CB 3.42Å; E176-Y180 PolarHBondContact O-N 3.27Å; E176-Y195 WeakPolarHBondContact CB-OH 3.16Å; E176-I199 HydrophobicContact CB-CD1 3.93Å; E176-I199 HydrophobicContact CG-CD1 4.1Å
177	Y	98.5	Very high	97.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-48.6	178.8	175.3	-95.8	0	0	0	112.8	S83 S86 Y87 M90 I141 L144 S173 L174 L175 S179 Y180 N181	S83-Y177 WeakPolarHBondContact O-CE1 3.27Å; S83-Y177 VanDerWaalsContact O-CZ 3.31Å; S83-Y177 PolarHBondContact O-OH 3.1Å; S86-Y177 WeakPolarHBondContact CB-OH 3.48Å; Y87-Y177 AromaticContact CD2-CD1 3.65Å; Y87-Y177 HydrophobicContact CD2-CD1 3.65Å; Y87-Y177 AromaticContact CD2-CD2 3.84Å; Y87-Y177 HydrophobicContact CD2-CD2 3.84Å; Y87-Y177 HydrophobicContact CD2-CE1 4.08Å; Y87-Y177 HydrophobicContact CD2-CE2 4.24Å; Y87-Y177 AromaticContact CD2-CG 3.5Å; Y87-Y177 HydrophobicContact CD2-CG 3.5Å; Y87-Y177 HydrophobicContact CE2-CD1 4.44Å; Y87-Y177 HydrophobicContact CE2-CD2 4.47Å; Y87-Y177 HydrophobicContact CE2-CG 4.02Å; Y87-Y177 AromaticContact CG-CD1 3.97Å; Y87-Y177 HydrophobicContact CG-CD1 3.97Å; Y87-Y177 HydrophobicContact CG-CE1 4.15Å; Y87-Y177 HydrophobicContact CG-CG 4.29Å; M90-Y177 HydrophobicContact CE-CE2 4.15Å; M90-Y177 HydrophobicContact SD-CD2 4.42Å; M90-Y177 HydrophobicContact SD-CE2 3.95Å; I141-Y177 WeakPolarHBondContact CG1-OH 3.44Å; L144-Y177 HydrophobicContact CD2-CD2 3.69Å; L144-Y177 HydrophobicContact CD2-CE2 4.01Å; S173-Y177 WeakPolarHBondContact O-CB 3.23Å; S173-Y177 PolarHBondContact O-N 2.89Å; L174-Y177 PolarHBondContact O-N 3.27Å; L175-Y177 VanDerWaalsContact C-N 3.29Å; L175-Y177 PolarHBondContact O-N 3.39Å; Y177-S179 VanDerWaalsContact C-N 3.31Å; Y177-S179 PolarHBondContact O-N 3.4Å; Y177-Y180 PolarHBondContact O-N 3.44Å; Y177-N181 VanDerWaalsContact CE2-ND2 3.27Å; Y177-N181 WeakPolarHBondContact CE2-ND2 3.42Å; Y177-N181 VanDerWaalsContact CZ-ND2 3.34Å; Y177-N181 PolarHBondContact O-N 3.38Å; Y177-N181 PolarHBondContact O-ND2 3.38Å
178	L	98.2	Very high	97	Very high	44 Å²	44	27 Å²	27	23%	0.23	13%	0.13	C	C	.	.	H	α-helix	trans	-65.1	-38.8	177.6	-73.1	177.1	0	0	0	111.1	T61 L174 L175 N181 C182	T61-L178 HydrophobicContact CG2-CB 4.22Å; L174-L178 HydrophobicContact CD1-CD1 3.91Å; L174-L178 HydrophobicContact CD1-CG 3.94Å; L174-L178 HydrophobicContact CG-CD1 3.89Å; L174-L178 HydrophobicContact CG-CG 4.3Å; L174-L178 WeakPolarHBondContact O-CB 3.3Å; L174-L178 VanDerWaalsContact O-CG 3.3Å; L174-L178 WeakPolarHBondContact O-CG 3.28Å; L174-L178 PolarHBondContact O-N 2.84Å; L175-L178 PolarHBondContact O-N 3.23Å; L178-N181 PolarHBondContact O-N 3.49Å; L178-C182 WeakPolarHBondContact O-CA 3.4Å; L178-C182 VanDerWaalsContact O-CB 3.28Å; L178-C182 WeakPolarHBondContact O-CB 3.41Å; L178-C182 PolarHBondContact O-N 3.42Å
179	S	98.3	Very high	96.6	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.3	-42.6	176.7	-159.4	0	0	0	0	111.8	H57 T61 L175 Y177 N181 N183 Y198	H57-S179 WeakPolarHBondContact CA-OG 3.35Å; H57-S179 WeakPolarHBondContact ND1-CB 3.48Å; H57-S179 PolarHBondContact ND1-OG 2.96Å; H57-S179 PolarHBondContact O-OG 2.99Å; H57-S179 VanDerWaalsContact O-OG 3.06Å; T61-S179 WeakPolarHBondContact OG1-CA 3.22Å; T61-S179 VanDerWaalsContact OG1-CB 3.27Å; T61-S179 WeakPolarHBondContact OG1-CB 3.41Å; T61-S179 PolarHBondContact OG1-OG 3.41Å; L175-S179 WeakPolarHBondContact O-CB 3.46Å; L175-S179 PolarHBondContact O-N 2.95Å; Y177-S179 VanDerWaalsContact C-N 3.31Å; Y177-S179 PolarHBondContact O-N 3.4Å; S179-N181 PolarHBondContact O-N 3.09Å; S179-N183 WeakPolarHBondContact O-CB 3.47Å; S179-N183 PolarHBondContact O-N 3.1Å; S179-N183 PolarHBondContact O-ND2 3.34Å; S179-Y198 VanDerWaalsContact C-OH 3.31Å; S179-Y198 PolarHBondContact O-OH 3.41Å; S179-Y198 VanDerWaalsContact O-OH 3.11Å; S179-Y198 PolarHBondContact OG-OH 2.98Å
180	Y	98.4	Very high	96.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.3	-45	174	172	-121.2	0	0	0	112.7	K140 L144 E176 Y177 N183 C193 Y195 Y198	K140-Y180 HydrophobicContact CB-CD1 4.33Å; K140-Y180 HydrophobicContact CB-CE1 3.55Å; K140-Y180 HydrophobicContact CD-CE1 4.3Å; K140-Y180 HydrophobicContact CD-CE2 4.23Å; K140-Y180 WeakPolarHBondContact CD-O 3.34Å; K140-Y180 WeakPolarHBondContact CE-O 3.41Å; K140-Y180 HydrophobicContact CG-CE1 4.01Å; K140-Y180 HydrophobicContact CG-CE2 4.2Å; K140-Y180 PolarHBondContact NZ-O 2.83Å; L144-Y180 HydrophobicContact CB-CE1 4.27Å; L144-Y180 HydrophobicContact CD2-CD1 4.22Å; L144-Y180 HydrophobicContact CD2-CE1 4.29Å; E176-Y180 VanDerWaalsContact O-CB 3.3Å; E176-Y180 WeakPolarHBondContact O-CB 3.42Å; E176-Y180 PolarHBondContact O-N 3.27Å; Y177-Y180 PolarHBondContact O-N 3.44Å; Y180-N183 PolarHBondContact O-ND2 3.42Å; Y180-C193 PolarHBondContact OH-O 2.93Å; Y180-Y195 AromaticContact CD1-CD2 3.81Å; Y180-Y195 HydrophobicContact CD1-CD2 3.81Å; Y180-Y195 HydrophobicContact CD2-CD2 4.24Å; Y180-Y195 HydrophobicContact CE1-CD2 4.25Å; Y180-Y195 AromaticContact CG-CD2 3.77Å; Y180-Y195 HydrophobicContact CG-CD2 3.77Å; Y180-Y195 HydrophobicContact CG-CE2 4.48Å; Y180-Y198 AromaticContact CD2-CD1 3.77Å; Y180-Y198 HydrophobicContact CD2-CD1 3.77Å; Y180-Y198 AromaticContact CD2-CG 3.74Å; Y180-Y198 HydrophobicContact CD2-CG 3.74Å; Y180-Y198 HydrophobicContact CG-CD1 4.19Å
181	N	97.9	Very high	96.1	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-75	-43.9	-178.8	-74.8	-71.6	0	0	0	112.8	K140 Y177 L178 S179	K140-N181 WeakPolarHBondContact CB-OD1 3.22Å; K140-N181 PolarHBondContact NZ-O 2.92Å; Y177-N181 VanDerWaalsContact CE2-ND2 3.27Å; Y177-N181 WeakPolarHBondContact CE2-ND2 3.42Å; Y177-N181 VanDerWaalsContact CZ-ND2 3.34Å; Y177-N181 PolarHBondContact O-N 3.38Å; Y177-N181 PolarHBondContact O-ND2 3.38Å; L178-N181 PolarHBondContact O-N 3.49Å; S179-N181 PolarHBondContact O-N 3.09Å
182	C	97.3	Very high	96	Very high	1 Å²	1	13.9 Å²	13.9	1%	0.007	8%	0.08	C	C	.	.	H	α-helix	trans	-110.3	21.8	-166.9	-57.4	0	0	0	0	114.5	T61 G64 L65 L178 I187	T61-C182 HydrophobicContact CG2-CB 4.26Å; G64-C182 WeakPolarHBondContact CA-O 3.29Å; L65-C182 HydrophobicContact CD2-CB 3.9Å; L65-C182 HydrophobicContact CG-CB 4.26Å; L178-C182 WeakPolarHBondContact O-CA 3.4Å; L178-C182 VanDerWaalsContact O-CB 3.28Å; L178-C182 WeakPolarHBondContact O-CB 3.41Å; L178-C182 PolarHBondContact O-N 3.42Å; C182-I187 HydrophobicContact CB-CD1 4.12Å
183	N	97.6	Very high	95.9	Very high	2 Å²	2	14 Å²	14	1%	0.011	8%	0.081	C	C	.	.			trans	-67.5	141.5	175.8	63.2	87.9	0	0	0	113	A60 K140 S179 Y180 M185 G186 I187 Y198	A60-N183 HydrophobicContact CB-CB 4.25Å; A60-N183 WeakPolarHBondContact O-CA 3.44Å; K140-N183 PolarHBondContact NZ-ND2 3.31Å; S179-N183 WeakPolarHBondContact O-CB 3.47Å; S179-N183 PolarHBondContact O-N 3.1Å; S179-N183 PolarHBondContact O-ND2 3.34Å; Y180-N183 PolarHBondContact O-ND2 3.42Å; N183-M185 HydrophobicContact CB-CE 3.88Å; N183-M185 PolarHBondContact O-N 3.45Å; N183-M185 VanDerWaalsContact O-N 3.17Å; N183-M185 PolarHBondContact OD1-N 2.96Å; N183-G186 PolarHBondContact O-N 3.09Å; N183-G186 PolarHBondContact OD1-N 2.91Å; N183-G186 VanDerWaalsContact OD1-N 3.1Å; N183-I187 VanDerWaalsContact O-CB 3.3Å; N183-I187 WeakPolarHBondContact O-CB 3.41Å; N183-I187 PolarHBondContact O-N 3.17Å; N183-Y198 HydrophobicContact CB-CE2 4.07Å
184	F	98	Very high	95.7	Very high	3 Å²	3	11.5 Å²	11.5	1%	0.013	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.3	-180	79.8	-82.5	0	0	0	114.9	A35 A38 A39 F42 A60 L63 G64 L67 G186	A35-F184 HydrophobicContact CB-CD2 4.19Å; A38-F184 HydrophobicContact CB-CD2 4.33Å; A38-F184 HydrophobicContact CB-CE2 4.01Å; A39-F184 HydrophobicContact CB-CE2 4.03Å; A39-F184 HydrophobicContact CB-CZ 4.37Å; F42-F184 HydrophobicContact CB-CE1 4.47Å; F42-F184 HydrophobicContact CB-CZ 3.99Å; F42-F184 HydrophobicContact CD2-CE1 4.01Å; F42-F184 HydrophobicContact CD2-CZ 4.37Å; F42-F184 HydrophobicContact CE2-CE1 4.49Å; F42-F184 HydrophobicContact CG-CE1 4.18Å; F42-F184 HydrophobicContact CG-CZ 4.14Å; A60-F184 HydrophobicContact CB-CD1 4.23Å; A60-F184 HydrophobicContact CB-CE1 4.41Å; A60-F184 PolarHBondContact O-N 2.79Å; L63-F184 HydrophobicContact CB-CB 3.92Å; L63-F184 HydrophobicContact CB-CD1 4.34Å; L63-F184 HydrophobicContact CB-CG 4.25Å; L63-F184 HydrophobicContact CD2-CB 3.96Å; L63-F184 HydrophobicContact CD2-CD1 3.93Å; L63-F184 HydrophobicContact CD2-CD2 3.76Å; L63-F184 HydrophobicContact CD2-CE1 4.35Å; L63-F184 HydrophobicContact CD2-CE2 4.21Å; L63-F184 HydrophobicContact CD2-CG 3.6Å; L63-F184 HydrophobicContact CD2-CZ 4.47Å; L63-F184 HydrophobicContact CG-CB 3.81Å; L63-F184 HydrophobicContact CG-CD2 4.5Å; L63-F184 HydrophobicContact CG-CG 4.04Å; G64-F184 VanDerWaalsContact CA-CA 3.49Å; L67-F184 HydrophobicContact CD1-CB 4.01Å; F184-G186 VanDerWaalsContact C-N 3.27Å; F184-G186 PolarHBondContact O-N 3.17Å
185	M	96.7	Very high	95.7	Very high	2 Å²	2	7.6 Å²	7.6	1%	0.01	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-26.9	-176.8	-61.4	160.6	-75.1	0	0	112.5	N183 Y198 F201 I298 N299 A302 F304	N183-M185 HydrophobicContact CB-CE 3.88Å; N183-M185 PolarHBondContact O-N 3.45Å; N183-M185 VanDerWaalsContact O-N 3.17Å; N183-M185 PolarHBondContact OD1-N 2.96Å; M185-Y198 HydrophobicContact CE-CE2 4.1Å; M185-F201 HydrophobicContact CE-CE1 3.86Å; M185-F201 HydrophobicContact SD-CE1 3.69Å; M185-F201 HydrophobicContact SD-CZ 4Å; M185-I298 HydrophobicContact CB-CG2 4.37Å; M185-N299 WeakPolarHBondContact CB-OD1 3.35Å; M185-N299 PolarHBondContact O-ND2 3.47Å; M185-A302 HydrophobicContact CG-CB 4.14Å; M185-A302 HydrophobicContact SD-CB 3.64Å; M185-F304 HydrophobicContact SD-CB 4.49Å
186	G	93.2	Very high	95.6	Very high	3 Å²	3	9.8 Å²	9.8	3%	0.031	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.4	-1.5	-174.4	0	0	0	0	0	116.4	N183 F184 L188 G190	N183-G186 PolarHBondContact O-N 3.09Å; N183-G186 PolarHBondContact OD1-N 2.91Å; N183-G186 VanDerWaalsContact OD1-N 3.1Å; F184-G186 VanDerWaalsContact C-N 3.27Å; F184-G186 PolarHBondContact O-N 3.17Å; G186-L188 VanDerWaalsContact C-N 3.32Å; G186-L188 PolarHBondContact O-N 2.77Å; G186-G190 VanDerWaalsContact CA-O 3.27Å; G186-G190 WeakPolarHBondContact CA-O 3.5Å; G186-G190 VanDerWaalsContact O-CA 3.28Å; G186-G190 WeakPolarHBondContact O-CA 3.32Å; G186-G190 PolarHBondContact O-N 3.32Å
187	I	95.3	Very high	95.4	Very high	3 Å²	3	11.4 Å²	11.4	2%	0.015	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-34.8	-175.4	-168.8	165	0	0	0	113.4	G64 A68 F79 P133 C182 N183	G64-I187 WeakPolarHBondContact O-CD1 3.5Å; A68-I187 HydrophobicContact CB-CD1 3.73Å; A68-I187 HydrophobicContact CB-CG1 4.42Å; F79-I187 HydrophobicContact CD2-CD1 4.31Å; P133-I187 VanDerWaalsContact CB-O 3.26Å; P133-I187 WeakPolarHBondContact CB-O 3.49Å; C182-I187 HydrophobicContact CB-CD1 4.12Å; N183-I187 VanDerWaalsContact O-CB 3.3Å; N183-I187 WeakPolarHBondContact O-CB 3.41Å; N183-I187 PolarHBondContact O-N 3.17Å
188	L	93.3	Very high	95.4	Very high	6 Å²	6	11.4 Å²	11.4	3%	0.031	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-39.4	-174.3	-63.7	-177.7	0	0	0	113.6	F28 C31 Q32 C71 F72 G186	F28-L188 HydrophobicContact CD2-CB 4.46Å; F28-L188 HydrophobicContact CE2-CB 4.03Å; C31-L188 HydrophobicContact CB-CD1 3.65Å; Q32-L188 HydrophobicContact CG-CD1 4.17Å; C71-L188 HydrophobicContact CB-CD2 4.27Å; F72-L188 HydrophobicContact CE2-CD2 3.66Å; F72-L188 HydrophobicContact CZ-CD2 4.14Å; G186-L188 VanDerWaalsContact C-N 3.32Å; G186-L188 PolarHBondContact O-N 2.77Å
189	A	89.3	Confident	95.3	Very high	12 Å²	12	9.6 Å²	9.6	10%	0.099	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-143.2	9.1	-170.8	0	0	0	0	0	115	F28 Q32 A295	F28-A189 HydrophobicContact CE2-CB 4.24Å; F28-A189 HydrophobicContact CZ-CB 3.85Å; Q32-A189 VanDerWaalsContact NE2-CB 3.3Å; A189-A295 HydrophobicContact CB-CB 4.13Å
190	G	88.5	Confident	95.1	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.			trans	76	-148.8	-169.2	0	0	0	0	0	112	G186 A295	G186-G190 VanDerWaalsContact CA-O 3.27Å; G186-G190 WeakPolarHBondContact CA-O 3.5Å; G186-G190 VanDerWaalsContact O-CA 3.28Å; G186-G190 WeakPolarHBondContact O-CA 3.32Å; G186-G190 PolarHBondContact O-N 3.32Å; G190-A295 WeakPolarHBondContact O-CB 3.17Å
191	P	91.4	Very high	95	Very high	3 Å²	3	11 Å²	11	2%	0.019	6%	0.057	C	C	.	.			cis	-66.8	162.7	0.1	30.1	-35.5	0	0	0	112.5	I320 N322 Q344	P191-I320 WeakPolarHBondContact CB-O 3.35Å; P191-I320 HydrophobicContact CG-CB 3.91Å; P191-I320 HydrophobicContact CG-CD1 3.68Å; P191-I320 HydrophobicContact CG-CG1 3.65Å; P191-I320 WeakPolarHBondContact CG-O 3.5Å; P191-N322 WeakPolarHBondContact CA-ND2 3.35Å; P191-N322 HydrophobicContact CB-CB 4.4Å; P191-N322 WeakPolarHBondContact CB-ND2 3.47Å; P191-Q344 HydrophobicContact CB-CG 4.23Å
192	L	94.6	Very high	94.9	Very high	5 Å²	5	11 Å²	11	3%	0.026	6%	0.057	C	C	.	.			trans	-64.6	140.8	165	172.5	70.5	0	0	0	109.1	Q139 K140 Q344 W348	Q139-L192 HydrophobicContact CB-CD1 3.83Å; Q139-L192 HydrophobicContact CB-CD2 3.88Å; Q139-L192 HydrophobicContact CB-CG 4.37Å; K140-L192 HydrophobicContact CB-CD1 4.36Å; K140-L192 HydrophobicContact CG-CD1 3.59Å; L192-Q344 HydrophobicContact CB-CB 3.81Å; L192-Q344 HydrophobicContact CG-CB 4.49Å; L192-Q344 WeakPolarHBondContact O-CB 3.31Å; L192-Q344 VanDerWaalsContact O-CG 3.24Å; L192-Q344 WeakPolarHBondContact O-CG 3.47Å; L192-W348 HydrophobicContact CD2-CB 3.49Å; L192-W348 VanDerWaalsContact CD2-CB 3.49Å; L192-W348 HydrophobicContact CD2-CG 4.2Å
193	C	94.8	Very high	94.8	Very high	6 Å²	6	13 Å²	13	4%	0.041	7%	0.066	C	C	.	.			trans	-132	163.6	172.4	59.5	0	0	0	0	109.8	Y180 F304 I320	Y180-C193 PolarHBondContact OH-O 2.93Å; C193-F304 HydrophobicContact CB-CE1 4.05Å; C193-F304 HydrophobicContact CB-CZ 3.65Å; C193-I320 HydrophobicContact CB-CG2 3.79Å
194	S	95.2	Very high	94.4	Very high	3 Å²	3	13.5 Å²	13.5	2%	0.021	7%	0.072	C	C	.	.			trans	-74.3	152.7	170.7	77.8	0	0	0	0	110.5	K196 D197 Y198	S194-K196 VanDerWaalsContact C-N 3.27Å; S194-K196 PolarHBondContact O-N 3.24Å; S194-D197 PolarHBondContact O-N 2.97Å; S194-D197 WeakPolarHBondContact OG-CB 3.31Å; S194-D197 PolarHBondContact OG-N 2.93Å; S194-D197 PolarHBondContact OG-OD2 3.28Å; S194-Y198 PolarHBondContact O-N 3.32Å; S194-Y198 VanDerWaalsContact O-N 3.1Å
195	Y	97.4	Very high	93.7	Very high	9 Å²	9	18.6 Å²	18.6	4%	0.035	9%	0.091	C	C	.	.	H	α-helix	trans	-60.9	-40.9	174.7	175.9	-100.3	0	0	0	111.1	L144 V168 P172 E176 Y180 D197 Y198 I199	L144-Y195 HydrophobicContact CD1-CD1 3.82Å; L144-Y195 HydrophobicContact CD1-CD2 3.93Å; L144-Y195 HydrophobicContact CD1-CE1 4.41Å; L144-Y195 HydrophobicContact CD1-CG 3.54Å; L144-Y195 HydrophobicContact CD2-CD2 4.05Å; L144-Y195 HydrophobicContact CD2-CE2 4.43Å; L144-Y195 HydrophobicContact CD2-CG 4.5Å; V168-Y195 HydrophobicContact CG1-CD1 4.28Å; V168-Y195 HydrophobicContact CG1-CE1 4.22Å; V168-Y195 HydrophobicContact CG2-CD1 3.74Å; V168-Y195 HydrophobicContact CG2-CE1 4.47Å; P172-Y195 HydrophobicContact CB-CE2 4.08Å; P172-Y195 WeakPolarHBondContact CB-OH 3.28Å; P172-Y195 HydrophobicContact CG-CE1 3.95Å; P172-Y195 HydrophobicContact CG-CE2 3.92Å; P172-Y195 VanDerWaalsContact CG-CZ 3.48Å; P172-Y195 WeakPolarHBondContact CG-OH 3.44Å; E176-Y195 WeakPolarHBondContact CB-OH 3.16Å; Y180-Y195 AromaticContact CD1-CD2 3.81Å; Y180-Y195 HydrophobicContact CD1-CD2 3.81Å; Y180-Y195 HydrophobicContact CD2-CD2 4.24Å; Y180-Y195 HydrophobicContact CE1-CD2 4.25Å; Y180-Y195 AromaticContact CG-CD2 3.77Å; Y180-Y195 HydrophobicContact CG-CD2 3.77Å; Y180-Y195 HydrophobicContact CG-CE2 4.48Å; Y195-D197 PolarHBondContact O-N 3.33Å; Y195-Y198 PolarHBondContact O-N 2.79Å; Y195-I199 HydrophobicContact CD1-CG1 4.02Å; Y195-I199 HydrophobicContact CD2-CD1 4.44Å; Y195-I199 HydrophobicContact CD2-CG1 3.94Å; Y195-I199 HydrophobicContact CE1-CG1 3.6Å; Y195-I199 HydrophobicContact CE2-CD1 3.72Å; Y195-I199 HydrophobicContact CE2-CG1 3.52Å; Y195-I199 HydrophobicContact CG-CG1 4.17Å; Y195-I199 WeakPolarHBondContact O-CB 3.27Å; Y195-I199 VanDerWaalsContact O-CG1 3.29Å; Y195-I199 WeakPolarHBondContact O-CG1 3.4Å; Y195-I199 PolarHBondContact O-N 3.42Å
196	K	95.5	Very high	92.2	Very high	91 Å²	91	20.8 Å²	20.8	40%	0.396	11%	0.107	S	C	.	.	H	α-helix	trans	-61.3	-43.8	179	-171.7	175.2	177.4	176.9	0	112.4	D165 S194 T200	D165-K196 WeakPolarHBondContact O-CD 3.45Å; D165-K196 PolarHBondContact O-NZ 2.96Å; S194-K196 VanDerWaalsContact C-N 3.27Å; S194-K196 PolarHBondContact O-N 3.24Å; K196-T200 VanDerWaalsContact O-CB 3.24Å; K196-T200 WeakPolarHBondContact O-CB 3.44Å; K196-T200 PolarHBondContact O-N 2.98Å; K196-T200 PolarHBondContact O-OG1 3.46Å
197	D	95.2	Very high	90.3	Very high	47 Å²	47	25.7 Å²	25.7	25%	0.251	13%	0.125	S	C	.	.	H	α-helix	trans	-64.2	-43.8	176.9	-65.3	-40.1	0	0	0	111	S194 Y195 T200 F201 F304 L319	S194-D197 PolarHBondContact O-N 2.97Å; S194-D197 WeakPolarHBondContact OG-CB 3.31Å; S194-D197 PolarHBondContact OG-N 2.93Å; S194-D197 PolarHBondContact OG-OD2 3.28Å; Y195-D197 PolarHBondContact O-N 3.33Å; D197-T200 PolarHBondContact O-N 3.06Å; D197-F201 WeakPolarHBondContact O-CB 3.38Å; D197-F201 PolarHBondContact O-N 3.24Å; D197-F304 HydrophobicContact CB-CE2 4.25Å; D197-L319 HydrophobicContact CB-CD2 4.47Å
198	Y	97.3	Very high	88	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-49.2	178.8	177.1	-101.5	0	0	0	112.1	S179 Y180 N183 M185 S194 Y195 T200 F201 I202 F304	S179-Y198 VanDerWaalsContact C-OH 3.31Å; S179-Y198 PolarHBondContact O-OH 3.41Å; S179-Y198 VanDerWaalsContact O-OH 3.11Å; S179-Y198 PolarHBondContact OG-OH 2.98Å; Y180-Y198 AromaticContact CD2-CD1 3.77Å; Y180-Y198 HydrophobicContact CD2-CD1 3.77Å; Y180-Y198 AromaticContact CD2-CG 3.74Å; Y180-Y198 HydrophobicContact CD2-CG 3.74Å; Y180-Y198 HydrophobicContact CG-CD1 4.19Å; N183-Y198 HydrophobicContact CB-CE2 4.07Å; M185-Y198 HydrophobicContact CE-CE2 4.1Å; S194-Y198 PolarHBondContact O-N 3.32Å; S194-Y198 VanDerWaalsContact O-N 3.1Å; Y195-Y198 PolarHBondContact O-N 2.79Å; Y198-T200 VanDerWaalsContact C-N 3.34Å; Y198-T200 PolarHBondContact O-N 3.28Å; Y198-F201 PolarHBondContact O-N 3.31Å; Y198-I202 HydrophobicContact CD1-CG2 4.35Å; Y198-I202 HydrophobicContact CE1-CB 4.35Å; Y198-I202 HydrophobicContact CE1-CG2 4.01Å; Y198-I202 WeakPolarHBondContact O-CB 3.5Å; Y198-I202 VanDerWaalsContact O-CG2 3.27Å; Y198-I202 WeakPolarHBondContact O-CG2 3.28Å; Y198-I202 PolarHBondContact O-N 3.13Å; Y198-F304 HydrophobicContact CD2-CE1 4.35Å
199	I	96.9	Very high	85.6	Confident	5 Å²	5	39 Å²	39	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-65.9	-38.9	179.7	-65.2	-57.4	0	0	0	110.7	E176 Y195 F201 I202 E203	E176-I199 HydrophobicContact CB-CD1 3.93Å; E176-I199 HydrophobicContact CG-CD1 4.1Å; Y195-I199 HydrophobicContact CD1-CG1 4.02Å; Y195-I199 HydrophobicContact CD2-CD1 4.44Å; Y195-I199 HydrophobicContact CD2-CG1 3.94Å; Y195-I199 HydrophobicContact CE1-CG1 3.6Å; Y195-I199 HydrophobicContact CE2-CD1 3.72Å; Y195-I199 HydrophobicContact CE2-CG1 3.52Å; Y195-I199 HydrophobicContact CG-CG1 4.17Å; Y195-I199 WeakPolarHBondContact O-CB 3.27Å; Y195-I199 VanDerWaalsContact O-CG1 3.29Å; Y195-I199 WeakPolarHBondContact O-CG1 3.4Å; Y195-I199 PolarHBondContact O-N 3.42Å; I199-F201 VanDerWaalsContact C-N 3.32Å; I199-F201 PolarHBondContact O-N 2.65Å; I199-I202 HydrophobicContact CD1-CG2 4.27Å; I199-E203 HydrophobicContact CG2-CG 4.24Å; I199-E203 WeakPolarHBondContact CG2-OE2 3.21Å; I199-E203 VanDerWaalsContact O-CB 3.31Å; I199-E203 WeakPolarHBondContact O-CB 3.33Å; I199-E203 WeakPolarHBondContact O-CG 3.39Å; I199-E203 PolarHBondContact O-N 3.16Å; I199-E203 VanDerWaalsContact O-N 3.09Å
200	T	94.3	Very high	83.1	Confident	17 Å²	17	43.3 Å²	43.3	10%	0.104	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-42.2	173.8	-60.1	0	0	0	0	111.8	K196 D197 Y198 G204 R205 S206	K196-T200 VanDerWaalsContact O-CB 3.24Å; K196-T200 WeakPolarHBondContact O-CB 3.44Å; K196-T200 PolarHBondContact O-N 2.98Å; K196-T200 PolarHBondContact O-OG1 3.46Å; D197-T200 PolarHBondContact O-N 3.06Å; Y198-T200 VanDerWaalsContact C-N 3.34Å; Y198-T200 PolarHBondContact O-N 3.28Å; T200-G204 PolarHBondContact O-N 2.74Å; T200-R205 HydrophobicContact CG2-CB 3.96Å; T200-R205 PolarHBondContact O-N 2.68Å; T200-S206 PolarHBondContact O-N 3Å; T200-S206 PolarHBondContact O-OG 3.02Å
201	F	95.3	Very high	80.7	Confident	13 Å²	13	50.1 Å²	50.1	6%	0.057	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-54.1	176.6	161.1	-102.4	0	0	0	113.1	F42 R56 M185 D197 Y198 I199 E203 G204 A302 F304	F42-F201 HydrophobicContact CE1-CE1 4.49Å; F42-F201 HydrophobicContact CE1-CZ 4.15Å; R56-F201 PolarHBondContact NH2-O 2.96Å; M185-F201 HydrophobicContact CE-CE1 3.86Å; M185-F201 HydrophobicContact SD-CE1 3.69Å; M185-F201 HydrophobicContact SD-CZ 4Å; D197-F201 WeakPolarHBondContact O-CB 3.38Å; D197-F201 PolarHBondContact O-N 3.24Å; Y198-F201 PolarHBondContact O-N 3.31Å; I199-F201 VanDerWaalsContact C-N 3.32Å; I199-F201 PolarHBondContact O-N 2.65Å; F201-E203 VanDerWaalsContact C-N 3.28Å; F201-E203 PolarHBondContact O-N 3.13Å; F201-G204 PolarHBondContact O-N 2.9Å; F201-G204 VanDerWaalsContact O-N 3.09Å; F201-A302 WeakPolarHBondContact CE2-O 3.46Å; F201-A302 HydrophobicContact CZ-CB 4.15Å; F201-F304 HydrophobicContact CB-CD2 3.58Å; F201-F304 HydrophobicContact CB-CE2 3.98Å; F201-F304 HydrophobicContact CB-CG 4.29Å; F201-F304 HydrophobicContact CD1-CB 3.87Å; F201-F304 HydrophobicContact CD1-CD1 4.33Å; F201-F304 AromaticContact CD1-CD2 3.98Å; F201-F304 HydrophobicContact CD1-CD2 3.98Å; F201-F304 AromaticContact CD1-CG 3.81Å; F201-F304 HydrophobicContact CD1-CG 3.81Å; F201-F304 HydrophobicContact CD2-CB 3.67Å; F201-F304 HydrophobicContact CD2-CD2 4.07Å; F201-F304 HydrophobicContact CD2-CG 4.16Å; F201-F304 HydrophobicContact CE1-CB 3.85Å; F201-F304 HydrophobicContact CE1-CG 4.22Å; F201-F304 HydrophobicContact CE2-CB 3.64Å; F201-F304 HydrophobicContact CG-CB 3.78Å; F201-F304 AromaticContact CG-CD2 3.57Å; F201-F304 HydrophobicContact CG-CD2 3.57Å; F201-F304 HydrophobicContact CG-CE2 4.36Å; F201-F304 AromaticContact CG-CG 3.78Å; F201-F304 HydrophobicContact CG-CG 3.78Å; F201-F304 HydrophobicContact CZ-CB 3.73Å
202	I	96.8	Very high	77.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-29.2	-170.6	-163.9	67.6	0	0	0	111.6	F42 R56 H57 A60 Y198 I199	F42-I202 HydrophobicContact CE1-CD1 4.21Å; F42-I202 HydrophobicContact CZ-CD1 3.64Å; R56-I202 HydrophobicContact CB-CD1 4.06Å; R56-I202 HydrophobicContact CB-CG1 4.27Å; R56-I202 PolarHBondContact NE-O 2.91Å; R56-I202 PolarHBondContact NH2-O 3.45Å; H57-I202 WeakPolarHBondContact CE1-CG2 3.37Å; H57-I202 WeakPolarHBondContact NE2-CG2 3.47Å; A60-I202 HydrophobicContact CB-CD1 4.19Å; Y198-I202 HydrophobicContact CD1-CG2 4.35Å; Y198-I202 HydrophobicContact CE1-CB 4.35Å; Y198-I202 HydrophobicContact CE1-CG2 4.01Å; Y198-I202 WeakPolarHBondContact O-CB 3.5Å; Y198-I202 VanDerWaalsContact O-CG2 3.27Å; Y198-I202 WeakPolarHBondContact O-CG2 3.28Å; Y198-I202 PolarHBondContact O-N 3.13Å; I199-I202 HydrophobicContact CD1-CG2 4.27Å
203	E	95.4	Very high	75.1	Confident	42 Å²	42	57.2 Å²	57.2	20%	0.196	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	0	175.5	-54.2	-166	110	0	0	113	S53 I199 F201 R205	S53-E203 WeakPolarHBondContact OG-CA 3.38Å; I199-E203 HydrophobicContact CG2-CG 4.24Å; I199-E203 WeakPolarHBondContact CG2-OE2 3.21Å; I199-E203 VanDerWaalsContact O-CB 3.31Å; I199-E203 WeakPolarHBondContact O-CB 3.33Å; I199-E203 WeakPolarHBondContact O-CG 3.39Å; I199-E203 PolarHBondContact O-N 3.16Å; I199-E203 VanDerWaalsContact O-N 3.09Å; F201-E203 VanDerWaalsContact C-N 3.28Å; F201-E203 PolarHBondContact O-N 3.13Å; E203-R205 PolarHBondContact O-N 2.96Å; E203-R205 IonicContact OE2-CZ 2.79Å; E203-R205 IonicContact OE2-NH1 3.81Å; E203-R205 PolarHBondContact OE2-NH1 2.66Å; E203-R205 IonicContact OE2-NH2 3.75Å; E203-R205 PolarHBondContact OE2-NH2 3.16Å
204	G	89	Confident	72.5	Confident	14 Å²	14	66.7 Å²	66.7	14%	0.144	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	19.1	174.6	0	0	0	0	0	115.6	S48 T200 F201 S206	S48-G204 VanDerWaalsContact CB-CA 3.48Å; T200-G204 PolarHBondContact O-N 2.74Å; F201-G204 PolarHBondContact O-N 2.9Å; F201-G204 VanDerWaalsContact O-N 3.09Å; G204-S206 VanDerWaalsContact C-N 3.3Å; G204-S206 PolarHBondContact O-N 2.93Å
205	R	83	Confident	69.6	Low	109 Å²	109	73.7 Å²	73.7	41%	0.411	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-79.3	-8.3	178.8	-71.6	-164.2	-68	-90.3	-10.3	114.4	T200 E203 Y207 H208	T200-R205 HydrophobicContact CG2-CB 3.96Å; T200-R205 PolarHBondContact O-N 2.68Å; E203-R205 PolarHBondContact O-N 2.96Å; E203-R205 IonicContact OE2-CZ 2.79Å; E203-R205 IonicContact OE2-NH1 3.81Å; E203-R205 PolarHBondContact OE2-NH1 2.66Å; E203-R205 IonicContact OE2-NH2 3.75Å; E203-R205 PolarHBondContact OE2-NH2 3.16Å; R205-Y207 PolarHBondContact O-N 3.32Å; R205-H208 PolarHBondContact O-N 3.49Å
206	S	64.2	Low	66.7	Low	49 Å²	49	76.9 Å²	76.9	34%	0.343	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-55.6	-22.6	-175.3	-55.6	0	0	0	0	115	T200 G204	T200-S206 PolarHBondContact O-N 3Å; T200-S206 PolarHBondContact O-OG 3.02Å; G204-S206 VanDerWaalsContact C-N 3.3Å; G204-S206 PolarHBondContact O-N 2.93Å
207	Y	53.8	Low	63.7	Low	105 Å²	105	80.3 Å²	80.3	41%	0.412	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-89.1	-6.4	-177.7	-54.7	-70	0	0	0	114.3	R205 E226	R205-Y207 PolarHBondContact O-N 3.32Å; Y207-E226 HydrophobicContact CE1-CB 3.89Å; Y207-E226 HydrophobicContact CE1-CG 3.93Å; Y207-E226 WeakPolarHBondContact OH-CG 3.42Å; Y207-E226 PolarHBondContact OH-OE1 2.95Å
208	H	45.9	Very low	60.8	Low	159 Å²	159	86.3 Å²	86.3	74%	0.736	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-102.3	9.6	179.4	-69.7	-72.3	0	0	0	113.5	R205 T210	R205-H208 PolarHBondContact O-N 3.49Å; H208-T210 PolarHBondContact O-N 3.12Å
209	M	43.2	Very low	57.8	Low	130 Å²	130	93.4 Å²	93.4	64%	0.64	49%	0.493	S	S	*	.			trans	-74.8	99.7	-178.4	-157.7	89.2	83.4	0	0	110.5	Q211	M209-Q211 PolarHBondContact O-N 2.93Å
210	T	36.6	Very low	54.8	Low	102 Å²	102	99.3 Å²	99.3	63%	0.626	53%	0.53	S	S	*	.			trans	-58.9	119.5	167.1	21.6	0	0	0	0	109.7	H208 S212	H208-T210 PolarHBondContact O-N 3.12Å; T210-S212 PolarHBondContact O-N 3.09Å
211	Q	38.7	Very low	52.3	Low	143 Å²	143	104 Å²	104	67%	0.668	55%	0.55	S	S	*	*			trans	-76.5	117	161.6	-73.7	-169.4	0.2	0	0	107.6	M209 G213	M209-Q211 PolarHBondContact O-N 2.93Å; Q211-G213 PolarHBondContact O-N 3.48Å
212	S	33	Very low	49.5	Very low	119 Å²	119	113.6 Å²	113.6	83%	0.832	59%	0.588	S	S	*	*			trans	-65.6	103.3	165.7	47.2	0	0	0	0	108.5	T210	T210-S212 PolarHBondContact O-N 3.09Å
213	G	35.3	Very low	47	Very low	39 Å²	39	123.1 Å²	123.1	40%	0.402	63%	0.632	S	S	.	*			trans	-64.1	152.2	175.8	0	0	0	0	0	111.7	Q211 N215 G216	Q211-G213 PolarHBondContact O-N 3.48Å; G213-N215 PolarHBondContact O-N 2.94Å; G213-G216 PolarHBondContact O-N 3.44Å; G213-G216 VanDerWaalsContact O-N 3.16Å
214	E	40.1	Very low	45.2	Very low	205 Å²	205	127.7 Å²	127.7	96%	0.958	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-7.3	-179.4	-74.3	179.4	148.1	0	0	114.7
215	N	34.2	Very low	44.2	Very low	149 Å²	149	133 Å²	133	80%	0.797	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	15.5	-177.8	-75.1	-25.3	0	0	0	115.2	G213 K217	G213-N215 PolarHBondContact O-N 2.94Å; N215-K217 PolarHBondContact O-N 3.47Å
216	G	36.3	Very low	44	Very low	77 Å²	77	130.6 Å²	130.6	79%	0.794	67%	0.671	S	S	*	*	S	Bend	trans	63.5	11	174.3	0	0	0	0	0	115.2	G213	G213-G216 PolarHBondContact O-N 3.44Å; G213-G216 VanDerWaalsContact O-N 3.16Å
217	K	32.9	Very low	45.1	Very low	163 Å²	163	129.1 Å²	129.1	71%	0.709	66%	0.66	S	S	*	*			trans	-94	116.1	169	-68.8	-175.4	178.4	-178.6	0	107.8	N215 E219	N215-K217 PolarHBondContact O-N 3.47Å; K217-E219 VanDerWaalsContact C-N 3.31Å; K217-E219 PolarHBondContact O-N 3.32Å
218	E	34.1	Very low	46.9	Very low	172 Å²	172	127.5 Å²	127.5	80%	0.804	66%	0.664	S	S	*	*			trans	-64.7	93.4	166.8	-67.3	-178.1	165.5	0	0	108	T220	E218-T220 PolarHBondContact O-N 3.36Å
219	E	34.3	Very low	49.2	Very low	150 Å²	150	120.4 Å²	120.4	70%	0.701	63%	0.632	S	S	*	*			trans	-76.7	105.7	166.5	-81.6	-172.7	172.7	0	0	108.1	K217 Q221	K217-E219 VanDerWaalsContact C-N 3.31Å; K217-E219 PolarHBondContact O-N 3.32Å; E219-Q221 PolarHBondContact O-N 2.94Å
220	T	34.5	Very low	51.7	Low	129 Å²	129	118.9 Å²	118.9	79%	0.791	63%	0.627	S	S	*	*			trans	-60.4	95.4	167.6	-11.6	0	0	0	0	108.3	E218 Y222	E218-T220 PolarHBondContact O-N 3.36Å; T220-Y222 PolarHBondContact O-N 2.94Å
221	Q	40.8	Very low	54.5	Low	114 Å²	114	118.7 Å²	118.7	53%	0.533	63%	0.625	S	S	.	*			trans	-71.7	121.5	172	-84.4	-167.3	4.3	0	0	109.6	E219	E219-Q221 PolarHBondContact O-N 2.94Å
222	Y	38.4	Very low	57.2	Low	215 Å²	215	112.4 Å²	112.4	84%	0.843	60%	0.598	S	S	*	*			trans	-44.4	143.8	163.9	-71.2	-93.2	0	0	0	111.3	T220 R224	T220-Y222 PolarHBondContact O-N 2.94Å; Y222-R224 PolarHBondContact O-N 2.91Å
223	E	44	Very low	60.2	Low	201 Å²	201	107.3 Å²	107.3	94%	0.939	56%	0.562	S	S	*	*			trans	-40.2	94.3	173.8	-73.8	179.8	143.3	0	0	111.6	T225	E223-T225 PolarHBondContact O-N 3.15Å
224	R	57.8	Low	63.2	Low	137 Å²	137	110.4 Å²	110.4	52%	0.517	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-75.2	128	170	-88.5	-177.4	176.8	174.6	1.3	107.9	Y222 E226	Y222-R224 PolarHBondContact O-N 2.91Å; R224-E226 PolarHBondContact O-N 2.87Å
225	T	66.9	Low	65.9	Low	125 Å²	125	106.1 Å²	106.1	77%	0.767	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-53.4	132.8	174.6	35.3	0	0	0	0	110.7	E223 Y309	E223-T225 PolarHBondContact O-N 3.15Å; T225-Y309 PolarHBondContact O-OH 2.94Å
226	E	78.1	Confident	68.9	Low	60 Å²	60	100.6 Å²	100.6	28%	0.28	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-53.8	122.9	176.9	178.8	-174.6	-168.6	0	0	109.8	R43 H47 Y207 R224	R43-E226 IonicContact CZ-OE1 2.79Å; R43-E226 IonicContact NE-OE1 3.76Å; R43-E226 PolarHBondContact NE-OE1 3.35Å; R43-E226 IonicContact NE-OE2 3.37Å; R43-E226 IonicContact NH1-OE1 3.18Å; R43-E226 IonicContact NH2-OE1 2.7Å; R43-E226 PolarHBondContact NH2-OE1 2.75Å; R43-E226 IonicContact NH2-OE2 2.81Å; H47-E226 IonicContact CD2-OE2 2.64Å; H47-E226 IonicContact NE2-OE2 3.68Å; H47-E226 PolarHBondContact NE2-OE2 3.02Å; Y207-E226 HydrophobicContact CE1-CB 3.89Å; Y207-E226 HydrophobicContact CE1-CG 3.93Å; Y207-E226 WeakPolarHBondContact OH-CG 3.42Å; Y207-E226 PolarHBondContact OH-OE1 2.95Å; R224-E226 PolarHBondContact O-N 2.87Å
227	P	88.5	Confident	71.8	Confident	17 Å²	17	99.9 Å²	99.9	11%	0.11	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-69.3	144.2	-178.1	26.2	-31.1	0	0	0	110.9	R43 F306 Y309 A315 W317	R43-P227 PolarHBondContact NH2-O 3.11Å; P227-F306 HydrophobicContact CG-CD1 4.46Å; P227-F306 HydrophobicContact CG-CD2 3.81Å; P227-F306 HydrophobicContact CG-CE1 4.21Å; P227-F306 HydrophobicContact CG-CE2 3.55Å; P227-F306 HydrophobicContact CG-CG 4.27Å; P227-F306 HydrophobicContact CG-CZ 3.74Å; P227-Y309 HydrophobicContact CB-CE1 4.49Å; P227-A315 HydrophobicContact CB-CB 3.69Å; P227-A315 HydrophobicContact CG-CB 4.09Å; P227-W317 HydrophobicContact CB-CZ2 4.16Å; P227-W317 HydrophobicContact CG-CZ2 3.94Å; P227-W317 WeakPolarHBondContact O-CZ2 3.15Å
228	S	91.4	Very high	74.9	Confident	72 Å²	72	97.4 Å²	97.4	50%	0.503	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-68.1	136	172.7	178.7	0	0	0	0	110.7	N230	S228-N230 VanDerWaalsContact C-N 3.31Å; S228-N230 VanDerWaalsContact OG-CG 3.29Å; S228-N230 PolarHBondContact OG-N 3.39Å; S228-N230 PolarHBondContact OG-ND2 3.41Å
229	P	94.6	Very high	77.9	Confident	9 Å²	9	92.4 Å²	92.4	6%	0.058	47%	0.467	C	S	.	.			trans	-85.7	-9.6	178.2	40.9	-36.7	0	0	0	111.6	R43 T231 A232 V233 N300 W317	R43-P229 VanDerWaalsContact NH1-CB 3.35Å; P229-T231 VanDerWaalsContact C-N 3.34Å; P229-T231 PolarHBondContact O-N 3.45Å; P229-A232 WeakPolarHBondContact O-CB 3.42Å; P229-A232 PolarHBondContact O-N 3.13Å; P229-V233 HydrophobicContact CB-CG2 4.03Å; P229-V233 WeakPolarHBondContact O-CG2 3.38Å; P229-V233 PolarHBondContact O-N 3.15Å; P229-N300 WeakPolarHBondContact CB-O 3.46Å; P229-W317 HydrophobicContact CB-CE3 4.36Å; P229-W317 HydrophobicContact CB-CH2 3.72Å; P229-W317 HydrophobicContact CB-CZ2 3.85Å; P229-W317 HydrophobicContact CB-CZ3 3.97Å
230	N	95.1	Very high	80.9	Confident	98 Å²	98	85.5 Å²	85.5	52%	0.524	44%	0.435	S	S	.	.	H	α-helix	trans	-58.1	-44.9	-159.8	-68.6	-5.4	0	0	0	112.1	S228 A232 V233 I234	S228-N230 VanDerWaalsContact C-N 3.31Å; S228-N230 VanDerWaalsContact OG-CG 3.29Å; S228-N230 PolarHBondContact OG-N 3.39Å; S228-N230 PolarHBondContact OG-ND2 3.41Å; N230-A232 PolarHBondContact O-N 2.99Å; N230-V233 PolarHBondContact O-N 3.26Å; N230-I234 WeakPolarHBondContact O-CB 3.46Å; N230-I234 WeakPolarHBondContact O-CD1 3.38Å; N230-I234 WeakPolarHBondContact O-CG1 3.3Å; N230-I234 PolarHBondContact O-N 3.2Å
231	T	94.8	Very high	83.8	Confident	98 Å²	98	81.4 Å²	81.4	60%	0.601	42%	0.419	S	S	*	.	H	α-helix	trans	-60.5	-45.4	177.8	-53	0	0	0	0	111.6	P229 Q235	P229-T231 VanDerWaalsContact C-N 3.34Å; P229-T231 PolarHBondContact O-N 3.45Å; T231-Q235 WeakPolarHBondContact O-CB 3.39Å; T231-Q235 VanDerWaalsContact O-CG 3.25Å; T231-Q235 WeakPolarHBondContact O-CG 3.36Å; T231-Q235 PolarHBondContact O-N 3.48Å
232	A	95.3	Very high	86.4	Confident	12 Å²	12	81.6 Å²	81.6	10%	0.099	42%	0.423	C	S	.	.	H	α-helix	trans	-67.1	-41	179.2	0	0	0	0	0	111.8	P229 N230 K236 W317	P229-A232 WeakPolarHBondContact O-CB 3.42Å; P229-A232 PolarHBondContact O-N 3.13Å; N230-A232 PolarHBondContact O-N 2.99Å; A232-K236 WeakPolarHBondContact O-CB 3.44Å; A232-K236 VanDerWaalsContact O-CG 3.31Å; A232-K236 WeakPolarHBondContact O-CG 3.23Å; A232-K236 PolarHBondContact O-N 2.97Å; A232-W317 HydrophobicContact CB-CB 3.62Å; A232-W317 HydrophobicContact CB-CD2 4.39Å; A232-W317 HydrophobicContact CB-CG 3.58Å
233	V	97.6	Very high	89.1	Confident	12 Å²	12	72 Å²	72	7%	0.073	39%	0.387	C	S	.	.	H	α-helix	trans	-64.4	-49	177	174.2	0	0	0	0	110.5	L36 P229 N230 Q235 K236 L237 N300 A301	L36-V233 HydrophobicContact CD1-CG1 4.28Å; P229-V233 HydrophobicContact CB-CG2 4.03Å; P229-V233 WeakPolarHBondContact O-CG2 3.38Å; P229-V233 PolarHBondContact O-N 3.15Å; N230-V233 PolarHBondContact O-N 3.26Å; V233-Q235 PolarHBondContact O-N 2.9Å; V233-K236 PolarHBondContact O-N 3.44Å; V233-K236 VanDerWaalsContact O-N 3.15Å; V233-L237 HydrophobicContact CG1-CD1 3.93Å; V233-L237 HydrophobicContact CG1-CG 4.25Å; V233-L237 VanDerWaalsContact O-CG 3.31Å; V233-L237 WeakPolarHBondContact O-CG 3.44Å; V233-L237 PolarHBondContact O-N 2.91Å; V233-N300 HydrophobicContact CG2-CB 4.01Å; V233-A301 HydrophobicContact CG2-CB 4.08Å
234	I	97.6	Very high	91.3	Very high	103 Å²	103	65 Å²	65	53%	0.528	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-46.8	178.4	-69.9	165.4	0	0	0	110.7	N230 K236 L237 L238	N230-I234 WeakPolarHBondContact O-CB 3.46Å; N230-I234 WeakPolarHBondContact O-CD1 3.38Å; N230-I234 WeakPolarHBondContact O-CG1 3.3Å; N230-I234 PolarHBondContact O-N 3.2Å; I234-K236 VanDerWaalsContact C-N 3.32Å; I234-K236 PolarHBondContact O-N 2.89Å; I234-L237 PolarHBondContact O-N 2.62Å; I234-L238 HydrophobicContact CG2-CD1 4.27Å; I234-L238 HydrophobicContact CG2-CG 4.5Å; I234-L238 WeakPolarHBondContact O-CG 3.45Å; I234-L238 PolarHBondContact O-N 3.01Å
235	Q	96.7	Very high	93	Very high	116 Å²	116	63.5 Å²	63.5	54%	0.542	36%	0.357	S	S	.	.	H	α-helix	trans	-58	-44	176.5	-75.4	175.4	-4.1	0	0	112.1	T231 V233 L238 I239	T231-Q235 WeakPolarHBondContact O-CB 3.39Å; T231-Q235 VanDerWaalsContact O-CG 3.25Å; T231-Q235 WeakPolarHBondContact O-CG 3.36Å; T231-Q235 PolarHBondContact O-N 3.48Å; V233-Q235 PolarHBondContact O-N 2.9Å; Q235-L238 PolarHBondContact O-N 2.72Å; Q235-I239 WeakPolarHBondContact O-CG1 3.43Å; Q235-I239 PolarHBondContact O-N 3.24Å; Q235-I239 VanDerWaalsContact O-N 3.1Å
236	K	97.2	Very high	94.1	Very high	33 Å²	33	61.3 Å²	61.3	14%	0.143	34%	0.337	C	S	.	.	H	α-helix	trans	-66.4	-38.3	177.1	-73.5	-177.7	-171	-64.8	0	112.3	A232 V233 I234 I239 C240 T293 D296 A297 N300	A232-K236 WeakPolarHBondContact O-CB 3.44Å; A232-K236 VanDerWaalsContact O-CG 3.31Å; A232-K236 WeakPolarHBondContact O-CG 3.23Å; A232-K236 PolarHBondContact O-N 2.97Å; V233-K236 PolarHBondContact O-N 3.44Å; V233-K236 VanDerWaalsContact O-N 3.15Å; I234-K236 VanDerWaalsContact C-N 3.32Å; I234-K236 PolarHBondContact O-N 2.89Å; K236-I239 WeakPolarHBondContact O-CB 3.44Å; K236-I239 PolarHBondContact O-N 3.32Å; K236-C240 PolarHBondContact O-N 2.63Å; K236-C240 PolarHBondContact O-SG 2.86Å; K236-T293 HydrophobicContact CB-CG2 3.69Å; K236-T293 HydrophobicContact CD-CG2 4.46Å; K236-T293 HydrophobicContact CG-CG2 3.88Å; K236-T293 WeakPolarHBondContact O-CG2 3.36Å; K236-D296 HydrophobicContact CD-CB 4.2Å; K236-D296 VanDerWaalsContact CE-CG 3.46Å; K236-D296 WeakPolarHBondContact CE-OD1 3.31Å; K236-D296 WeakPolarHBondContact CE-OD2 3.35Å; K236-D296 VanDerWaalsContact NZ-CG 3.33Å; K236-D296 IonicContact NZ-OD1 3.04Å; K236-D296 IonicContact NZ-OD2 2.84Å; K236-D296 PolarHBondContact NZ-OD2 3.49Å; K236-A297 HydrophobicContact CB-CB 3.85Å; K236-A297 HydrophobicContact CD-CB 4.23Å; K236-N300 WeakPolarHBondContact CE-ND2 3.41Å
237	L	97.9	Very high	94.6	Very high	61 Å²	61	60.7 Å²	60.7	32%	0.319	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-37.2	175.6	-67.9	176.1	0	0	0	112.3	L36 V233 I234 C240 G241 L294 A297	L36-L237 HydrophobicContact CD2-CD1 4.09Å; L36-L237 HydrophobicContact CD2-CD2 3.76Å; V233-L237 HydrophobicContact CG1-CD1 3.93Å; V233-L237 HydrophobicContact CG1-CG 4.25Å; V233-L237 VanDerWaalsContact O-CG 3.31Å; V233-L237 WeakPolarHBondContact O-CG 3.44Å; V233-L237 PolarHBondContact O-N 2.91Å; I234-L237 PolarHBondContact O-N 2.62Å; L237-C240 WeakPolarHBondContact O-CB 3.37Å; L237-C240 PolarHBondContact O-N 3.32Å; L237-G241 PolarHBondContact O-N 3.29Å; L237-L294 HydrophobicContact CD2-CD1 4.01Å; L237-A297 HydrophobicContact CD2-CB 4.45Å
238	L	97.7	Very high	94.5	Very high	112 Å²	112	64.1 Å²	64.1	59%	0.586	35%	0.351	S	S	*	.	H	α-helix	trans	-61.3	-45.3	171.9	-69.8	172.8	0	0	0	111.2	I234 Q235 C240 G241 L242	I234-L238 HydrophobicContact CG2-CD1 4.27Å; I234-L238 HydrophobicContact CG2-CG 4.5Å; I234-L238 WeakPolarHBondContact O-CG 3.45Å; I234-L238 PolarHBondContact O-N 3.01Å; Q235-L238 PolarHBondContact O-N 2.72Å; L238-C240 VanDerWaalsContact C-N 3.29Å; L238-C240 PolarHBondContact O-N 2.75Å; L238-G241 PolarHBondContact O-N 3.35Å; L238-L242 WeakPolarHBondContact O-CG 3.47Å; L238-L242 PolarHBondContact O-N 3.29Å
239	I	96.9	Very high	94.3	Very high	66 Å²	66	64 Å²	64	34%	0.338	35%	0.348	S	S	.	.	H	α-helix	trans	-59.8	-41	174.4	-67.4	166.5	0	0	0	110.9	Q235 K236 S243 T293 I325	Q235-I239 WeakPolarHBondContact O-CG1 3.43Å; Q235-I239 PolarHBondContact O-N 3.24Å; Q235-I239 VanDerWaalsContact O-N 3.1Å; K236-I239 WeakPolarHBondContact O-CB 3.44Å; K236-I239 PolarHBondContact O-N 3.32Å; I239-S243 VanDerWaalsContact O-CB 3.27Å; I239-S243 WeakPolarHBondContact O-CB 3.42Å; I239-S243 PolarHBondContact O-N 3.31Å; I239-S243 PolarHBondContact O-OG 2.73Å; I239-T293 HydrophobicContact CB-CG2 4.17Å; I239-T293 HydrophobicContact CG2-CG2 3.99Å; I239-I325 HydrophobicContact CG2-CD1 3.58Å
240	C	96.8	Very high	93.9	Very high	5 Å²	5	66.2 Å²	66.2	3%	0.034	36%	0.358	C	S	.	.	H	α-helix	trans	-62.4	-48.3	176.5	-66.7	0	0	0	0	111.6	K236 L237 L238 L242 S243 L244 F290 L294	K236-C240 PolarHBondContact O-N 2.63Å; K236-C240 PolarHBondContact O-SG 2.86Å; L237-C240 WeakPolarHBondContact O-CB 3.37Å; L237-C240 PolarHBondContact O-N 3.32Å; L238-C240 VanDerWaalsContact C-N 3.29Å; L238-C240 PolarHBondContact O-N 2.75Å; C240-L242 PolarHBondContact O-N 3.02Å; C240-S243 PolarHBondContact O-N 3.01Å; C240-L244 WeakPolarHBondContact O-CB 3.37Å; C240-L244 PolarHBondContact O-N 3.47Å; C240-F290 HydrophobicContact CB-CD2 3.85Å; C240-F290 HydrophobicContact CB-CE2 4.2Å; C240-L294 PolarHBondContact SG-N 2.96Å
241	G	95.6	Very high	93.1	Very high	44 Å²	44	63 Å²	63	45%	0.454	34%	0.343	S	S	.	.	H	α-helix	trans	-59	-46.6	178.2	0	0	0	0	0	112.3	L237 L238 L245	L237-G241 PolarHBondContact O-N 3.29Å; L238-G241 PolarHBondContact O-N 3.35Å; G241-L245 VanDerWaalsContact O-CB 3.28Å; G241-L245 WeakPolarHBondContact O-CB 3.45Å; G241-L245 PolarHBondContact O-N 3.09Å
242	L	95.1	Very high	92.3	Very high	118 Å²	118	63.6 Å²	63.6	62%	0.618	35%	0.347	S	S	*	.	H	α-helix	trans	-63.5	-43.4	176.4	-68.4	173.4	0	0	0	112.2	L238 C240 F246	L238-L242 WeakPolarHBondContact O-CG 3.47Å; L238-L242 PolarHBondContact O-N 3.29Å; C240-L242 PolarHBondContact O-N 3.02Å; L242-F246 WeakPolarHBondContact O-CB 3.45Å; L242-F246 PolarHBondContact O-N 2.7Å
243	S	94.8	Very high	91.9	Very high	13 Å²	13	67.2 Å²	67.2	9%	0.091	37%	0.368	C	S	.	.	H	α-helix	trans	-66.8	-40.8	-179.7	-58.6	0	0	0	0	112	I239 C240 H247 P286	I239-S243 VanDerWaalsContact O-CB 3.27Å; I239-S243 WeakPolarHBondContact O-CB 3.42Å; I239-S243 PolarHBondContact O-N 3.31Å; I239-S243 PolarHBondContact O-OG 2.73Å; C240-S243 PolarHBondContact O-N 3.01Å; S243-H247 WeakPolarHBondContact O-CB 3.49Å; S243-H247 PolarHBondContact O-N 3.09Å; S243-P286 WeakPolarHBondContact O-CB 3.47Å
244	L	92	Very high	91.6	Very high	53 Å²	53	68.5 Å²	68.5	28%	0.277	37%	0.374	S	S	.	.	H	α-helix	trans	-67.4	-46.1	176.9	-178.3	61.8	0	0	0	111	C240 F246 H247 L248 F290	C240-L244 WeakPolarHBondContact O-CB 3.37Å; C240-L244 PolarHBondContact O-N 3.47Å; L244-F246 VanDerWaalsContact C-N 3.31Å; L244-F246 PolarHBondContact O-N 3.06Å; L244-H247 PolarHBondContact O-N 2.89Å; L244-L248 HydrophobicContact CD1-CD1 4.01Å; L244-L248 HydrophobicContact CD1-CG 4.07Å; L244-L248 HydrophobicContact CG-CD1 3.97Å; L244-L248 HydrophobicContact CG-CG 4.39Å; L244-L248 WeakPolarHBondContact O-CG 3Å; L244-L248 PolarHBondContact O-N 3.06Å; L244-F290 HydrophobicContact CB-CD2 3.88Å; L244-F290 HydrophobicContact CB-CE2 4.23Å; L244-F290 HydrophobicContact CB-CG 4.37Å; L244-F290 HydrophobicContact CD2-CE2 4.08Å; L244-F290 HydrophobicContact CD2-CZ 4.4Å
245	L	91.6	Very high	91.4	Very high	106 Å²	106	66 Å²	66	56%	0.555	37%	0.365	S	S	*	.	H	α-helix	trans	-57.2	-47.2	175.8	177	63.5	0	0	0	111	G241 H247 L248 T249	G241-L245 VanDerWaalsContact O-CB 3.28Å; G241-L245 WeakPolarHBondContact O-CB 3.45Å; G241-L245 PolarHBondContact O-N 3.09Å; L245-H247 PolarHBondContact O-N 3.49Å; L245-L248 PolarHBondContact O-N 3.47Å; L245-T249 HydrophobicContact CD1-CG2 4.04Å; L245-T249 WeakPolarHBondContact O-CB 3.27Å; L245-T249 WeakPolarHBondContact O-CG2 3.36Å; L245-T249 PolarHBondContact O-N 3.14Å; L245-T249 VanDerWaalsContact O-N 3.13Å; L245-T249 PolarHBondContact O-OG1 3.01Å
246	F	90.9	Very high	91.2	Very high	80 Å²	80	60.8 Å²	60.8	35%	0.351	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-45	177.2	-169.4	-72.9	0	0	0	111.2	L242 L244 L248 T249 I250 A283 P286	L242-F246 WeakPolarHBondContact O-CB 3.45Å; L242-F246 PolarHBondContact O-N 2.7Å; L244-F246 VanDerWaalsContact C-N 3.31Å; L244-F246 PolarHBondContact O-N 3.06Å; F246-L248 PolarHBondContact O-N 3Å; F246-T249 PolarHBondContact O-N 3.08Å; F246-T249 PolarHBondContact O-OG1 2.76Å; F246-I250 HydrophobicContact CD1-CB 3.88Å; F246-I250 HydrophobicContact CD1-CG1 4.13Å; F246-I250 HydrophobicContact CD1-CG2 4.46Å; F246-I250 HydrophobicContact CD2-CG1 4.11Å; F246-I250 HydrophobicContact CE1-CB 3.53Å; F246-I250 HydrophobicContact CE1-CG1 3.95Å; F246-I250 HydrophobicContact CE1-CG2 3.62Å; F246-I250 HydrophobicContact CE2-CB 4.43Å; F246-I250 HydrophobicContact CE2-CG1 3.96Å; F246-I250 HydrophobicContact CG-CB 4.47Å; F246-I250 HydrophobicContact CG-CG1 4.21Å; F246-I250 HydrophobicContact CZ-CB 3.87Å; F246-I250 HydrophobicContact CZ-CG1 3.89Å; F246-I250 HydrophobicContact CZ-CG2 3.67Å; F246-I250 WeakPolarHBondContact O-CB 3.45Å; F246-I250 PolarHBondContact O-N 3.44Å; F246-A283 HydrophobicContact CE1-CB 4.16Å; F246-P286 HydrophobicContact CD1-CB 4.27Å; F246-P286 HydrophobicContact CD1-CG 3.58Å; F246-P286 HydrophobicContact CE1-CG 4.1Å; F246-P286 HydrophobicContact CG-CG 4.26Å
247	H	89.1	Confident	91	Very high	46 Å²	46	63.9 Å²	63.9	21%	0.213	36%	0.356	C	S	.	.	H	α-helix	trans	-60.3	-47.2	179.5	-179.5	56.5	0	0	0	112	S243 L244 L245 T249 C251 P286	S243-H247 WeakPolarHBondContact O-CB 3.49Å; S243-H247 PolarHBondContact O-N 3.09Å; L244-H247 PolarHBondContact O-N 2.89Å; L245-H247 PolarHBondContact O-N 3.49Å; H247-T249 VanDerWaalsContact C-N 3.29Å; H247-T249 PolarHBondContact O-N 3.39Å; H247-C251 WeakPolarHBondContact ND1-CB 3.2Å; H247-C251 WeakPolarHBondContact O-CB 3.22Å; H247-C251 PolarHBondContact O-N 3.38Å; H247-P286 HydrophobicContact CB-CB 4.29Å
248	L	86.4	Confident	90.9	Very high	89 Å²	89	65 Å²	65	47%	0.466	36%	0.357	S	S	.	.	H	α-helix	trans	-69.7	-23.4	-178	-65.5	176.5	0	0	0	113.4	L21 L244 L245 F246	L21-L248 HydrophobicContact CD2-CD2 4.21Å; L244-L248 HydrophobicContact CD1-CD1 4.01Å; L244-L248 HydrophobicContact CD1-CG 4.07Å; L244-L248 HydrophobicContact CG-CD1 3.97Å; L244-L248 HydrophobicContact CG-CG 4.39Å; L244-L248 WeakPolarHBondContact O-CG 3Å; L244-L248 PolarHBondContact O-N 3.06Å; L245-L248 PolarHBondContact O-N 3.47Å; F246-L248 PolarHBondContact O-N 3Å
249	T	86.5	Confident	90.8	Very high	71 Å²	71	59.9 Å²	59.9	44%	0.436	33%	0.329	S	S	.	.	H	α-helix	trans	-100.2	-41.3	-176.7	53	0	0	0	0	113.8	L245 F246 H247	L245-T249 HydrophobicContact CD1-CG2 4.04Å; L245-T249 WeakPolarHBondContact O-CB 3.27Å; L245-T249 WeakPolarHBondContact O-CG2 3.36Å; L245-T249 PolarHBondContact O-N 3.14Å; L245-T249 VanDerWaalsContact O-N 3.13Å; L245-T249 PolarHBondContact O-OG1 3.01Å; F246-T249 PolarHBondContact O-N 3.08Å; F246-T249 PolarHBondContact O-OG1 2.76Å; H247-T249 VanDerWaalsContact C-N 3.29Å; H247-T249 PolarHBondContact O-N 3.39Å
250	I	85.7	Confident	90.7	Very high	54 Å²	54	58 Å²	58	28%	0.277	32%	0.32	S	S	.	.	H	α-helix	trans	-102.8	-31.2	-169.5	-54.7	-58.5	0	0	0	112.5	F246 T252 T253 L254 A283	F246-I250 HydrophobicContact CD1-CB 3.88Å; F246-I250 HydrophobicContact CD1-CG1 4.13Å; F246-I250 HydrophobicContact CD1-CG2 4.46Å; F246-I250 HydrophobicContact CD2-CG1 4.11Å; F246-I250 HydrophobicContact CE1-CB 3.53Å; F246-I250 HydrophobicContact CE1-CG1 3.95Å; F246-I250 HydrophobicContact CE1-CG2 3.62Å; F246-I250 HydrophobicContact CE2-CB 4.43Å; F246-I250 HydrophobicContact CE2-CG1 3.96Å; F246-I250 HydrophobicContact CG-CB 4.47Å; F246-I250 HydrophobicContact CG-CG1 4.21Å; F246-I250 HydrophobicContact CZ-CB 3.87Å; F246-I250 HydrophobicContact CZ-CG1 3.89Å; F246-I250 HydrophobicContact CZ-CG2 3.67Å; F246-I250 WeakPolarHBondContact O-CB 3.45Å; F246-I250 PolarHBondContact O-N 3.44Å; I250-T252 VanDerWaalsContact C-N 3.28Å; I250-T252 PolarHBondContact O-N 3.44Å; I250-T253 PolarHBondContact O-N 2.89Å; I250-T253 VanDerWaalsContact O-N 3.13Å; I250-T253 PolarHBondContact O-OG1 3.13Å; I250-L254 HydrophobicContact CG2-CD1 3.67Å; I250-L254 PolarHBondContact O-N 3.28Å; I250-A283 HydrophobicContact CG2-CB 4Å
251	C	78.6	Confident	90.7	Very high	30 Å²	30	60.7 Å²	60.7	20%	0.203	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.8	-173.2	-168.8	0	0	0	0	112.8	H247 T253	H247-C251 WeakPolarHBondContact ND1-CB 3.2Å; H247-C251 WeakPolarHBondContact O-CB 3.22Å; H247-C251 PolarHBondContact O-N 3.38Å; C251-T253 VanDerWaalsContact C-N 3.33Å
252	T	77.9	Confident	90.6	Very high	112 Å²	112	65.8 Å²	65.8	69%	0.687	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-22.2	179.3	52.7	0	0	0	0	113	I250	I250-T252 VanDerWaalsContact C-N 3.28Å; I250-T252 PolarHBondContact O-N 3.44Å
253	T	86.9	Confident	90.6	Very high	88 Å²	88	66.1 Å²	66.1	54%	0.54	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-18.9	-180	61.7	0	0	0	0	112.8	I250 C251 P255	I250-T253 PolarHBondContact O-N 2.89Å; I250-T253 VanDerWaalsContact O-N 3.13Å; I250-T253 PolarHBondContact O-OG1 3.13Å; C251-T253 VanDerWaalsContact C-N 3.33Å; T253-P255 VanDerWaalsContact C-CD 3.41Å; T253-P255 WeakPolarHBondContact O-CD 3.27Å
254	L	91.9	Very high	90.6	Very high	39 Å²	39	66.1 Å²	66.1	20%	0.204	34%	0.343	C	S	.	.	S	Bend	trans	-127.6	62.7	-175.8	-67	164.6	0	0	0	111.7	I250 Y276 I279 A283	I250-L254 HydrophobicContact CG2-CD1 3.67Å; I250-L254 PolarHBondContact O-N 3.28Å; L254-Y276 HydrophobicContact CD2-CD2 4.38Å; L254-Y276 HydrophobicContact CD2-CE2 3.71Å; L254-I279 HydrophobicContact CD1-CG2 3.39Å; L254-I279 HydrophobicContact CD2-CG2 4.28Å; L254-I279 HydrophobicContact CG-CG2 4.38Å; L254-A283 HydrophobicContact CB-CB 4.17Å; L254-A283 HydrophobicContact CD1-CB 4.31Å
255	P	92.5	Very high	90.6	Very high	50 Å²	50	65.6 Å²	65.6	33%	0.325	34%	0.339	S	S	.	.			trans	-63.8	136.6	-179.6	26.9	-34.2	0	0	0	111.7	T253 E257 Y258 Y276	T253-P255 VanDerWaalsContact C-CD 3.41Å; T253-P255 WeakPolarHBondContact O-CD 3.27Å; P255-E257 WeakPolarHBondContact CB-OE2 2.95Å; P255-E257 PolarHBondContact O-N 2.99Å; P255-Y258 PolarHBondContact O-N 3.32Å; P255-Y276 PolarHBondContact O-OH 3.17Å
256	V	93.3	Very high	90.7	Very high	7 Å²	7	64.8 Å²	64.8	4%	0.042	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-65.5	-28.8	-179.9	176.9	0	0	0	0	110.9	Y258 N259 L281 A284 V431 V434	V256-Y258 PolarHBondContact O-N 3.01Å; V256-N259 WeakPolarHBondContact O-CB 3.42Å; V256-N259 PolarHBondContact O-N 3.23Å; V256-N259 VanDerWaalsContact O-N 3.11Å; V256-N259 PolarHBondContact O-ND2 3.5Å; V256-L281 HydrophobicContact CB-CD2 4.49Å; V256-L281 HydrophobicContact CG1-CD1 4.46Å; V256-L281 HydrophobicContact CG1-CD2 3.76Å; V256-L281 HydrophobicContact CG2-CD1 4.33Å; V256-L281 HydrophobicContact CG2-CD2 4.02Å; V256-A284 HydrophobicContact CG2-CB 4.04Å; V256-V431 HydrophobicContact CG1-CG2 4.44Å; V256-V434 HydrophobicContact CB-CB 4.44Å; V256-V434 HydrophobicContact CB-CG1 3.81Å; V256-V434 HydrophobicContact CG1-CB 4.04Å; V256-V434 HydrophobicContact CG1-CG1 3.97Å; V256-V434 HydrophobicContact CG2-CG1 3.96Å
257	E	93.5	Very high	90.9	Very high	97 Å²	97	65.2 Å²	65.2	45%	0.453	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-60.5	-24.9	177.6	-61.6	75	-165.5	0	0	112.7	P255 N259 I260 D261 L435	P255-E257 WeakPolarHBondContact CB-OE2 2.95Å; P255-E257 PolarHBondContact O-N 2.99Å; E257-N259 PolarHBondContact O-N 3.36Å; E257-I260 WeakPolarHBondContact O-CG1 3.33Å; E257-I260 PolarHBondContact O-N 2.9Å; E257-D261 PolarHBondContact O-N 3.39Å; E257-L435 HydrophobicContact CG-CD2 4.18Å
258	Y	95.1	Very high	91.2	Very high	86 Å²	86	63.9 Å²	63.9	34%	0.337	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-67.3	-19.2	177.2	-169.5	-115.4	0	0	0	112.8	P255 V256 I260 D261 F264 Y276	P255-Y258 PolarHBondContact O-N 3.32Å; V256-Y258 PolarHBondContact O-N 3.01Å; Y258-I260 PolarHBondContact O-N 3.26Å; Y258-I260 VanDerWaalsContact O-N 3.15Å; Y258-D261 HydrophobicContact CD2-CB 3.62Å; Y258-D261 HydrophobicContact CE2-CB 3.98Å; Y258-D261 HydrophobicContact CG-CB 4.36Å; Y258-D261 WeakPolarHBondContact O-CB 3.43Å; Y258-D261 PolarHBondContact O-N 3.34Å; Y258-D261 VanDerWaalsContact O-N 3.15Å; Y258-F264 HydrophobicContact CD1-CB 4.3Å; Y258-F264 HydrophobicContact CD1-CD1 4.25Å; Y258-F264 AromaticContact CD1-CD2 3.93Å; Y258-F264 HydrophobicContact CD1-CD2 3.93Å; Y258-F264 HydrophobicContact CD1-CE2 4.29Å; Y258-F264 AromaticContact CD1-CG 3.9Å; Y258-F264 HydrophobicContact CD1-CG 3.9Å; Y258-F264 HydrophobicContact CD2-CB 4.4Å; Y258-F264 HydrophobicContact CE1-CB 3.88Å; Y258-F264 HydrophobicContact CE1-CD1 4.3Å; Y258-F264 AromaticContact CE1-CD2 3.2Å; Y258-F264 HydrophobicContact CE1-CD2 3.2Å; Y258-F264 AromaticContact CE1-CE2 3.72Å; Y258-F264 HydrophobicContact CE1-CE2 3.72Å; Y258-F264 AromaticContact CE1-CG 3.53Å; Y258-F264 HydrophobicContact CE1-CG 3.53Å; Y258-F264 HydrophobicContact CE1-CZ 4.46Å; Y258-F264 HydrophobicContact CE2-CB 3.92Å; Y258-F264 HydrophobicContact CE2-CG 4.48Å; Y258-F264 AromaticContact CZ-CD2 3.65Å; Y258-F264 AromaticContact CZ-CG 3.85Å; Y258-F264 VanDerWaalsContact O-CD1 3.26Å; Y258-F264 WeakPolarHBondContact O-CD1 3.18Å; Y258-Y276 VanDerWaalsContact CB-OH 3.25Å; Y258-Y276 WeakPolarHBondContact CB-OH 3.44Å; Y258-Y276 HydrophobicContact CD1-CD1 4.17Å; Y258-Y276 HydrophobicContact CD1-CD2 4.21Å; Y258-Y276 AromaticContact CD1-CE1 3.64Å; Y258-Y276 HydrophobicContact CD1-CE1 3.64Å; Y258-Y276 AromaticContact CD1-CE2 3.65Å; Y258-Y276 HydrophobicContact CD1-CE2 3.65Å; Y258-Y276 HydrophobicContact CD1-CG 4.44Å; Y258-Y276 AromaticContact CD1-CZ 3.35Å; Y258-Y276 HydrophobicContact CE1-CE2 4.23Å; Y258-Y276 HydrophobicContact CG-CE1 4.18Å; Y258-Y276 AromaticContact CG-CZ 3.95Å
259	N	95.6	Very high	91.6	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.016	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-62.9	-19	171.2	-70.1	-82.2	0	0	0	112.9	V256 E257 Q265 L277 S280 F444	V256-N259 WeakPolarHBondContact O-CB 3.42Å; V256-N259 PolarHBondContact O-N 3.23Å; V256-N259 VanDerWaalsContact O-N 3.11Å; V256-N259 PolarHBondContact O-ND2 3.5Å; E257-N259 PolarHBondContact O-N 3.36Å; N259-Q265 PolarHBondContact O-NE2 3.31Å; N259-L277 WeakPolarHBondContact OD1-CA 3.35Å; N259-S280 PolarHBondContact ND2-OG 3.01Å; N259-F444 HydrophobicContact CB-CD2 4.13Å; N259-F444 HydrophobicContact CB-CE2 4.22Å
260	I	95.1	Very high	92	Very high	28 Å²	28	64.5 Å²	64.5	14%	0.144	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-111.5	7.3	176.9	63.8	169.5	0	0	0	114	E257 Y258 E262 L435 P440 F444	E257-I260 WeakPolarHBondContact O-CG1 3.33Å; E257-I260 PolarHBondContact O-N 2.9Å; Y258-I260 PolarHBondContact O-N 3.26Å; Y258-I260 VanDerWaalsContact O-N 3.15Å; I260-E262 PolarHBondContact O-N 2.96Å; I260-L435 HydrophobicContact CD1-CD1 4.21Å; I260-L435 HydrophobicContact CD1-CD2 4.07Å; I260-L435 HydrophobicContact CG2-CD1 4.13Å; I260-P440 HydrophobicContact CD1-CB 3.59Å; I260-P440 HydrophobicContact CD1-CG 4.4Å; I260-F444 HydrophobicContact CG2-CB 3.6Å; I260-F444 HydrophobicContact CG2-CD2 4.44Å; I260-F444 HydrophobicContact CG2-CG 4.49Å
261	D	95.9	Very high	92.4	Very high	61 Å²	61	65.7 Å²	65.7	33%	0.326	36%	0.362	S	S	.	.			trans	-65.5	132	173.6	177.5	-96.4	0	0	0	110.6	E257 Y258 H263 F264 Q265	E257-D261 PolarHBondContact O-N 3.39Å; Y258-D261 HydrophobicContact CD2-CB 3.62Å; Y258-D261 HydrophobicContact CE2-CB 3.98Å; Y258-D261 HydrophobicContact CG-CB 4.36Å; Y258-D261 WeakPolarHBondContact O-CB 3.43Å; Y258-D261 PolarHBondContact O-N 3.34Å; Y258-D261 VanDerWaalsContact O-N 3.15Å; D261-H263 VanDerWaalsContact C-N 3.34Å; D261-H263 PolarHBondContact O-N 3.13Å; D261-H263 WeakPolarHBondContact OD1-CA 3.44Å; D261-H263 WeakPolarHBondContact OD1-CB 3.5Å; D261-H263 PolarHBondContact OD1-N 3.46Å; D261-F264 HydrophobicContact CB-CB 3.97Å; D261-F264 PolarHBondContact O-N 3.47Å; D261-F264 PolarHBondContact OD1-N 3.28Å; D261-Q265 WeakPolarHBondContact O-CB 3.42Å; D261-Q265 VanDerWaalsContact O-CG 3.31Å; D261-Q265 WeakPolarHBondContact O-CG 3.18Å; D261-Q265 PolarHBondContact O-N 2.98Å
262	E	93.8	Very high	93.3	Very high	150 Å²	150	67.5 Å²	67.5	70%	0.701	37%	0.372	S	S	*	.	H	α-helix	trans	-64.2	-40.2	-174.4	-66.5	-176.4	173.8	0	0	111.8	I260 Q265 A266	I260-E262 PolarHBondContact O-N 2.96Å; E262-Q265 PolarHBondContact O-N 3.33Å; E262-A266 WeakPolarHBondContact O-CB 3.24Å; E262-A266 PolarHBondContact O-N 2.96Å
263	H	94.6	Very high	94.1	Very high	126 Å²	126	63.3 Å²	63.3	58%	0.583	34%	0.344	S	S	*	.	H	α-helix	trans	-68.5	-44.4	179.4	-177.7	75.4	0	0	0	111.1	D261 Q265 A266 T267	D261-H263 VanDerWaalsContact C-N 3.34Å; D261-H263 PolarHBondContact O-N 3.13Å; D261-H263 WeakPolarHBondContact OD1-CA 3.44Å; D261-H263 WeakPolarHBondContact OD1-CB 3.5Å; D261-H263 PolarHBondContact OD1-N 3.46Å; H263-Q265 PolarHBondContact O-N 3.41Å; H263-A266 PolarHBondContact O-N 2.86Å; H263-T267 WeakPolarHBondContact O-CB 3.44Å; H263-T267 WeakPolarHBondContact O-CG2 3.43Å; H263-T267 PolarHBondContact O-N 2.94Å; H263-T267 PolarHBondContact O-OG1 2.95Å
264	F	95.2	Very high	94.6	Very high	13 Å²	13	62.1 Å²	62.1	6%	0.057	33%	0.334	C	S	.	.	H	α-helix	trans	-60	-45.1	174.9	-177.4	-112.8	0	0	0	111.7	Y258 D261 A266 T267 A268 T272 K273 Y276	Y258-F264 HydrophobicContact CD1-CB 4.3Å; Y258-F264 HydrophobicContact CD1-CD1 4.25Å; Y258-F264 AromaticContact CD1-CD2 3.93Å; Y258-F264 HydrophobicContact CD1-CD2 3.93Å; Y258-F264 HydrophobicContact CD1-CE2 4.29Å; Y258-F264 AromaticContact CD1-CG 3.9Å; Y258-F264 HydrophobicContact CD1-CG 3.9Å; Y258-F264 HydrophobicContact CD2-CB 4.4Å; Y258-F264 HydrophobicContact CE1-CB 3.88Å; Y258-F264 HydrophobicContact CE1-CD1 4.3Å; Y258-F264 AromaticContact CE1-CD2 3.2Å; Y258-F264 HydrophobicContact CE1-CD2 3.2Å; Y258-F264 AromaticContact CE1-CE2 3.72Å; Y258-F264 HydrophobicContact CE1-CE2 3.72Å; Y258-F264 AromaticContact CE1-CG 3.53Å; Y258-F264 HydrophobicContact CE1-CG 3.53Å; Y258-F264 HydrophobicContact CE1-CZ 4.46Å; Y258-F264 HydrophobicContact CE2-CB 3.92Å; Y258-F264 HydrophobicContact CE2-CG 4.48Å; Y258-F264 AromaticContact CZ-CD2 3.65Å; Y258-F264 AromaticContact CZ-CG 3.85Å; Y258-F264 VanDerWaalsContact O-CD1 3.26Å; Y258-F264 WeakPolarHBondContact O-CD1 3.18Å; D261-F264 HydrophobicContact CB-CB 3.97Å; D261-F264 PolarHBondContact O-N 3.47Å; D261-F264 PolarHBondContact OD1-N 3.28Å; F264-A266 VanDerWaalsContact C-N 3.34Å; F264-A266 PolarHBondContact O-N 3.42Å; F264-T267 PolarHBondContact O-N 3.13Å; F264-A268 HydrophobicContact CD2-CB 3.65Å; F264-A268 HydrophobicContact CE1-CB 4.47Å; F264-A268 HydrophobicContact CE2-CB 3.46Å; F264-A268 VanDerWaalsContact CE2-CB 3.46Å; F264-A268 HydrophobicContact CG-CB 4.25Å; F264-A268 HydrophobicContact CZ-CB 3.91Å; F264-A268 WeakPolarHBondContact O-CB 3.41Å; F264-A268 PolarHBondContact O-N 3.15Å; F264-T272 HydrophobicContact CE2-CG2 4.05Å; F264-T272 HydrophobicContact CZ-CG2 4.41Å; F264-K273 HydrophobicContact CE1-CG 4.08Å; F264-K273 HydrophobicContact CZ-CG 4.19Å; F264-Y276 HydrophobicContact CE1-CD1 4.28Å; F264-Y276 HydrophobicContact CE1-CG 4.43Å; F264-Y276 HydrophobicContact CZ-CD1 4.23Å; F264-Y276 AromaticContact CZ-CG 3.91Å; F264-Y276 HydrophobicContact CZ-CG 3.91Å
265	Q	93.4	Very high	94.8	Very high	42 Å²	42	65 Å²	65	20%	0.196	35%	0.348	C	S	.	.	H	α-helix	trans	-64.6	-37.9	179.3	-74.4	-171.1	-2.8	0	0	112.8	N259 D261 E262 H263 K273 S447	N259-Q265 PolarHBondContact O-NE2 3.31Å; D261-Q265 WeakPolarHBondContact O-CB 3.42Å; D261-Q265 VanDerWaalsContact O-CG 3.31Å; D261-Q265 WeakPolarHBondContact O-CG 3.18Å; D261-Q265 PolarHBondContact O-N 2.98Å; E262-Q265 PolarHBondContact O-N 3.33Å; H263-Q265 PolarHBondContact O-N 3.41Å; Q265-K273 WeakPolarHBondContact O-CE 3.38Å; Q265-K273 PolarHBondContact O-NZ 2.93Å; Q265-S447 PolarHBondContact NE2-OG 3.3Å
266	A	92.9	Very high	95	Very high	88 Å²	88	64.1 Å²	64.1	73%	0.727	34%	0.339	S	S	*	.	H	α-helix	trans	-73.5	-34.1	-179.8	0	0	0	0	0	113.3	E262 H263 F264	E262-A266 WeakPolarHBondContact O-CB 3.24Å; E262-A266 PolarHBondContact O-N 2.96Å; H263-A266 PolarHBondContact O-N 2.86Å; F264-A266 VanDerWaalsContact C-N 3.34Å; F264-A266 PolarHBondContact O-N 3.42Å
267	T	94.7	Very high	95.2	Very high	89 Å²	89	63.8 Å²	63.8	55%	0.546	34%	0.337	S	S	.	.	H	α-helix	trans	-107.6	-28.1	-168.5	61.2	0	0	0	0	114.7	H263 F264	H263-T267 WeakPolarHBondContact O-CB 3.44Å; H263-T267 WeakPolarHBondContact O-CG2 3.43Å; H263-T267 PolarHBondContact O-N 2.94Å; H263-T267 PolarHBondContact O-OG1 2.95Å; F264-T267 PolarHBondContact O-N 3.13Å
268	A	95	Very high	95.3	Very high	18 Å²	18	61.6 Å²	61.6	15%	0.149	33%	0.325	C	S	.	.			trans	-74.9	137.8	-172.9	0	0	0	0	0	112.7	F264 T272 K273	F264-A268 HydrophobicContact CD2-CB 3.65Å; F264-A268 HydrophobicContact CE1-CB 4.47Å; F264-A268 HydrophobicContact CE2-CB 3.46Å; F264-A268 VanDerWaalsContact CE2-CB 3.46Å; F264-A268 HydrophobicContact CG-CB 4.25Å; F264-A268 HydrophobicContact CZ-CB 3.91Å; F264-A268 WeakPolarHBondContact O-CB 3.41Å; F264-A268 PolarHBondContact O-N 3.15Å; A268-T272 HydrophobicContact CB-CG2 4.19Å; A268-K273 HydrophobicContact CB-CG 3.97Å; A268-K273 VanDerWaalsContact O-CE 3.23Å; A268-K273 WeakPolarHBondContact O-CE 3.36Å
269	S	96	Very high	95.3	Very high	60 Å²	60	60.7 Å²	60.7	42%	0.42	33%	0.325	S	S	.	.			trans	-66.1	157.8	171.9	80.3	0	0	0	0	111.9	P271 T272 K273	S269-P271 WeakPolarHBondContact OG-CD 3.48Å; S269-T272 WeakPolarHBondContact O-CB 3.24Å; S269-T272 PolarHBondContact O-N 2.99Å; S269-T272 VanDerWaalsContact O-N 3.11Å; S269-T272 PolarHBondContact OG-N 2.79Å; S269-T272 PolarHBondContact OG-OG1 3.22Å; S269-K273 WeakPolarHBondContact O-CG 3.17Å; S269-K273 PolarHBondContact O-N 3.04Å
270	W	93.8	Very high	95.2	Very high	113 Å²	113	60.5 Å²	60.5	43%	0.428	32%	0.324	S	S	.	.	H	α-helix	trans	-55.2	-47.3	176.5	-88.2	113.9	0	0	0	114	T272 K273 I274 W448 Y449	W270-T272 VanDerWaalsContact C-N 3.3Å; W270-T272 PolarHBondContact O-N 3.09Å; W270-K273 PolarHBondContact O-N 3.21Å; W270-I274 WeakPolarHBondContact O-CG1 3.49Å; W270-I274 PolarHBondContact O-N 3.07Å; W270-W448 HydrophobicContact CZ3-CD2 4.17Å; W270-W448 HydrophobicContact CZ3-CE3 4.01Å; W270-W448 HydrophobicContact CZ3-CZ3 4.36Å; W270-Y449 AromaticContact CH2-CD2 3.88Å; W270-Y449 HydrophobicContact CH2-CD2 3.88Å; W270-Y449 HydrophobicContact CH2-CE2 4.15Å; W270-Y449 AromaticContact CZ2-CD2 3.62Å; W270-Y449 HydrophobicContact CZ2-CD2 3.62Å; W270-Y449 AromaticContact CZ2-CE2 3.57Å; W270-Y449 HydrophobicContact CZ2-CE2 3.57Å
271	P	95.8	Very high	95.2	Very high	80 Å²	80	59.5 Å²	59.5	52%	0.519	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-42.4	173.6	-27	35.4	0	0	0	112.9	S269 K273 I274 I275	S269-P271 WeakPolarHBondContact OG-CD 3.48Å; P271-K273 PolarHBondContact O-N 2.96Å; P271-I274 PolarHBondContact O-N 3.25Å; P271-I275 WeakPolarHBondContact O-CB 3.26Å; P271-I275 VanDerWaalsContact O-CG1 3.27Å; P271-I275 WeakPolarHBondContact O-CG1 3.35Å; P271-I275 PolarHBondContact O-N 2.75Å
272	T	96.1	Very high	95.1	Very high	67 Å²	67	58.9 Å²	58.9	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-43.9	176.9	-52	0	0	0	0	111.4	F264 A268 S269 W270 I275 Y276	F264-T272 HydrophobicContact CE2-CG2 4.05Å; F264-T272 HydrophobicContact CZ-CG2 4.41Å; A268-T272 HydrophobicContact CB-CG2 4.19Å; S269-T272 WeakPolarHBondContact O-CB 3.24Å; S269-T272 PolarHBondContact O-N 2.99Å; S269-T272 VanDerWaalsContact O-N 3.11Å; S269-T272 PolarHBondContact OG-N 2.79Å; S269-T272 PolarHBondContact OG-OG1 3.22Å; W270-T272 VanDerWaalsContact C-N 3.3Å; W270-T272 PolarHBondContact O-N 3.09Å; T272-I275 PolarHBondContact O-N 3.48Å; T272-Y276 VanDerWaalsContact O-CB 3.26Å; T272-Y276 WeakPolarHBondContact O-CB 3.47Å; T272-Y276 PolarHBondContact O-N 2.99Å
273	K	95.8	Very high	95	Very high	25 Å²	25	51.8 Å²	51.8	11%	0.109	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-43.5	176.7	-70.4	176	177.1	175.7	0	112.1	F264 Q265 A268 S269 W270 P271 L277 W448	F264-K273 HydrophobicContact CE1-CG 4.08Å; F264-K273 HydrophobicContact CZ-CG 4.19Å; Q265-K273 WeakPolarHBondContact O-CE 3.38Å; Q265-K273 PolarHBondContact O-NZ 2.93Å; A268-K273 HydrophobicContact CB-CG 3.97Å; A268-K273 VanDerWaalsContact O-CE 3.23Å; A268-K273 WeakPolarHBondContact O-CE 3.36Å; S269-K273 WeakPolarHBondContact O-CG 3.17Å; S269-K273 PolarHBondContact O-N 3.04Å; W270-K273 PolarHBondContact O-N 3.21Å; P271-K273 PolarHBondContact O-N 2.96Å; K273-L277 WeakPolarHBondContact O-CB 3.2Å; K273-L277 PolarHBondContact O-N 3.31Å; K273-W448 HydrophobicContact CB-CZ2 4.28Å
274	I	96.3	Very high	94.9	Very high	63 Å²	63	46.3 Å²	46.3	32%	0.323	26%	0.259	S	S	.	.	H	α-helix	trans	-65.3	-47	178.2	-67.5	166.7	0	0	0	111.4	W270 P271 L277 Y278 V424 W448	W270-I274 WeakPolarHBondContact O-CG1 3.49Å; W270-I274 PolarHBondContact O-N 3.07Å; P271-I274 PolarHBondContact O-N 3.25Å; I274-L277 PolarHBondContact O-N 2.64Å; I274-Y278 PolarHBondContact O-N 3.27Å; I274-V424 HydrophobicContact CG2-CG2 3.73Å; I274-W448 HydrophobicContact CB-CH2 4.41Å; I274-W448 HydrophobicContact CG1-CH2 3.7Å; I274-W448 HydrophobicContact CG1-CZ3 4.14Å
275	I	96.7	Very high	94.7	Very high	98 Å²	98	46.9 Å²	46.9	50%	0.503	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-46.4	179.9	-69.5	167.7	0	0	0	110.2	P271 T272 Y278 I279	P271-I275 WeakPolarHBondContact O-CB 3.26Å; P271-I275 VanDerWaalsContact O-CG1 3.27Å; P271-I275 WeakPolarHBondContact O-CG1 3.35Å; P271-I275 PolarHBondContact O-N 2.75Å; T272-I275 PolarHBondContact O-N 3.48Å; I275-Y278 PolarHBondContact O-N 3.07Å; I275-I279 HydrophobicContact CG2-CD1 3.52Å; I275-I279 HydrophobicContact CG2-CG1 4.28Å; I275-I279 WeakPolarHBondContact O-CB 3.4Å; I275-I279 VanDerWaalsContact O-CG1 3.3Å; I275-I279 WeakPolarHBondContact O-CG1 3.43Å; I275-I279 PolarHBondContact O-N 3.32Å
276	Y	96.4	Very high	94.7	Very high	32 Å²	32	45.3 Å²	45.3	13%	0.125	26%	0.255	C	S	.	.	H	α-helix	trans	-63.6	-43.2	178.5	-168.9	-87.8	0	0	0	111.9	L254 P255 Y258 F264 T272 Y278 I279 S280	L254-Y276 HydrophobicContact CD2-CD2 4.38Å; L254-Y276 HydrophobicContact CD2-CE2 3.71Å; P255-Y276 PolarHBondContact O-OH 3.17Å; Y258-Y276 VanDerWaalsContact CB-OH 3.25Å; Y258-Y276 WeakPolarHBondContact CB-OH 3.44Å; Y258-Y276 HydrophobicContact CD1-CD1 4.17Å; Y258-Y276 HydrophobicContact CD1-CD2 4.21Å; Y258-Y276 AromaticContact CD1-CE1 3.64Å; Y258-Y276 HydrophobicContact CD1-CE1 3.64Å; Y258-Y276 AromaticContact CD1-CE2 3.65Å; Y258-Y276 HydrophobicContact CD1-CE2 3.65Å; Y258-Y276 HydrophobicContact CD1-CG 4.44Å; Y258-Y276 AromaticContact CD1-CZ 3.35Å; Y258-Y276 HydrophobicContact CE1-CE2 4.23Å; Y258-Y276 HydrophobicContact CG-CE1 4.18Å; Y258-Y276 AromaticContact CG-CZ 3.95Å; F264-Y276 HydrophobicContact CE1-CD1 4.28Å; F264-Y276 HydrophobicContact CE1-CG 4.43Å; F264-Y276 HydrophobicContact CZ-CD1 4.23Å; F264-Y276 AromaticContact CZ-CG 3.91Å; F264-Y276 HydrophobicContact CZ-CG 3.91Å; T272-Y276 VanDerWaalsContact O-CB 3.26Å; T272-Y276 WeakPolarHBondContact O-CB 3.47Å; T272-Y276 PolarHBondContact O-N 2.99Å; Y276-Y278 VanDerWaalsContact C-N 3.34Å; Y276-Y278 PolarHBondContact O-N 3.27Å; Y276-I279 PolarHBondContact O-N 2.98Å; Y276-S280 VanDerWaalsContact O-CB 3.27Å; Y276-S280 WeakPolarHBondContact O-CB 3.28Å; Y276-S280 PolarHBondContact O-N 3.04Å; Y276-S280 PolarHBondContact O-OG 2.94Å
277	L	96.8	Very high	94.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.3	-50.8	174.9	174.8	67.3	0	0	0	110.7	N259 K273 I274 S280 L281 V431 F444 W448	N259-L277 WeakPolarHBondContact OD1-CA 3.35Å; K273-L277 WeakPolarHBondContact O-CB 3.2Å; K273-L277 PolarHBondContact O-N 3.31Å; I274-L277 PolarHBondContact O-N 2.64Å; L277-S280 PolarHBondContact O-OG 3.15Å; L277-L281 HydrophobicContact CD1-CD2 3.93Å; L277-L281 WeakPolarHBondContact O-CD2 3.37Å; L277-L281 PolarHBondContact O-N 2.89Å; L277-V431 HydrophobicContact CD1-CG2 3.44Å; L277-V431 VanDerWaalsContact CD1-CG2 3.44Å; L277-F444 HydrophobicContact CD1-CE2 3.9Å; L277-F444 HydrophobicContact CD1-CZ 3.78Å; L277-F444 HydrophobicContact CD2-CZ 4.2Å; L277-W448 HydrophobicContact CB-CH2 4.31Å; L277-W448 HydrophobicContact CB-CZ2 3.95Å; L277-W448 HydrophobicContact CD2-CH2 3.4Å; L277-W448 HydrophobicContact CD2-CZ2 3.46Å; L277-W448 VanDerWaalsContact CD2-CZ2 3.46Å; L277-W448 HydrophobicContact CD2-CZ3 4.13Å; L277-W448 HydrophobicContact CG-CH2 4.46Å; L277-W448 HydrophobicContact CG-CZ2 4.24Å
278	Y	95.9	Very high	94.6	Very high	52 Å²	52	42.5 Å²	42.5	20%	0.204	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-48.7	179.7	171.5	-117.1	0	0	0	112.2	I274 I275 Y276 L281 L282 Q423	I274-Y278 PolarHBondContact O-N 3.27Å; I275-Y278 PolarHBondContact O-N 3.07Å; Y276-Y278 VanDerWaalsContact C-N 3.34Å; Y276-Y278 PolarHBondContact O-N 3.27Å; Y278-L281 PolarHBondContact O-N 3.18Å; Y278-L282 HydrophobicContact CE1-CD2 4.32Å; Y278-L282 VanDerWaalsContact O-CB 3.26Å; Y278-L282 WeakPolarHBondContact O-CB 3.47Å; Y278-L282 PolarHBondContact O-N 3.3Å; Y278-Q423 HydrophobicContact CD2-CB 3.83Å; Y278-Q423 HydrophobicContact CE2-CB 3.71Å; Y278-Q423 HydrophobicContact CE2-CG 3.92Å
279	I	94.8	Very high	94.6	Very high	66 Å²	66	42.1 Å²	42.1	34%	0.338	21%	0.212	S	C	.	.	H	α-helix	trans	-68	-41.8	-174.9	-68.7	177.4	0	0	0	111.6	L254 I275 Y276 L282 A283	L254-I279 HydrophobicContact CD1-CG2 3.39Å; L254-I279 HydrophobicContact CD2-CG2 4.28Å; L254-I279 HydrophobicContact CG-CG2 4.38Å; I275-I279 HydrophobicContact CG2-CD1 3.52Å; I275-I279 HydrophobicContact CG2-CG1 4.28Å; I275-I279 WeakPolarHBondContact O-CB 3.4Å; I275-I279 VanDerWaalsContact O-CG1 3.3Å; I275-I279 WeakPolarHBondContact O-CG1 3.43Å; I275-I279 PolarHBondContact O-N 3.32Å; Y276-I279 PolarHBondContact O-N 2.98Å; I279-L282 PolarHBondContact O-N 3.39Å; I279-A283 WeakPolarHBondContact O-CB 3.39Å; I279-A283 PolarHBondContact O-N 2.98Å
280	S	95.3	Very high	94.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.5	-42.3	177.7	56.4	0	0	0	0	112	N259 Y276 L277 A283 A284	N259-S280 PolarHBondContact ND2-OG 3.01Å; Y276-S280 VanDerWaalsContact O-CB 3.27Å; Y276-S280 WeakPolarHBondContact O-CB 3.28Å; Y276-S280 PolarHBondContact O-N 3.04Å; Y276-S280 PolarHBondContact O-OG 2.94Å; L277-S280 PolarHBondContact O-OG 3.15Å; S280-A283 PolarHBondContact O-N 2.97Å; S280-A284 PolarHBondContact O-N 2.98Å
281	L	94.4	Very high	94.6	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-72.9	-34.6	176.6	-85.4	-63.8	0	0	0	112.4	V256 L277 Y278 A283 A284 R285 V430 V431 V434	V256-L281 HydrophobicContact CB-CD2 4.49Å; V256-L281 HydrophobicContact CG1-CD1 4.46Å; V256-L281 HydrophobicContact CG1-CD2 3.76Å; V256-L281 HydrophobicContact CG2-CD1 4.33Å; V256-L281 HydrophobicContact CG2-CD2 4.02Å; L277-L281 HydrophobicContact CD1-CD2 3.93Å; L277-L281 WeakPolarHBondContact O-CD2 3.37Å; L277-L281 PolarHBondContact O-N 2.89Å; Y278-L281 PolarHBondContact O-N 3.18Å; L281-A283 VanDerWaalsContact C-N 3.28Å; L281-A283 PolarHBondContact O-N 3.21Å; L281-A284 PolarHBondContact O-N 3.33Å; L281-R285 WeakPolarHBondContact O-CG 3.49Å; L281-R285 PolarHBondContact O-N 3.42Å; L281-V430 HydrophobicContact CD1-CB 4.3Å; L281-V430 HydrophobicContact CD1-CG1 3.86Å; L281-V431 HydrophobicContact CD2-CG2 3.87Å; L281-V434 HydrophobicContact CD1-CG2 3.93Å
282	L	93.4	Very high	94.6	Very high	47 Å²	47	33.9 Å²	33.9	25%	0.246	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-41.8	168.2	176.5	65.1	0	0	0	110.5	Y278 I279 A284 R285 P286	Y278-L282 HydrophobicContact CE1-CD2 4.32Å; Y278-L282 VanDerWaalsContact O-CB 3.26Å; Y278-L282 WeakPolarHBondContact O-CB 3.47Å; Y278-L282 PolarHBondContact O-N 3.3Å; I279-L282 PolarHBondContact O-N 3.39Å; L282-A284 VanDerWaalsContact C-N 3.31Å; L282-A284 PolarHBondContact O-N 2.95Å; L282-R285 PolarHBondContact O-N 3.35Å; L282-P286 WeakPolarHBondContact O-CD 3.07Å
283	A	92.3	Very high	94.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.008	15%	0.149	C	C	.	.	H	α-helix	trans	-70.4	-24.4	179.7	0	0	0	0	0	114.5	F246 I250 L254 I279 S280 L281 P286	F246-A283 HydrophobicContact CE1-CB 4.16Å; I250-A283 HydrophobicContact CG2-CB 4Å; L254-A283 HydrophobicContact CB-CB 4.17Å; L254-A283 HydrophobicContact CD1-CB 4.31Å; I279-A283 WeakPolarHBondContact O-CB 3.39Å; I279-A283 PolarHBondContact O-N 2.98Å; S280-A283 PolarHBondContact O-N 2.97Å; L281-A283 VanDerWaalsContact C-N 3.28Å; L281-A283 PolarHBondContact O-N 3.21Å; A283-P286 WeakPolarHBondContact O-CD 3.49Å
284	A	91.1	Very high	94.7	Very high	12 Å²	12	30 Å²	30	10%	0.099	14%	0.144	C	C	.	.	H	α-helix	trans	-80.3	-18.7	176.8	0	0	0	0	0	114.3	V256 S280 L281 L282 K287	V256-A284 HydrophobicContact CG2-CB 4.04Å; S280-A284 PolarHBondContact O-N 2.98Å; L281-A284 PolarHBondContact O-N 3.33Å; L282-A284 VanDerWaalsContact C-N 3.31Å; L282-A284 PolarHBondContact O-N 2.95Å; A284-K287 WeakPolarHBondContact O-CE 3.48Å
285	R	92	Very high	94.7	Very high	24 Å²	24	27 Å²	27	9%	0.091	13%	0.129	C	C	.	.	S	Bend	trans	-75.2	-36.2	-175.5	-79.1	-175.2	-74.4	157.4	-2.6	116.5	L281 L282 K287 Y288 Y289 E329 W341	L281-R285 WeakPolarHBondContact O-CG 3.49Å; L281-R285 PolarHBondContact O-N 3.42Å; L282-R285 PolarHBondContact O-N 3.35Å; R285-K287 PolarHBondContact O-N 3.3Å; R285-Y288 WeakPolarHBondContact O-CB 3.24Å; R285-Y288 WeakPolarHBondContact O-CD2 3.29Å; R285-Y288 PolarHBondContact O-N 2.94Å; R285-Y289 HydrophobicContact CB-CE2 4.39Å; R285-Y289 PolarHBondContact NH1-OH 3.37Å; R285-Y289 PolarHBondContact O-N 2.96Å; R285-E329 IonicContact CZ-OE1 3.12Å; R285-E329 IonicContact CZ-OE2 2.9Å; R285-E329 IonicContact NH1-OE1 3.07Å; R285-E329 PolarHBondContact NH1-OE1 2.85Å; R285-E329 IonicContact NH1-OE2 2.95Å; R285-E329 PolarHBondContact NH1-OE2 3.36Å; R285-E329 IonicContact NH2-OE1 3.66Å; R285-E329 IonicContact NH2-OE2 2.78Å; R285-E329 PolarHBondContact NH2-OE2 3.04Å; R285-W341 HydrophobicContact CB-CZ3 4.4Å; R285-W341 HydrophobicContact CG-CH2 4.02Å; R285-W341 HydrophobicContact CG-CZ3 3.96Å
286	P	94	Very high	94.8	Very high	10 Å²	10	22.5 Å²	22.5	7%	0.065	11%	0.106	C	C	.	.	H	α-helix	trans	-55.8	-26.9	-172.1	-33.8	38.7	0	0	0	115.9	S243 F246 H247 L282 A283 Y288 Y289 F290	S243-P286 WeakPolarHBondContact O-CB 3.47Å; F246-P286 HydrophobicContact CD1-CB 4.27Å; F246-P286 HydrophobicContact CD1-CG 3.58Å; F246-P286 HydrophobicContact CE1-CG 4.1Å; F246-P286 HydrophobicContact CG-CG 4.26Å; H247-P286 HydrophobicContact CB-CB 4.29Å; L282-P286 WeakPolarHBondContact O-CD 3.07Å; A283-P286 WeakPolarHBondContact O-CD 3.49Å; P286-Y288 VanDerWaalsContact C-N 3.26Å; P286-Y288 PolarHBondContact O-N 3.03Å; P286-Y289 PolarHBondContact O-N 3.4Å; P286-Y289 VanDerWaalsContact O-N 3.13Å; P286-F290 WeakPolarHBondContact O-CB 3.34Å; P286-F290 PolarHBondContact O-N 2.83Å
287	K	90.9	Very high	94.8	Very high	60 Å²	60	21 Å²	21	26%	0.261	10%	0.1	S	C	.	.	H	α-helix	trans	-58.3	-37.5	172.4	67.5	-173.3	178.5	-179.7	0	112.9	A284 R285 A291	A284-K287 WeakPolarHBondContact O-CE 3.48Å; R285-K287 PolarHBondContact O-N 3.3Å; K287-A291 WeakPolarHBondContact O-CB 3.28Å; K287-A291 PolarHBondContact O-N 2.78Å
288	Y	93.2	Very high	94.9	Very high	57 Å²	57	21 Å²	21	22%	0.224	10%	0.1	C	C	.	.	H	α-helix	trans	-73.9	-37.6	175.5	-58.5	-76.5	0	0	0	111.3	R285 P286 F290 A291 W292 W341	R285-Y288 WeakPolarHBondContact O-CB 3.24Å; R285-Y288 WeakPolarHBondContact O-CD2 3.29Å; R285-Y288 PolarHBondContact O-N 2.94Å; P286-Y288 VanDerWaalsContact C-N 3.26Å; P286-Y288 PolarHBondContact O-N 3.03Å; Y288-F290 VanDerWaalsContact C-N 3.34Å; Y288-A291 PolarHBondContact O-N 2.99Å; Y288-W292 HydrophobicContact CD1-CH2 4.27Å; Y288-W292 HydrophobicContact CD1-CZ2 4.22Å; Y288-W292 WeakPolarHBondContact O-CB 3.21Å; Y288-W292 PolarHBondContact O-N 2.95Å; Y288-W341 AromaticContact CD2-CH2 3.72Å; Y288-W341 HydrophobicContact CD2-CH2 3.72Å; Y288-W341 HydrophobicContact CD2-CZ2 4.08Å; Y288-W341 AromaticContact CG-CH2 3.86Å; Y288-W341 HydrophobicContact CG-CH2 3.86Å; Y288-W341 HydrophobicContact CG-CZ2 4.03Å
289	Y	95.9	Very high	95	Very high	11 Å²	11	18.6 Å²	18.6	4%	0.043	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-44.3	175.1	-63.2	-12.8	0	0	0	111.5	R285 P286 T293 L323 I325 I328 E329 W341	R285-Y289 HydrophobicContact CB-CE2 4.39Å; R285-Y289 PolarHBondContact NH1-OH 3.37Å; R285-Y289 PolarHBondContact O-N 2.96Å; P286-Y289 PolarHBondContact O-N 3.4Å; P286-Y289 VanDerWaalsContact O-N 3.13Å; Y289-T293 WeakPolarHBondContact O-CB 3.33Å; Y289-T293 PolarHBondContact O-N 3.01Å; Y289-T293 PolarHBondContact O-OG1 2.92Å; Y289-L323 HydrophobicContact CD1-CD1 3.62Å; Y289-L323 HydrophobicContact CD1-CD2 4.06Å; Y289-L323 HydrophobicContact CD1-CG 4.45Å; Y289-L323 HydrophobicContact CE1-CD1 4.41Å; Y289-L323 HydrophobicContact CE1-CD2 4.03Å; Y289-L323 HydrophobicContact CG-CD1 4.42Å; Y289-I325 HydrophobicContact CD1-CD1 4.4Å; Y289-I325 HydrophobicContact CD1-CG1 4.16Å; Y289-I325 HydrophobicContact CD2-CD1 4.06Å; Y289-I325 HydrophobicContact CD2-CG1 4.25Å; Y289-I325 HydrophobicContact CD2-CG2 4.19Å; Y289-I325 HydrophobicContact CE1-CG1 4.32Å; Y289-I325 HydrophobicContact CE2-CG1 4.43Å; Y289-I325 HydrophobicContact CE2-CG2 3.86Å; Y289-I325 HydrophobicContact CG-CD1 3.91Å; Y289-I325 HydrophobicContact CG-CG1 4.12Å; Y289-I328 HydrophobicContact CE1-CD1 4.14Å; Y289-I328 WeakPolarHBondContact OH-CG2 3.34Å; Y289-E329 WeakPolarHBondContact CE2-OE1 3.39Å; Y289-E329 VanDerWaalsContact CZ-OE1 3.3Å; Y289-E329 PolarHBondContact OH-OE1 3.05Å; Y289-W341 HydrophobicContact CD1-CZ3 4.37Å; Y289-W341 HydrophobicContact CE1-CE3 4.13Å; Y289-W341 HydrophobicContact CE1-CH2 4.48Å; Y289-W341 AromaticContact CE1-CZ3 3.55Å; Y289-W341 HydrophobicContact CE1-CZ3 3.55Å
290	F	95.6	Very high	95.1	Very high	23 Å²	23	15.5 Å²	15.5	10%	0.101	7%	0.074	C	C	.	.	H	α-helix	trans	-58.8	-60.6	172.7	169.2	-104	0	0	0	111.5	V29 C240 L244 P286 Y288 W292 T293 L294	V29-F290 HydrophobicContact CG1-CZ 4.29Å; V29-F290 HydrophobicContact CG2-CE1 3.96Å; V29-F290 HydrophobicContact CG2-CZ 4.1Å; C240-F290 HydrophobicContact CB-CD2 3.85Å; C240-F290 HydrophobicContact CB-CE2 4.2Å; L244-F290 HydrophobicContact CB-CD2 3.88Å; L244-F290 HydrophobicContact CB-CE2 4.23Å; L244-F290 HydrophobicContact CB-CG 4.37Å; L244-F290 HydrophobicContact CD2-CE2 4.08Å; L244-F290 HydrophobicContact CD2-CZ 4.4Å; P286-F290 WeakPolarHBondContact O-CB 3.34Å; P286-F290 PolarHBondContact O-N 2.83Å; Y288-F290 VanDerWaalsContact C-N 3.34Å; F290-W292 PolarHBondContact O-N 3.22Å; F290-T293 PolarHBondContact O-N 3.25Å; F290-L294 HydrophobicContact CE1-CD2 4.45Å; F290-L294 HydrophobicContact CE2-CD2 4.09Å; F290-L294 HydrophobicContact CZ-CD2 3.78Å; F290-L294 VanDerWaalsContact O-CB 3.29Å; F290-L294 WeakPolarHBondContact O-CB 3.48Å; F290-L294 PolarHBondContact O-N 3.16Å
291	A	93.8	Very high	95.2	Very high	18 Å²	18	15.7 Å²	15.7	15%	0.149	8%	0.076	C	C	.	.	H	α-helix	trans	-61.3	-45.9	-171.3	0	0	0	0	0	112.9	F28 K287 Y288 A295	F28-A291 HydrophobicContact CE1-CB 4.38Å; F28-A291 HydrophobicContact CZ-CB 4.48Å; K287-A291 WeakPolarHBondContact O-CB 3.28Å; K287-A291 PolarHBondContact O-N 2.78Å; Y288-A291 PolarHBondContact O-N 2.99Å; A291-A295 WeakPolarHBondContact O-CB 3.32Å; A291-A295 PolarHBondContact O-N 3.01Å; A291-A295 VanDerWaalsContact O-N 3.14Å
292	W	95.9	Very high	95.3	Very high	39 Å²	39	15.5 Å²	15.5	15%	0.148	8%	0.076	C	C	.	.	H	α-helix	trans	-78.4	-29.5	-177.9	-66	-22.6	0	0	0	113.4	Y288 F290 D296 N322 L323 W341 N342	Y288-W292 HydrophobicContact CD1-CH2 4.27Å; Y288-W292 HydrophobicContact CD1-CZ2 4.22Å; Y288-W292 WeakPolarHBondContact O-CB 3.21Å; Y288-W292 PolarHBondContact O-N 2.95Å; F290-W292 PolarHBondContact O-N 3.22Å; W292-D296 WeakPolarHBondContact O-CB 3.34Å; W292-D296 PolarHBondContact O-N 3.02Å; W292-D296 VanDerWaalsContact O-N 3.08Å; W292-N322 HydrophobicContact CB-CB 4.19Å; W292-N322 HydrophobicContact CG-CB 4.42Å; W292-L323 HydrophobicContact CB-CD1 3.79Å; W292-L323 HydrophobicContact CB-CG 4.28Å; W292-L323 HydrophobicContact CE3-CD1 3.85Å; W292-L323 HydrophobicContact CE3-CD2 3.67Å; W292-L323 HydrophobicContact CE3-CG 3.7Å; W292-L323 HydrophobicContact CZ3-CD2 3.97Å; W292-L323 HydrophobicContact CZ3-CG 4.49Å; W292-W341 AromaticContact CH2-CE2 3.98Å; W292-W341 AromaticContact CH2-CZ2 3.98Å; W292-W341 HydrophobicContact CH2-CZ2 3.98Å; W292-W341 AromaticContact CH2-NE1 3.91Å; W292-W341 HydrophobicContact CZ3-CD2 4.29Å; W292-W341 AromaticContact CZ3-CE2 3.79Å; W292-W341 HydrophobicContact CZ3-CH2 4.43Å; W292-W341 AromaticContact CZ3-CZ2 3.87Å; W292-W341 HydrophobicContact CZ3-CZ2 3.87Å; W292-N342 HydrophobicContact CH2-CB 3.59Å; W292-N342 HydrophobicContact CZ2-CB 4.33Å; W292-N342 HydrophobicContact CZ3-CB 3.7Å
293	T	97.2	Very high	95.3	Very high	8 Å²	8	13.8 Å²	13.8	5%	0.049	7%	0.069	C	C	.	.	H	α-helix	trans	-73.7	-35.4	174.6	-54.9	0	0	0	0	111.3	K236 I239 Y289 F290 D296 A297	K236-T293 HydrophobicContact CB-CG2 3.69Å; K236-T293 HydrophobicContact CD-CG2 4.46Å; K236-T293 HydrophobicContact CG-CG2 3.88Å; K236-T293 WeakPolarHBondContact O-CG2 3.36Å; I239-T293 HydrophobicContact CB-CG2 4.17Å; I239-T293 HydrophobicContact CG2-CG2 3.99Å; Y289-T293 WeakPolarHBondContact O-CB 3.33Å; Y289-T293 PolarHBondContact O-N 3.01Å; Y289-T293 PolarHBondContact O-OG1 2.92Å; F290-T293 PolarHBondContact O-N 3.25Å; T293-D296 PolarHBondContact O-N 3.15Å; T293-A297 WeakPolarHBondContact O-CB 3.42Å; T293-A297 PolarHBondContact O-N 3.15Å
294	L	97.5	Very high	95.4	Very high	2 Å²	2	14 Å²	14	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-65.6	-44.7	175.3	-177.8	56.8	0	0	0	110.9	Q32 L237 C240 F290 D296 A297 I298	Q32-L294 HydrophobicContact CB-CD2 3.54Å; Q32-L294 HydrophobicContact CB-CG 4.14Å; Q32-L294 HydrophobicContact CG-CD2 4.29Å; L237-L294 HydrophobicContact CD2-CD1 4.01Å; C240-L294 PolarHBondContact SG-N 2.96Å; F290-L294 HydrophobicContact CE1-CD2 4.45Å; F290-L294 HydrophobicContact CE2-CD2 4.09Å; F290-L294 HydrophobicContact CZ-CD2 3.78Å; F290-L294 VanDerWaalsContact O-CB 3.29Å; F290-L294 WeakPolarHBondContact O-CB 3.48Å; F290-L294 PolarHBondContact O-N 3.16Å; L294-D296 VanDerWaalsContact C-N 3.34Å; L294-D296 PolarHBondContact O-N 2.91Å; L294-A297 WeakPolarHBondContact O-CB 3.45Å; L294-A297 PolarHBondContact O-N 3.47Å; L294-A297 VanDerWaalsContact O-N 3.13Å; L294-I298 HydrophobicContact CG-CD1 4.24Å; L294-I298 WeakPolarHBondContact O-CG1 3.47Å; L294-I298 PolarHBondContact O-N 3Å
295	A	96.5	Very high	95.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-57.1	-46.2	173.5	0	0	0	0	0	112.1	A189 G190 A291 A297 I298 N299	A189-A295 HydrophobicContact CB-CB 4.13Å; G190-A295 WeakPolarHBondContact O-CB 3.17Å; A291-A295 WeakPolarHBondContact O-CB 3.32Å; A291-A295 PolarHBondContact O-N 3.01Å; A291-A295 VanDerWaalsContact O-N 3.14Å; A295-A297 VanDerWaalsContact C-N 3.34Å; A295-A297 PolarHBondContact O-N 3.15Å; A295-I298 PolarHBondContact O-N 3.39Å; A295-N299 PolarHBondContact O-N 3.22Å; A295-N299 PolarHBondContact O-ND2 3.33Å
296	D	96.9	Very high	95.5	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.021	7%	0.071	C	C	.	.	H	α-helix	trans	-61.1	-40.3	174.6	-170.6	-2.8	0	0	0	112	K236 W292 T293 L294 I298 N299 N300 S321	K236-D296 HydrophobicContact CD-CB 4.2Å; K236-D296 VanDerWaalsContact CE-CG 3.46Å; K236-D296 WeakPolarHBondContact CE-OD1 3.31Å; K236-D296 WeakPolarHBondContact CE-OD2 3.35Å; K236-D296 VanDerWaalsContact NZ-CG 3.33Å; K236-D296 IonicContact NZ-OD1 3.04Å; K236-D296 IonicContact NZ-OD2 2.84Å; K236-D296 PolarHBondContact NZ-OD2 3.49Å; W292-D296 WeakPolarHBondContact O-CB 3.34Å; W292-D296 PolarHBondContact O-N 3.02Å; W292-D296 VanDerWaalsContact O-N 3.08Å; T293-D296 PolarHBondContact O-N 3.15Å; L294-D296 VanDerWaalsContact C-N 3.34Å; L294-D296 PolarHBondContact O-N 2.91Å; D296-I298 PolarHBondContact O-N 3.29Å; D296-N299 PolarHBondContact O-N 3.22Å; D296-N300 WeakPolarHBondContact O-CB 3.43Å; D296-N300 PolarHBondContact O-N 3.43Å; D296-N300 PolarHBondContact O-ND2 3.26Å; D296-N300 PolarHBondContact OD1-ND2 3.03Å; D296-S321 WeakPolarHBondContact OD2-CA 3.26Å; D296-S321 VanDerWaalsContact OD2-CB 3.31Å; D296-S321 WeakPolarHBondContact OD2-CB 3.17Å; D296-S321 PolarHBondContact OD2-OG 2.86Å
297	A	97.9	Very high	95.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.4	-40.2	175.5	0	0	0	0	0	113	K236 L237 T293 L294 A295 N300 A301	K236-A297 HydrophobicContact CB-CB 3.85Å; K236-A297 HydrophobicContact CD-CB 4.23Å; L237-A297 HydrophobicContact CD2-CB 4.45Å; T293-A297 WeakPolarHBondContact O-CB 3.42Å; T293-A297 PolarHBondContact O-N 3.15Å; L294-A297 WeakPolarHBondContact O-CB 3.45Å; L294-A297 PolarHBondContact O-N 3.47Å; L294-A297 VanDerWaalsContact O-N 3.13Å; A295-A297 VanDerWaalsContact C-N 3.34Å; A295-A297 PolarHBondContact O-N 3.15Å; A297-N300 PolarHBondContact O-N 2.84Å; A297-A301 WeakPolarHBondContact O-CB 3.2Å; A297-A301 PolarHBondContact O-N 3.04Å
298	I	98.4	Very high	95.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-62.2	-46.9	177.4	-69.1	159	0	0	0	110.8	Q32 A35 L36 A39 M185 L294 A295 D296 N300 A301 A302	Q32-I298 HydrophobicContact CB-CD1 4.11Å; Q32-I298 VanDerWaalsContact O-CD1 3.28Å; Q32-I298 WeakPolarHBondContact O-CD1 3.49Å; A35-I298 HydrophobicContact CB-CD1 4.07Å; A35-I298 HydrophobicContact CB-CG2 4.08Å; L36-I298 HydrophobicContact CB-CG1 3.83Å; L36-I298 HydrophobicContact CD1-CG1 4.13Å; A39-I298 HydrophobicContact CB-CG2 4.1Å; A39-I298 VanDerWaalsContact CB-O 3.24Å; A39-I298 WeakPolarHBondContact CB-O 3.42Å; M185-I298 HydrophobicContact CB-CG2 4.37Å; L294-I298 HydrophobicContact CG-CD1 4.24Å; L294-I298 WeakPolarHBondContact O-CG1 3.47Å; L294-I298 PolarHBondContact O-N 3Å; A295-I298 PolarHBondContact O-N 3.39Å; D296-I298 PolarHBondContact O-N 3.29Å; I298-N300 PolarHBondContact O-N 2.84Å; I298-A301 PolarHBondContact O-N 2.88Å; I298-A302 PolarHBondContact O-N 3.11Å; I298-A302 VanDerWaalsContact O-N 3.13Å
299	N	97.7	Very high	94.9	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.011	8%	0.078	C	C	.	.	H	α-helix	trans	-60.7	-48.9	177.3	-73.5	-95	0	0	0	109.9	M185 A295 D296 A301 A302 G303 F304 I320	M185-N299 WeakPolarHBondContact CB-OD1 3.35Å; M185-N299 PolarHBondContact O-ND2 3.47Å; A295-N299 PolarHBondContact O-N 3.22Å; A295-N299 PolarHBondContact O-ND2 3.33Å; D296-N299 PolarHBondContact O-N 3.22Å; N299-A301 VanDerWaalsContact C-N 3.3Å; N299-A301 PolarHBondContact O-N 3.33Å; N299-A302 WeakPolarHBondContact O-CA 3.22Å; N299-A302 WeakPolarHBondContact O-CB 3.22Å; N299-A302 PolarHBondContact O-N 2.63Å; N299-G303 PolarHBondContact O-N 3.42Å; N299-F304 CarbonylContact C-O 3.52Å; N299-F304 HydrophobicContact CB-CB 4.31Å; N299-F304 HydrophobicContact CB-CD1 4.24Å; N299-F304 WeakPolarHBondContact CB-O 3.47Å; N299-F304 CarbonylContact O-C 3.37Å; N299-F304 WeakPolarHBondContact O-CA 3.18Å; N299-F304 PolarHBondContact O-N 3.01Å; N299-F304 WeakPolarHBondContact OD1-CD1 3.46Å; N299-I320 HydrophobicContact CB-CD1 3.69Å
300	N	97.2	Very high	94.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-61.8	-37.2	-179.9	-76	-24.2	0	0	0	112.8	P229 V233 K236 D296 A297 I298 A302 G303 F304 G305 W317	P229-N300 WeakPolarHBondContact CB-O 3.46Å; V233-N300 HydrophobicContact CG2-CB 4.01Å; K236-N300 WeakPolarHBondContact CE-ND2 3.41Å; D296-N300 WeakPolarHBondContact O-CB 3.43Å; D296-N300 PolarHBondContact O-N 3.43Å; D296-N300 PolarHBondContact O-ND2 3.26Å; D296-N300 PolarHBondContact OD1-ND2 3.03Å; A297-N300 PolarHBondContact O-N 2.84Å; I298-N300 PolarHBondContact O-N 2.84Å; N300-A302 VanDerWaalsContact C-N 3.28Å; N300-A302 PolarHBondContact O-N 3.19Å; N300-G303 WeakPolarHBondContact O-CA 3.48Å; N300-G303 PolarHBondContact O-N 3.2Å; N300-F304 VanDerWaalsContact CA-O 3.28Å; N300-F304 WeakPolarHBondContact CA-O 3.3Å; N300-F304 PolarHBondContact N-O 2.99Å; N300-F304 PolarHBondContact OD1-O 3.36Å; N300-G305 WeakPolarHBondContact OD1-CA 3.11Å; N300-W317 HydrophobicContact CB-CE3 4.02Å; N300-W317 PolarHBondContact ND2-O 3.19Å
301	A	97.6	Very high	94.1	Very high	4 Å²	4	26.6 Å²	26.6	3%	0.033	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-36.9	174.5	0	0	0	0	0	112	L36 A39 I40 R43 V233 A297 I298 N299 G303	L36-A301 HydrophobicContact CD1-CB 3.72Å; A39-A301 HydrophobicContact CB-CB 3.97Å; I40-A301 HydrophobicContact CG1-CB 4.06Å; R43-A301 VanDerWaalsContact CD-O 3.28Å; R43-A301 WeakPolarHBondContact CD-O 3.46Å; V233-A301 HydrophobicContact CG2-CB 4.08Å; A297-A301 WeakPolarHBondContact O-CB 3.2Å; A297-A301 PolarHBondContact O-N 3.04Å; I298-A301 PolarHBondContact O-N 2.88Å; N299-A301 VanDerWaalsContact C-N 3.3Å; N299-A301 PolarHBondContact O-N 3.33Å; A301-G303 PolarHBondContact O-N 3.27Å
302	A	96.3	Very high	93.8	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.033	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-8.6	173.2	0	0	0	0	0	113.4	A39 M185 F201 I298 N299 N300 F304	A39-A302 HydrophobicContact CB-CB 3.85Å; A39-A302 WeakPolarHBondContact O-CA 3.32Å; M185-A302 HydrophobicContact CG-CB 4.14Å; M185-A302 HydrophobicContact SD-CB 3.64Å; F201-A302 WeakPolarHBondContact CE2-O 3.46Å; F201-A302 HydrophobicContact CZ-CB 4.15Å; I298-A302 PolarHBondContact O-N 3.11Å; I298-A302 VanDerWaalsContact O-N 3.13Å; N299-A302 WeakPolarHBondContact O-CA 3.22Å; N299-A302 WeakPolarHBondContact O-CB 3.22Å; N299-A302 PolarHBondContact O-N 2.63Å; N300-A302 VanDerWaalsContact C-N 3.28Å; N300-A302 PolarHBondContact O-N 3.19Å; A302-F304 VanDerWaalsContact C-N 3.33Å
303	G	93.9	Very high	93.3	Very high	11 Å²	11	32.2 Å²	32.2	11%	0.113	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	-1.6	-171.3	0	0	0	0	0	113.5	N299 N300 A301	N299-G303 PolarHBondContact O-N 3.42Å; N300-G303 WeakPolarHBondContact O-CA 3.48Å; N300-G303 PolarHBondContact O-N 3.2Å; A301-G303 PolarHBondContact O-N 3.27Å
304	F	94.3	Very high	92.8	Very high	5 Å²	5	34.1 Å²	34.1	2%	0.022	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	124.3	176.6	-171.7	-147.6	0	0	0	110.5	M185 C193 D197 Y198 F201 N299 N300 A302 L319 I320	M185-F304 HydrophobicContact SD-CB 4.49Å; C193-F304 HydrophobicContact CB-CE1 4.05Å; C193-F304 HydrophobicContact CB-CZ 3.65Å; D197-F304 HydrophobicContact CB-CE2 4.25Å; Y198-F304 HydrophobicContact CD2-CE1 4.35Å; F201-F304 HydrophobicContact CB-CD2 3.58Å; F201-F304 HydrophobicContact CB-CE2 3.98Å; F201-F304 HydrophobicContact CB-CG 4.29Å; F201-F304 HydrophobicContact CD1-CB 3.87Å; F201-F304 HydrophobicContact CD1-CD1 4.33Å; F201-F304 AromaticContact CD1-CD2 3.98Å; F201-F304 HydrophobicContact CD1-CD2 3.98Å; F201-F304 AromaticContact CD1-CG 3.81Å; F201-F304 HydrophobicContact CD1-CG 3.81Å; F201-F304 HydrophobicContact CD2-CB 3.67Å; F201-F304 HydrophobicContact CD2-CD2 4.07Å; F201-F304 HydrophobicContact CD2-CG 4.16Å; F201-F304 HydrophobicContact CE1-CB 3.85Å; F201-F304 HydrophobicContact CE1-CG 4.22Å; F201-F304 HydrophobicContact CE2-CB 3.64Å; F201-F304 HydrophobicContact CG-CB 3.78Å; F201-F304 AromaticContact CG-CD2 3.57Å; F201-F304 HydrophobicContact CG-CD2 3.57Å; F201-F304 HydrophobicContact CG-CE2 4.36Å; F201-F304 AromaticContact CG-CG 3.78Å; F201-F304 HydrophobicContact CG-CG 3.78Å; F201-F304 HydrophobicContact CZ-CB 3.73Å; N299-F304 CarbonylContact C-O 3.52Å; N299-F304 HydrophobicContact CB-CB 4.31Å; N299-F304 HydrophobicContact CB-CD1 4.24Å; N299-F304 WeakPolarHBondContact CB-O 3.47Å; N299-F304 CarbonylContact O-C 3.37Å; N299-F304 WeakPolarHBondContact O-CA 3.18Å; N299-F304 PolarHBondContact O-N 3.01Å; N299-F304 WeakPolarHBondContact OD1-CD1 3.46Å; N300-F304 VanDerWaalsContact CA-O 3.28Å; N300-F304 WeakPolarHBondContact CA-O 3.3Å; N300-F304 PolarHBondContact N-O 2.99Å; N300-F304 PolarHBondContact OD1-O 3.36Å; A302-F304 VanDerWaalsContact C-N 3.33Å; F304-L319 HydrophobicContact CE2-CD2 4.42Å; F304-I320 HydrophobicContact CD1-CD1 3.78Å; F304-I320 HydrophobicContact CE1-CD1 3.64Å; F304-I320 HydrophobicContact CG-CD1 4.3Å; F304-I320 HydrophobicContact CZ-CD1 4.08Å; F304-I320 HydrophobicContact CZ-CG2 4.28Å
305	G	92.6	Very high	92.5	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.01	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	122.9	-6	-176.6	0	0	0	0	0	114.2	N300 R307 W317 D318 L319	N300-G305 WeakPolarHBondContact OD1-CA 3.11Å; G305-R307 PolarHBondContact O-N 3.04Å; G305-W317 CarbonylContact O-C 3.29Å; G305-W317 VanDerWaalsContact O-C 3.26Å; G305-W317 WeakPolarHBondContact O-CA 3.35Å; G305-D318 PolarHBondContact O-N 3.42Å; G305-L319 WeakPolarHBondContact O-CB 3.47Å; G305-L319 PolarHBondContact O-N 3.38Å
306	F	93.1	Very high	92.3	Very high	47 Å²	47	41 Å²	41	21%	0.206	22%	0.217	C	C	.	.			trans	-67	123.5	167.9	-178.9	-119.1	0	0	0	111	P227 G308 Y309 A315 R316 W317	P227-F306 HydrophobicContact CG-CD1 4.46Å; P227-F306 HydrophobicContact CG-CD2 3.81Å; P227-F306 HydrophobicContact CG-CE1 4.21Å; P227-F306 HydrophobicContact CG-CE2 3.55Å; P227-F306 HydrophobicContact CG-CG 4.27Å; P227-F306 HydrophobicContact CG-CZ 3.74Å; F306-G308 VanDerWaalsContact CE2-O 3.3Å; F306-G308 WeakPolarHBondContact CE2-O 3.36Å; F306-Y309 HydrophobicContact CE1-CE2 4.47Å; F306-Y309 AromaticContact CZ-CD2 4Å; F306-Y309 HydrophobicContact CZ-CD2 4Å; F306-Y309 HydrophobicContact CZ-CE1 4.42Å; F306-Y309 AromaticContact CZ-CE2 3.69Å; F306-Y309 HydrophobicContact CZ-CE2 3.69Å; F306-Y309 HydrophobicContact CZ-CG 4.48Å; F306-Y309 AromaticContact CZ-CZ 3.93Å; F306-A315 HydrophobicContact CD2-CB 4.38Å; F306-A315 HydrophobicContact CE2-CB 3.78Å; F306-R316 WeakPolarHBondContact CA-O 3.28Å; F306-R316 WeakPolarHBondContact CD2-O 3.42Å; F306-W317 HydrophobicContact CB-CE3 4.02Å; F306-W317 HydrophobicContact CB-CH2 4.12Å; F306-W317 HydrophobicContact CB-CZ3 3.79Å; F306-W317 HydrophobicContact CD2-CZ2 4.38Å
307	R	89.8	Confident	92.2	Very high	93 Å²	93	41.9 Å²	41.9	35%	0.351	22%	0.22	S	C	.	.			trans	-96	-19.6	178.7	179.4	175.6	-78.2	154.9	0.6	113	G305 R316 D318 L319	G305-R307 PolarHBondContact O-N 3.04Å; R307-R316 HydrophobicContact CB-CB 4.31Å; R307-R316 PolarHBondContact N-O 3.03Å; R307-D318 VanDerWaalsContact CZ-O 3.24Å; R307-D318 IonicContact CZ-OD1 3.5Å; R307-D318 IonicContact CZ-OD2 3.64Å; R307-D318 IonicContact NE-OD1 3.81Å; R307-D318 IonicContact NH1-OD1 3.16Å; R307-D318 PolarHBondContact NH1-OD1 3.43Å; R307-D318 IonicContact NH1-OD2 2.66Å; R307-D318 PolarHBondContact NH1-OD2 2.9Å; R307-D318 PolarHBondContact NH2-O 3.38Å; R307-L319 HydrophobicContact CB-CB 4.09Å; R307-L319 HydrophobicContact CB-CD1 4.33Å; R307-L319 HydrophobicContact CG-CD1 4.39Å; R307-L319 PolarHBondContact NH2-O 3.34Å
308	G	88.3	Confident	92.1	Very high	11 Å²	11	43.6 Å²	43.6	11%	0.113	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	122.8	-172.4	-167.2	0	0	0	0	0	111.8	F306 R316	F306-G308 VanDerWaalsContact CE2-O 3.3Å; F306-G308 WeakPolarHBondContact CE2-O 3.36Å; G308-R316 WeakPolarHBondContact O-CB 3.38Å; G308-R316 PolarHBondContact O-N 3.42Å
309	Y	87.4	Confident	91.9	Very high	57 Å²	57	45.4 Å²	45.4	22%	0.224	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	150.2	179.4	-60.7	-85	0	0	0	111.2	T225 P227 F306 G313 A314 A315	T225-Y309 PolarHBondContact O-OH 2.94Å; P227-Y309 HydrophobicContact CB-CE1 4.49Å; F306-Y309 HydrophobicContact CE1-CE2 4.47Å; F306-Y309 AromaticContact CZ-CD2 4Å; F306-Y309 HydrophobicContact CZ-CD2 4Å; F306-Y309 HydrophobicContact CZ-CE1 4.42Å; F306-Y309 AromaticContact CZ-CE2 3.69Å; F306-Y309 HydrophobicContact CZ-CE2 3.69Å; F306-Y309 HydrophobicContact CZ-CG 4.48Å; F306-Y309 AromaticContact CZ-CZ 3.93Å; Y309-G313 WeakPolarHBondContact CD1-O 3.4Å; Y309-A314 CarbonylContact C-O 3.58Å; Y309-A314 WeakPolarHBondContact CA-O 3.38Å; Y309-A315 HydrophobicContact CD1-CB 4.2Å; Y309-A315 HydrophobicContact CE1-CB 3.99Å
310	D	86.4	Confident	91.7	Very high	52 Å²	52	45.4 Å²	45.4	28%	0.278	24%	0.239	S	C	.	.			trans	-80.4	179.3	167.7	73.4	10	0	0	0	111.9	N312 G313 A314 R316	D310-N312 PolarHBondContact O-N 3.33Å; D310-N312 VanDerWaalsContact O-N 3.12Å; D310-N312 VanDerWaalsContact OD1-CA 3.31Å; D310-N312 WeakPolarHBondContact OD1-CA 3.48Å; D310-N312 WeakPolarHBondContact OD1-CB 3.42Å; D310-N312 PolarHBondContact OD1-N 3.07Å; D310-G313 PolarHBondContact O-N 2.65Å; D310-G313 PolarHBondContact OD1-N 3.38Å; D310-A314 PolarHBondContact N-O 3.13Å; D310-A314 PolarHBondContact OD1-N 2.67Å; D310-R316 HydrophobicContact CB-CG 4.2Å
311	K	87.9	Confident	91.6	Very high	200 Å²	200	45.7 Å²	45.7	87%	0.87	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-20.1	177.4	59.3	172.2	179.3	173	0	114.2
312	N	87.8	Confident	91.5	Very high	129 Å²	129	45.7 Å²	45.7	69%	0.69	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	2.2	179	-57.1	-27	0	0	0	111.6	D310 A314	D310-N312 PolarHBondContact O-N 3.33Å; D310-N312 VanDerWaalsContact O-N 3.12Å; D310-N312 VanDerWaalsContact OD1-CA 3.31Å; D310-N312 WeakPolarHBondContact OD1-CA 3.48Å; D310-N312 WeakPolarHBondContact OD1-CB 3.42Å; D310-N312 PolarHBondContact OD1-N 3.07Å; N312-A314 VanDerWaalsContact C-N 3.33Å
313	G	84.4	Confident	91.4	Very high	46 Å²	46	46.3 Å²	46.3	47%	0.474	24%	0.243	S	C	.	.	S	Bend	trans	78.9	11	-176.6	0	0	0	0	0	114.4	Y309 D310	Y309-G313 WeakPolarHBondContact CD1-O 3.4Å; D310-G313 PolarHBondContact O-N 2.65Å; D310-G313 PolarHBondContact OD1-N 3.38Å
314	A	87.7	Confident	91.5	Very high	49 Å²	49	50.5 Å²	50.5	41%	0.405	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-83.2	134.5	177	0	0	0	0	0	111.2	Y309 D310 N312 R316	Y309-A314 CarbonylContact C-O 3.58Å; Y309-A314 WeakPolarHBondContact CA-O 3.38Å; D310-A314 PolarHBondContact N-O 3.13Å; D310-A314 PolarHBondContact OD1-N 2.67Å; N312-A314 VanDerWaalsContact C-N 3.33Å; A314-R316 PolarHBondContact O-N 3.25Å
315	A	90.8	Very high	91.6	Very high	35 Å²	35	52.3 Å²	52.3	29%	0.289	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	127.2	180	0	0	0	0	0	111.5	P227 F306 Y309	P227-A315 HydrophobicContact CB-CB 3.69Å; P227-A315 HydrophobicContact CG-CB 4.09Å; F306-A315 HydrophobicContact CD2-CB 4.38Å; F306-A315 HydrophobicContact CE2-CB 3.78Å; Y309-A315 HydrophobicContact CD1-CB 4.2Å; Y309-A315 HydrophobicContact CE1-CB 3.99Å
316	R	92.5	Very high	91.7	Very high	111 Å²	111	59.2 Å²	59.2	42%	0.419	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.2	176.7	-62.3	-159.5	-64.6	-172.5	-0.5	111.4	F306 R307 G308 D310 A314	F306-R316 WeakPolarHBondContact CA-O 3.28Å; F306-R316 WeakPolarHBondContact CD2-O 3.42Å; R307-R316 HydrophobicContact CB-CB 4.31Å; R307-R316 PolarHBondContact N-O 3.03Å; G308-R316 WeakPolarHBondContact O-CB 3.38Å; G308-R316 PolarHBondContact O-N 3.42Å; D310-R316 HydrophobicContact CB-CG 4.2Å; A314-R316 PolarHBondContact O-N 3.25Å
317	W	94.8	Very high	91.9	Very high	23 Å²	23	60.3 Å²	60.3	9%	0.087	30%	0.303	C	S	.	.			trans	-113.1	41.6	-177.2	-66.9	95	0	0	0	111.7	P227 P229 A232 N300 G305 F306	P227-W317 HydrophobicContact CB-CZ2 4.16Å; P227-W317 HydrophobicContact CG-CZ2 3.94Å; P227-W317 WeakPolarHBondContact O-CZ2 3.15Å; P229-W317 HydrophobicContact CB-CE3 4.36Å; P229-W317 HydrophobicContact CB-CH2 3.72Å; P229-W317 HydrophobicContact CB-CZ2 3.85Å; P229-W317 HydrophobicContact CB-CZ3 3.97Å; A232-W317 HydrophobicContact CB-CB 3.62Å; A232-W317 HydrophobicContact CB-CD2 4.39Å; A232-W317 HydrophobicContact CB-CG 3.58Å; N300-W317 HydrophobicContact CB-CE3 4.02Å; N300-W317 PolarHBondContact ND2-O 3.19Å; G305-W317 CarbonylContact O-C 3.29Å; G305-W317 VanDerWaalsContact O-C 3.26Å; G305-W317 WeakPolarHBondContact O-CA 3.35Å; F306-W317 HydrophobicContact CB-CE3 4.02Å; F306-W317 HydrophobicContact CB-CH2 4.12Å; F306-W317 HydrophobicContact CB-CZ3 3.79Å; F306-W317 HydrophobicContact CD2-CZ2 4.38Å
318	D	94.4	Very high	92.2	Very high	35 Å²	35	55.9 Å²	55.9	19%	0.187	29%	0.286	C	S	.	.			trans	-123.9	21	-174.8	81.4	-38.5	0	0	0	113.9	G305 R307 I320 S321 R324	G305-D318 PolarHBondContact O-N 3.42Å; R307-D318 VanDerWaalsContact CZ-O 3.24Å; R307-D318 IonicContact CZ-OD1 3.5Å; R307-D318 IonicContact CZ-OD2 3.64Å; R307-D318 IonicContact NE-OD1 3.81Å; R307-D318 IonicContact NH1-OD1 3.16Å; R307-D318 PolarHBondContact NH1-OD1 3.43Å; R307-D318 IonicContact NH1-OD2 2.66Å; R307-D318 PolarHBondContact NH1-OD2 2.9Å; R307-D318 PolarHBondContact NH2-O 3.38Å; D318-I320 PolarHBondContact O-N 3.26Å; D318-S321 WeakPolarHBondContact CA-OG 2.98Å; D318-R324 IonicContact OD2-NH2 2.8Å; D318-R324 PolarHBondContact OD2-NH2 3.43Å
319	L	94.5	Very high	92.6	Very high	39 Å²	39	56.7 Å²	56.7	20%	0.204	29%	0.287	C	S	.	.	S	Bend	trans	-54.6	-51	-178.4	179.7	68.7	0	0	0	111.5	D197 F304 G305 R307	D197-L319 HydrophobicContact CB-CD2 4.47Å; F304-L319 HydrophobicContact CE2-CD2 4.42Å; G305-L319 WeakPolarHBondContact O-CB 3.47Å; G305-L319 PolarHBondContact O-N 3.38Å; R307-L319 HydrophobicContact CB-CB 4.09Å; R307-L319 HydrophobicContact CB-CD1 4.33Å; R307-L319 HydrophobicContact CG-CD1 4.39Å; R307-L319 PolarHBondContact NH2-O 3.34Å
320	I	94.6	Very high	93	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.304	C	S	.	.	S	Bend	trans	-113.4	16.3	-175.3	64.1	180	0	0	0	112.8	P191 C193 N299 F304 D318 N322	P191-I320 WeakPolarHBondContact CB-O 3.35Å; P191-I320 HydrophobicContact CG-CB 3.91Å; P191-I320 HydrophobicContact CG-CD1 3.68Å; P191-I320 HydrophobicContact CG-CG1 3.65Å; P191-I320 WeakPolarHBondContact CG-O 3.5Å; C193-I320 HydrophobicContact CB-CG2 3.79Å; N299-I320 HydrophobicContact CB-CD1 3.69Å; F304-I320 HydrophobicContact CD1-CD1 3.78Å; F304-I320 HydrophobicContact CE1-CD1 3.64Å; F304-I320 HydrophobicContact CG-CD1 4.3Å; F304-I320 HydrophobicContact CZ-CD1 4.08Å; F304-I320 HydrophobicContact CZ-CG2 4.28Å; D318-I320 PolarHBondContact O-N 3.26Å; I320-N322 PolarHBondContact O-N 3.13Å
321	S	95	Very high	93.5	Very high	7 Å²	7	57.2 Å²	57.2	5%	0.049	29%	0.291	C	S	.	.			trans	-58.6	131.6	179.4	-71.1	0	0	0	0	111.5	D296 D318 Q344	D296-S321 WeakPolarHBondContact OD2-CA 3.26Å; D296-S321 VanDerWaalsContact OD2-CB 3.31Å; D296-S321 WeakPolarHBondContact OD2-CB 3.17Å; D296-S321 PolarHBondContact OD2-OG 2.86Å; D318-S321 WeakPolarHBondContact CA-OG 2.98Å; S321-Q344 PolarHBondContact O-NE2 3.2Å
322	N	94.2	Very high	93.8	Very high	3 Å²	3	48.8 Å²	48.8	2%	0.016	26%	0.257	C	S	.	.			trans	-90.8	-17	179.5	-103.5	-16.7	0	0	0	113.6	P191 W292 I320 N342 I343 Q344	P191-N322 WeakPolarHBondContact CA-ND2 3.35Å; P191-N322 HydrophobicContact CB-CB 4.4Å; P191-N322 WeakPolarHBondContact CB-ND2 3.47Å; W292-N322 HydrophobicContact CB-CB 4.19Å; W292-N322 HydrophobicContact CG-CB 4.42Å; I320-N322 PolarHBondContact O-N 3.13Å; N322-N342 CarbonylContact O-C 3.42Å; N322-N342 VanDerWaalsContact O-CA 3.26Å; N322-N342 WeakPolarHBondContact O-CA 3.48Å; N322-N342 PolarHBondContact O-N 3.2Å; N322-I343 WeakPolarHBondContact O-CG1 3.48Å; N322-I343 PolarHBondContact O-N 3.41Å; N322-Q344 WeakPolarHBondContact OD1-CB 3.47Å; N322-Q344 WeakPolarHBondContact OD1-CG 3.35Å; N322-Q344 PolarHBondContact OD1-N 2.84Å; N322-Q344 VanDerWaalsContact OD1-N 3.15Å
323	L	95.1	Very high	94.2	Very high	18 Å²	18	43.4 Å²	43.4	9%	0.094	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-135.6	144.3	-172.1	-72.1	170.4	0	0	0	112	Y289 W292 I325 I328 W341	Y289-L323 HydrophobicContact CD1-CD1 3.62Å; Y289-L323 HydrophobicContact CD1-CD2 4.06Å; Y289-L323 HydrophobicContact CD1-CG 4.45Å; Y289-L323 HydrophobicContact CE1-CD1 4.41Å; Y289-L323 HydrophobicContact CE1-CD2 4.03Å; Y289-L323 HydrophobicContact CG-CD1 4.42Å; W292-L323 HydrophobicContact CB-CD1 3.79Å; W292-L323 HydrophobicContact CB-CG 4.28Å; W292-L323 HydrophobicContact CE3-CD1 3.85Å; W292-L323 HydrophobicContact CE3-CD2 3.67Å; W292-L323 HydrophobicContact CE3-CG 3.7Å; W292-L323 HydrophobicContact CZ3-CD2 3.97Å; W292-L323 HydrophobicContact CZ3-CG 4.49Å; L323-I325 HydrophobicContact CB-CG1 4.41Å; L323-I328 HydrophobicContact CD2-CD1 3.66Å; L323-W341 HydrophobicContact CD2-CE3 4.28Å
324	R	96.3	Very high	94.7	Very high	98 Å²	98	41.7 Å²	41.7	37%	0.37	21%	0.208	S	C	.	.			trans	-131	73.3	171.3	-86	-177.4	-179.8	-167.9	-0.3	108.6	D318 Q326 Q327 I328 N340 I343	D318-R324 IonicContact OD2-NH2 2.8Å; D318-R324 PolarHBondContact OD2-NH2 3.43Å; R324-Q326 VanDerWaalsContact C-N 3.31Å; R324-Q326 PolarHBondContact O-N 3.28Å; R324-Q327 HydrophobicContact CB-CB 4.16Å; R324-Q327 HydrophobicContact CB-CG 4.38Å; R324-Q327 VanDerWaalsContact CB-OE1 3.27Å; R324-Q327 WeakPolarHBondContact O-CA 3.15Å; R324-Q327 WeakPolarHBondContact O-CB 3.39Å; R324-Q327 PolarHBondContact O-N 2.84Å; R324-Q327 PolarHBondContact O-OE1 2.9Å; R324-I328 WeakPolarHBondContact O-CG1 3.46Å; R324-I328 PolarHBondContact O-N 3.4Å; R324-N340 HydrophobicContact CB-CB 3.9Å; R324-N340 VanDerWaalsContact CB-OD1 3.3Å; R324-N340 WeakPolarHBondContact CB-OD1 3.38Å; R324-N340 WeakPolarHBondContact CD-OD1 3.36Å; R324-N340 PolarHBondContact N-O 2.97Å; R324-I343 HydrophobicContact CB-CD1 4.25Å; R324-I343 HydrophobicContact CG-CD1 3.85Å
325	I	95.9	Very high	94.9	Very high	44 Å²	44	44.5 Å²	44.5	23%	0.226	21%	0.211	C	C	.	.	H	α-helix	trans	-51.8	-47.1	-165.6	-61.4	174.1	0	0	0	111.9	I239 Y289 L323 Q327 I328 E329	I239-I325 HydrophobicContact CG2-CD1 3.58Å; Y289-I325 HydrophobicContact CD1-CD1 4.4Å; Y289-I325 HydrophobicContact CD1-CG1 4.16Å; Y289-I325 HydrophobicContact CD2-CD1 4.06Å; Y289-I325 HydrophobicContact CD2-CG1 4.25Å; Y289-I325 HydrophobicContact CD2-CG2 4.19Å; Y289-I325 HydrophobicContact CE1-CG1 4.32Å; Y289-I325 HydrophobicContact CE2-CG1 4.43Å; Y289-I325 HydrophobicContact CE2-CG2 3.86Å; Y289-I325 HydrophobicContact CG-CD1 3.91Å; Y289-I325 HydrophobicContact CG-CG1 4.12Å; L323-I325 HydrophobicContact CB-CG1 4.41Å; I325-Q327 VanDerWaalsContact C-N 3.33Å; I325-Q327 PolarHBondContact O-N 2.73Å; I325-I328 WeakPolarHBondContact O-CB 3.32Å; I325-I328 PolarHBondContact O-N 3.22Å; I325-I328 VanDerWaalsContact O-N 3.12Å; I325-E329 HydrophobicContact CG2-CG 4.24Å; I325-E329 WeakPolarHBondContact O-CG 3.39Å; I325-E329 PolarHBondContact O-N 2.88Å
326	Q	95.6	Very high	95.1	Very high	146 Å²	146	45.7 Å²	45.7	68%	0.682	21%	0.212	S	C	*	.	H	α-helix	trans	-60.2	-42.3	179.1	-173.3	-178.7	-2.1	0	0	112.2	R324 I328 M330	R324-Q326 VanDerWaalsContact C-N 3.31Å; R324-Q326 PolarHBondContact O-N 3.28Å; Q326-I328 VanDerWaalsContact C-N 3.29Å; Q326-I328 PolarHBondContact O-N 2.9Å; Q326-M330 HydrophobicContact CG-CG 4.45Å; Q326-M330 VanDerWaalsContact O-CB 3.24Å; Q326-M330 WeakPolarHBondContact O-CB 3.31Å; Q326-M330 WeakPolarHBondContact O-CG 3.41Å; Q326-M330 PolarHBondContact O-N 2.93Å
327	Q	96.3	Very high	95.3	Very high	69 Å²	69	41 Å²	41	32%	0.322	19%	0.194	S	C	.	.	H	α-helix	trans	-70.3	-26.9	178.2	-65.4	78.5	1.1	0	0	112.5	R324 I325 S331 M336 N340	R324-Q327 HydrophobicContact CB-CB 4.16Å; R324-Q327 HydrophobicContact CB-CG 4.38Å; R324-Q327 VanDerWaalsContact CB-OE1 3.27Å; R324-Q327 WeakPolarHBondContact O-CA 3.15Å; R324-Q327 WeakPolarHBondContact O-CB 3.39Å; R324-Q327 PolarHBondContact O-N 2.84Å; R324-Q327 PolarHBondContact O-OE1 2.9Å; I325-Q327 VanDerWaalsContact C-N 3.33Å; I325-Q327 PolarHBondContact O-N 2.73Å; Q327-S331 WeakPolarHBondContact O-CB 3.25Å; Q327-S331 PolarHBondContact O-N 3.12Å; Q327-M336 HydrophobicContact CB-CE 4.21Å; Q327-N340 HydrophobicContact CB-CB 4.04Å; Q327-N340 VanDerWaalsContact CB-CG 3.47Å; Q327-N340 WeakPolarHBondContact CB-OD1 3.27Å
328	I	96.8	Very high	95.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70.7	-55.2	173.9	-62.6	167.6	0	0	0	109.4	Y289 L323 R324 I325 Q326 M330 S331 F337 N340 W341 Q423	Y289-I328 HydrophobicContact CE1-CD1 4.14Å; Y289-I328 WeakPolarHBondContact OH-CG2 3.34Å; L323-I328 HydrophobicContact CD2-CD1 3.66Å; R324-I328 WeakPolarHBondContact O-CG1 3.46Å; R324-I328 PolarHBondContact O-N 3.4Å; I325-I328 WeakPolarHBondContact O-CB 3.32Å; I325-I328 PolarHBondContact O-N 3.22Å; I325-I328 VanDerWaalsContact O-N 3.12Å; Q326-I328 VanDerWaalsContact C-N 3.29Å; Q326-I328 PolarHBondContact O-N 2.9Å; I328-M330 VanDerWaalsContact C-N 3.3Å; I328-M330 PolarHBondContact O-N 3.28Å; I328-S331 WeakPolarHBondContact O-CB 3.16Å; I328-S331 PolarHBondContact O-N 3.35Å; I328-S331 PolarHBondContact O-OG 3.22Å; I328-S331 VanDerWaalsContact O-OG 3.05Å; I328-F337 HydrophobicContact CB-CD2 4.47Å; I328-F337 HydrophobicContact CB-CE2 4.46Å; I328-F337 HydrophobicContact CG2-CD2 3.57Å; I328-F337 HydrophobicContact CG2-CE1 4.19Å; I328-F337 HydrophobicContact CG2-CE2 3.19Å; I328-F337 HydrophobicContact CG2-CG 4.26Å; I328-F337 HydrophobicContact CG2-CZ 3.52Å; I328-F337 WeakPolarHBondContact O-CD2 3.44Å; I328-N340 VanDerWaalsContact CD1-O 3.29Å; I328-N340 WeakPolarHBondContact CD1-O 3.46Å; I328-N340 HydrophobicContact CG1-CB 3.76Å; I328-W341 HydrophobicContact CD1-CB 4.47Å; I328-W341 HydrophobicContact CD1-CE3 4.14Å; I328-W341 HydrophobicContact CG2-CE3 4.39Å; I328-Q423 PolarHBondContact O-NE2 3.14Å
329	E	95.6	Very high	95.4	Very high	29 Å²	29	44.5 Å²	44.5	14%	0.136	22%	0.215	C	C	.	.	H	α-helix	trans	-68.8	-29	-176.3	-57.5	-49.2	156.2	0	0	113	R285 Y289 I325 W419 Q423	R285-E329 IonicContact CZ-OE1 3.12Å; R285-E329 IonicContact CZ-OE2 2.9Å; R285-E329 IonicContact NH1-OE1 3.07Å; R285-E329 PolarHBondContact NH1-OE1 2.85Å; R285-E329 IonicContact NH1-OE2 2.95Å; R285-E329 PolarHBondContact NH1-OE2 3.36Å; R285-E329 IonicContact NH2-OE1 3.66Å; R285-E329 IonicContact NH2-OE2 2.78Å; R285-E329 PolarHBondContact NH2-OE2 3.04Å; Y289-E329 WeakPolarHBondContact CE2-OE1 3.39Å; Y289-E329 VanDerWaalsContact CZ-OE1 3.3Å; Y289-E329 PolarHBondContact OH-OE1 3.05Å; I325-E329 HydrophobicContact CG2-CG 4.24Å; I325-E329 WeakPolarHBondContact O-CG 3.39Å; I325-E329 PolarHBondContact O-N 2.88Å; E329-W419 PolarHBondContact O-NE1 3.12Å; E329-Q423 PolarHBondContact O-NE2 2.74Å
330	M	96.3	Very high	95.5	Very high	120 Å²	120	43.4 Å²	43.4	59%	0.591	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.6	19	179.1	-56.1	-61.7	171.8	0	0	113.1	Q326 I328 T332	Q326-M330 HydrophobicContact CG-CG 4.45Å; Q326-M330 VanDerWaalsContact O-CB 3.24Å; Q326-M330 WeakPolarHBondContact O-CB 3.31Å; Q326-M330 WeakPolarHBondContact O-CG 3.41Å; Q326-M330 PolarHBondContact O-N 2.93Å; I328-M330 VanDerWaalsContact C-N 3.3Å; I328-M330 PolarHBondContact O-N 3.28Å; M330-T332 PolarHBondContact O-N 2.82Å
331	S	96.4	Very high	95.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.			trans	-67.8	128.2	-176.8	67.8	0	0	0	0	112.4	Q327 I328 T422 Q423	Q327-S331 WeakPolarHBondContact O-CB 3.25Å; Q327-S331 PolarHBondContact O-N 3.12Å; I328-S331 WeakPolarHBondContact O-CB 3.16Å; I328-S331 PolarHBondContact O-N 3.35Å; I328-S331 PolarHBondContact O-OG 3.22Å; I328-S331 VanDerWaalsContact O-OG 3.05Å; S331-T422 WeakPolarHBondContact OG-CG2 3.4Å; S331-Q423 PolarHBondContact OG-NE2 2.99Å
332	T	95.8	Very high	95.7	Very high	23 Å²	23	46.3 Å²	46.3	14%	0.141	22%	0.22	C	C	.	.	S	Bend	trans	-100.8	10.5	176.7	62.8	0	0	0	0	113	M330 R397 D415 T418 W419	M330-T332 PolarHBondContact O-N 2.82Å; T332-R397 PolarHBondContact O-NH1 3.02Å; T332-R397 VanDerWaalsContact O-NH1 3.07Å; T332-D415 HydrophobicContact CG2-CB 4.18Å; T332-T418 WeakPolarHBondContact O-CB 3.44Å; T332-W419 HydrophobicContact CG2-CB 4.29Å
333	S	95.1	Very high	95.8	Very high	16 Å²	16	47.3 Å²	47.3	11%	0.112	23%	0.225	C	C	.	.	S	Bend	trans	-156.7	150.3	171	61.5	0	0	0	0	111.4	K335 M336 F337 T422	S333-K335 PolarHBondContact O-N 2.69Å; S333-M336 WeakPolarHBondContact O-CB 3.33Å; S333-M336 PolarHBondContact O-N 3.45Å; S333-M336 VanDerWaalsContact OG-CB 3.3Å; S333-M336 WeakPolarHBondContact OG-CB 3.47Å; S333-M336 PolarHBondContact OG-N 2.93Å; S333-F337 PolarHBondContact O-N 3.42Å; S333-F337 VanDerWaalsContact O-N 3.14Å; S333-T422 VanDerWaalsContact CA-OG1 3.28Å; S333-T422 WeakPolarHBondContact CA-OG1 3.01Å; S333-T422 PolarHBondContact N-OG1 3.45Å
334	F	94.9	Very high	95.9	Very high	9 Å²	9	47.1 Å²	47.1	4%	0.039	22%	0.224	C	C	.	.	H	α-helix	trans	-52.2	-43.4	176	-158.9	-92.8	0	0	0	112.3	M336 F337 L338 M389 T390 A393 A425 I426 T429	F334-M336 PolarHBondContact O-N 3.48Å; F334-F337 PolarHBondContact O-N 2.87Å; F334-L338 HydrophobicContact CD1-CD1 3.77Å; F334-L338 HydrophobicContact CD1-CG 4.14Å; F334-L338 HydrophobicContact CE1-CD1 3.68Å; F334-L338 HydrophobicContact CE1-CD2 4.37Å; F334-L338 HydrophobicContact CE1-CG 4.1Å; F334-L338 WeakPolarHBondContact O-CG 3.04Å; F334-L338 PolarHBondContact O-N 3.3Å; F334-L338 VanDerWaalsContact O-N 3.12Å; F334-M389 HydrophobicContact CD1-CB 4.42Å; F334-M389 HydrophobicContact CD2-CB 4.03Å; F334-M389 HydrophobicContact CE1-CB 4.14Å; F334-M389 HydrophobicContact CE2-CB 3.74Å; F334-M389 HydrophobicContact CE2-CG 4.34Å; F334-M389 HydrophobicContact CG-CB 4.37Å; F334-M389 HydrophobicContact CZ-CB 3.81Å; F334-T390 WeakPolarHBondContact CD1-OG1 3.39Å; F334-T390 WeakPolarHBondContact CE1-OG1 3.42Å; F334-A393 HydrophobicContact CB-CB 3.82Å; F334-A425 HydrophobicContact CD2-CB 4.43Å; F334-I426 HydrophobicContact CD2-CD1 4.36Å; F334-I426 HydrophobicContact CD2-CG1 3.51Å; F334-I426 HydrophobicContact CE2-CB 4.38Å; F334-I426 HydrophobicContact CE2-CG1 3.51Å; F334-I426 HydrophobicContact CG-CG1 4.44Å; F334-I426 HydrophobicContact CZ-CG1 4.44Å; F334-T429 HydrophobicContact CZ-CG2 4.12Å
335	K	92.3	Very high	96	Very high	108 Å²	108	42.8 Å²	42.8	47%	0.47	21%	0.208	S	C	.	.	H	α-helix	trans	-62	-43.9	176.1	175	167.4	172.5	48.3	0	112.5	S333 F337 L338 D339	S333-K335 PolarHBondContact O-N 2.69Å; K335-F337 VanDerWaalsContact C-N 3.28Å; K335-F337 PolarHBondContact O-N 3.37Å; K335-L338 PolarHBondContact O-N 3.35Å; K335-D339 VanDerWaalsContact CE-OD2 3.27Å; K335-D339 WeakPolarHBondContact CE-OD2 3.35Å; K335-D339 WeakPolarHBondContact CG-OD2 3.06Å; K335-D339 IonicContact NZ-OD1 3.97Å; K335-D339 PolarHBondContact NZ-OD1 3.13Å; K335-D339 IonicContact NZ-OD2 2.98Å; K335-D339 PolarHBondContact NZ-OD2 3.48Å; K335-D339 WeakPolarHBondContact O-CB 3.48Å; K335-D339 VanDerWaalsContact O-CG 3.22Å; K335-D339 PolarHBondContact O-N 2.87Å
336	M	95.4	Very high	96	Very high	61 Å²	61	42.5 Å²	42.5	30%	0.3	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-39.5	179.5	179.7	174.9	173.5	0	0	111.3	Q327 S333 F334 N340	Q327-M336 HydrophobicContact CB-CE 4.21Å; S333-M336 WeakPolarHBondContact O-CB 3.33Å; S333-M336 PolarHBondContact O-N 3.45Å; S333-M336 VanDerWaalsContact OG-CB 3.3Å; S333-M336 WeakPolarHBondContact OG-CB 3.47Å; S333-M336 PolarHBondContact OG-N 2.93Å; F334-M336 PolarHBondContact O-N 3.48Å; M336-N340 PolarHBondContact O-N 3.48Å; M336-N340 PolarHBondContact O-ND2 3.18Å
337	F	97.1	Very high	96	Very high	11 Å²	11	38.1 Å²	38.1	5%	0.048	19%	0.193	C	C	.	.	H	α-helix	trans	-62.3	-51.6	174.5	-170.9	-80.9	0	0	0	111.6	I328 S333 F334 K335 D339 N340 W341 I426	I328-F337 HydrophobicContact CB-CD2 4.47Å; I328-F337 HydrophobicContact CB-CE2 4.46Å; I328-F337 HydrophobicContact CG2-CD2 3.57Å; I328-F337 HydrophobicContact CG2-CE1 4.19Å; I328-F337 HydrophobicContact CG2-CE2 3.19Å; I328-F337 HydrophobicContact CG2-CG 4.26Å; I328-F337 HydrophobicContact CG2-CZ 3.52Å; I328-F337 WeakPolarHBondContact O-CD2 3.44Å; S333-F337 PolarHBondContact O-N 3.42Å; S333-F337 VanDerWaalsContact O-N 3.14Å; F334-F337 PolarHBondContact O-N 2.87Å; K335-F337 VanDerWaalsContact C-N 3.28Å; K335-F337 PolarHBondContact O-N 3.37Å; F337-D339 VanDerWaalsContact C-N 3.29Å; F337-D339 PolarHBondContact O-N 3.29Å; F337-N340 PolarHBondContact O-N 2.95Å; F337-W341 HydrophobicContact CD1-CB 4.18Å; F337-W341 HydrophobicContact CE1-CB 4.08Å; F337-W341 HydrophobicContact CE1-CD2 4.32Å; F337-W341 HydrophobicContact CE1-CE3 4.24Å; F337-W341 HydrophobicContact CE1-CG 4.25Å; F337-W341 HydrophobicContact CZ-CE3 4.32Å; F337-W341 PolarHBondContact O-N 2.87Å; F337-I426 HydrophobicContact CB-CD1 3.34Å; F337-I426 HydrophobicContact CD1-CD1 3.86Å; F337-I426 HydrophobicContact CD1-CG2 4.28Å; F337-I426 HydrophobicContact CD2-CD1 3.33Å; F337-I426 HydrophobicContact CE1-CD1 4.43Å; F337-I426 HydrophobicContact CE1-CG2 3.88Å; F337-I426 HydrophobicContact CE2-CD1 3.92Å; F337-I426 HydrophobicContact CE2-CG2 4.08Å; F337-I426 HydrophobicContact CG-CD1 3.26Å; F337-I426 HydrophobicContact CG-CG1 4.38Å; F337-I426 HydrophobicContact CZ-CD1 4.46Å; F337-I426 HydrophobicContact CZ-CG2 3.76Å
338	L	95.1	Very high	96.1	Very high	55 Å²	55	34.9 Å²	34.9	29%	0.288	18%	0.178	S	C	.	.	H	α-helix	trans	-59.6	-38.5	-179.4	-67.2	-177.9	0	0	0	112.7	F334 K335 N340 W341 F366	F334-L338 HydrophobicContact CD1-CD1 3.77Å; F334-L338 HydrophobicContact CD1-CG 4.14Å; F334-L338 HydrophobicContact CE1-CD1 3.68Å; F334-L338 HydrophobicContact CE1-CD2 4.37Å; F334-L338 HydrophobicContact CE1-CG 4.1Å; F334-L338 WeakPolarHBondContact O-CG 3.04Å; F334-L338 PolarHBondContact O-N 3.3Å; F334-L338 VanDerWaalsContact O-N 3.12Å; K335-L338 PolarHBondContact O-N 3.35Å; L338-N340 PolarHBondContact O-N 2.94Å; L338-W341 PolarHBondContact O-N 3.29Å; L338-F366 HydrophobicContact CD1-CZ 3.87Å
339	D	95.3	Very high	96.1	Very high	77 Å²	77	35.7 Å²	35.7	41%	0.412	18%	0.182	S	C	.	.	H	α-helix	trans	-68.6	-15.2	179.3	-70.3	-16.9	0	0	0	113	K335 F337	K335-D339 VanDerWaalsContact CE-OD2 3.27Å; K335-D339 WeakPolarHBondContact CE-OD2 3.35Å; K335-D339 WeakPolarHBondContact CG-OD2 3.06Å; K335-D339 IonicContact NZ-OD1 3.97Å; K335-D339 PolarHBondContact NZ-OD1 3.13Å; K335-D339 IonicContact NZ-OD2 2.98Å; K335-D339 PolarHBondContact NZ-OD2 3.48Å; K335-D339 WeakPolarHBondContact O-CB 3.48Å; K335-D339 VanDerWaalsContact O-CG 3.22Å; K335-D339 PolarHBondContact O-N 2.87Å; F337-D339 VanDerWaalsContact C-N 3.29Å; F337-D339 PolarHBondContact O-N 3.29Å
340	N	97.4	Very high	96.1	Very high	17 Å²	17	38.4 Å²	38.4	9%	0.091	19%	0.193	C	C	.	.	H	α-helix	trans	-113.3	-8.4	-178.3	-71.1	-79.4	0	0	0	113.6	R324 Q327 I328 M336 F337 L338	R324-N340 HydrophobicContact CB-CB 3.9Å; R324-N340 VanDerWaalsContact CB-OD1 3.3Å; R324-N340 WeakPolarHBondContact CB-OD1 3.38Å; R324-N340 WeakPolarHBondContact CD-OD1 3.36Å; R324-N340 PolarHBondContact N-O 2.97Å; Q327-N340 HydrophobicContact CB-CB 4.04Å; Q327-N340 VanDerWaalsContact CB-CG 3.47Å; Q327-N340 WeakPolarHBondContact CB-OD1 3.27Å; I328-N340 VanDerWaalsContact CD1-O 3.29Å; I328-N340 WeakPolarHBondContact CD1-O 3.46Å; I328-N340 HydrophobicContact CG1-CB 3.76Å; M336-N340 PolarHBondContact O-N 3.48Å; M336-N340 PolarHBondContact O-ND2 3.18Å; F337-N340 PolarHBondContact O-N 2.95Å; L338-N340 PolarHBondContact O-N 2.94Å
341	W	96.6	Very high	96.1	Very high	55 Å²	55	35 Å²	35	21%	0.208	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-99.7	124.1	175.7	176.8	-85.5	0	0	0	110.7	R285 Y288 Y289 W292 L323 I328 F337 L338 I343	R285-W341 HydrophobicContact CB-CZ3 4.4Å; R285-W341 HydrophobicContact CG-CH2 4.02Å; R285-W341 HydrophobicContact CG-CZ3 3.96Å; Y288-W341 AromaticContact CD2-CH2 3.72Å; Y288-W341 HydrophobicContact CD2-CH2 3.72Å; Y288-W341 HydrophobicContact CD2-CZ2 4.08Å; Y288-W341 AromaticContact CG-CH2 3.86Å; Y288-W341 HydrophobicContact CG-CH2 3.86Å; Y288-W341 HydrophobicContact CG-CZ2 4.03Å; Y289-W341 HydrophobicContact CD1-CZ3 4.37Å; Y289-W341 HydrophobicContact CE1-CE3 4.13Å; Y289-W341 HydrophobicContact CE1-CH2 4.48Å; Y289-W341 AromaticContact CE1-CZ3 3.55Å; Y289-W341 HydrophobicContact CE1-CZ3 3.55Å; W292-W341 AromaticContact CH2-CE2 3.98Å; W292-W341 AromaticContact CH2-CZ2 3.98Å; W292-W341 HydrophobicContact CH2-CZ2 3.98Å; W292-W341 AromaticContact CH2-NE1 3.91Å; W292-W341 HydrophobicContact CZ3-CD2 4.29Å; W292-W341 AromaticContact CZ3-CE2 3.79Å; W292-W341 HydrophobicContact CZ3-CH2 4.43Å; W292-W341 AromaticContact CZ3-CZ2 3.87Å; W292-W341 HydrophobicContact CZ3-CZ2 3.87Å; L323-W341 HydrophobicContact CD2-CE3 4.28Å; I328-W341 HydrophobicContact CD1-CB 4.47Å; I328-W341 HydrophobicContact CD1-CE3 4.14Å; I328-W341 HydrophobicContact CG2-CE3 4.39Å; F337-W341 HydrophobicContact CD1-CB 4.18Å; F337-W341 HydrophobicContact CE1-CB 4.08Å; F337-W341 HydrophobicContact CE1-CD2 4.32Å; F337-W341 HydrophobicContact CE1-CE3 4.24Å; F337-W341 HydrophobicContact CE1-CG 4.25Å; F337-W341 HydrophobicContact CZ-CE3 4.32Å; F337-W341 PolarHBondContact O-N 2.87Å; L338-W341 PolarHBondContact O-N 3.29Å; W341-I343 VanDerWaalsContact C-N 3.34Å; W341-I343 PolarHBondContact O-N 2.92Å
342	N	96.1	Very high	96	Very high	13 Å²	13	35.6 Å²	35.6	7%	0.07	18%	0.178	C	C	.	.	S	Bend	trans	50	53.4	-179.4	-161.7	-5.7	0	0	0	112.4	W292 N322 Q344 T345 A346	W292-N342 HydrophobicContact CH2-CB 3.59Å; W292-N342 HydrophobicContact CZ2-CB 4.33Å; W292-N342 HydrophobicContact CZ3-CB 3.7Å; N322-N342 CarbonylContact O-C 3.42Å; N322-N342 VanDerWaalsContact O-CA 3.26Å; N322-N342 WeakPolarHBondContact O-CA 3.48Å; N322-N342 PolarHBondContact O-N 3.2Å; N342-Q344 VanDerWaalsContact C-N 3.31Å; N342-Q344 PolarHBondContact O-N 3.43Å; N342-T345 WeakPolarHBondContact ND2-CB 3.41Å; N342-T345 PolarHBondContact ND2-OG1 2.85Å; N342-T345 VanDerWaalsContact ND2-OG1 3.09Å; N342-T345 WeakPolarHBondContact O-CB 3.43Å; N342-T345 PolarHBondContact O-N 3.15Å; N342-T345 VanDerWaalsContact O-N 3.09Å; N342-T345 WeakPolarHBondContact OD1-CB 3.5Å; N342-T345 PolarHBondContact OD1-OG1 2.84Å; N342-A346 PolarHBondContact O-N 3.45Å
343	I	97.4	Very high	96.1	Very high	25 Å²	25	35.2 Å²	35.2	13%	0.128	18%	0.176	C	C	.	.	H	α-helix	trans	-53.2	-45.3	-167.8	-63.8	168.4	0	0	0	111.8	N322 R324 W341 T345 A346 L347	N322-I343 WeakPolarHBondContact O-CG1 3.48Å; N322-I343 PolarHBondContact O-N 3.41Å; R324-I343 HydrophobicContact CB-CD1 4.25Å; R324-I343 HydrophobicContact CG-CD1 3.85Å; W341-I343 VanDerWaalsContact C-N 3.34Å; W341-I343 PolarHBondContact O-N 2.92Å; I343-T345 VanDerWaalsContact C-N 3.35Å; I343-T345 PolarHBondContact O-N 3.3Å; I343-A346 PolarHBondContact O-N 2.9Å; I343-L347 HydrophobicContact CG2-CD1 4.19Å; I343-L347 WeakPolarHBondContact O-CG 3.44Å; I343-L347 PolarHBondContact O-N 3.16Å
344	Q	96.8	Very high	96	Very high	14 Å²	14	37.2 Å²	37.2	7%	0.065	18%	0.181	C	C	.	.	H	α-helix	trans	-69.9	-35.1	-175.7	-54.5	-62	-32.1	0	0	111.6	P191 L192 S321 N322 N342 L347 W348	P191-Q344 HydrophobicContact CB-CG 4.23Å; L192-Q344 HydrophobicContact CB-CB 3.81Å; L192-Q344 HydrophobicContact CG-CB 4.49Å; L192-Q344 WeakPolarHBondContact O-CB 3.31Å; L192-Q344 VanDerWaalsContact O-CG 3.24Å; L192-Q344 WeakPolarHBondContact O-CG 3.47Å; S321-Q344 PolarHBondContact O-NE2 3.2Å; N322-Q344 WeakPolarHBondContact OD1-CB 3.47Å; N322-Q344 WeakPolarHBondContact OD1-CG 3.35Å; N322-Q344 PolarHBondContact OD1-N 2.84Å; N322-Q344 VanDerWaalsContact OD1-N 3.15Å; N342-Q344 VanDerWaalsContact C-N 3.31Å; N342-Q344 PolarHBondContact O-N 3.43Å; Q344-L347 PolarHBondContact O-N 3.38Å; Q344-W348 PolarHBondContact O-N 3.03Å
345	T	97.3	Very high	95.9	Very high	7 Å²	7	38.5 Å²	38.5	4%	0.043	19%	0.187	C	C	.	.	H	α-helix	trans	-64.3	-41.8	171.4	-64.5	0	0	0	0	111.6	Q139 N342 I343 L347 W348 L349 W372	Q139-T345 VanDerWaalsContact NE2-CG2 3.28Å; Q139-T345 PolarHBondContact NE2-OG1 3.45Å; N342-T345 WeakPolarHBondContact ND2-CB 3.41Å; N342-T345 PolarHBondContact ND2-OG1 2.85Å; N342-T345 VanDerWaalsContact ND2-OG1 3.09Å; N342-T345 WeakPolarHBondContact O-CB 3.43Å; N342-T345 PolarHBondContact O-N 3.15Å; N342-T345 VanDerWaalsContact O-N 3.09Å; N342-T345 WeakPolarHBondContact OD1-CB 3.5Å; N342-T345 PolarHBondContact OD1-OG1 2.84Å; I343-T345 VanDerWaalsContact C-N 3.35Å; I343-T345 PolarHBondContact O-N 3.3Å; T345-L347 VanDerWaalsContact C-N 3.3Å; T345-L347 PolarHBondContact O-N 3.46Å; T345-W348 HydrophobicContact CG2-CE3 4.07Å; T345-W348 HydrophobicContact CG2-CZ3 4.38Å; T345-W348 WeakPolarHBondContact O-CB 3.4Å; T345-W348 PolarHBondContact O-N 3.09Å; T345-L349 HydrophobicContact CG2-CD1 4.31Å; T345-L349 WeakPolarHBondContact O-CB 3.34Å; T345-L349 WeakPolarHBondContact O-CG 3.28Å; T345-L349 PolarHBondContact O-N 2.85Å; T345-W372 HydrophobicContact CG2-CE3 4.31Å; T345-W372 HydrophobicContact CG2-CH2 3.83Å; T345-W372 HydrophobicContact CG2-CZ2 4.44Å; T345-W372 HydrophobicContact CG2-CZ3 3.75Å
346	A	96.8	Very high	95.9	Very high	37 Å²	37	37 Å²	37	31%	0.306	18%	0.179	S	C	.	.	H	α-helix	trans	-63.1	-38.3	176.1	0	0	0	0	0	111.8	N342 I343 K350	N342-A346 PolarHBondContact O-N 3.45Å; I343-A346 PolarHBondContact O-N 2.9Å; A346-K350 WeakPolarHBondContact O-CB 3.31Å; A346-K350 PolarHBondContact O-N 3.36Å
347	L	96.3	Very high	95.6	Very high	55 Å²	55	35.6 Å²	35.6	29%	0.288	17%	0.174	S	C	.	.	H	α-helix	trans	-66.2	-40.9	173.5	-69.6	174.7	0	0	0	112.2	I343 Q344 T345 K350 R351	I343-L347 HydrophobicContact CG2-CD1 4.19Å; I343-L347 WeakPolarHBondContact O-CG 3.44Å; I343-L347 PolarHBondContact O-N 3.16Å; Q344-L347 PolarHBondContact O-N 3.38Å; T345-L347 VanDerWaalsContact C-N 3.3Å; T345-L347 PolarHBondContact O-N 3.46Å; L347-K350 WeakPolarHBondContact O-CB 3.37Å; L347-K350 PolarHBondContact O-N 3.3Å; L347-R351 WeakPolarHBondContact O-CB 3.36Å; L347-R351 WeakPolarHBondContact O-CG 3.35Å; L347-R351 PolarHBondContact O-N 3.39Å
348	W	97.6	Very high	95.1	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-58.2	-56.2	172.5	162.5	69	0	0	0	111.6	Q139 T142 S143 L192 Q344 T345 K350 R351 V352 L368 W372	Q139-W348 HydrophobicContact CB-CD2 4.12Å; Q139-W348 HydrophobicContact CB-CG 4.08Å; Q139-W348 HydrophobicContact CG-CD2 3.57Å; Q139-W348 HydrophobicContact CG-CE3 3.73Å; Q139-W348 HydrophobicContact CG-CG 4.02Å; Q139-W348 HydrophobicContact CG-CH2 4.23Å; Q139-W348 HydrophobicContact CG-CZ2 4.08Å; Q139-W348 HydrophobicContact CG-CZ3 4.05Å; T142-W348 PolarHBondContact OG1-NE1 3.2Å; S143-W348 VanDerWaalsContact OG-CD1 3.3Å; L192-W348 HydrophobicContact CD2-CB 3.49Å; L192-W348 VanDerWaalsContact CD2-CB 3.49Å; L192-W348 HydrophobicContact CD2-CG 4.2Å; Q344-W348 PolarHBondContact O-N 3.03Å; T345-W348 HydrophobicContact CG2-CE3 4.07Å; T345-W348 HydrophobicContact CG2-CZ3 4.38Å; T345-W348 WeakPolarHBondContact O-CB 3.4Å; T345-W348 PolarHBondContact O-N 3.09Å; W348-K350 PolarHBondContact O-N 3.06Å; W348-K350 VanDerWaalsContact O-N 3.15Å; W348-R351 PolarHBondContact O-N 3.35Å; W348-V352 VanDerWaalsContact CD1-CG1 3.49Å; W348-V352 HydrophobicContact CD2-CG2 4.29Å; W348-V352 HydrophobicContact CG-CG2 4.31Å; W348-V352 HydrophobicContact CZ2-CG2 4.3Å; W348-V352 WeakPolarHBondContact O-CG2 3.35Å; W348-V352 PolarHBondContact O-N 3.28Å; W348-L368 HydrophobicContact CH2-CG 4.38Å; W348-W372 HydrophobicContact CH2-CB 3.89Å; W348-W372 AromaticContact CH2-CD1 3.5Å; W348-W372 HydrophobicContact CH2-CD2 4.16Å; W348-W372 AromaticContact CH2-CG 3.57Å; W348-W372 HydrophobicContact CH2-CG 3.57Å; W348-W372 HydrophobicContact CZ3-CB 4.24Å; W348-W372 AromaticContact CZ3-CD1 3.96Å; W348-W372 AromaticContact CZ3-CD2 3.86Å; W348-W372 HydrophobicContact CZ3-CD2 3.86Å; W348-W372 HydrophobicContact CZ3-CE3 4.42Å; W348-W372 AromaticContact CZ3-CG 3.76Å; W348-W372 HydrophobicContact CZ3-CG 3.76Å
349	L	97.5	Very high	94.7	Very high	17 Å²	17	44.1 Å²	44.1	9%	0.089	22%	0.22	C	C	.	.	H	α-helix	trans	-51.2	-41.3	176.8	-79.1	176.5	0	0	0	111.8	T345 C353 Y354 T365 L368	T345-L349 HydrophobicContact CG2-CD1 4.31Å; T345-L349 WeakPolarHBondContact O-CB 3.34Å; T345-L349 WeakPolarHBondContact O-CG 3.28Å; T345-L349 PolarHBondContact O-N 2.85Å; L349-C353 WeakPolarHBondContact O-CB 3.25Å; L349-C353 PolarHBondContact O-N 3Å; L349-C353 VanDerWaalsContact O-N 3.13Å; L349-Y354 PolarHBondContact O-N 2.84Å; L349-Y354 VanDerWaalsContact O-N 3.07Å; L349-T365 HydrophobicContact CB-CG2 3.75Å; L349-T365 HydrophobicContact CD1-CG2 4.33Å; L349-T365 HydrophobicContact CD2-CG2 4.33Å; L349-T365 HydrophobicContact CG-CG2 4.36Å; L349-L368 HydrophobicContact CD2-CB 4.27Å; L349-L368 HydrophobicContact CD2-CD2 3.81Å; L349-L368 HydrophobicContact CD2-CG 3.82Å
350	K	95.4	Very high	94.4	Very high	85 Å²	85	42.7 Å²	42.7	37%	0.37	22%	0.216	S	C	.	.	I	π-helix	trans	-61.9	-50.9	175.3	-179	-178.2	169.5	-169.1	0	111.8	A346 L347 W348 Y354 E355	A346-K350 WeakPolarHBondContact O-CB 3.31Å; A346-K350 PolarHBondContact O-N 3.36Å; L347-K350 WeakPolarHBondContact O-CB 3.37Å; L347-K350 PolarHBondContact O-N 3.3Å; W348-K350 PolarHBondContact O-N 3.06Å; W348-K350 VanDerWaalsContact O-N 3.15Å; K350-Y354 HydrophobicContact CG-CD1 4.44Å; K350-Y354 PolarHBondContact O-N 3.38Å; K350-E355 WeakPolarHBondContact CE-OE1 3.13Å; K350-E355 HydrophobicContact CG-CG 3.93Å; K350-E355 IonicContact NZ-OE1 2.69Å; K350-E355 WeakPolarHBondContact O-CB 3.49Å; K350-E355 WeakPolarHBondContact O-CG 3.21Å; K350-E355 PolarHBondContact O-N 3.43Å
351	R	94.7	Very high	94.1	Very high	50 Å²	50	43.5 Å²	43.5	19%	0.189	22%	0.223	C	C	.	.	I	π-helix	trans	-72.9	-37.5	-173	-70.1	168.2	-172.7	170.4	3.4	113.9	L347 W348 R356	L347-R351 WeakPolarHBondContact O-CB 3.36Å; L347-R351 WeakPolarHBondContact O-CG 3.35Å; L347-R351 PolarHBondContact O-N 3.39Å; W348-R351 PolarHBondContact O-N 3.35Å; R351-R356 PolarHBondContact O-NE 2.98Å
352	V	95.9	Very high	93.9	Very high	12 Å²	12	41.8 Å²	41.8	7%	0.073	22%	0.218	C	C	.	.	I	π-helix	trans	-93.2	-20.8	-175.7	-52.1	0	0	0	0	113.2	F103 W348 L368	F103-V352 HydrophobicContact CE2-CB 4.35Å; F103-V352 HydrophobicContact CE2-CG2 3.94Å; W348-V352 VanDerWaalsContact CD1-CG1 3.49Å; W348-V352 HydrophobicContact CD2-CG2 4.29Å; W348-V352 HydrophobicContact CG-CG2 4.31Å; W348-V352 HydrophobicContact CZ2-CG2 4.3Å; W348-V352 WeakPolarHBondContact O-CG2 3.35Å; W348-V352 PolarHBondContact O-N 3.28Å; V352-L368 HydrophobicContact CG2-CD2 4.08Å
353	C	96.2	Very high	93.8	Very high	14 Å²	14	44.5 Å²	44.5	10%	0.095	23%	0.232	C	C	.	.	I	π-helix	trans	-126.1	-66.2	-177.4	-178.6	0	0	0	0	112.4	L349 E355 R356 T357 L368	L349-C353 WeakPolarHBondContact O-CB 3.25Å; L349-C353 PolarHBondContact O-N 3Å; L349-C353 VanDerWaalsContact O-N 3.13Å; C353-E355 VanDerWaalsContact C-N 3.29Å; C353-E355 PolarHBondContact O-N 3.49Å; C353-E355 VanDerWaalsContact O-N 3.15Å; C353-R356 PolarHBondContact O-N 2.98Å; C353-T357 WeakPolarHBondContact O-CG2 3.38Å; C353-T357 PolarHBondContact O-N 3.14Å; C353-L368 HydrophobicContact CB-CD2 3.51Å
354	Y	94.5	Very high	93.7	Very high	58 Å²	58	46.6 Å²	46.6	23%	0.227	24%	0.241	C	C	.	.	I	π-helix	trans	-56	-40	-170.4	-173.4	-95.4	0	0	0	113.7	L349 K350 P361 T365 R470	L349-Y354 PolarHBondContact O-N 2.84Å; L349-Y354 VanDerWaalsContact O-N 3.07Å; K350-Y354 HydrophobicContact CG-CD1 4.44Å; K350-Y354 PolarHBondContact O-N 3.38Å; Y354-P361 HydrophobicContact CD2-CB 3.52Å; Y354-P361 HydrophobicContact CE2-CB 3.62Å; Y354-P361 HydrophobicContact CG-CB 4.09Å; Y354-T365 WeakPolarHBondContact CB-OG1 3.48Å; Y354-R470 VanDerWaalsContact CE1-NH1 3.27Å
355	E	92.6	Very high	93.6	Very high	36 Å²	36	46.7 Å²	46.7	17%	0.168	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-14.5	-179	-65.9	-170.8	144.3	0	0	113.9	K350 C353 R470	K350-E355 WeakPolarHBondContact CE-OE1 3.13Å; K350-E355 HydrophobicContact CG-CG 3.93Å; K350-E355 IonicContact NZ-OE1 2.69Å; K350-E355 WeakPolarHBondContact O-CB 3.49Å; K350-E355 WeakPolarHBondContact O-CG 3.21Å; K350-E355 PolarHBondContact O-N 3.43Å; C353-E355 VanDerWaalsContact C-N 3.29Å; C353-E355 PolarHBondContact O-N 3.49Å; C353-E355 VanDerWaalsContact O-N 3.15Å; E355-R470 IonicContact OE1-CZ 3.2Å; E355-R470 IonicContact OE1-NH1 2.96Å; E355-R470 IonicContact OE1-NH2 2.65Å; E355-R470 PolarHBondContact OE1-NH2 3.35Å
356	R	91.5	Very high	93.6	Very high	78 Å²	78	47.9 Å²	47.9	29%	0.294	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-12.5	-176.8	-64.4	-173.4	-176	-93.4	-10.1	113.4	D150 R351 C353	D150-R356 IonicContact OD1-CZ 3.31Å; D150-R356 IonicContact OD1-NH1 3.08Å; D150-R356 PolarHBondContact OD1-NH1 2.79Å; D150-R356 IonicContact OD1-NH2 3.02Å; D150-R356 PolarHBondContact OD1-NH2 2.99Å; D150-R356 VanDerWaalsContact OD1-NH2 3.16Å; D150-R356 IonicContact OD2-CZ 3.44Å; D150-R356 IonicContact OD2-NH1 2.59Å; D150-R356 IonicContact OD2-NH2 2.68Å; D150-R356 PolarHBondContact OD2-NH2 3Å; R351-R356 PolarHBondContact O-NE 2.98Å; C353-R356 PolarHBondContact O-N 2.98Å
357	T	90.4	Very high	93.6	Very high	31 Å²	31	50.4 Å²	50.4	19%	0.19	26%	0.255	C	S	.	.			trans	-103.7	142.9	179.4	-168.6	0	0	0	0	112.8	C353 P361 Q364	C353-T357 WeakPolarHBondContact O-CG2 3.38Å; C353-T357 PolarHBondContact O-N 3.14Å; T357-P361 VanDerWaalsContact CG2-CA 3.46Å; T357-P361 HydrophobicContact CG2-CB 3.66Å; T357-P361 HydrophobicContact CG2-CG 3.95Å; T357-Q364 HydrophobicContact CG2-CB 4.41Å; T357-Q364 PolarHBondContact OG1-NE2 2.94Å; T357-Q364 PolarHBondContact OG1-OE1 3.5Å
358	S	85.4	Confident	93.6	Very high	93 Å²	93	48.4 Å²	48.4	65%	0.65	24%	0.244	S	C	*	.	S	Bend	trans	-95.7	-28.9	179.6	58.3	0	0	0	0	113
359	F	86.6	Confident	93.6	Very high	151 Å²	151	48.7 Å²	48.7	66%	0.662	25%	0.247	S	C	*	.	S	Bend	trans	-104.3	119.5	-173.5	-179.2	-103.9	0	0	0	111	Q364	F359-Q364 PolarHBondContact O-NE2 3.31Å
360	S	88.3	Confident	93.6	Very high	47 Å²	47	48 Å²	48	33%	0.329	24%	0.243	S	C	.	.			trans	45.6	57.5	177.5	-60.6	0	0	0	0	115.4	T362 I363 Q364	S360-T362 VanDerWaalsContact C-N 3.28Å; S360-T362 PolarHBondContact O-N 3.36Å; S360-T362 VanDerWaalsContact O-N 3.13Å; S360-I363 PolarHBondContact O-N 3.36Å; S360-Q364 PolarHBondContact O-N 3.24Å; S360-Q364 VanDerWaalsContact O-N 3.15Å
361	P	92.3	Very high	93.6	Very high	35 Å²	35	46.3 Å²	46.3	23%	0.227	24%	0.238	C	C	.	.	H	α-helix	trans	-55.3	-38.2	-172.3	-26.2	34.1	0	0	0	114.9	Y354 T357 T365	Y354-P361 HydrophobicContact CD2-CB 3.52Å; Y354-P361 HydrophobicContact CE2-CB 3.62Å; Y354-P361 HydrophobicContact CG-CB 4.09Å; T357-P361 VanDerWaalsContact CG2-CA 3.46Å; T357-P361 HydrophobicContact CG2-CB 3.66Å; T357-P361 HydrophobicContact CG2-CG 3.95Å; P361-T365 VanDerWaalsContact O-CB 3.31Å; P361-T365 WeakPolarHBondContact O-CB 3.41Å; P361-T365 PolarHBondContact O-N 3.38Å; P361-T365 PolarHBondContact O-OG1 2.88Å
362	T	91.8	Very high	93.8	Very high	19 Å²	19	44.3 Å²	44.3	12%	0.117	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-48.9	175.7	-60.8	0	0	0	0	111.4	S360 Q364 T365 F366 L391	S360-T362 VanDerWaalsContact C-N 3.28Å; S360-T362 PolarHBondContact O-N 3.36Å; S360-T362 VanDerWaalsContact O-N 3.13Å; T362-Q364 PolarHBondContact O-N 3.32Å; T362-T365 PolarHBondContact O-N 3.43Å; T362-F366 HydrophobicContact CG2-CD2 3.93Å; T362-F366 HydrophobicContact CG2-CE2 3.95Å; T362-F366 VanDerWaalsContact O-CD2 3.32Å; T362-F366 WeakPolarHBondContact O-CD2 3.33Å; T362-F366 PolarHBondContact O-N 2.78Å; T362-L391 HydrophobicContact CG2-CD2 4.49Å
363	I	93.9	Very high	93.7	Very high	69 Å²	69	45.3 Å²	45.3	35%	0.354	23%	0.234	S	C	.	.	H	α-helix	trans	-62	-49.2	-177.5	-56.6	-176.4	0	0	0	110.2	S360 T365 F366 I367 V387	S360-I363 PolarHBondContact O-N 3.36Å; I363-T365 VanDerWaalsContact C-N 3.27Å; I363-T365 PolarHBondContact O-N 2.9Å; I363-F366 PolarHBondContact O-N 2.68Å; I363-I367 HydrophobicContact CG2-CD1 3.82Å; I363-I367 HydrophobicContact CG2-CG1 4.43Å; I363-I367 WeakPolarHBondContact O-CG1 3.44Å; I363-I367 PolarHBondContact O-N 3.03Å; I363-V387 HydrophobicContact CG1-CG1 3.92Å
364	Q	95.3	Very high	93.5	Very high	69 Å²	69	44.7 Å²	44.7	32%	0.322	23%	0.23	S	C	.	.	H	α-helix	trans	-61.2	-36.7	179.3	-62.7	-167.2	21.8	0	0	112.3	T357 F359 S360 T362 I367 L368	T357-Q364 HydrophobicContact CG2-CB 4.41Å; T357-Q364 PolarHBondContact OG1-NE2 2.94Å; T357-Q364 PolarHBondContact OG1-OE1 3.5Å; F359-Q364 PolarHBondContact O-NE2 3.31Å; S360-Q364 PolarHBondContact O-N 3.24Å; S360-Q364 VanDerWaalsContact O-N 3.15Å; T362-Q364 PolarHBondContact O-N 3.32Å; Q364-I367 PolarHBondContact O-N 3.49Å; Q364-L368 WeakPolarHBondContact O-CB 3.36Å; Q364-L368 PolarHBondContact O-N 2.9Å
365	T	96.4	Very high	93.4	Very high	17 Å²	17	43.4 Å²	43.4	10%	0.104	23%	0.228	C	C	.	.	H	α-helix	trans	-65.1	-43.4	177.6	-57.6	0	0	0	0	111.8	L349 Y354 P361 T362 I363 L368 S369	L349-T365 HydrophobicContact CB-CG2 3.75Å; L349-T365 HydrophobicContact CD1-CG2 4.33Å; L349-T365 HydrophobicContact CD2-CG2 4.33Å; L349-T365 HydrophobicContact CG-CG2 4.36Å; Y354-T365 WeakPolarHBondContact CB-OG1 3.48Å; P361-T365 VanDerWaalsContact O-CB 3.31Å; P361-T365 WeakPolarHBondContact O-CB 3.41Å; P361-T365 PolarHBondContact O-N 3.38Å; P361-T365 PolarHBondContact O-OG1 2.88Å; T362-T365 PolarHBondContact O-N 3.43Å; I363-T365 VanDerWaalsContact C-N 3.27Å; I363-T365 PolarHBondContact O-N 2.9Å; T365-L368 PolarHBondContact O-N 3.32Å; T365-S369 WeakPolarHBondContact O-CB 2.93Å; T365-S369 PolarHBondContact O-N 2.9Å
366	F	96.4	Very high	93.3	Very high	31 Å²	31	41.8 Å²	41.8	14%	0.136	22%	0.22	C	C	.	.	H	α-helix	trans	-70.3	-36	178	-86.9	-95.8	0	0	0	112.2	L338 T362 I363 S369 A370 F383 V387 T390	L338-F366 HydrophobicContact CD1-CZ 3.87Å; T362-F366 HydrophobicContact CG2-CD2 3.93Å; T362-F366 HydrophobicContact CG2-CE2 3.95Å; T362-F366 VanDerWaalsContact O-CD2 3.32Å; T362-F366 WeakPolarHBondContact O-CD2 3.33Å; T362-F366 PolarHBondContact O-N 2.78Å; I363-F366 PolarHBondContact O-N 2.68Å; F366-S369 WeakPolarHBondContact O-CB 3.42Å; F366-S369 PolarHBondContact O-N 3.13Å; F366-A370 PolarHBondContact O-N 3.33Å; F366-F383 HydrophobicContact CB-CB 4.31Å; F366-F383 HydrophobicContact CD1-CB 4.06Å; F366-F383 AromaticContact CD1-CD1 3.8Å; F366-F383 HydrophobicContact CD1-CD1 3.8Å; F366-F383 HydrophobicContact CD1-CG 4.43Å; F366-F383 WeakPolarHBondContact CD1-O 3.29Å; F366-F383 HydrophobicContact CE1-CD1 4.36Å; F366-F383 WeakPolarHBondContact O-CB 3.34Å; F366-V387 HydrophobicContact CB-CG2 3.4Å; F366-V387 HydrophobicContact CD1-CG2 4.2Å; F366-V387 HydrophobicContact CD2-CG2 3.88Å; F366-V387 HydrophobicContact CG-CG2 3.57Å; F366-T390 WeakPolarHBondContact CZ-OG1 3.34Å
367	I	96.2	Very high	93.4	Very high	91 Å²	91	40 Å²	40	47%	0.467	22%	0.218	S	C	.	.	H	α-helix	trans	-62.9	-47.3	172.5	-68.8	170.5	0	0	0	110.5	I363 Q364 S369 A370 I371	I363-I367 HydrophobicContact CG2-CD1 3.82Å; I363-I367 HydrophobicContact CG2-CG1 4.43Å; I363-I367 WeakPolarHBondContact O-CG1 3.44Å; I363-I367 PolarHBondContact O-N 3.03Å; Q364-I367 PolarHBondContact O-N 3.49Å; I367-S369 VanDerWaalsContact C-N 3.26Å; I367-S369 PolarHBondContact O-N 3.29Å; I367-A370 WeakPolarHBondContact O-CB 3.16Å; I367-A370 PolarHBondContact O-N 3.44Å; I367-A370 VanDerWaalsContact O-N 3.09Å; I367-I371 HydrophobicContact CG2-CD1 3.9Å; I367-I371 WeakPolarHBondContact O-CG1 3.47Å; I367-I371 PolarHBondContact O-N 3.21Å
368	L	97.4	Very high	93.7	Very high	12 Å²	12	38.5 Å²	38.5	6%	0.063	21%	0.209	C	C	.	.	H	α-helix	trans	-58	-42.8	175.4	174.8	57.7	0	0	0	111.3	F103 L107 W348 L349 V352 C353 Q364 T365 A370 I371 W372	F103-L368 HydrophobicContact CE1-CD1 4.13Å; F103-L368 HydrophobicContact CE2-CD1 4.39Å; F103-L368 HydrophobicContact CE2-CD2 4.16Å; F103-L368 HydrophobicContact CZ-CD1 3.47Å; F103-L368 VanDerWaalsContact CZ-CD1 3.47Å; F103-L368 HydrophobicContact CZ-CD2 3.74Å; F103-L368 HydrophobicContact CZ-CG 4.25Å; L107-L368 HydrophobicContact CD1-CD1 4.41Å; L107-L368 HydrophobicContact CD2-CD1 3.61Å; W348-L368 HydrophobicContact CH2-CG 4.38Å; L349-L368 HydrophobicContact CD2-CB 4.27Å; L349-L368 HydrophobicContact CD2-CD2 3.81Å; L349-L368 HydrophobicContact CD2-CG 3.82Å; V352-L368 HydrophobicContact CG2-CD2 4.08Å; C353-L368 HydrophobicContact CB-CD2 3.51Å; Q364-L368 WeakPolarHBondContact O-CB 3.36Å; Q364-L368 PolarHBondContact O-N 2.9Å; T365-L368 PolarHBondContact O-N 3.32Å; L368-A370 VanDerWaalsContact C-N 3.33Å; L368-A370 PolarHBondContact O-N 3.07Å; L368-I371 PolarHBondContact O-N 3.46Å; L368-W372 WeakPolarHBondContact O-CB 3.36Å; L368-W372 PolarHBondContact O-N 2.7Å
369	S	97.4	Very high	94.2	Very high	8 Å²	8	35 Å²	35	6%	0.056	18%	0.182	C	C	.	.	H	α-helix	trans	-59	-43.7	175	-171.7	0	0	0	0	111.6	T365 F366 I367 W372 H373 F383	T365-S369 WeakPolarHBondContact O-CB 2.93Å; T365-S369 PolarHBondContact O-N 2.9Å; F366-S369 WeakPolarHBondContact O-CB 3.42Å; F366-S369 PolarHBondContact O-N 3.13Å; I367-S369 VanDerWaalsContact C-N 3.26Å; I367-S369 PolarHBondContact O-N 3.29Å; S369-W372 PolarHBondContact O-N 2.85Å; S369-H373 PolarHBondContact O-N 3.29Å; S369-H373 VanDerWaalsContact O-N 3.09Å; S369-H373 PolarHBondContact O-ND1 3.22Å; S369-H373 PolarHBondContact OG-CE1 3.35Å; S369-F383 WeakPolarHBondContact OG-CE1 3.34Å; S369-F383 VanDerWaalsContact OG-CZ 3.27Å; S369-F383 WeakPolarHBondContact OG-CZ 3.37Å
370	A	97	Very high	94.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-49.8	176.5	0	0	0	0	0	112.4	F366 I367 L368 W372 H373 G374 Y380 F383	F366-A370 PolarHBondContact O-N 3.33Å; I367-A370 WeakPolarHBondContact O-CB 3.16Å; I367-A370 PolarHBondContact O-N 3.44Å; I367-A370 VanDerWaalsContact O-N 3.09Å; L368-A370 VanDerWaalsContact C-N 3.33Å; L368-A370 PolarHBondContact O-N 3.07Å; A370-W372 VanDerWaalsContact C-N 3.29Å; A370-W372 PolarHBondContact O-N 2.99Å; A370-H373 PolarHBondContact O-N 2.88Å; A370-G374 PolarHBondContact O-N 2.92Å; A370-Y380 HydrophobicContact CB-CD1 3.87Å; A370-Y380 HydrophobicContact CB-CE1 4.05Å; A370-Y380 HydrophobicContact CB-CG 4.24Å; A370-F383 HydrophobicContact CB-CB 4.06Å; A370-F383 HydrophobicContact CB-CD2 3.53Å; A370-F383 HydrophobicContact CB-CE2 4.41Å; A370-F383 HydrophobicContact CB-CG 4.08Å
371	I	96.6	Very high	95.1	Very high	50 Å²	50	31.5 Å²	31.5	26%	0.256	16%	0.16	S	C	.	.	H	α-helix	trans	-60.2	-41.6	179.5	-64	167.7	0	0	0	110.8	L107 I367 L368 H373 G374 Y380	L107-I371 HydrophobicContact CD1-CG2 4.13Å; L107-I371 HydrophobicContact CD2-CG2 3.84Å; L107-I371 HydrophobicContact CG-CG2 3.94Å; I367-I371 HydrophobicContact CG2-CD1 3.9Å; I367-I371 WeakPolarHBondContact O-CG1 3.47Å; I367-I371 PolarHBondContact O-N 3.21Å; L368-I371 PolarHBondContact O-N 3.46Å; I371-H373 PolarHBondContact O-N 3.38Å; I371-G374 PolarHBondContact O-N 3.05Å; I371-Y380 HydrophobicContact CG1-CE1 4.33Å
372	W	97.2	Very high	95.4	Very high	8 Å²	8	30.3 Å²	30.3	3%	0.03	15%	0.152	C	C	.	.	H	α-helix	trans	-64.3	-38.8	178.7	176.2	74.6	0	0	0	112.9	L107 Q114 M135 Q139 T345 W348 L368 S369 A370 G374	L107-W372 HydrophobicContact CD1-CB 4.36Å; Q114-W372 PolarHBondContact NE2-O 2.84Å; M135-W372 HydrophobicContact CB-CZ2 3.68Å; M135-W372 HydrophobicContact CE-CD2 3.5Å; M135-W372 VanDerWaalsContact CE-CE2 3.49Å; M135-W372 HydrophobicContact CE-CE3 3.45Å; M135-W372 VanDerWaalsContact CE-CE3 3.45Å; M135-W372 HydrophobicContact CE-CG 4.32Å; M135-W372 HydrophobicContact CE-CH2 3.42Å; M135-W372 VanDerWaalsContact CE-CH2 3.42Å; M135-W372 HydrophobicContact CE-CZ2 3.48Å; M135-W372 VanDerWaalsContact CE-CZ2 3.48Å; M135-W372 HydrophobicContact CE-CZ3 3.4Å; M135-W372 WeakPolarHBondContact CE-O 3.28Å; M135-W372 HydrophobicContact CG-CZ2 4.44Å; M135-W372 PolarHBondContact O-NE1 3.02Å; Q139-W372 VanDerWaalsContact CD-CZ2 3.46Å; Q139-W372 HydrophobicContact CG-CZ2 4.14Å; T345-W372 HydrophobicContact CG2-CE3 4.31Å; T345-W372 HydrophobicContact CG2-CH2 3.83Å; T345-W372 HydrophobicContact CG2-CZ2 4.44Å; T345-W372 HydrophobicContact CG2-CZ3 3.75Å; W348-W372 HydrophobicContact CH2-CB 3.89Å; W348-W372 AromaticContact CH2-CD1 3.5Å; W348-W372 HydrophobicContact CH2-CD2 4.16Å; W348-W372 AromaticContact CH2-CG 3.57Å; W348-W372 HydrophobicContact CH2-CG 3.57Å; W348-W372 HydrophobicContact CZ3-CB 4.24Å; W348-W372 AromaticContact CZ3-CD1 3.96Å; W348-W372 AromaticContact CZ3-CD2 3.86Å; W348-W372 HydrophobicContact CZ3-CD2 3.86Å; W348-W372 HydrophobicContact CZ3-CE3 4.42Å; W348-W372 AromaticContact CZ3-CG 3.76Å; W348-W372 HydrophobicContact CZ3-CG 3.76Å; L368-W372 WeakPolarHBondContact O-CB 3.36Å; L368-W372 PolarHBondContact O-N 2.7Å; S369-W372 PolarHBondContact O-N 2.85Å; A370-W372 VanDerWaalsContact C-N 3.29Å; A370-W372 PolarHBondContact O-N 2.99Å; W372-G374 VanDerWaalsContact C-N 3.34Å
373	H	94.4	Very high	95.7	Very high	34 Å²	34	30.7 Å²	30.7	16%	0.157	15%	0.152	C	C	.	.	H	α-helix	trans	-69.6	-32.8	175.1	-72.8	86.4	0	0	0	112.4	Q114 S369 A370 I371 Y379 F383 F433	Q114-H373 PolarHBondContact NE2-O 3.49Å; S369-H373 PolarHBondContact O-N 3.29Å; S369-H373 VanDerWaalsContact O-N 3.09Å; S369-H373 PolarHBondContact O-ND1 3.22Å; S369-H373 PolarHBondContact OG-CE1 3.35Å; A370-H373 PolarHBondContact O-N 2.88Å; I371-H373 PolarHBondContact O-N 3.38Å; H373-Y379 HydrophobicContact CB-CD1 4.31Å; H373-Y379 HydrophobicContact CB-CD2 3.72Å; H373-Y379 HydrophobicContact CB-CE2 4Å; H373-Y379 HydrophobicContact CB-CG 3.89Å; H373-Y379 WeakPolarHBondContact O-CE2 3.49Å; H373-F383 HydrophobicContact CB-CE2 4.26Å; H373-F383 AromaticContact CE1-CE2 3.95Å; H373-F383 AromaticContact CE1-CZ 3.27Å; H373-F383 WeakPolarHBondContact CE1-CZ 3.3Å; H373-F383 AromaticContact CG-CE2 3.88Å; H373-F383 AromaticContact CG-CZ 3.94Å; H373-F383 AromaticContact ND1-CE2 3.42Å; H373-F383 WeakPolarHBondContact ND1-CE2 3.32Å; H373-F383 AromaticContact ND1-CZ 3.22Å; H373-F383 WeakPolarHBondContact ND1-CZ 3.42Å; H373-F383 AromaticContact NE2-CZ 3.96Å; H373-F433 HydrophobicContact CB-CE2 4.41Å; H373-F433 AromaticContact CD2-CE2 3.44Å; H373-F433 VanDerWaalsContact CD2-CE2 3.44Å; H373-F433 WeakPolarHBondContact CD2-CE2 3.26Å; H373-F433 AromaticContact CD2-CZ 3.5Å; H373-F433 VanDerWaalsContact CD2-CZ 3.5Å; H373-F433 WeakPolarHBondContact CD2-CZ 3.3Å; H373-F433 AromaticContact CG-CE2 3.91Å; H373-F433 AromaticContact NE2-CE2 3.86Å; H373-F433 AromaticContact NE2-CZ 3.96Å
374	G	92.6	Very high	95.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.165	C	C	.	.			trans	133.4	-154.7	165.1	0	0	0	0	0	114.5	A370 I371 W372 Y380	A370-G374 PolarHBondContact O-N 2.92Å; I371-G374 PolarHBondContact O-N 3.05Å; W372-G374 VanDerWaalsContact C-N 3.34Å; G374-Y380 VanDerWaalsContact O-CE2 3.23Å; G374-Y380 WeakPolarHBondContact O-CE2 3.31Å; G374-Y380 PolarHBondContact O-OH 2.92Å
375	V	91.8	Very high	95.9	Very high	32 Å²	32	30.1 Å²	30.1	19%	0.194	15%	0.152	C	C	.	.	S	Bend	trans	-96.8	-0.3	-167.1	-59.7	0	0	0	0	114.8	T111 V115 V118 P377	T111-V375 HydrophobicContact CG2-CG1 3.97Å; V115-V375 HydrophobicContact CG2-CB 4.34Å; V115-V375 HydrophobicContact CG2-CG1 3.57Å; V115-V375 HydrophobicContact CG2-CG2 4.12Å; V118-V375 HydrophobicContact CB-CG2 4.17Å; V118-V375 HydrophobicContact CG1-CG2 4.49Å; V118-V375 HydrophobicContact CG2-CG2 3.85Å; V375-P377 WeakPolarHBondContact O-CD 3.46Å
376	Y	91.3	Very high	95.9	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.008	15%	0.147	C	C	.	.			trans	-66.3	127.7	175.4	-76	-63.3	0	0	0	110.8	V118 Y123 G124 G378 Y379 Y380 L436	V118-Y376 HydrophobicContact CG1-CD1 4.48Å; V118-Y376 HydrophobicContact CG1-CE1 3.88Å; V118-Y376 HydrophobicContact CG2-CD2 4.32Å; V118-Y376 HydrophobicContact CG2-CE1 3.98Å; V118-Y376 HydrophobicContact CG2-CE2 3.79Å; Y123-Y376 HydrophobicContact CD2-CD1 4.46Å; Y123-Y376 AromaticContact CD2-CE1 3.75Å; Y123-Y376 HydrophobicContact CD2-CE1 3.75Å; Y123-Y376 HydrophobicContact CE1-CE1 4.47Å; Y123-Y376 AromaticContact CE2-CD1 3.88Å; Y123-Y376 HydrophobicContact CE2-CD1 3.88Å; Y123-Y376 AromaticContact CE2-CE1 3.6Å; Y123-Y376 HydrophobicContact CE2-CE1 3.6Å; Y123-Y376 HydrophobicContact CG-CE1 4.25Å; Y123-Y376 AromaticContact CZ-CE1 3.98Å; G124-Y376 PolarHBondContact N-OH 3.26Å; Y376-G378 PolarHBondContact O-N 3.04Å; Y376-G378 VanDerWaalsContact O-N 3.13Å; Y376-Y379 AromaticContact CD2-CE2 3.77Å; Y376-Y379 HydrophobicContact CD2-CE2 3.77Å; Y376-Y379 AromaticContact CD2-CZ 3.95Å; Y376-Y379 HydrophobicContact CG-CE2 4.29Å; Y376-Y379 WeakPolarHBondContact O-CB 3.41Å; Y376-Y379 PolarHBondContact O-N 2.98Å; Y376-Y380 WeakPolarHBondContact O-CD2 3.42Å; Y376-L436 HydrophobicContact CD1-CB 3.96Å; Y376-L436 HydrophobicContact CD2-CD1 4.25Å; Y376-L436 HydrophobicContact CD2-CD2 3.89Å; Y376-L436 HydrophobicContact CD2-CG 4.46Å; Y376-L436 HydrophobicContact CE1-CB 4.48Å; Y376-L436 HydrophobicContact CE1-CD1 4.49Å; Y376-L436 HydrophobicContact CE2-CD1 4.08Å; Y376-L436 HydrophobicContact CE2-CD2 4.49Å; Y376-L436 HydrophobicContact CG-CB 4.01Å; Y376-L436 HydrophobicContact CG-CD1 4.5Å; Y376-L436 HydrophobicContact CG-CD2 4.03Å; Y376-L436 HydrophobicContact CG-CG 4.41Å
377	P	93.9	Very high	95.9	Very high	39 Å²	39	28.5 Å²	28.5	25%	0.253	14%	0.144	S	C	.	.	H	α-helix	trans	-56.9	-31.2	-178.8	-28.6	35.8	0	0	0	114.4	V375 Y379 Y380 L381 L436 I438	V375-P377 WeakPolarHBondContact O-CD 3.46Å; P377-Y379 PolarHBondContact O-N 3.49Å; P377-Y380 PolarHBondContact O-N 3.02Å; P377-Y380 VanDerWaalsContact O-N 3.15Å; P377-L381 PolarHBondContact O-N 3.33Å; P377-L381 VanDerWaalsContact O-N 3.13Å; P377-L436 WeakPolarHBondContact CD-O 3.36Å; P377-I438 HydrophobicContact CB-CD1 3.89Å; P377-I438 HydrophobicContact CB-CG1 3.27Å; P377-I438 HydrophobicContact CG-CD1 4.02Å; P377-I438 HydrophobicContact CG-CG1 3.72Å
378	G	95.3	Very high	95.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-55.7	-35.6	176.2	0	0	0	0	0	113.6	Y376 L381 T382 P432 L436	Y376-G378 PolarHBondContact O-N 3.04Å; Y376-G378 VanDerWaalsContact O-N 3.13Å; G378-L381 PolarHBondContact O-N 3Å; G378-T382 WeakPolarHBondContact O-CB 3.44Å; G378-T382 PolarHBondContact O-N 3.05Å; G378-T382 PolarHBondContact O-OG1 3.45Å; G378-P432 WeakPolarHBondContact CA-O 3.47Å; G378-P432 WeakPolarHBondContact O-CB 3.42Å; G378-L436 PolarHBondContact N-O 3.24Å
379	Y	95.9	Very high	95.9	Very high	21 Å²	21	25.5 Å²	25.5	8%	0.082	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-49.5	176	-59.2	-29.9	0	0	0	111.2	H373 Y376 P377 L381 T382 F383 F433 L436	H373-Y379 HydrophobicContact CB-CD1 4.31Å; H373-Y379 HydrophobicContact CB-CD2 3.72Å; H373-Y379 HydrophobicContact CB-CE2 4Å; H373-Y379 HydrophobicContact CB-CG 3.89Å; H373-Y379 WeakPolarHBondContact O-CE2 3.49Å; Y376-Y379 AromaticContact CD2-CE2 3.77Å; Y376-Y379 HydrophobicContact CD2-CE2 3.77Å; Y376-Y379 AromaticContact CD2-CZ 3.95Å; Y376-Y379 HydrophobicContact CG-CE2 4.29Å; Y376-Y379 WeakPolarHBondContact O-CB 3.41Å; Y376-Y379 PolarHBondContact O-N 2.98Å; P377-Y379 PolarHBondContact O-N 3.49Å; Y379-L381 VanDerWaalsContact C-N 3.33Å; Y379-L381 PolarHBondContact O-N 3.34Å; Y379-T382 PolarHBondContact O-N 2.77Å; Y379-F383 WeakPolarHBondContact O-CD2 3.29Å; Y379-F383 PolarHBondContact O-N 2.7Å; Y379-F433 AromaticContact CD1-CD2 3.41Å; Y379-F433 HydrophobicContact CD1-CD2 3.41Å; Y379-F433 VanDerWaalsContact CD1-CD2 3.41Å; Y379-F433 AromaticContact CD1-CE2 3.5Å; Y379-F433 HydrophobicContact CD1-CE2 3.5Å; Y379-F433 AromaticContact CD1-CG 3.98Å; Y379-F433 HydrophobicContact CD1-CG 3.98Å; Y379-F433 HydrophobicContact CD1-CZ 4.15Å; Y379-F433 HydrophobicContact CE1-CD1 4.28Å; Y379-F433 AromaticContact CE1-CD2 3.84Å; Y379-F433 HydrophobicContact CE1-CD2 3.84Å; Y379-F433 HydrophobicContact CE1-CE1 4.13Å; Y379-F433 AromaticContact CE1-CE2 3.67Å; Y379-F433 HydrophobicContact CE1-CE2 3.67Å; Y379-F433 HydrophobicContact CE1-CG 4.12Å; Y379-F433 AromaticContact CE1-CZ 3.82Å; Y379-F433 HydrophobicContact CE1-CZ 3.82Å; Y379-F433 HydrophobicContact CG-CD2 4.47Å; Y379-F433 HydrophobicContact CG-CE2 4.45Å; Y379-L436 HydrophobicContact CD1-CD2 4.35Å; Y379-L436 HydrophobicContact CE1-CD2 3.5Å; Y379-L436 WeakPolarHBondContact OH-CD2 3.37Å
380	Y	97.3	Very high	95.7	Very high	93 Å²	93	25.6 Å²	25.6	37%	0.365	13%	0.129	S	C	.	.	H	α-helix	trans	-60.9	-42.2	-179.8	-63.1	-94.6	0	0	0	111.9	A370 I371 G374 Y376 P377 F383 L384	A370-Y380 HydrophobicContact CB-CD1 3.87Å; A370-Y380 HydrophobicContact CB-CE1 4.05Å; A370-Y380 HydrophobicContact CB-CG 4.24Å; I371-Y380 HydrophobicContact CG1-CE1 4.33Å; G374-Y380 VanDerWaalsContact O-CE2 3.23Å; G374-Y380 WeakPolarHBondContact O-CE2 3.31Å; G374-Y380 PolarHBondContact O-OH 2.92Å; Y376-Y380 WeakPolarHBondContact O-CD2 3.42Å; P377-Y380 PolarHBondContact O-N 3.02Å; P377-Y380 VanDerWaalsContact O-N 3.15Å; Y380-F383 PolarHBondContact O-N 2.79Å; Y380-L384 VanDerWaalsContact O-CB 3.23Å; Y380-L384 WeakPolarHBondContact O-CB 3.32Å; Y380-L384 PolarHBondContact O-N 3.34Å
381	L	97.7	Very high	95.6	Very high	31 Å²	31	27.7 Å²	27.7	16%	0.162	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-44.5	175.7	-66.8	177.1	0	0	0	112	P377 G378 Y379 T385 P432 S441 F442	P377-L381 PolarHBondContact O-N 3.33Å; P377-L381 VanDerWaalsContact O-N 3.13Å; G378-L381 PolarHBondContact O-N 3Å; Y379-L381 VanDerWaalsContact C-N 3.33Å; Y379-L381 PolarHBondContact O-N 3.34Å; L381-T385 VanDerWaalsContact O-CB 3.28Å; L381-T385 WeakPolarHBondContact O-CB 3.38Å; L381-T385 PolarHBondContact O-N 2.99Å; L381-T385 PolarHBondContact O-OG1 3.44Å; L381-P432 HydrophobicContact CB-CB 3.86Å; L381-P432 HydrophobicContact CB-CG 4.18Å; L381-P432 HydrophobicContact CD1-CB 4.47Å; L381-S441 VanDerWaalsContact CD1-CB 3.45Å; L381-F442 HydrophobicContact CD1-CD2 4.48Å; L381-F442 HydrophobicContact CD1-CE2 4.18Å; L381-F442 HydrophobicContact CD2-CE2 4.14Å; L381-F442 HydrophobicContact CD2-CZ 4.18Å
382	T	97.8	Very high	95.5	Very high	9 Å²	9	25.7 Å²	25.7	6%	0.055	13%	0.131	C	C	.	.	H	α-helix	trans	-63	-48.6	176.7	-77.7	0	0	0	0	112	G378 Y379 T385 G386 T429 F433	G378-T382 WeakPolarHBondContact O-CB 3.44Å; G378-T382 PolarHBondContact O-N 3.05Å; G378-T382 PolarHBondContact O-OG1 3.45Å; Y379-T382 PolarHBondContact O-N 2.77Å; T382-T385 PolarHBondContact O-N 3.4Å; T382-G386 PolarHBondContact O-N 3.07Å; T382-T429 WeakPolarHBondContact CA-O 3.23Å; T382-T429 WeakPolarHBondContact CB-O 3.49Å; T382-T429 HydrophobicContact CG2-CG2 4.24Å; T382-T429 WeakPolarHBondContact CG2-O 3.22Å; T382-T429 WeakPolarHBondContact O-CG2 3.37Å; T382-T429 PolarHBondContact OG1-O 2.99Å; T382-F433 HydrophobicContact CG2-CB 4.02Å; T382-F433 HydrophobicContact CG2-CD2 4.25Å; T382-F433 WeakPolarHBondContact OG1-CB 3.46Å; T382-F433 PolarHBondContact OG1-N 3.46Å
383	F	97.4	Very high	95.4	Very high	27 Å²	27	26.8 Å²	26.8	12%	0.118	14%	0.142	C	C	.	.	H	α-helix	trans	-71	-35.8	-177	-70.3	-67.8	0	0	0	112.3	F366 S369 A370 H373 Y379 Y380 G386 V387 F433	F366-F383 HydrophobicContact CB-CB 4.31Å; F366-F383 HydrophobicContact CD1-CB 4.06Å; F366-F383 AromaticContact CD1-CD1 3.8Å; F366-F383 HydrophobicContact CD1-CD1 3.8Å; F366-F383 HydrophobicContact CD1-CG 4.43Å; F366-F383 WeakPolarHBondContact CD1-O 3.29Å; F366-F383 HydrophobicContact CE1-CD1 4.36Å; F366-F383 WeakPolarHBondContact O-CB 3.34Å; S369-F383 WeakPolarHBondContact OG-CE1 3.34Å; S369-F383 VanDerWaalsContact OG-CZ 3.27Å; S369-F383 WeakPolarHBondContact OG-CZ 3.37Å; A370-F383 HydrophobicContact CB-CB 4.06Å; A370-F383 HydrophobicContact CB-CD2 3.53Å; A370-F383 HydrophobicContact CB-CE2 4.41Å; A370-F383 HydrophobicContact CB-CG 4.08Å; H373-F383 HydrophobicContact CB-CE2 4.26Å; H373-F383 AromaticContact CE1-CE2 3.95Å; H373-F383 AromaticContact CE1-CZ 3.27Å; H373-F383 WeakPolarHBondContact CE1-CZ 3.3Å; H373-F383 AromaticContact CG-CE2 3.88Å; H373-F383 AromaticContact CG-CZ 3.94Å; H373-F383 AromaticContact ND1-CE2 3.42Å; H373-F383 WeakPolarHBondContact ND1-CE2 3.32Å; H373-F383 AromaticContact ND1-CZ 3.22Å; H373-F383 WeakPolarHBondContact ND1-CZ 3.42Å; H373-F383 AromaticContact NE2-CZ 3.96Å; Y379-F383 WeakPolarHBondContact O-CD2 3.29Å; Y379-F383 PolarHBondContact O-N 2.7Å; Y380-F383 PolarHBondContact O-N 2.79Å; F383-G386 WeakPolarHBondContact O-CA 3.42Å; F383-G386 PolarHBondContact O-N 3.48Å; F383-V387 PolarHBondContact O-N 2.91Å; F383-F433 HydrophobicContact CE2-CD2 4.27Å; F383-F433 HydrophobicContact CE2-CE2 4.14Å; F383-F433 HydrophobicContact CZ-CD2 4.39Å; F383-F433 HydrophobicContact CZ-CE2 4.1Å
384	L	96.5	Very high	95.3	Very high	119 Å²	119	28.5 Å²	28.5	62%	0.623	15%	0.147	S	C	*	.	H	α-helix	trans	-64.5	-43.8	173	-178	60.8	0	0	0	111.6	Y380 G386 V387 L388	Y380-L384 VanDerWaalsContact O-CB 3.23Å; Y380-L384 WeakPolarHBondContact O-CB 3.32Å; Y380-L384 PolarHBondContact O-N 3.34Å; L384-G386 VanDerWaalsContact C-N 3.27Å; L384-G386 PolarHBondContact O-N 3.18Å; L384-V387 WeakPolarHBondContact O-CB 3.26Å; L384-V387 PolarHBondContact O-N 2.81Å; L384-L388 PolarHBondContact O-N 2.84Å
385	T	97.6	Very high	95.4	Very high	7 Å²	7	28.6 Å²	28.6	4%	0.043	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-40.1	172.4	-60.2	0	0	0	0	110.6	L381 T382 V387 L388 M389 T429 Y445 H453	L381-T385 VanDerWaalsContact O-CB 3.28Å; L381-T385 WeakPolarHBondContact O-CB 3.38Å; L381-T385 PolarHBondContact O-N 2.99Å; L381-T385 PolarHBondContact O-OG1 3.44Å; T382-T385 PolarHBondContact O-N 3.4Å; T385-V387 VanDerWaalsContact C-N 3.32Å; T385-V387 PolarHBondContact O-N 2.84Å; T385-L388 WeakPolarHBondContact O-CB 3.27Å; T385-L388 PolarHBondContact O-N 2.78Å; T385-L388 VanDerWaalsContact O-N 3.14Å; T385-M389 HydrophobicContact CG2-CE 3.74Å; T385-M389 HydrophobicContact CG2-CG 4.12Å; T385-M389 WeakPolarHBondContact O-CG 3.43Å; T385-M389 PolarHBondContact O-N 3.44Å; T385-T429 HydrophobicContact CG2-CG2 4Å; T385-Y445 PolarHBondContact OG1-OH 2.98Å; T385-Y445 VanDerWaalsContact OG1-OH 3.05Å; T385-H453 PolarHBondContact OG1-NE2 2.95Å
386	G	96.8	Very high	95.5	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-36	175.6	0	0	0	0	0	113.9	T382 F383 L384 T390	T382-G386 PolarHBondContact O-N 3.07Å; F383-G386 WeakPolarHBondContact O-CA 3.42Å; F383-G386 PolarHBondContact O-N 3.48Å; L384-G386 VanDerWaalsContact C-N 3.27Å; L384-G386 PolarHBondContact O-N 3.18Å; G386-T390 WeakPolarHBondContact O-CB 3.44Å; G386-T390 PolarHBondContact O-N 3.24Å; G386-T390 PolarHBondContact O-OG1 3.36Å
387	V	95.6	Very high	95.6	Very high	13 Å²	13	33.9 Å²	33.9	8%	0.079	17%	0.169	C	C	.	.	H	α-helix	trans	-58.9	-54	171.3	171.5	0	0	0	0	110.1	I363 F366 F383 L384 T385 M389 T390 L391	I363-V387 HydrophobicContact CG1-CG1 3.92Å; F366-V387 HydrophobicContact CB-CG2 3.4Å; F366-V387 HydrophobicContact CD1-CG2 4.2Å; F366-V387 HydrophobicContact CD2-CG2 3.88Å; F366-V387 HydrophobicContact CG-CG2 3.57Å; F383-V387 PolarHBondContact O-N 2.91Å; L384-V387 WeakPolarHBondContact O-CB 3.26Å; L384-V387 PolarHBondContact O-N 2.81Å; T385-V387 VanDerWaalsContact C-N 3.32Å; T385-V387 PolarHBondContact O-N 2.84Å; V387-M389 PolarHBondContact O-N 3.23Å; V387-T390 PolarHBondContact O-N 3.26Å; V387-L391 HydrophobicContact CG1-CD1 3.96Å; V387-L391 WeakPolarHBondContact O-CG 3.35Å; V387-L391 PolarHBondContact O-N 3.04Å
388	L	96.4	Very high	95.5	Very high	27 Å²	27	35.8 Å²	35.8	14%	0.141	18%	0.177	C	C	.	.	H	α-helix	trans	-58.5	-51.2	-178.4	177.8	62.1	0	0	0	111	L384 T385 T390 L391 A392 H453 I457 L460	L384-L388 PolarHBondContact O-N 2.84Å; T385-L388 WeakPolarHBondContact O-CB 3.27Å; T385-L388 PolarHBondContact O-N 2.78Å; T385-L388 VanDerWaalsContact O-N 3.14Å; L388-T390 VanDerWaalsContact C-N 3.34Å; L388-T390 PolarHBondContact O-N 2.71Å; L388-L391 PolarHBondContact O-N 3.02Å; L388-A392 VanDerWaalsContact O-CB 3.3Å; L388-A392 WeakPolarHBondContact O-CB 3.26Å; L388-A392 PolarHBondContact O-N 3.23Å; L388-H453 HydrophobicContact CD2-CB 4.08Å; L388-I457 HydrophobicContact CD1-CG1 4.01Å; L388-I457 HydrophobicContact CD2-CG1 4.16Å; L388-L460 HydrophobicContact CD1-CD1 3.64Å
389	M	96.6	Very high	95.5	Very high	13 Å²	13	37.6 Å²	37.6	6%	0.064	19%	0.186	C	C	.	.	H	α-helix	trans	-62.8	-39.6	-179.7	-62.6	-51.5	156.5	0	0	112.2	F334 T385 V387 A393 Y428 T429 L452	F334-M389 HydrophobicContact CD1-CB 4.42Å; F334-M389 HydrophobicContact CD2-CB 4.03Å; F334-M389 HydrophobicContact CE1-CB 4.14Å; F334-M389 HydrophobicContact CE2-CB 3.74Å; F334-M389 HydrophobicContact CE2-CG 4.34Å; F334-M389 HydrophobicContact CG-CB 4.37Å; F334-M389 HydrophobicContact CZ-CB 3.81Å; T385-M389 HydrophobicContact CG2-CE 3.74Å; T385-M389 HydrophobicContact CG2-CG 4.12Å; T385-M389 WeakPolarHBondContact O-CG 3.43Å; T385-M389 PolarHBondContact O-N 3.44Å; V387-M389 PolarHBondContact O-N 3.23Å; M389-A393 WeakPolarHBondContact O-CB 3.34Å; M389-A393 PolarHBondContact O-N 2.7Å; M389-Y428 HydrophobicContact CE-CD1 4.39Å; M389-Y428 HydrophobicContact CE-CE1 4.4Å; M389-T429 WeakPolarHBondContact CG-OG1 3.36Å; M389-L452 HydrophobicContact CE-CB 3.68Å; M389-L452 WeakPolarHBondContact CE-O 3.39Å; M389-L452 HydrophobicContact SD-CB 4.36Å
390	T	94.6	Very high	95.3	Very high	11 Å²	11	40.2 Å²	40.2	7%	0.067	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-44.5	178.1	-63.3	0	0	0	0	111.6	F334 F366 G386 V387 L388 R394	F334-T390 WeakPolarHBondContact CD1-OG1 3.39Å; F334-T390 WeakPolarHBondContact CE1-OG1 3.42Å; F366-T390 WeakPolarHBondContact CZ-OG1 3.34Å; G386-T390 WeakPolarHBondContact O-CB 3.44Å; G386-T390 PolarHBondContact O-N 3.24Å; G386-T390 PolarHBondContact O-OG1 3.36Å; V387-T390 PolarHBondContact O-N 3.26Å; L388-T390 VanDerWaalsContact C-N 3.34Å; L388-T390 PolarHBondContact O-N 2.71Å; T390-R394 WeakPolarHBondContact O-CB 3.33Å; T390-R394 PolarHBondContact O-N 2.84Å; T390-R394 VanDerWaalsContact O-N 3.15Å
391	L	93.7	Very high	95.1	Very high	44 Å²	44	40 Å²	40	23%	0.23	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-45.9	179.8	-66.3	176.7	0	0	0	110.9	T362 V387 L388 R394 A395 L460	T362-L391 HydrophobicContact CG2-CD2 4.49Å; V387-L391 HydrophobicContact CG1-CD1 3.96Å; V387-L391 WeakPolarHBondContact O-CG 3.35Å; V387-L391 PolarHBondContact O-N 3.04Å; L388-L391 PolarHBondContact O-N 3.02Å; L391-R394 PolarHBondContact O-N 3.5Å; L391-A395 PolarHBondContact O-N 3.44Å; L391-L460 HydrophobicContact CB-CD1 4.03Å; L391-L460 HydrophobicContact CB-CD2 3.85Å
392	A	95.5	Very high	94.9	Very high	8 Å²	8	43.2 Å²	43.2	7%	0.066	21%	0.211	C	C	.	.	H	α-helix	trans	-63.1	-47.4	178.8	0	0	0	0	0	111.6	L388 R394 A395 M396 V459 L460	L388-A392 VanDerWaalsContact O-CB 3.3Å; L388-A392 WeakPolarHBondContact O-CB 3.26Å; L388-A392 PolarHBondContact O-N 3.23Å; A392-R394 VanDerWaalsContact C-N 3.26Å; A392-R394 PolarHBondContact O-N 2.87Å; A392-A395 PolarHBondContact O-N 3.48Å; A392-A395 VanDerWaalsContact O-N 3.14Å; A392-M396 WeakPolarHBondContact O-CG 3.25Å; A392-M396 PolarHBondContact O-N 2.84Å; A392-V459 HydrophobicContact CB-CB 4.28Å; A392-V459 HydrophobicContact CB-CG1 3.95Å; A392-V459 WeakPolarHBondContact O-CG1 3.45Å; A392-L460 HydrophobicContact CB-CG 4.39Å
393	A	94.6	Very high	94.7	Very high	32 Å²	32	50 Å²	50	26%	0.264	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-36	177.5	0	0	0	0	0	112.2	F334 M389 R397	F334-A393 HydrophobicContact CB-CB 3.82Å; M389-A393 WeakPolarHBondContact O-CB 3.34Å; M389-A393 PolarHBondContact O-N 2.7Å; A393-R397 WeakPolarHBondContact O-CB 3.44Å; A393-R397 PolarHBondContact O-N 3.37Å
394	R	93.3	Very high	94.5	Very high	69 Å²	69	51.6 Å²	51.6	26%	0.26	24%	0.243	S	C	.	.	H	α-helix	trans	-66.2	-45.5	174.4	-173.7	-174.3	-58.4	179.9	3.8	111.6	T390 L391 A392 R397 N398	T390-R394 WeakPolarHBondContact O-CB 3.33Å; T390-R394 PolarHBondContact O-N 2.84Å; T390-R394 VanDerWaalsContact O-N 3.15Å; L391-R394 PolarHBondContact O-N 3.5Å; A392-R394 VanDerWaalsContact C-N 3.26Å; A392-R394 PolarHBondContact O-N 2.87Å; R394-R397 PolarHBondContact O-N 3.48Å; R394-N398 WeakPolarHBondContact O-CB 3.4Å; R394-N398 PolarHBondContact O-N 2.5Å; R394-N398 PolarHBondContact O-ND2 3.05Å
395	A	94	Very high	94.3	Very high	2 Å²	2	48.9 Å²	48.9	2%	0.017	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-48	177	0	0	0	0	0	111	L391 A392 R397 N398 N399 V459 L460 L463 V465	L391-A395 PolarHBondContact O-N 3.44Å; A392-A395 PolarHBondContact O-N 3.48Å; A392-A395 VanDerWaalsContact O-N 3.14Å; A395-R397 PolarHBondContact O-N 3.39Å; A395-N398 PolarHBondContact O-N 3.15Å; A395-N399 WeakPolarHBondContact O-CB 3.38Å; A395-N399 PolarHBondContact O-N 3.29Å; A395-N399 VanDerWaalsContact O-N 3.1Å; A395-N399 PolarHBondContact O-ND2 2.86Å; A395-V459 HydrophobicContact CB-CG1 3.99Å; A395-L460 HydrophobicContact CB-CD2 4.36Å; A395-L463 HydrophobicContact CB-CB 4.47Å; A395-V465 HydrophobicContact CB-CG2 4.25Å
396	M	94.4	Very high	93.9	Very high	78 Å²	78	56.2 Å²	56.2	38%	0.384	26%	0.263	S	S	.	.	H	α-helix	trans	-56.3	-52.1	175.6	-73.2	-61.6	-68.4	0	0	111.9	A392 N398 N399 F400 V459 L463	A392-M396 WeakPolarHBondContact O-CG 3.25Å; A392-M396 PolarHBondContact O-N 2.84Å; M396-N398 VanDerWaalsContact C-N 3.32Å; M396-N398 PolarHBondContact O-N 3.39Å; M396-N399 PolarHBondContact O-N 2.9Å; M396-F400 HydrophobicContact CE-CD2 3.61Å; M396-F400 HydrophobicContact CE-CE2 3.69Å; M396-F400 WeakPolarHBondContact O-CB 3.47Å; M396-F400 WeakPolarHBondContact O-CD2 3.49Å; M396-F400 PolarHBondContact O-N 3.1Å; M396-F400 HydrophobicContact SD-CD2 3.86Å; M396-F400 HydrophobicContact SD-CE2 3.64Å; M396-V459 HydrophobicContact CG-CG1 3.78Å; M396-V459 HydrophobicContact CG-CG2 4.08Å; M396-V459 HydrophobicContact SD-CG1 4.02Å; M396-V459 HydrophobicContact SD-CG2 3.7Å; M396-L463 HydrophobicContact SD-CD1 3.61Å
397	R	92.9	Very high	93.7	Very high	68 Å²	68	60.1 Å²	60.1	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-64.1	-38	-176.8	-165.3	172.5	-177.4	105	-9.6	112.2	T332 A393 R394 A395 N399 R401	T332-R397 PolarHBondContact O-NH1 3.02Å; T332-R397 VanDerWaalsContact O-NH1 3.07Å; A393-R397 WeakPolarHBondContact O-CB 3.44Å; A393-R397 PolarHBondContact O-N 3.37Å; R394-R397 PolarHBondContact O-N 3.48Å; A395-R397 PolarHBondContact O-N 3.39Å; R397-N399 VanDerWaalsContact C-N 3.35Å; R397-R401 HydrophobicContact CG-CB 4.08Å; R397-R401 WeakPolarHBondContact O-CB 3.49Å; R397-R401 PolarHBondContact O-N 3.45Å
398	N	92.5	Very high	93.6	Very high	78 Å²	78	64.1 Å²	64.1	42%	0.417	32%	0.317	S	S	.	.	H	α-helix	trans	-70.1	-29.8	178.9	-74.2	-12.3	0	0	0	113.7	R394 A395 M396	R394-N398 WeakPolarHBondContact O-CB 3.4Å; R394-N398 PolarHBondContact O-N 2.5Å; R394-N398 PolarHBondContact O-ND2 3.05Å; A395-N398 PolarHBondContact O-N 3.15Å; M396-N398 VanDerWaalsContact C-N 3.32Å; M396-N398 PolarHBondContact O-N 3.39Å
399	N	93.6	Very high	93.5	Very high	38 Å²	38	70.3 Å²	70.3	20%	0.203	35%	0.345	C	S	.	.	H	α-helix	trans	-95.2	-25.3	-176	-75.4	-76.2	0	0	0	113.4	A395 M396 R397 H402 Y403 L463 P464	A395-N399 WeakPolarHBondContact O-CB 3.38Å; A395-N399 PolarHBondContact O-N 3.29Å; A395-N399 VanDerWaalsContact O-N 3.1Å; A395-N399 PolarHBondContact O-ND2 2.86Å; M396-N399 PolarHBondContact O-N 2.9Å; R397-N399 VanDerWaalsContact C-N 3.35Å; N399-H402 PolarHBondContact O-CE1 3.04Å; N399-Y403 WeakPolarHBondContact O-CE2 3.37Å; N399-L463 HydrophobicContact CB-CD1 4.4Å; N399-P464 PolarHBondContact ND2-O 3.18Å; N399-P464 VanDerWaalsContact ND2-O 3.13Å; N399-P464 WeakPolarHBondContact OD1-CD 3.33Å; N399-P464 WeakPolarHBondContact OD1-CG 3.31Å
400	F	92.9	Very high	93.3	Very high	77 Å²	77	72.5 Å²	72.5	34%	0.338	36%	0.356	S	S	.	.	H	α-helix	trans	-114.7	-30.9	-173.4	-66.3	-68.9	0	0	0	114.7	M396 H402 Y403 F404 L463	M396-F400 HydrophobicContact CE-CD2 3.61Å; M396-F400 HydrophobicContact CE-CE2 3.69Å; M396-F400 WeakPolarHBondContact O-CB 3.47Å; M396-F400 WeakPolarHBondContact O-CD2 3.49Å; M396-F400 PolarHBondContact O-N 3.1Å; M396-F400 HydrophobicContact SD-CD2 3.86Å; M396-F400 HydrophobicContact SD-CE2 3.64Å; F400-H402 VanDerWaalsContact C-N 3.27Å; F400-H402 PolarHBondContact O-N 3.21Å; F400-H402 VanDerWaalsContact O-N 3.12Å; F400-Y403 PolarHBondContact O-N 3.27Å; F400-Y403 VanDerWaalsContact O-N 3.11Å; F400-F404 HydrophobicContact CB-CE2 4.31Å; F400-F404 WeakPolarHBondContact O-CD2 3.24Å; F400-L463 HydrophobicContact CD2-CD1 4.4Å; F400-L463 HydrophobicContact CE2-CD1 3.63Å; F400-L463 HydrophobicContact CE2-CD2 4.15Å; F400-L463 HydrophobicContact CZ-CD1 4.44Å; F400-L463 HydrophobicContact CZ-CD2 4.17Å
401	R	93.4	Very high	93.4	Very high	87 Å²	87	75.8 Å²	75.8	33%	0.328	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-56	-39.6	-167.8	-178.5	176.3	177.7	-87	-3.2	113.3	R397 Y403 F404 I405 Y414	R397-R401 HydrophobicContact CG-CB 4.08Å; R397-R401 WeakPolarHBondContact O-CB 3.49Å; R397-R401 PolarHBondContact O-N 3.45Å; R401-Y403 PolarHBondContact O-N 3.45Å; R401-F404 PolarHBondContact O-N 2.83Å; R401-I405 HydrophobicContact CG-CG1 4.4Å; R401-I405 WeakPolarHBondContact O-CG1 3.34Å; R401-Y414 HydrophobicContact CB-CE1 4.42Å; R401-Y414 HydrophobicContact CG-CE1 3.97Å
402	H	92.8	Very high	93.5	Very high	99 Å²	99	79.1 Å²	79.1	46%	0.458	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-63	-26.4	-175.8	57.9	-81.8	0	0	0	113.6	N399 F400 F404	N399-H402 PolarHBondContact O-CE1 3.04Å; F400-H402 VanDerWaalsContact C-N 3.27Å; F400-H402 PolarHBondContact O-N 3.21Å; F400-H402 VanDerWaalsContact O-N 3.12Å; H402-F404 PolarHBondContact O-N 2.92Å
403	Y	93.1	Very high	93.5	Very high	152 Å²	152	84.6 Å²	84.6	60%	0.596	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-71.5	-12.8	175.6	-60.9	-64.9	0	0	0	113.8	N399 F400 R401 L410	N399-Y403 WeakPolarHBondContact O-CE2 3.37Å; F400-Y403 PolarHBondContact O-N 3.27Å; F400-Y403 VanDerWaalsContact O-N 3.11Å; R401-Y403 PolarHBondContact O-N 3.45Å; Y403-L410 WeakPolarHBondContact O-CD2 3.43Å
404	F	93.6	Very high	93.5	Very high	60 Å²	60	84.2 Å²	84.2	26%	0.263	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-118.4	8	-174.4	-57	-89.1	0	0	0	113.5	F400 R401 H402 L410 K411 Y414	F400-F404 HydrophobicContact CB-CE2 4.31Å; F400-F404 WeakPolarHBondContact O-CD2 3.24Å; R401-F404 PolarHBondContact O-N 2.83Å; H402-F404 PolarHBondContact O-N 2.92Å; F404-L410 HydrophobicContact CB-CG 4.27Å; F404-L410 HydrophobicContact CD1-CD1 3.74Å; F404-L410 HydrophobicContact CD1-CD2 4.19Å; F404-L410 HydrophobicContact CD1-CG 3.82Å; F404-L410 HydrophobicContact CE1-CD1 4.29Å; F404-L410 HydrophobicContact CG-CG 4.49Å; F404-K411 WeakPolarHBondContact O-CA 3.28Å; F404-K411 VanDerWaalsContact O-CB 3.31Å; F404-K411 WeakPolarHBondContact O-CB 3.33Å; F404-K411 PolarHBondContact O-N 2.91Å; F404-K411 VanDerWaalsContact O-N 3.15Å; F404-Y414 HydrophobicContact CB-CD1 4.47Å; F404-Y414 HydrophobicContact CB-CD2 3.7Å; F404-Y414 HydrophobicContact CB-CG 3.66Å; F404-Y414 HydrophobicContact CD1-CD2 4.18Å; F404-Y414 AromaticContact CD2-CD2 3.52Å; F404-Y414 HydrophobicContact CD2-CD2 3.52Å; F404-Y414 AromaticContact CD2-CE2 3.85Å; F404-Y414 HydrophobicContact CD2-CE2 3.85Å; F404-Y414 HydrophobicContact CD2-CG 4.36Å; F404-Y414 HydrophobicContact CE2-CD2 4.19Å; F404-Y414 HydrophobicContact CE2-CE2 4.41Å; F404-Y414 AromaticContact CG-CD2 3.53Å; F404-Y414 HydrophobicContact CG-CD2 3.53Å; F404-Y414 HydrophobicContact CG-CE2 4.31Å; F404-Y414 AromaticContact CG-CG 4Å; F404-Y414 HydrophobicContact CG-CG 4Å
405	I	91.8	Very high	93.6	Very high	62 Å²	62	82.4 Å²	82.4	32%	0.318	40%	0.397	S	S	.	.	S	Bend	trans	-75	-32.8	-177	-58.9	-179.5	0	0	0	111.3	R401	R401-I405 HydrophobicContact CG-CG1 4.4Å; R401-I405 WeakPolarHBondContact O-CG1 3.34Å
406	E	89.7	Confident	93.8	Very high	162 Å²	162	85.6 Å²	85.6	76%	0.757	42%	0.416	S	S	*	.	S	Bend	trans	-135.2	138.6	-177.5	-63.4	-177.9	-176.2	0	0	109.7
407	P	92.8	Very high	93.8	Very high	83 Å²	83	85.5 Å²	85.5	54%	0.539	42%	0.416	S	S	.	.	S	Bend	cis	-76.5	171.3	-1.6	32.2	-36.1	0	0	0	113.7	Q409 L410 K411	P407-Q409 PolarHBondContact O-N 3.26Å; P407-Q409 VanDerWaalsContact O-N 3.13Å; P407-L410 HydrophobicContact CG-CB 4.32Å; P407-L410 WeakPolarHBondContact O-CB 3.45Å; P407-L410 PolarHBondContact O-N 2.94Å; P407-K411 PolarHBondContact O-N 3.02Å; P407-K411 VanDerWaalsContact O-N 3.11Å
408	S	93	Very high	94	Very high	97 Å²	97	83.3 Å²	83.3	68%	0.678	41%	0.411	S	S	*	.	H	α-helix	trans	-55.6	-33.3	-174.7	59.5	0	0	0	0	114.6	K411 L412	S408-K411 PolarHBondContact O-N 3.26Å; S408-L412 PolarHBondContact O-N 2.85Å
409	Q	94.3	Very high	94.2	Very high	156 Å²	156	83.3 Å²	83.3	73%	0.729	41%	0.405	S	S	*	.	H	α-helix	trans	-65.3	-42.3	175.7	-66.6	176.6	-17.7	0	0	112	P407 K411 L412 F413	P407-Q409 PolarHBondContact O-N 3.26Å; P407-Q409 VanDerWaalsContact O-N 3.13Å; Q409-K411 VanDerWaalsContact C-N 3.32Å; Q409-L412 PolarHBondContact O-N 2.89Å; Q409-F413 PolarHBondContact O-N 3.31Å
410	L	93.8	Very high	94.4	Very high	59 Å²	59	85.2 Å²	85.2	31%	0.309	41%	0.414	S	S	.	.	H	α-helix	trans	-67.5	-36.9	177.2	-173.7	61.6	0	0	0	111.1	Y403 F404 P407 F413 Y414	Y403-L410 WeakPolarHBondContact O-CD2 3.43Å; F404-L410 HydrophobicContact CB-CG 4.27Å; F404-L410 HydrophobicContact CD1-CD1 3.74Å; F404-L410 HydrophobicContact CD1-CD2 4.19Å; F404-L410 HydrophobicContact CD1-CG 3.82Å; F404-L410 HydrophobicContact CE1-CD1 4.29Å; F404-L410 HydrophobicContact CG-CG 4.49Å; P407-L410 HydrophobicContact CG-CB 4.32Å; P407-L410 WeakPolarHBondContact O-CB 3.45Å; P407-L410 PolarHBondContact O-N 2.94Å; L410-F413 PolarHBondContact O-N 3.21Å; L410-Y414 WeakPolarHBondContact O-CB 3.48Å; L410-Y414 PolarHBondContact O-N 3.15Å
411	K	95.2	Very high	94.5	Very high	80 Å²	80	85.8 Å²	85.8	35%	0.348	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-45.7	171.9	-175.5	-172.6	169.7	-63.2	0	112.2	F404 P407 S408 Q409 F413 Y414 D415	F404-K411 WeakPolarHBondContact O-CA 3.28Å; F404-K411 VanDerWaalsContact O-CB 3.31Å; F404-K411 WeakPolarHBondContact O-CB 3.33Å; F404-K411 PolarHBondContact O-N 2.91Å; F404-K411 VanDerWaalsContact O-N 3.15Å; P407-K411 PolarHBondContact O-N 3.02Å; P407-K411 VanDerWaalsContact O-N 3.11Å; S408-K411 PolarHBondContact O-N 3.26Å; Q409-K411 VanDerWaalsContact C-N 3.32Å; K411-F413 VanDerWaalsContact C-N 3.33Å; K411-F413 PolarHBondContact O-N 3.48Å; K411-Y414 PolarHBondContact O-N 2.84Å; K411-D415 IonicContact NZ-OD2 2.65Å; K411-D415 PolarHBondContact NZ-OD2 3.08Å; K411-D415 WeakPolarHBondContact O-CB 3.3Å; K411-D415 VanDerWaalsContact O-CG 3.3Å; K411-D415 PolarHBondContact O-N 2.8Å
412	L	95.4	Very high	94.7	Very high	115 Å²	115	82.2 Å²	82.2	60%	0.602	41%	0.412	S	S	*	.	H	α-helix	trans	-61.1	-44.8	177.5	-180	63.9	0	0	0	110.8	S408 Q409 Y414 D415 V416	S408-L412 PolarHBondContact O-N 2.85Å; Q409-L412 PolarHBondContact O-N 2.89Å; L412-Y414 PolarHBondContact O-N 2.69Å; L412-D415 PolarHBondContact O-N 2.96Å; L412-V416 HydrophobicContact CD1-CG2 4.38Å; L412-V416 WeakPolarHBondContact O-CG2 3.1Å; L412-V416 PolarHBondContact O-N 3.06Å
413	F	95.7	Very high	94.9	Very high	122 Å²	122	77.7 Å²	77.7	54%	0.535	39%	0.391	S	S	.	.	H	α-helix	trans	-57.2	-48.9	174.4	175.3	-101.4	0	0	0	111.6	Q409 L410 K411 D415 V416 I417	Q409-F413 PolarHBondContact O-N 3.31Å; L410-F413 PolarHBondContact O-N 3.21Å; K411-F413 VanDerWaalsContact C-N 3.33Å; K411-F413 PolarHBondContact O-N 3.48Å; F413-D415 PolarHBondContact O-N 3.16Å; F413-V416 PolarHBondContact O-N 3.41Å; F413-I417 HydrophobicContact CD2-CG1 4.3Å; F413-I417 HydrophobicContact CE1-CG1 4.12Å; F413-I417 HydrophobicContact CE2-CD1 4.19Å; F413-I417 HydrophobicContact CE2-CG1 3.9Å; F413-I417 HydrophobicContact CZ-CD1 4.27Å; F413-I417 HydrophobicContact CZ-CG1 3.8Å; F413-I417 WeakPolarHBondContact O-CG1 3.27Å; F413-I417 PolarHBondContact O-N 3.31Å
414	Y	95.6	Very high	95.1	Very high	24 Å²	24	71.5 Å²	71.5	9%	0.094	37%	0.369	C	S	.	.	H	α-helix	trans	-60	-43.2	175.9	177.2	-92.1	0	0	0	112.6	R401 F404 L410 K411 L412 I417 T418	R401-Y414 HydrophobicContact CB-CE1 4.42Å; R401-Y414 HydrophobicContact CG-CE1 3.97Å; F404-Y414 HydrophobicContact CB-CD1 4.47Å; F404-Y414 HydrophobicContact CB-CD2 3.7Å; F404-Y414 HydrophobicContact CB-CG 3.66Å; F404-Y414 HydrophobicContact CD1-CD2 4.18Å; F404-Y414 AromaticContact CD2-CD2 3.52Å; F404-Y414 HydrophobicContact CD2-CD2 3.52Å; F404-Y414 AromaticContact CD2-CE2 3.85Å; F404-Y414 HydrophobicContact CD2-CE2 3.85Å; F404-Y414 HydrophobicContact CD2-CG 4.36Å; F404-Y414 HydrophobicContact CE2-CD2 4.19Å; F404-Y414 HydrophobicContact CE2-CE2 4.41Å; F404-Y414 AromaticContact CG-CD2 3.53Å; F404-Y414 HydrophobicContact CG-CD2 3.53Å; F404-Y414 HydrophobicContact CG-CE2 4.31Å; F404-Y414 AromaticContact CG-CG 4Å; F404-Y414 HydrophobicContact CG-CG 4Å; L410-Y414 WeakPolarHBondContact O-CB 3.48Å; L410-Y414 PolarHBondContact O-N 3.15Å; K411-Y414 PolarHBondContact O-N 2.84Å; L412-Y414 PolarHBondContact O-N 2.69Å; Y414-I417 PolarHBondContact O-N 3.02Å; Y414-T418 HydrophobicContact CD1-CG2 4.09Å; Y414-T418 HydrophobicContact CD2-CG2 4.07Å; Y414-T418 HydrophobicContact CE1-CG2 3.71Å; Y414-T418 HydrophobicContact CE2-CG2 3.69Å; Y414-T418 HydrophobicContact CG-CG2 4.26Å; Y414-T418 VanDerWaalsContact CZ-CG2 3.49Å; Y414-T418 VanDerWaalsContact O-CB 3.31Å; Y414-T418 WeakPolarHBondContact O-CB 3.27Å; Y414-T418 VanDerWaalsContact O-CG2 3.31Å; Y414-T418 WeakPolarHBondContact O-CG2 3.23Å; Y414-T418 PolarHBondContact O-N 2.99Å; Y414-T418 PolarHBondContact O-OG1 3.4Å
415	D	95.5	Very high	95.3	Very high	32 Å²	32	69.3 Å²	69.3	17%	0.171	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-41.1	179.1	-74.6	-23.4	0	0	0	111.4	T332 K411 L412 F413 T418 W419	T332-D415 HydrophobicContact CG2-CB 4.18Å; K411-D415 IonicContact NZ-OD2 2.65Å; K411-D415 PolarHBondContact NZ-OD2 3.08Å; K411-D415 WeakPolarHBondContact O-CB 3.3Å; K411-D415 VanDerWaalsContact O-CG 3.3Å; K411-D415 PolarHBondContact O-N 2.8Å; L412-D415 PolarHBondContact O-N 2.96Å; F413-D415 PolarHBondContact O-N 3.16Å; D415-T418 WeakPolarHBondContact CA-OG1 3.38Å; D415-T418 PolarHBondContact O-OG1 3.27Å; D415-W419 WeakPolarHBondContact O-CB 3.33Å; D415-W419 PolarHBondContact O-N 3.23Å
416	V	96.8	Very high	95.6	Very high	69 Å²	69	66.9 Å²	66.9	42%	0.418	35%	0.349	S	S	.	.	H	α-helix	trans	-64.5	-48.4	175.8	171.3	0	0	0	0	111.1	L412 F413 W419 I420	L412-V416 HydrophobicContact CD1-CG2 4.38Å; L412-V416 WeakPolarHBondContact O-CG2 3.1Å; L412-V416 PolarHBondContact O-N 3.06Å; F413-V416 PolarHBondContact O-N 3.41Å; V416-W419 WeakPolarHBondContact O-CB 3.43Å; V416-W419 PolarHBondContact O-N 3.35Å; V416-I420 HydrophobicContact CG1-CD1 4.24Å; V416-I420 WeakPolarHBondContact O-CG1 3.49Å; V416-I420 PolarHBondContact O-N 2.95Å
417	I	96.1	Very high	95.9	Very high	75 Å²	75	59.3 Å²	59.3	39%	0.385	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-46.2	179.9	-65.8	-61.3	0	0	0	111	F413 Y414 W419 I420 V421	F413-I417 HydrophobicContact CD2-CG1 4.3Å; F413-I417 HydrophobicContact CE1-CG1 4.12Å; F413-I417 HydrophobicContact CE2-CD1 4.19Å; F413-I417 HydrophobicContact CE2-CG1 3.9Å; F413-I417 HydrophobicContact CZ-CD1 4.27Å; F413-I417 HydrophobicContact CZ-CG1 3.8Å; F413-I417 WeakPolarHBondContact O-CG1 3.27Å; F413-I417 PolarHBondContact O-N 3.31Å; Y414-I417 PolarHBondContact O-N 3.02Å; I417-W419 VanDerWaalsContact C-N 3.29Å; I417-W419 PolarHBondContact O-N 3.5Å; I417-I420 PolarHBondContact O-N 3.25Å; I417-V421 HydrophobicContact CG2-CG2 4.38Å; I417-V421 WeakPolarHBondContact O-CG2 3.39Å; I417-V421 PolarHBondContact O-N 3.27Å
418	T	96.2	Very high	96.2	Very high	23 Å²	23	55.4 Å²	55.4	14%	0.141	29%	0.289	C	S	.	.	H	α-helix	trans	-69	-28.8	179.2	54.1	0	0	0	0	112.7	T332 Y414 D415 T422	T332-T418 WeakPolarHBondContact O-CB 3.44Å; Y414-T418 HydrophobicContact CD1-CG2 4.09Å; Y414-T418 HydrophobicContact CD2-CG2 4.07Å; Y414-T418 HydrophobicContact CE1-CG2 3.71Å; Y414-T418 HydrophobicContact CE2-CG2 3.69Å; Y414-T418 HydrophobicContact CG-CG2 4.26Å; Y414-T418 VanDerWaalsContact CZ-CG2 3.49Å; Y414-T418 VanDerWaalsContact O-CB 3.31Å; Y414-T418 WeakPolarHBondContact O-CB 3.27Å; Y414-T418 VanDerWaalsContact O-CG2 3.31Å; Y414-T418 WeakPolarHBondContact O-CG2 3.23Å; Y414-T418 PolarHBondContact O-N 2.99Å; Y414-T418 PolarHBondContact O-OG1 3.4Å; D415-T418 WeakPolarHBondContact CA-OG1 3.38Å; D415-T418 PolarHBondContact O-OG1 3.27Å; T418-T422 WeakPolarHBondContact O-CB 3.26Å; T418-T422 PolarHBondContact O-N 2.95Å; T418-T422 PolarHBondContact O-OG1 3.03Å
419	W	97.4	Very high	96.4	Very high	78 Å²	78	51 Å²	51	30%	0.295	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-54.3	168.4	170.2	74.5	0	0	0	111.2	E329 T332 D415 V416 I417 V421 T422 Q423	E329-W419 PolarHBondContact O-NE1 3.12Å; T332-W419 HydrophobicContact CG2-CB 4.29Å; D415-W419 WeakPolarHBondContact O-CB 3.33Å; D415-W419 PolarHBondContact O-N 3.23Å; V416-W419 WeakPolarHBondContact O-CB 3.43Å; V416-W419 PolarHBondContact O-N 3.35Å; I417-W419 VanDerWaalsContact C-N 3.29Å; I417-W419 PolarHBondContact O-N 3.5Å; W419-V421 PolarHBondContact O-N 3.37Å; W419-T422 PolarHBondContact O-N 3.3Å; W419-T422 VanDerWaalsContact O-N 3.16Å; W419-Q423 WeakPolarHBondContact O-CG 3.45Å; W419-Q423 PolarHBondContact O-N 3.45Å
420	I	96.6	Very high	96.5	Very high	78 Å²	78	45.9 Å²	45.9	40%	0.4	24%	0.237	S	C	.	.	H	α-helix	trans	-55.4	-52	178.4	-65.1	170.4	0	0	0	110.4	V416 I417 T422 Q423 V424	V416-I420 HydrophobicContact CG1-CD1 4.24Å; V416-I420 WeakPolarHBondContact O-CG1 3.49Å; V416-I420 PolarHBondContact O-N 2.95Å; I417-I420 PolarHBondContact O-N 3.25Å; I420-T422 VanDerWaalsContact C-N 3.3Å; I420-T422 PolarHBondContact O-N 2.89Å; I420-Q423 PolarHBondContact O-N 3.05Å; I420-V424 WeakPolarHBondContact O-CG2 3.33Å; I420-V424 PolarHBondContact O-N 2.78Å
421	V	96.4	Very high	96.7	Very high	88 Å²	88	43 Å²	43	53%	0.533	22%	0.222	S	C	.	.	H	α-helix	trans	-61.5	-39.5	-178.9	173.1	0	0	0	0	111.3	I417 W419 A425	I417-V421 HydrophobicContact CG2-CG2 4.38Å; I417-V421 WeakPolarHBondContact O-CG2 3.39Å; I417-V421 PolarHBondContact O-N 3.27Å; W419-V421 PolarHBondContact O-N 3.37Å; V421-A425 VanDerWaalsContact O-CB 3.23Å; V421-A425 WeakPolarHBondContact O-CB 3.38Å; V421-A425 PolarHBondContact O-N 2.92Å
422	T	97.1	Very high	96.7	Very high	12 Å²	12	39.2 Å²	39.2	7%	0.074	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-47.2	177.8	-66.3	0	0	0	0	111.2	S331 S333 T418 W419 I420 V424 A425 I426	S331-T422 WeakPolarHBondContact OG-CG2 3.4Å; S333-T422 VanDerWaalsContact CA-OG1 3.28Å; S333-T422 WeakPolarHBondContact CA-OG1 3.01Å; S333-T422 PolarHBondContact N-OG1 3.45Å; T418-T422 WeakPolarHBondContact O-CB 3.26Å; T418-T422 PolarHBondContact O-N 2.95Å; T418-T422 PolarHBondContact O-OG1 3.03Å; W419-T422 PolarHBondContact O-N 3.3Å; W419-T422 VanDerWaalsContact O-N 3.16Å; I420-T422 VanDerWaalsContact C-N 3.3Å; I420-T422 PolarHBondContact O-N 2.89Å; T422-V424 VanDerWaalsContact C-N 3.35Å; T422-V424 PolarHBondContact O-N 3.01Å; T422-A425 PolarHBondContact O-N 3.03Å; T422-I426 HydrophobicContact CG2-CD1 3.52Å; T422-I426 HydrophobicContact CG2-CG1 4.43Å; T422-I426 WeakPolarHBondContact O-CB 3.32Å; T422-I426 WeakPolarHBondContact O-CD1 3.49Å; T422-I426 VanDerWaalsContact O-CG1 3.26Å; T422-I426 WeakPolarHBondContact O-CG1 3.41Å; T422-I426 PolarHBondContact O-N 3.33Å
423	Q	97.2	Very high	96.7	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.019	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-41.1	179.9	-66.2	-58.5	-23.9	0	0	112	Y278 I328 E329 S331 W419 I420 S427	Y278-Q423 HydrophobicContact CD2-CB 3.83Å; Y278-Q423 HydrophobicContact CE2-CB 3.71Å; Y278-Q423 HydrophobicContact CE2-CG 3.92Å; I328-Q423 PolarHBondContact O-NE2 3.14Å; E329-Q423 PolarHBondContact O-NE2 2.74Å; S331-Q423 PolarHBondContact OG-NE2 2.99Å; W419-Q423 WeakPolarHBondContact O-CG 3.45Å; W419-Q423 PolarHBondContact O-N 3.45Å; I420-Q423 PolarHBondContact O-N 3.05Å; Q423-S427 WeakPolarHBondContact O-CB 3.46Å; Q423-S427 PolarHBondContact O-N 3.42Å; Q423-S427 PolarHBondContact O-OG 3.24Å
424	V	97.2	Very high	96.6	Very high	23 Å²	23	30.5 Å²	30.5	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-65.6	-46.5	175	175	0	0	0	0	111.2	I274 I420 T422 I426 S427 Y428	I274-V424 HydrophobicContact CG2-CG2 3.73Å; I420-V424 WeakPolarHBondContact O-CG2 3.33Å; I420-V424 PolarHBondContact O-N 2.78Å; T422-V424 VanDerWaalsContact C-N 3.35Å; T422-V424 PolarHBondContact O-N 3.01Å; V424-I426 VanDerWaalsContact C-N 3.31Å; V424-I426 PolarHBondContact O-N 3.3Å; V424-S427 PolarHBondContact O-N 3.45Å; V424-Y428 WeakPolarHBondContact O-CB 3.3Å; V424-Y428 PolarHBondContact O-N 2.93Å
425	A	97.7	Very high	96.4	Very high	14 Å²	14	30.4 Å²	30.4	12%	0.116	17%	0.165	C	C	.	.	H	α-helix	trans	-61.7	-38.6	-179.6	0	0	0	0	0	112.6	F334 V421 T422 T429 L452	F334-A425 HydrophobicContact CD2-CB 4.43Å; V421-A425 VanDerWaalsContact O-CB 3.23Å; V421-A425 WeakPolarHBondContact O-CB 3.38Å; V421-A425 PolarHBondContact O-N 2.92Å; T422-A425 PolarHBondContact O-N 3.03Å; A425-T429 WeakPolarHBondContact O-CB 3.13Å; A425-T429 PolarHBondContact O-N 3.47Å; A425-T429 PolarHBondContact O-OG1 3.31Å; A425-L452 HydrophobicContact CB-CD1 4.32Å
426	I	97.4	Very high	96.2	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.051	16%	0.159	C	C	.	.	H	α-helix	trans	-69.6	-47	176.1	-68.3	162.5	0	0	0	110.5	F334 F337 T422 V424 Y428 T429 V430	F334-I426 HydrophobicContact CD2-CD1 4.36Å; F334-I426 HydrophobicContact CD2-CG1 3.51Å; F334-I426 HydrophobicContact CE2-CB 4.38Å; F334-I426 HydrophobicContact CE2-CG1 3.51Å; F334-I426 HydrophobicContact CG-CG1 4.44Å; F334-I426 HydrophobicContact CZ-CG1 4.44Å; F337-I426 HydrophobicContact CB-CD1 3.34Å; F337-I426 HydrophobicContact CD1-CD1 3.86Å; F337-I426 HydrophobicContact CD1-CG2 4.28Å; F337-I426 HydrophobicContact CD2-CD1 3.33Å; F337-I426 HydrophobicContact CE1-CD1 4.43Å; F337-I426 HydrophobicContact CE1-CG2 3.88Å; F337-I426 HydrophobicContact CE2-CD1 3.92Å; F337-I426 HydrophobicContact CE2-CG2 4.08Å; F337-I426 HydrophobicContact CG-CD1 3.26Å; F337-I426 HydrophobicContact CG-CG1 4.38Å; F337-I426 HydrophobicContact CZ-CD1 4.46Å; F337-I426 HydrophobicContact CZ-CG2 3.76Å; T422-I426 HydrophobicContact CG2-CD1 3.52Å; T422-I426 HydrophobicContact CG2-CG1 4.43Å; T422-I426 WeakPolarHBondContact O-CB 3.32Å; T422-I426 WeakPolarHBondContact O-CD1 3.49Å; T422-I426 VanDerWaalsContact O-CG1 3.26Å; T422-I426 WeakPolarHBondContact O-CG1 3.41Å; T422-I426 PolarHBondContact O-N 3.33Å; V424-I426 VanDerWaalsContact C-N 3.31Å; V424-I426 PolarHBondContact O-N 3.3Å; I426-Y428 VanDerWaalsContact C-N 3.31Å; I426-Y428 PolarHBondContact O-N 3.3Å; I426-T429 WeakPolarHBondContact O-CB 3.41Å; I426-T429 PolarHBondContact O-N 3.12Å; I426-V430 HydrophobicContact CG2-CG2 4.13Å; I426-V430 WeakPolarHBondContact O-CB 3.41Å; I426-V430 VanDerWaalsContact O-CG2 3.29Å; I426-V430 WeakPolarHBondContact O-CG2 3.24Å; I426-V430 PolarHBondContact O-N 2.95Å
427	S	97.6	Very high	95.9	Very high	4 Å²	4	27.3 Å²	27.3	3%	0.028	15%	0.149	C	C	.	.	H	α-helix	trans	-57.9	-46.7	178.8	-55.6	0	0	0	0	110.7	Q423 V424 T429 V430 V431	Q423-S427 WeakPolarHBondContact O-CB 3.46Å; Q423-S427 PolarHBondContact O-N 3.42Å; Q423-S427 PolarHBondContact O-OG 3.24Å; V424-S427 PolarHBondContact O-N 3.45Å; S427-T429 VanDerWaalsContact C-N 3.31Å; S427-T429 PolarHBondContact O-N 2.72Å; S427-V430 PolarHBondContact O-N 3.01Å; S427-V431 WeakPolarHBondContact O-CG2 3.47Å; S427-V431 PolarHBondContact O-N 3.19Å; S427-V431 VanDerWaalsContact O-N 3.16Å
428	Y	97.9	Very high	95.7	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-39.9	174.4	-176.9	-90.9	0	0	0	113.3	M389 V424 I426 F444 Y445 W448 L452 H453	M389-Y428 HydrophobicContact CE-CD1 4.39Å; M389-Y428 HydrophobicContact CE-CE1 4.4Å; V424-Y428 WeakPolarHBondContact O-CB 3.3Å; V424-Y428 PolarHBondContact O-N 2.93Å; I426-Y428 VanDerWaalsContact C-N 3.31Å; I426-Y428 PolarHBondContact O-N 3.3Å; Y428-F444 AromaticContact CD2-CE1 3.59Å; Y428-F444 HydrophobicContact CD2-CE1 3.59Å; Y428-F444 AromaticContact CD2-CZ 3.72Å; Y428-F444 HydrophobicContact CD2-CZ 3.72Å; Y428-F444 AromaticContact CE2-CE1 3.79Å; Y428-F444 HydrophobicContact CE2-CE1 3.79Å; Y428-F444 HydrophobicContact CE2-CZ 4.19Å; Y428-F444 HydrophobicContact CG-CE1 4.16Å; Y428-F444 HydrophobicContact CG-CZ 4.46Å; Y428-Y445 HydrophobicContact CD1-CE1 4.18Å; Y428-Y445 AromaticContact CE1-CD1 3.89Å; Y428-Y445 HydrophobicContact CE1-CD1 3.89Å; Y428-Y445 AromaticContact CE1-CE1 3.64Å; Y428-Y445 HydrophobicContact CE1-CE1 3.64Å; Y428-Y445 AromaticContact CE2-CD1 3.96Å; Y428-Y445 HydrophobicContact CE2-CD1 3.96Å; Y428-Y445 HydrophobicContact CE2-CE1 4.31Å; Y428-Y445 AromaticContact CZ-CD1 3.44Å; Y428-Y445 VanDerWaalsContact CZ-CD1 3.44Å; Y428-Y445 AromaticContact CZ-CE1 3.71Å; Y428-Y445 VanDerWaalsContact OH-CD1 3.28Å; Y428-Y445 WeakPolarHBondContact OH-CD1 3.28Å; Y428-W448 HydrophobicContact CD2-CD2 4.14Å; Y428-W448 HydrophobicContact CD2-CE3 4.01Å; Y428-W448 HydrophobicContact CD2-CG 4.37Å; Y428-W448 HydrophobicContact CE2-CB 3.71Å; Y428-W448 HydrophobicContact CE2-CD2 4.18Å; Y428-W448 HydrophobicContact CE2-CE3 4.21Å; Y428-W448 AromaticContact CE2-CG 3.98Å; Y428-W448 HydrophobicContact CE2-CG 3.98Å; Y428-L452 HydrophobicContact CD1-CB 3.96Å; Y428-L452 HydrophobicContact CD1-CD1 3.86Å; Y428-L452 HydrophobicContact CD1-CG 4.33Å; Y428-L452 HydrophobicContact CD2-CD1 4.19Å; Y428-L452 HydrophobicContact CE1-CB 3.9Å; Y428-L452 HydrophobicContact CG-CB 4.42Å; Y428-L452 HydrophobicContact CG-CD1 3.64Å; Y428-L452 HydrophobicContact CG-CG 4.29Å; Y428-H453 AromaticContact CE1-CE1 3.41Å; Y428-H453 VanDerWaalsContact CE1-CE1 3.41Å; Y428-H453 WeakPolarHBondContact CE1-CE1 3.42Å; Y428-H453 AromaticContact CE1-ND1 3.57Å; Y428-H453 AromaticContact CZ-CE1 3.79Å; Y428-H453 AromaticContact CZ-ND1 3.72Å; Y428-H453 PolarHBondContact OH-CE1 3.37Å; Y428-H453 PolarHBondContact OH-ND1 3.11Å
429	T	97.8	Very high	95.6	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-69.5	-34.9	179.3	-59.7	0	0	0	0	112.2	F334 T382 T385 M389 A425 I426 S427	F334-T429 HydrophobicContact CZ-CG2 4.12Å; T382-T429 WeakPolarHBondContact CA-O 3.23Å; T382-T429 WeakPolarHBondContact CB-O 3.49Å; T382-T429 HydrophobicContact CG2-CG2 4.24Å; T382-T429 WeakPolarHBondContact CG2-O 3.22Å; T382-T429 WeakPolarHBondContact O-CG2 3.37Å; T382-T429 PolarHBondContact OG1-O 2.99Å; T385-T429 HydrophobicContact CG2-CG2 4Å; M389-T429 WeakPolarHBondContact CG-OG1 3.36Å; A425-T429 WeakPolarHBondContact O-CB 3.13Å; A425-T429 PolarHBondContact O-N 3.47Å; A425-T429 PolarHBondContact O-OG1 3.31Å; I426-T429 WeakPolarHBondContact O-CB 3.41Å; I426-T429 PolarHBondContact O-N 3.12Å; S427-T429 VanDerWaalsContact C-N 3.31Å; S427-T429 PolarHBondContact O-N 2.72Å
430	V	96.7	Very high	95.5	Very high	48 Å²	48	32.2 Å²	32.2	29%	0.291	17%	0.174	S	C	.	.	H	α-helix	trans	-88.2	-18.4	-171.8	174	0	0	0	0	113	L281 I426 S427 F433 V434	L281-V430 HydrophobicContact CD1-CB 4.3Å; L281-V430 HydrophobicContact CD1-CG1 3.86Å; I426-V430 HydrophobicContact CG2-CG2 4.13Å; I426-V430 WeakPolarHBondContact O-CB 3.41Å; I426-V430 VanDerWaalsContact O-CG2 3.29Å; I426-V430 WeakPolarHBondContact O-CG2 3.24Å; I426-V430 PolarHBondContact O-N 2.95Å; S427-V430 PolarHBondContact O-N 3.01Å; V430-F433 HydrophobicContact CG1-CB 4.28Å; V430-F433 WeakPolarHBondContact O-CA 3.34Å; V430-F433 WeakPolarHBondContact O-CB 3.07Å; V430-F433 PolarHBondContact O-N 2.9Å; V430-V434 HydrophobicContact CG1-CG2 4.23Å; V430-V434 PolarHBondContact O-N 2.94Å
431	V	96.6	Very high	95.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-48.8	-50.1	179.1	165.8	0	0	0	0	113.5	V256 L277 L281 S427 F433 V434 L435 F444	V256-V431 HydrophobicContact CG1-CG2 4.44Å; L277-V431 HydrophobicContact CD1-CG2 3.44Å; L277-V431 VanDerWaalsContact CD1-CG2 3.44Å; L281-V431 HydrophobicContact CD2-CG2 3.87Å; S427-V431 WeakPolarHBondContact O-CG2 3.47Å; S427-V431 PolarHBondContact O-N 3.19Å; S427-V431 VanDerWaalsContact O-N 3.16Å; V431-F433 VanDerWaalsContact C-N 3.26Å; V431-F433 PolarHBondContact O-N 2.96Å; V431-V434 PolarHBondContact O-N 3.47Å; V431-L435 HydrophobicContact CG1-CD1 3.48Å; V431-L435 VanDerWaalsContact CG1-CD1 3.48Å; V431-L435 HydrophobicContact CG1-CG 4.01Å; V431-L435 WeakPolarHBondContact O-CG 3.33Å; V431-L435 PolarHBondContact O-N 2.95Å; V431-F444 HydrophobicContact CB-CD1 3.87Å; V431-F444 HydrophobicContact CB-CE1 3.75Å; V431-F444 HydrophobicContact CB-CE2 4.48Å; V431-F444 HydrophobicContact CB-CG 4.3Å; V431-F444 HydrophobicContact CB-CZ 4.09Å; V431-F444 HydrophobicContact CG1-CB 4.07Å; V431-F444 HydrophobicContact CG1-CD1 3.57Å; V431-F444 HydrophobicContact CG1-CD2 3.93Å; V431-F444 HydrophobicContact CG1-CE1 3.96Å; V431-F444 HydrophobicContact CG1-CE2 4.27Å; V431-F444 HydrophobicContact CG1-CG 3.57Å; V431-F444 HydrophobicContact CG1-CZ 4.3Å; V431-F444 HydrophobicContact CG2-CD1 4.37Å; V431-F444 HydrophobicContact CG2-CD2 4.45Å; V431-F444 HydrophobicContact CG2-CE1 3.9Å; V431-F444 HydrophobicContact CG2-CE2 3.98Å; V431-F444 HydrophobicContact CG2-CZ 3.7Å
432	P	96.8	Very high	95.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-33.2	176.9	-22	30.3	0	0	0	114.3	G378 L381 V434 L435 L436 S441 Y445	G378-P432 WeakPolarHBondContact CA-O 3.47Å; G378-P432 WeakPolarHBondContact O-CB 3.42Å; L381-P432 HydrophobicContact CB-CB 3.86Å; L381-P432 HydrophobicContact CB-CG 4.18Å; L381-P432 HydrophobicContact CD1-CB 4.47Å; P432-V434 PolarHBondContact O-N 3.36Å; P432-L435 PolarHBondContact O-N 3.21Å; P432-L436 PolarHBondContact O-N 3.46Å; P432-S441 WeakPolarHBondContact CA-OG 3.26Å; P432-S441 WeakPolarHBondContact CB-OG 3.49Å; P432-Y445 HydrophobicContact CG-CE1 4.16Å; P432-Y445 HydrophobicContact CG-CE2 4.03Å; P432-Y445 WeakPolarHBondContact CG-OH 3.4Å
433	F	95.3	Very high	95.4	Very high	33 Å²	33	31.1 Å²	31.1	15%	0.145	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-33.1	176.3	-170.2	-82.1	0	0	0	111.8	Y126 H373 Y379 T382 F383 V430 V431 L436	Y126-F433 PolarHBondContact OH-O 3.12Å; H373-F433 HydrophobicContact CB-CE2 4.41Å; H373-F433 AromaticContact CD2-CE2 3.44Å; H373-F433 VanDerWaalsContact CD2-CE2 3.44Å; H373-F433 WeakPolarHBondContact CD2-CE2 3.26Å; H373-F433 AromaticContact CD2-CZ 3.5Å; H373-F433 VanDerWaalsContact CD2-CZ 3.5Å; H373-F433 WeakPolarHBondContact CD2-CZ 3.3Å; H373-F433 AromaticContact CG-CE2 3.91Å; H373-F433 AromaticContact NE2-CE2 3.86Å; H373-F433 AromaticContact NE2-CZ 3.96Å; Y379-F433 AromaticContact CD1-CD2 3.41Å; Y379-F433 HydrophobicContact CD1-CD2 3.41Å; Y379-F433 VanDerWaalsContact CD1-CD2 3.41Å; Y379-F433 AromaticContact CD1-CE2 3.5Å; Y379-F433 HydrophobicContact CD1-CE2 3.5Å; Y379-F433 AromaticContact CD1-CG 3.98Å; Y379-F433 HydrophobicContact CD1-CG 3.98Å; Y379-F433 HydrophobicContact CD1-CZ 4.15Å; Y379-F433 HydrophobicContact CE1-CD1 4.28Å; Y379-F433 AromaticContact CE1-CD2 3.84Å; Y379-F433 HydrophobicContact CE1-CD2 3.84Å; Y379-F433 HydrophobicContact CE1-CE1 4.13Å; Y379-F433 AromaticContact CE1-CE2 3.67Å; Y379-F433 HydrophobicContact CE1-CE2 3.67Å; Y379-F433 HydrophobicContact CE1-CG 4.12Å; Y379-F433 AromaticContact CE1-CZ 3.82Å; Y379-F433 HydrophobicContact CE1-CZ 3.82Å; Y379-F433 HydrophobicContact CG-CD2 4.47Å; Y379-F433 HydrophobicContact CG-CE2 4.45Å; T382-F433 HydrophobicContact CG2-CB 4.02Å; T382-F433 HydrophobicContact CG2-CD2 4.25Å; T382-F433 WeakPolarHBondContact OG1-CB 3.46Å; T382-F433 PolarHBondContact OG1-N 3.46Å; F383-F433 HydrophobicContact CE2-CD2 4.27Å; F383-F433 HydrophobicContact CE2-CE2 4.14Å; F383-F433 HydrophobicContact CZ-CD2 4.39Å; F383-F433 HydrophobicContact CZ-CE2 4.1Å; V430-F433 HydrophobicContact CG1-CB 4.28Å; V430-F433 WeakPolarHBondContact O-CA 3.34Å; V430-F433 WeakPolarHBondContact O-CB 3.07Å; V430-F433 PolarHBondContact O-N 2.9Å; V431-F433 VanDerWaalsContact C-N 3.26Å; V431-F433 PolarHBondContact O-N 2.96Å; F433-L436 WeakPolarHBondContact O-CD2 3.31Å
434	V	93	Very high	95.4	Very high	21 Å²	21	30.9 Å²	30.9	13%	0.127	16%	0.159	C	C	.	.	H	α-helix	trans	-82.2	-38.1	176.3	-174.3	0	0	0	0	111.4	Y126 V256 L281 V430 V431 P432	Y126-V434 VanDerWaalsContact OH-CA 3.26Å; Y126-V434 WeakPolarHBondContact OH-CA 3.39Å; Y126-V434 PolarHBondContact OH-O 2.86Å; V256-V434 HydrophobicContact CB-CB 4.44Å; V256-V434 HydrophobicContact CB-CG1 3.81Å; V256-V434 HydrophobicContact CG1-CB 4.04Å; V256-V434 HydrophobicContact CG1-CG1 3.97Å; V256-V434 HydrophobicContact CG2-CG1 3.96Å; L281-V434 HydrophobicContact CD1-CG2 3.93Å; V430-V434 HydrophobicContact CG1-CG2 4.23Å; V430-V434 PolarHBondContact O-N 2.94Å; V431-V434 PolarHBondContact O-N 3.47Å; P432-V434 PolarHBondContact O-N 3.36Å
435	L	92.3	Very high	95.4	Very high	21 Å²	21	30 Å²	30	11%	0.11	15%	0.154	C	C	.	.	H	α-helix	trans	-77.6	-19.8	-178.4	-63.7	177.9	0	0	0	113.9	E257 I260 V431 P432 S437 P440	E257-L435 HydrophobicContact CG-CD2 4.18Å; I260-L435 HydrophobicContact CD1-CD1 4.21Å; I260-L435 HydrophobicContact CD1-CD2 4.07Å; I260-L435 HydrophobicContact CG2-CD1 4.13Å; V431-L435 HydrophobicContact CG1-CD1 3.48Å; V431-L435 VanDerWaalsContact CG1-CD1 3.48Å; V431-L435 HydrophobicContact CG1-CG 4.01Å; V431-L435 WeakPolarHBondContact O-CG 3.33Å; V431-L435 PolarHBondContact O-N 2.95Å; P432-L435 PolarHBondContact O-N 3.21Å; L435-S437 PolarHBondContact O-N 3.45Å; L435-P440 HydrophobicContact CB-CB 4.1Å; L435-P440 HydrophobicContact CD1-CB 3.88Å; L435-P440 HydrophobicContact CG-CB 4.41Å
436	L	91	Very high	95.3	Very high	6 Å²	6	32.5 Å²	32.5	3%	0.031	17%	0.17	C	C	.	.			trans	60.9	-19.9	178.7	-57.6	175.5	0	0	0	116.6	Y126 Y376 P377 G378 Y379 P432 F433	Y126-L436 HydrophobicContact CE1-CD1 4.47Å; Y126-L436 HydrophobicContact CE2-CD1 3.94Å; Y126-L436 HydrophobicContact CE2-CG 4.42Å; Y126-L436 WeakPolarHBondContact OH-CD2 3.21Å; Y126-L436 WeakPolarHBondContact OH-CG 3.49Å; Y376-L436 HydrophobicContact CD1-CB 3.96Å; Y376-L436 HydrophobicContact CD2-CD1 4.25Å; Y376-L436 HydrophobicContact CD2-CD2 3.89Å; Y376-L436 HydrophobicContact CD2-CG 4.46Å; Y376-L436 HydrophobicContact CE1-CB 4.48Å; Y376-L436 HydrophobicContact CE1-CD1 4.49Å; Y376-L436 HydrophobicContact CE2-CD1 4.08Å; Y376-L436 HydrophobicContact CE2-CD2 4.49Å; Y376-L436 HydrophobicContact CG-CB 4.01Å; Y376-L436 HydrophobicContact CG-CD1 4.5Å; Y376-L436 HydrophobicContact CG-CD2 4.03Å; Y376-L436 HydrophobicContact CG-CG 4.41Å; P377-L436 WeakPolarHBondContact CD-O 3.36Å; G378-L436 PolarHBondContact N-O 3.24Å; Y379-L436 HydrophobicContact CD1-CD2 4.35Å; Y379-L436 HydrophobicContact CE1-CD2 3.5Å; Y379-L436 WeakPolarHBondContact OH-CD2 3.37Å; P432-L436 PolarHBondContact O-N 3.46Å; F433-L436 WeakPolarHBondContact O-CD2 3.31Å
437	S	89.7	Confident	95.1	Very high	31 Å²	31	32.9 Å²	32.9	22%	0.217	17%	0.174	C	C	.	.	S	Bend	trans	-115	151.4	-168.2	-177.1	0	0	0	0	113.6	Y123 L435 P440 S441	Y123-S437 WeakPolarHBondContact OH-CB 3.5Å; L435-S437 PolarHBondContact O-N 3.45Å; S437-P440 WeakPolarHBondContact OG-CD 3.49Å; S437-S441 VanDerWaalsContact O-CB 3.3Å; S437-S441 WeakPolarHBondContact O-CB 3.43Å; S437-S441 PolarHBondContact O-N 2.89Å; S437-S441 PolarHBondContact O-OG 3.2Å
438	I	92.4	Very high	95	Very high	91 Å²	91	33.1 Å²	33.1	47%	0.467	17%	0.174	S	C	.	.	H	α-helix	trans	-61.6	-58.5	-179.3	-64.4	-177.8	0	0	0	111.3	P377 S441 F442	P377-I438 HydrophobicContact CB-CD1 3.89Å; P377-I438 HydrophobicContact CB-CG1 3.27Å; P377-I438 HydrophobicContact CG-CD1 4.02Å; P377-I438 HydrophobicContact CG-CG1 3.72Å; I438-S441 WeakPolarHBondContact O-CB 3.49Å; I438-S441 PolarHBondContact O-N 2.9Å; I438-S441 VanDerWaalsContact O-N 3.11Å; I438-F442 HydrophobicContact CG2-CD2 3.55Å; I438-F442 HydrophobicContact CG2-CE2 3.73Å; I438-F442 WeakPolarHBondContact O-CD2 3.45Å; I438-F442 PolarHBondContact O-N 2.78Å
439	K	94.5	Very high	94.9	Very high	156 Å²	156	40.7 Å²	40.7	68%	0.678	20%	0.204	S	C	*	.	H	α-helix	trans	-58.8	-53.2	-171.3	172.5	-177.4	-179.6	-174.3	0	112.3	S441 F442 M443	K439-S441 VanDerWaalsContact C-N 3.28Å; K439-S441 PolarHBondContact O-N 2.84Å; K439-F442 PolarHBondContact O-N 3.02Å; K439-M443 HydrophobicContact CG-SD 4.09Å; K439-M443 WeakPolarHBondContact O-CG 3.27Å; K439-M443 PolarHBondContact O-N 3.38Å
440	P	94.4	Very high	94.9	Very high	31 Å²	31	44.6 Å²	44.6	20%	0.201	22%	0.218	C	C	.	.	H	α-helix	trans	-53	-42.3	172.7	-31.7	40.2	0	0	0	113.8	I260 L435 S437 M443 F444	I260-P440 HydrophobicContact CD1-CB 3.59Å; I260-P440 HydrophobicContact CD1-CG 4.4Å; L435-P440 HydrophobicContact CB-CB 4.1Å; L435-P440 HydrophobicContact CD1-CB 3.88Å; L435-P440 HydrophobicContact CG-CB 4.41Å; S437-P440 WeakPolarHBondContact OG-CD 3.49Å; P440-M443 PolarHBondContact O-N 2.91Å; P440-F444 PolarHBondContact O-N 3.37Å
441	S	96.4	Very high	94.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-42.4	-178.6	-58.8	0	0	0	0	112.6	L381 P432 S437 I438 K439 F444 Y445	L381-S441 VanDerWaalsContact CD1-CB 3.45Å; P432-S441 WeakPolarHBondContact CA-OG 3.26Å; P432-S441 WeakPolarHBondContact CB-OG 3.49Å; S437-S441 VanDerWaalsContact O-CB 3.3Å; S437-S441 WeakPolarHBondContact O-CB 3.43Å; S437-S441 PolarHBondContact O-N 2.89Å; S437-S441 PolarHBondContact O-OG 3.2Å; I438-S441 WeakPolarHBondContact O-CB 3.49Å; I438-S441 PolarHBondContact O-N 2.9Å; I438-S441 VanDerWaalsContact O-N 3.11Å; K439-S441 VanDerWaalsContact C-N 3.28Å; K439-S441 PolarHBondContact O-N 2.84Å; S441-F444 WeakPolarHBondContact O-CB 3.28Å; S441-F444 PolarHBondContact O-N 3.23Å; S441-Y445 WeakPolarHBondContact O-CD2 3.3Å; S441-Y445 PolarHBondContact O-N 2.93Å
442	F	96.4	Very high	94.9	Very high	90 Å²	90	46 Å²	46	40%	0.395	23%	0.227	S	C	.	.	H	α-helix	trans	-71.7	-33.1	176	-82.3	-78.3	0	0	0	112.6	L381 I438 K439 F444 Y445 S446 Y450	L381-F442 HydrophobicContact CD1-CD2 4.48Å; L381-F442 HydrophobicContact CD1-CE2 4.18Å; L381-F442 HydrophobicContact CD2-CE2 4.14Å; L381-F442 HydrophobicContact CD2-CZ 4.18Å; I438-F442 HydrophobicContact CG2-CD2 3.55Å; I438-F442 HydrophobicContact CG2-CE2 3.73Å; I438-F442 WeakPolarHBondContact O-CD2 3.45Å; I438-F442 PolarHBondContact O-N 2.78Å; K439-F442 PolarHBondContact O-N 3.02Å; F442-F444 VanDerWaalsContact C-N 3.33Å; F442-Y445 PolarHBondContact O-N 3.42Å; F442-S446 WeakPolarHBondContact O-CB 3.34Å; F442-S446 PolarHBondContact O-N 2.9Å; F442-Y450 HydrophobicContact CD1-CE1 4.33Å
443	M	95.3	Very high	94.9	Very high	65 Å²	65	47.5 Å²	47.5	32%	0.32	23%	0.234	S	C	.	.	H	α-helix	trans	-59.7	-44.6	170.7	-73.1	175.2	65.6	0	0	111.2	K439 P440 S446 S447	K439-M443 HydrophobicContact CG-SD 4.09Å; K439-M443 WeakPolarHBondContact O-CG 3.27Å; K439-M443 PolarHBondContact O-N 3.38Å; P440-M443 PolarHBondContact O-N 2.91Å; M443-S446 PolarHBondContact O-N 3.14Å; M443-S447 PolarHBondContact O-N 3.44Å; M443-S447 PolarHBondContact O-OG 2.99Å
444	F	96.8	Very high	95.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-51.3	173.9	173.9	-106.6	0	0	0	112.1	N259 I260 L277 Y428 V431 P440 S441 F442 S446 S447 W448	N259-F444 HydrophobicContact CB-CD2 4.13Å; N259-F444 HydrophobicContact CB-CE2 4.22Å; I260-F444 HydrophobicContact CG2-CB 3.6Å; I260-F444 HydrophobicContact CG2-CD2 4.44Å; I260-F444 HydrophobicContact CG2-CG 4.49Å; L277-F444 HydrophobicContact CD1-CE2 3.9Å; L277-F444 HydrophobicContact CD1-CZ 3.78Å; L277-F444 HydrophobicContact CD2-CZ 4.2Å; Y428-F444 AromaticContact CD2-CE1 3.59Å; Y428-F444 HydrophobicContact CD2-CE1 3.59Å; Y428-F444 AromaticContact CD2-CZ 3.72Å; Y428-F444 HydrophobicContact CD2-CZ 3.72Å; Y428-F444 AromaticContact CE2-CE1 3.79Å; Y428-F444 HydrophobicContact CE2-CE1 3.79Å; Y428-F444 HydrophobicContact CE2-CZ 4.19Å; Y428-F444 HydrophobicContact CG-CE1 4.16Å; Y428-F444 HydrophobicContact CG-CZ 4.46Å; V431-F444 HydrophobicContact CB-CD1 3.87Å; V431-F444 HydrophobicContact CB-CE1 3.75Å; V431-F444 HydrophobicContact CB-CE2 4.48Å; V431-F444 HydrophobicContact CB-CG 4.3Å; V431-F444 HydrophobicContact CB-CZ 4.09Å; V431-F444 HydrophobicContact CG1-CB 4.07Å; V431-F444 HydrophobicContact CG1-CD1 3.57Å; V431-F444 HydrophobicContact CG1-CD2 3.93Å; V431-F444 HydrophobicContact CG1-CE1 3.96Å; V431-F444 HydrophobicContact CG1-CE2 4.27Å; V431-F444 HydrophobicContact CG1-CG 3.57Å; V431-F444 HydrophobicContact CG1-CZ 4.3Å; V431-F444 HydrophobicContact CG2-CD1 4.37Å; V431-F444 HydrophobicContact CG2-CD2 4.45Å; V431-F444 HydrophobicContact CG2-CE1 3.9Å; V431-F444 HydrophobicContact CG2-CE2 3.98Å; V431-F444 HydrophobicContact CG2-CZ 3.7Å; P440-F444 PolarHBondContact O-N 3.37Å; S441-F444 WeakPolarHBondContact O-CB 3.28Å; S441-F444 PolarHBondContact O-N 3.23Å; F442-F444 VanDerWaalsContact C-N 3.33Å; F444-S446 VanDerWaalsContact C-N 3.31Å; F444-S446 PolarHBondContact O-N 3.3Å; F444-S447 PolarHBondContact O-N 2.98Å; F444-S447 PolarHBondContact O-OG 2.89Å; F444-W448 AromaticContact CD2-CD1 3.88Å; F444-W448 AromaticContact CD2-NE1 3.9Å; F444-W448 AromaticContact CE2-CD1 3.55Å; F444-W448 AromaticContact CE2-CE2 3.93Å; F444-W448 HydrophobicContact CE2-CG 4.35Å; F444-W448 AromaticContact CE2-NE1 3.25Å; F444-W448 AromaticContact CZ-CD1 3.95Å; F444-W448 HydrophobicContact CZ-CD2 4.41Å; F444-W448 HydrophobicContact CZ-CG 4.34Å; F444-W448 AromaticContact CZ-NE1 3.81Å; F444-W448 VanDerWaalsContact O-CD1 3.3Å; F444-W448 PolarHBondContact O-N 2.83Å
445	Y	97.1	Very high	95.2	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-64.1	-37.6	-178.9	-67.5	-31.2	0	0	0	113	T385 Y428 P432 S441 F442 W448 Y449 Y450 H453	T385-Y445 PolarHBondContact OG1-OH 2.98Å; T385-Y445 VanDerWaalsContact OG1-OH 3.05Å; Y428-Y445 HydrophobicContact CD1-CE1 4.18Å; Y428-Y445 AromaticContact CE1-CD1 3.89Å; Y428-Y445 HydrophobicContact CE1-CD1 3.89Å; Y428-Y445 AromaticContact CE1-CE1 3.64Å; Y428-Y445 HydrophobicContact CE1-CE1 3.64Å; Y428-Y445 AromaticContact CE2-CD1 3.96Å; Y428-Y445 HydrophobicContact CE2-CD1 3.96Å; Y428-Y445 HydrophobicContact CE2-CE1 4.31Å; Y428-Y445 AromaticContact CZ-CD1 3.44Å; Y428-Y445 VanDerWaalsContact CZ-CD1 3.44Å; Y428-Y445 AromaticContact CZ-CE1 3.71Å; Y428-Y445 VanDerWaalsContact OH-CD1 3.28Å; Y428-Y445 WeakPolarHBondContact OH-CD1 3.28Å; P432-Y445 HydrophobicContact CG-CE1 4.16Å; P432-Y445 HydrophobicContact CG-CE2 4.03Å; P432-Y445 WeakPolarHBondContact CG-OH 3.4Å; S441-Y445 WeakPolarHBondContact O-CD2 3.3Å; S441-Y445 PolarHBondContact O-N 2.93Å; F442-Y445 PolarHBondContact O-N 3.42Å; Y445-W448 CarbonylContact O-C 2.77Å; Y445-W448 PolarHBondContact O-N 3.34Å; Y445-Y449 PolarHBondContact O-N 3.09Å; Y445-Y449 VanDerWaalsContact O-N 3.13Å; Y445-Y450 VanDerWaalsContact CB-CE1 3.43Å; Y445-Y450 HydrophobicContact CD2-CE1 4.44Å; Y445-Y450 HydrophobicContact CG-CD1 4.49Å; Y445-Y450 HydrophobicContact CG-CE1 4.35Å; Y445-Y450 PolarHBondContact O-N 3.14Å; Y445-H453 AromaticContact CD1-CE1 3.8Å; Y445-H453 AromaticContact CD2-CE1 4Å; Y445-H453 AromaticContact CE1-CE1 3.67Å; Y445-H453 AromaticContact CE2-CE1 3.86Å; Y445-H453 AromaticContact CG-CE1 3.95Å; Y445-H453 AromaticContact CZ-CE1 3.66Å
446	S	95.7	Very high	95.5	Very high	66 Å²	66	53 Å²	53	46%	0.462	26%	0.264	S	S	.	.	H	α-helix	trans	-65.3	-40.7	176.5	-168.6	0	0	0	0	112.2	F442 M443 F444 W448 Y449	F442-S446 WeakPolarHBondContact O-CB 3.34Å; F442-S446 PolarHBondContact O-N 2.9Å; M443-S446 PolarHBondContact O-N 3.14Å; F444-S446 VanDerWaalsContact C-N 3.31Å; F444-S446 PolarHBondContact O-N 3.3Å; S446-W448 PolarHBondContact O-N 3.43Å; S446-Y449 WeakPolarHBondContact O-CA 3.1Å; S446-Y449 PolarHBondContact O-N 2.9Å
447	S	94.4	Very high	95.7	Very high	18 Å²	18	56.9 Å²	56.9	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-69.9	-19.9	178.3	73.2	0	0	0	0	113.3	Q265 M443 F444	Q265-S447 PolarHBondContact NE2-OG 3.3Å; M443-S447 PolarHBondContact O-N 3.44Å; M443-S447 PolarHBondContact O-OG 2.99Å; F444-S447 PolarHBondContact O-N 2.98Å; F444-S447 PolarHBondContact O-OG 2.89Å
448	W	95.4	Very high	96.1	Very high	10 Å²	10	59.3 Å²	59.3	4%	0.038	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	7.5	169.5	-76.8	68.9	0	0	0	113.3	W270 K273 I274 L277 Y428 F444 Y445 S446 Y450 C451	W270-W448 HydrophobicContact CZ3-CD2 4.17Å; W270-W448 HydrophobicContact CZ3-CE3 4.01Å; W270-W448 HydrophobicContact CZ3-CZ3 4.36Å; K273-W448 HydrophobicContact CB-CZ2 4.28Å; I274-W448 HydrophobicContact CB-CH2 4.41Å; I274-W448 HydrophobicContact CG1-CH2 3.7Å; I274-W448 HydrophobicContact CG1-CZ3 4.14Å; L277-W448 HydrophobicContact CB-CH2 4.31Å; L277-W448 HydrophobicContact CB-CZ2 3.95Å; L277-W448 HydrophobicContact CD2-CH2 3.4Å; L277-W448 HydrophobicContact CD2-CZ2 3.46Å; L277-W448 VanDerWaalsContact CD2-CZ2 3.46Å; L277-W448 HydrophobicContact CD2-CZ3 4.13Å; L277-W448 HydrophobicContact CG-CH2 4.46Å; L277-W448 HydrophobicContact CG-CZ2 4.24Å; Y428-W448 HydrophobicContact CD2-CD2 4.14Å; Y428-W448 HydrophobicContact CD2-CE3 4.01Å; Y428-W448 HydrophobicContact CD2-CG 4.37Å; Y428-W448 HydrophobicContact CE2-CB 3.71Å; Y428-W448 HydrophobicContact CE2-CD2 4.18Å; Y428-W448 HydrophobicContact CE2-CE3 4.21Å; Y428-W448 AromaticContact CE2-CG 3.98Å; Y428-W448 HydrophobicContact CE2-CG 3.98Å; F444-W448 AromaticContact CD2-CD1 3.88Å; F444-W448 AromaticContact CD2-NE1 3.9Å; F444-W448 AromaticContact CE2-CD1 3.55Å; F444-W448 AromaticContact CE2-CE2 3.93Å; F444-W448 HydrophobicContact CE2-CG 4.35Å; F444-W448 AromaticContact CE2-NE1 3.25Å; F444-W448 AromaticContact CZ-CD1 3.95Å; F444-W448 HydrophobicContact CZ-CD2 4.41Å; F444-W448 HydrophobicContact CZ-CG 4.34Å; F444-W448 AromaticContact CZ-NE1 3.81Å; F444-W448 VanDerWaalsContact O-CD1 3.3Å; F444-W448 PolarHBondContact O-N 2.83Å; Y445-W448 CarbonylContact O-C 2.77Å; Y445-W448 PolarHBondContact O-N 3.34Å; S446-W448 PolarHBondContact O-N 3.43Å; W448-Y450 PolarHBondContact O-N 3.16Å; W448-Y450 VanDerWaalsContact O-N 3.08Å; W448-C451 VanDerWaalsContact O-CB 3.27Å; W448-C451 WeakPolarHBondContact O-CB 3.46Å; W448-C451 PolarHBondContact O-N 3.27Å; W448-C451 PolarHBondContact O-SG 2.95Å
449	Y	95.8	Very high	96.2	Very high	159 Å²	159	55.7 Å²	55.7	62%	0.624	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	28.2	-179.2	-52.8	-85.4	0	0	0	113.9	W270 Y445 S446 C451 I454	W270-Y449 AromaticContact CH2-CD2 3.88Å; W270-Y449 HydrophobicContact CH2-CD2 3.88Å; W270-Y449 HydrophobicContact CH2-CE2 4.15Å; W270-Y449 AromaticContact CZ2-CD2 3.62Å; W270-Y449 HydrophobicContact CZ2-CD2 3.62Å; W270-Y449 AromaticContact CZ2-CE2 3.57Å; W270-Y449 HydrophobicContact CZ2-CE2 3.57Å; Y445-Y449 PolarHBondContact O-N 3.09Å; Y445-Y449 VanDerWaalsContact O-N 3.13Å; S446-Y449 WeakPolarHBondContact O-CA 3.1Å; S446-Y449 PolarHBondContact O-N 2.9Å; Y449-C451 PolarHBondContact O-N 3.36Å; Y449-I454 WeakPolarHBondContact O-CD1 3.43Å
450	Y	97.3	Very high	96.3	Very high	86 Å²	86	50.6 Å²	50.6	34%	0.337	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	26.5	-174.7	-56.7	-92.3	0	0	0	113.6	F442 Y445 W448 L452 H453 I454	F442-Y450 HydrophobicContact CD1-CE1 4.33Å; Y445-Y450 VanDerWaalsContact CB-CE1 3.43Å; Y445-Y450 HydrophobicContact CD2-CE1 4.44Å; Y445-Y450 HydrophobicContact CG-CD1 4.49Å; Y445-Y450 HydrophobicContact CG-CE1 4.35Å; Y445-Y450 PolarHBondContact O-N 3.14Å; W448-Y450 PolarHBondContact O-N 3.16Å; W448-Y450 VanDerWaalsContact O-N 3.08Å; Y450-L452 VanDerWaalsContact C-N 3.35Å; Y450-L452 PolarHBondContact O-N 2.9Å; Y450-H453 PolarHBondContact O-N 2.95Å; Y450-I454 WeakPolarHBondContact O-CG1 3.27Å; Y450-I454 PolarHBondContact O-N 3.39Å
451	C	96.1	Very high	96.3	Very high	47 Å²	47	55.4 Å²	55.4	32%	0.318	28%	0.279	S	S	.	.	H	α-helix	trans	-57.9	-42.1	-164.8	64.4	0	0	0	0	113.6	W448 Y449 L455	W448-C451 VanDerWaalsContact O-CB 3.27Å; W448-C451 WeakPolarHBondContact O-CB 3.46Å; W448-C451 PolarHBondContact O-N 3.27Å; W448-C451 PolarHBondContact O-SG 2.95Å; Y449-C451 PolarHBondContact O-N 3.36Å; C451-L455 VanDerWaalsContact O-CB 3.28Å; C451-L455 WeakPolarHBondContact O-CB 3.5Å; C451-L455 PolarHBondContact O-N 3.38Å
452	L	96.6	Very high	96.2	Very high	31 Å²	31	61.8 Å²	61.8	16%	0.162	31%	0.313	C	S	.	.	H	α-helix	trans	-74.9	-31	178.9	-64.7	-169.2	0	0	0	112.5	M389 A425 Y428 Y450 L455 G456	M389-L452 HydrophobicContact CE-CB 3.68Å; M389-L452 WeakPolarHBondContact CE-O 3.39Å; M389-L452 HydrophobicContact SD-CB 4.36Å; A425-L452 HydrophobicContact CB-CD1 4.32Å; Y428-L452 HydrophobicContact CD1-CB 3.96Å; Y428-L452 HydrophobicContact CD1-CD1 3.86Å; Y428-L452 HydrophobicContact CD1-CG 4.33Å; Y428-L452 HydrophobicContact CD2-CD1 4.19Å; Y428-L452 HydrophobicContact CE1-CB 3.9Å; Y428-L452 HydrophobicContact CG-CB 4.42Å; Y428-L452 HydrophobicContact CG-CD1 3.64Å; Y428-L452 HydrophobicContact CG-CG 4.29Å; Y450-L452 VanDerWaalsContact C-N 3.35Å; Y450-L452 PolarHBondContact O-N 2.9Å; L452-L455 HydrophobicContact CD2-CD2 4.29Å; L452-G456 PolarHBondContact O-N 2.65Å
453	H	98.1	Very high	96.1	Very high	31 Å²	31	59.3 Å²	59.3	14%	0.144	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-48	172.3	-63	97.1	0	0	0	110.6	T385 L388 Y428 Y445 Y450 L455 G456 I457	T385-H453 PolarHBondContact OG1-NE2 2.95Å; L388-H453 HydrophobicContact CD2-CB 4.08Å; Y428-H453 AromaticContact CE1-CE1 3.41Å; Y428-H453 VanDerWaalsContact CE1-CE1 3.41Å; Y428-H453 WeakPolarHBondContact CE1-CE1 3.42Å; Y428-H453 AromaticContact CE1-ND1 3.57Å; Y428-H453 AromaticContact CZ-CE1 3.79Å; Y428-H453 AromaticContact CZ-ND1 3.72Å; Y428-H453 PolarHBondContact OH-CE1 3.37Å; Y428-H453 PolarHBondContact OH-ND1 3.11Å; Y445-H453 AromaticContact CD1-CE1 3.8Å; Y445-H453 AromaticContact CD2-CE1 4Å; Y445-H453 AromaticContact CE1-CE1 3.67Å; Y445-H453 AromaticContact CE2-CE1 3.86Å; Y445-H453 AromaticContact CG-CE1 3.95Å; Y445-H453 AromaticContact CZ-CE1 3.66Å; Y450-H453 PolarHBondContact O-N 2.95Å; H453-L455 PolarHBondContact O-N 3.27Å; H453-G456 PolarHBondContact O-N 3.41Å; H453-I457 VanDerWaalsContact O-CG1 3.28Å; H453-I457 WeakPolarHBondContact O-CG1 3.31Å; H453-I457 PolarHBondContact O-N 3.33Å
454	I	98	Very high	95.7	Very high	89 Å²	89	60.3 Å²	60.3	46%	0.456	31%	0.314	S	S	.	.	H	α-helix	trans	-59.1	-49.4	177.4	-64.4	168	0	0	0	109.8	Y449 Y450 G456 I457 L458	Y449-I454 WeakPolarHBondContact O-CD1 3.43Å; Y450-I454 WeakPolarHBondContact O-CG1 3.27Å; Y450-I454 PolarHBondContact O-N 3.39Å; I454-G456 PolarHBondContact O-N 3.22Å; I454-I457 PolarHBondContact O-N 2.92Å; I454-L458 HydrophobicContact CG2-CD1 3.92Å; I454-L458 HydrophobicContact CG2-CG 4.36Å; I454-L458 WeakPolarHBondContact O-CB 3.38Å; I454-L458 VanDerWaalsContact O-CG 3.31Å; I454-L458 WeakPolarHBondContact O-CG 3.22Å; I454-L458 PolarHBondContact O-N 2.77Å
455	L	96.6	Very high	94.8	Very high	99 Å²	99	63.7 Å²	63.7	52%	0.518	34%	0.335	S	S	.	.	H	α-helix	trans	-59.1	-45.2	177.4	-179.1	62.5	0	0	0	111.9	C451 L452 H453 I457 L458 V459	C451-L455 VanDerWaalsContact O-CB 3.28Å; C451-L455 WeakPolarHBondContact O-CB 3.5Å; C451-L455 PolarHBondContact O-N 3.38Å; L452-L455 HydrophobicContact CD2-CD2 4.29Å; H453-L455 PolarHBondContact O-N 3.27Å; L455-I457 VanDerWaalsContact C-N 3.34Å; L455-I457 PolarHBondContact O-N 3.04Å; L455-L458 PolarHBondContact O-N 2.99Å; L455-V459 HydrophobicContact CD1-CG2 4.38Å; L455-V459 WeakPolarHBondContact O-CB 3.28Å; L455-V459 VanDerWaalsContact O-CG2 3.26Å; L455-V459 WeakPolarHBondContact O-CG2 3.37Å; L455-V459 PolarHBondContact O-N 2.79Å
456	G	96.6	Very high	93.5	Very high	3 Å²	3	71.3 Å²	71.3	3%	0.031	37%	0.368	C	S	.	.	H	α-helix	trans	-60.6	-42.4	178	0	0	0	0	0	112.5	L452 H453 I454 L460	L452-G456 PolarHBondContact O-N 2.65Å; H453-G456 PolarHBondContact O-N 3.41Å; I454-G456 PolarHBondContact O-N 3.22Å; G456-L460 WeakPolarHBondContact O-CG 3.33Å; G456-L460 PolarHBondContact O-N 2.8Å; G456-L460 VanDerWaalsContact O-N 3.14Å
457	I	97.1	Very high	91.8	Very high	87 Å²	87	77.4 Å²	77.4	45%	0.446	39%	0.387	S	S	.	.	H	α-helix	trans	-65.5	-47.7	176.7	-68.3	165.1	0	0	0	110.3	L388 H453 I454 L455 V459 L460 L461	L388-I457 HydrophobicContact CD1-CG1 4.01Å; L388-I457 HydrophobicContact CD2-CG1 4.16Å; H453-I457 VanDerWaalsContact O-CG1 3.28Å; H453-I457 WeakPolarHBondContact O-CG1 3.31Å; H453-I457 PolarHBondContact O-N 3.33Å; I454-I457 PolarHBondContact O-N 2.92Å; L455-I457 VanDerWaalsContact C-N 3.34Å; L455-I457 PolarHBondContact O-N 3.04Å; I457-V459 VanDerWaalsContact C-N 3.32Å; I457-V459 PolarHBondContact O-N 3.1Å; I457-L460 PolarHBondContact O-N 2.84Å; I457-L460 VanDerWaalsContact O-N 3.09Å; I457-L461 HydrophobicContact CG2-CD1 3.82Å; I457-L461 HydrophobicContact CG2-CG 4.25Å; I457-L461 WeakPolarHBondContact O-CG 3.45Å; I457-L461 PolarHBondContact O-N 3.26Å
458	L	96.8	Very high	89.9	Confident	82 Å²	82	80.9 Å²	80.9	43%	0.429	41%	0.407	S	S	.	.	H	α-helix	trans	-58.3	-44	177.8	-71.5	173.2	0	0	0	111.7	I454 L455 L460 L461 L462	I454-L458 HydrophobicContact CG2-CD1 3.92Å; I454-L458 HydrophobicContact CG2-CG 4.36Å; I454-L458 WeakPolarHBondContact O-CB 3.38Å; I454-L458 VanDerWaalsContact O-CG 3.31Å; I454-L458 WeakPolarHBondContact O-CG 3.22Å; I454-L458 PolarHBondContact O-N 2.77Å; L455-L458 PolarHBondContact O-N 2.99Å; L458-L460 VanDerWaalsContact C-N 3.3Å; L458-L460 PolarHBondContact O-N 3.13Å; L458-L461 PolarHBondContact O-N 3.47Å; L458-L462 HydrophobicContact CB-CD1 4.45Å; L458-L462 VanDerWaalsContact O-CB 3.28Å; L458-L462 WeakPolarHBondContact O-CB 3.39Å; L458-L462 VanDerWaalsContact O-CG 3.22Å; L458-L462 WeakPolarHBondContact O-CG 3.04Å; L458-L462 PolarHBondContact O-N 3.37Å
459	V	95.8	Very high	87.4	Confident	15 Å²	15	87.6 Å²	87.6	9%	0.091	44%	0.439	C	S	.	.	H	α-helix	trans	-56.9	-44.1	174.9	163	0	0	0	0	111.4	A392 A395 M396 L455 I457 L463	A392-V459 HydrophobicContact CB-CB 4.28Å; A392-V459 HydrophobicContact CB-CG1 3.95Å; A392-V459 WeakPolarHBondContact O-CG1 3.45Å; A395-V459 HydrophobicContact CB-CG1 3.99Å; M396-V459 HydrophobicContact CG-CG1 3.78Å; M396-V459 HydrophobicContact CG-CG2 4.08Å; M396-V459 HydrophobicContact SD-CG1 4.02Å; M396-V459 HydrophobicContact SD-CG2 3.7Å; L455-V459 HydrophobicContact CD1-CG2 4.38Å; L455-V459 WeakPolarHBondContact O-CB 3.28Å; L455-V459 VanDerWaalsContact O-CG2 3.26Å; L455-V459 WeakPolarHBondContact O-CG2 3.37Å; L455-V459 PolarHBondContact O-N 2.79Å; I457-V459 VanDerWaalsContact C-N 3.32Å; I457-V459 PolarHBondContact O-N 3.1Å; V459-L463 HydrophobicContact CG1-CD1 3.94Å; V459-L463 VanDerWaalsContact O-CB 3.27Å; V459-L463 WeakPolarHBondContact O-CB 3.44Å; V459-L463 WeakPolarHBondContact O-CG 3.21Å; V459-L463 PolarHBondContact O-N 2.93Å
460	L	94.9	Very high	85.3	Confident	49 Å²	49	85.8 Å²	85.8	26%	0.257	43%	0.431	S	S	.	.	H	α-helix	trans	-73	-28	-179.6	-68.4	178.2	0	0	0	113.7	L388 L391 A392 A395 G456 I457 L458 V465	L388-L460 HydrophobicContact CD1-CD1 3.64Å; L391-L460 HydrophobicContact CB-CD1 4.03Å; L391-L460 HydrophobicContact CB-CD2 3.85Å; A392-L460 HydrophobicContact CB-CG 4.39Å; A395-L460 HydrophobicContact CB-CD2 4.36Å; G456-L460 WeakPolarHBondContact O-CG 3.33Å; G456-L460 PolarHBondContact O-N 2.8Å; G456-L460 VanDerWaalsContact O-N 3.14Å; I457-L460 PolarHBondContact O-N 2.84Å; I457-L460 VanDerWaalsContact O-N 3.09Å; L458-L460 VanDerWaalsContact C-N 3.3Å; L458-L460 PolarHBondContact O-N 3.13Å; L460-V465 HydrophobicContact CD2-CG2 3.9Å
461	L	94.9	Very high	82.7	Confident	132 Å²	132	89.3 Å²	89.3	69%	0.691	44%	0.444	S	S	*	.	H	α-helix	trans	-78.2	-37.6	175.4	-69.2	175.3	0	0	0	112.2	I457 L458	I457-L461 HydrophobicContact CG2-CD1 3.82Å; I457-L461 HydrophobicContact CG2-CG 4.25Å; I457-L461 WeakPolarHBondContact O-CG 3.45Å; I457-L461 PolarHBondContact O-N 3.26Å; L458-L461 PolarHBondContact O-N 3.47Å
462	L	94.8	Very high	79.9	Confident	135 Å²	135	93.4 Å²	93.4	71%	0.707	46%	0.456	S	S	*	.	H	α-helix	trans	-93.9	-28.3	-171	-62.9	174.5	0	0	0	113.8	L458	L458-L462 HydrophobicContact CB-CD1 4.45Å; L458-L462 VanDerWaalsContact O-CB 3.28Å; L458-L462 WeakPolarHBondContact O-CB 3.39Å; L458-L462 VanDerWaalsContact O-CG 3.22Å; L458-L462 WeakPolarHBondContact O-CG 3.04Å; L458-L462 PolarHBondContact O-N 3.37Å
463	L	93.4	Very high	77.1	Confident	37 Å²	37	96.4 Å²	96.4	19%	0.194	47%	0.472	C	S	.	.	S	Bend	trans	-103	143.5	-176.2	-57.6	-176.7	0	0	0	112.3	A395 M396 N399 F400 V459 V465	A395-L463 HydrophobicContact CB-CB 4.47Å; M396-L463 HydrophobicContact SD-CD1 3.61Å; N399-L463 HydrophobicContact CB-CD1 4.4Å; F400-L463 HydrophobicContact CD2-CD1 4.4Å; F400-L463 HydrophobicContact CE2-CD1 3.63Å; F400-L463 HydrophobicContact CE2-CD2 4.15Å; F400-L463 HydrophobicContact CZ-CD1 4.44Å; F400-L463 HydrophobicContact CZ-CD2 4.17Å; V459-L463 HydrophobicContact CG1-CD1 3.94Å; V459-L463 VanDerWaalsContact O-CB 3.27Å; V459-L463 WeakPolarHBondContact O-CB 3.44Å; V459-L463 WeakPolarHBondContact O-CG 3.21Å; V459-L463 PolarHBondContact O-N 2.93Å; L463-V465 PolarHBondContact O-N 3.37Å
464	P	86.8	Confident	74.5	Confident	86 Å²	86	98.8 Å²	98.8	56%	0.558	49%	0.489	S	S	*	.			trans	-67.6	122.3	175.7	28.5	-32.9	0	0	0	109.9	N399	N399-P464 PolarHBondContact ND2-O 3.18Å; N399-P464 VanDerWaalsContact ND2-O 3.13Å; N399-P464 WeakPolarHBondContact OD1-CD 3.33Å; N399-P464 WeakPolarHBondContact OD1-CG 3.31Å
465	V	79.2	Confident	71.8	Confident	72 Å²	72	99.5 Å²	99.5	44%	0.436	49%	0.49	S	S	.	.			trans	-91.9	101.7	173.2	-174.9	0	0	0	0	108.3	A395 L460 L463 K467	A395-V465 HydrophobicContact CB-CG2 4.25Å; L460-V465 HydrophobicContact CD2-CG2 3.9Å; L463-V465 PolarHBondContact O-N 3.37Å; V465-K467 PolarHBondContact O-N 3.07Å
466	K	70.3	Confident	69	Low	164 Å²	164	99 Å²	99	71%	0.713	49%	0.485	S	S	*	.			trans	-58.8	113.2	172.4	-73.1	-172	179.6	-179.4	0	109.1	T468	K466-T468 PolarHBondContact O-N 3.28Å
467	K	58.7	Low	66.4	Low	194 Å²	194	104.1 Å²	104.1	84%	0.843	51%	0.512	S	S	*	.			trans	-61.9	123.2	168.9	-71	-175.9	-179.6	178.5	0	107.5	V465 Q469	V465-K467 PolarHBondContact O-N 3.07Å; K467-Q469 PolarHBondContact O-N 3.42Å
468	T	54.3	Low	64	Low	90 Å²	90	103.1 Å²	103.1	55%	0.552	51%	0.507	S	S	*	.			trans	-61.8	103.5	170.2	-54.6	0	0	0	0	107.4	K466 R470	K466-T468 PolarHBondContact O-N 3.28Å; T468-R470 VanDerWaalsContact C-N 3.25Å; T468-R470 HydrophobicContact CG2-CB 4.4Å; T468-R470 PolarHBondContact O-N 2.87Å
469	Q	43.1	Very low	61.3	Low	152 Å²	152	105.5 Å²	105.5	71%	0.71	52%	0.516	S	S	*	.			trans	-66.4	84.4	175.2	-75.5	-172.2	-16	0	0	108.9	K467	K467-Q469 PolarHBondContact O-N 3.42Å
470	R	52	Low	58.8	Low	121 Å²	121	109.8 Å²	109.8	46%	0.457	54%	0.538	S	S	.	.			trans	-102.8	-7.8	-177.5	-148.1	-179.1	179	-166.8	-1.4	114.1	Y354 E355 T468	Y354-R470 VanDerWaalsContact CE1-NH1 3.27Å; E355-R470 IonicContact OE1-CZ 3.2Å; E355-R470 IonicContact OE1-NH1 2.96Å; E355-R470 IonicContact OE1-NH2 2.65Å; E355-R470 PolarHBondContact OE1-NH2 3.35Å; T468-R470 VanDerWaalsContact C-N 3.25Å; T468-R470 HydrophobicContact CG2-CB 4.4Å; T468-R470 PolarHBondContact O-N 2.87Å
471	R	42.9	Very low	56.2	Low	159 Å²	159	110.6 Å²	110.6	60%	0.6	55%	0.547	S	S	*	.	S	Bend	trans	-126.6	-7.7	-173.8	-139.6	-179.2	-176	-179.4	1.6	116.7	H475	R471-H475 PolarHBondContact O-N 3.45Å
472	K	36.5	Very low	53.7	Low	134 Å²	134	109.8 Å²	109.8	58%	0.583	54%	0.54	S	S	*	.	H	α-helix	trans	-69.1	-46.9	174.4	-117.5	-173.5	174.9	-164.5	0	111	T474 H475 E476	K472-T474 VanDerWaalsContact C-N 3.33Å; K472-T474 PolarHBondContact O-N 3.28Å; K472-H475 PolarHBondContact O-N 2.99Å; K472-E476 WeakPolarHBondContact O-CB 3.48Å; K472-E476 WeakPolarHBondContact O-CG 3.31Å; K472-E476 PolarHBondContact O-N 2.69Å
473	N	39	Very low	51	Low	94 Å²	94	106.3 Å²	106.3	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-67.9	-28.4	-177.4	-59.2	13	0	0	0	113.7	N477	N473-N477 VanDerWaalsContact O-CB 3.24Å; N473-N477 WeakPolarHBondContact O-CB 3.13Å; N473-N477 VanDerWaalsContact O-CG 3.27Å; N473-N477 PolarHBondContact O-N 3.12Å; N473-N477 PolarHBondContact O-ND2 2.84Å
474	T	42.8	Very low	48.7	Very low	80 Å²	80	111.2 Å²	111.2	49%	0.491	55%	0.547	S	S	.	.	H	α-helix	trans	-76.9	-40	177	-47	0	0	0	0	111.5	K472 I478	K472-T474 VanDerWaalsContact C-N 3.33Å; K472-T474 PolarHBondContact O-N 3.28Å; T474-I478 HydrophobicContact CG2-CD1 3.93Å; T474-I478 WeakPolarHBondContact O-CB 3.19Å; T474-I478 WeakPolarHBondContact O-CD1 3.34Å; T474-I478 WeakPolarHBondContact O-CG1 3.34Å; T474-I478 PolarHBondContact O-N 3.45Å
475	H	40.4	Very low	46.6	Very low	104 Å²	104	115 Å²	115	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-71.3	-37.3	174.7	-96	-67.8	0	0	0	112.7	R471 K472 I478 Q479	R471-H475 PolarHBondContact O-N 3.45Å; K472-H475 PolarHBondContact O-N 2.99Å; H475-I478 PolarHBondContact O-N 3.03Å; H475-Q479 WeakPolarHBondContact O-CB 3.45Å; H475-Q479 PolarHBondContact O-N 3.04Å
476	E	39.7	Very low	44.7	Very low	88 Å²	88	118.7 Å²	118.7	41%	0.411	57%	0.565	S	S	.	*	H	α-helix	trans	-65.5	-42	174.2	-77.8	169.3	-177.7	0	0	111.2	K472 I478 Q479 L480	K472-E476 WeakPolarHBondContact O-CB 3.48Å; K472-E476 WeakPolarHBondContact O-CG 3.31Å; K472-E476 PolarHBondContact O-N 2.69Å; E476-I478 PolarHBondContact O-N 3.26Å; E476-Q479 PolarHBondContact O-N 2.92Å; E476-L480 WeakPolarHBondContact O-CB 3.4Å; E476-L480 WeakPolarHBondContact O-CD1 3.47Å; E476-L480 PolarHBondContact O-N 3.11Å
477	N	41.2	Very low	43.4	Very low	111 Å²	111	115.7 Å²	115.7	59%	0.594	56%	0.556	S	S	*	*	H	α-helix	trans	-68.2	-32.7	174.3	-79.2	-26.6	0	0	0	113.2	N473 S481	N473-N477 VanDerWaalsContact O-CB 3.24Å; N473-N477 WeakPolarHBondContact O-CB 3.13Å; N473-N477 VanDerWaalsContact O-CG 3.27Å; N473-N477 PolarHBondContact O-N 3.12Å; N473-N477 PolarHBondContact O-ND2 2.84Å; N477-S481 WeakPolarHBondContact O-CB 3.36Å; N477-S481 PolarHBondContact O-N 3.06Å; N477-S481 PolarHBondContact O-OG 3.48Å
478	I	47.2	Very low	42.7	Very low	67 Å²	67	114 Å²	114	34%	0.344	55%	0.551	S	S	.	*	H	α-helix	trans	-70.7	-41.4	174.3	-70	166	0	0	0	110.5	T474 H475 E476 S481 Q482	T474-I478 HydrophobicContact CG2-CD1 3.93Å; T474-I478 WeakPolarHBondContact O-CB 3.19Å; T474-I478 WeakPolarHBondContact O-CD1 3.34Å; T474-I478 WeakPolarHBondContact O-CG1 3.34Å; T474-I478 PolarHBondContact O-N 3.45Å; H475-I478 PolarHBondContact O-N 3.03Å; E476-I478 PolarHBondContact O-N 3.26Å; I478-S481 WeakPolarHBondContact CA-OG 3.35Å; I478-S481 PolarHBondContact O-N 2.82Å; I478-S481 PolarHBondContact O-OG 3.28Å; I478-Q482 HydrophobicContact CG2-CG 4.48Å; I478-Q482 WeakPolarHBondContact O-CB 3.48Å; I478-Q482 WeakPolarHBondContact O-CG 3.31Å; I478-Q482 PolarHBondContact O-N 3.34Å
479	Q	38.8	Very low	41.8	Very low	132 Å²	132	112.3 Å²	112.3	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-66.1	-40.5	174.3	-85.7	-174.9	-25.9	0	0	112.5	H475 E476 Q482 S483	H475-Q479 WeakPolarHBondContact O-CB 3.45Å; H475-Q479 PolarHBondContact O-N 3.04Å; E476-Q479 PolarHBondContact O-N 2.92Å; Q479-Q482 PolarHBondContact O-N 2.65Å; Q479-S483 VanDerWaalsContact O-CB 3.25Å; Q479-S483 WeakPolarHBondContact O-CB 3.41Å; Q479-S483 PolarHBondContact O-N 3.49Å
480	L	42.9	Very low	41.5	Very low	105 Å²	105	112.4 Å²	112.4	55%	0.55	55%	0.553	S	S	.	*	H	α-helix	trans	-66.7	-36	175.4	-99.3	123.7	0	0	0	112.9	E476 K484	E476-L480 WeakPolarHBondContact O-CB 3.4Å; E476-L480 WeakPolarHBondContact O-CD1 3.47Å; E476-L480 PolarHBondContact O-N 3.11Å; L480-K484 WeakPolarHBondContact O-CB 3.02Å; L480-K484 WeakPolarHBondContact O-CG 3.44Å; L480-K484 PolarHBondContact O-N 2.92Å
481	S	41.4	Very low	40.6	Very low	65 Å²	65	113.8 Å²	113.8	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-76.6	-31.6	176.2	58.1	0	0	0	0	113.1	N477 I478 K485	N477-S481 WeakPolarHBondContact O-CB 3.36Å; N477-S481 PolarHBondContact O-N 3.06Å; N477-S481 PolarHBondContact O-OG 3.48Å; I478-S481 WeakPolarHBondContact CA-OG 3.35Å; I478-S481 PolarHBondContact O-N 2.82Å; I478-S481 PolarHBondContact O-OG 3.28Å; S481-K485 PolarHBondContact O-N 2.97Å
482	Q	41.8	Very low	40.1	Very low	116 Å²	116	110.9 Å²	110.9	54%	0.542	57%	0.573	S	S	.	*	H	α-helix	trans	-71.3	-40.2	170.6	-77	178.6	-21	0	0	112	I478 Q479 K485 F486	I478-Q482 HydrophobicContact CG2-CG 4.48Å; I478-Q482 WeakPolarHBondContact O-CB 3.48Å; I478-Q482 WeakPolarHBondContact O-CG 3.31Å; I478-Q482 PolarHBondContact O-N 3.34Å; Q479-Q482 PolarHBondContact O-N 2.65Å; Q482-K485 PolarHBondContact O-N 3.26Å; Q482-F486 PolarHBondContact O-N 3.15Å
483	S	39	Very low	39.8	Very low	62 Å²	62	113.1 Å²	113.1	43%	0.434	59%	0.591	S	S	.	*	H	α-helix	trans	-61.9	-45.4	174	158.2	0	0	0	0	111.6	Q479 K485 F486 D487	Q479-S483 VanDerWaalsContact O-CB 3.25Å; Q479-S483 WeakPolarHBondContact O-CB 3.41Å; Q479-S483 PolarHBondContact O-N 3.49Å; S483-K485 VanDerWaalsContact C-N 3.3Å; S483-K485 PolarHBondContact O-N 3.31Å; S483-F486 PolarHBondContact O-N 3.42Å; S483-F486 VanDerWaalsContact O-N 3.16Å; S483-D487 PolarHBondContact O-N 2.92Å
484	K	44.2	Very low	39.2	Very low	139 Å²	139	112.2 Å²	112.2	60%	0.604	60%	0.604	S	S	*	*	H	α-helix	trans	-61.9	-34.8	175	-81.2	-175	172.9	-173.1	0	113.6	L480 E488	L480-K484 WeakPolarHBondContact O-CB 3.02Å; L480-K484 WeakPolarHBondContact O-CG 3.44Å; L480-K484 PolarHBondContact O-N 2.92Å; K484-E488 PolarHBondContact O-N 3.3Å; K484-E488 VanDerWaalsContact O-N 3.09Å
485	K	42.6	Very low	38.7	Very low	166 Å²	166	114.1 Å²	114.1	72%	0.722	62%	0.617	S	S	*	*	H	α-helix	trans	-72.5	-27.4	175.7	-95.4	-174.5	173.2	-178.8	0	113.8	S481 Q482 S483 G489	S481-K485 PolarHBondContact O-N 2.97Å; Q482-K485 PolarHBondContact O-N 3.26Å; S483-K485 VanDerWaalsContact C-N 3.3Å; S483-K485 PolarHBondContact O-N 3.31Å; K485-G489 PolarHBondContact O-N 3.41Å
486	F	39.8	Very low	38	Very low	149 Å²	149	116.8 Å²	116.8	65%	0.654	64%	0.635	S	S	*	*	H	α-helix	trans	-75.4	-41.2	173	-97.2	-89.6	0	0	0	111.2	Q482 S483 E488 G489 E490	Q482-F486 PolarHBondContact O-N 3.15Å; S483-F486 PolarHBondContact O-N 3.42Å; S483-F486 VanDerWaalsContact O-N 3.16Å; F486-E488 PolarHBondContact O-N 3.11Å; F486-G489 PolarHBondContact O-N 2.98Å; F486-G489 VanDerWaalsContact O-N 3.15Å; F486-E490 PolarHBondContact O-N 3.13Å
487	D	42.9	Very low	37.3	Very low	101 Å²	101	118.4 Å²	118.4	54%	0.54	66%	0.656	S	S	.	*	H	α-helix	trans	-68.6	-31.2	177.8	-72.8	-26.6	0	0	0	113.4	S483	S483-D487 PolarHBondContact O-N 2.92Å
488	E	43.8	Very low	36.6	Very low	158 Å²	158	122.9 Å²	122.9	74%	0.738	67%	0.67	S	S	*	*	H	α-helix	trans	-78.4	-20.5	172.3	-77.9	-179.5	169.8	0	0	113	K484 F486	K484-E488 PolarHBondContact O-N 3.3Å; K484-E488 VanDerWaalsContact O-N 3.09Å; F486-E488 PolarHBondContact O-N 3.11Å
489	G	34.7	Very low	35.4	Very low	55 Å²	55	124.5 Å²	124.5	57%	0.567	69%	0.688	S	S	*	*	H	α-helix	trans	-85.9	-23.8	-179.9	0	0	0	0	0	114.8	K485 F486	K485-G489 PolarHBondContact O-N 3.41Å; F486-G489 PolarHBondContact O-N 2.98Å; F486-G489 VanDerWaalsContact O-N 3.15Å
490	E	36.9	Very low	34.7	Very low	154 Å²	154	124 Å²	124	72%	0.72	69%	0.694	S	S	*	*	S	Bend	trans	-92.7	-8	-177.7	-80.4	-172.2	156.2	0	0	114.7	F486	F486-E490 PolarHBondContact O-N 3.13Å
491	N	34	Very low	33.9	Very low	151 Å²	151	124.2 Å²	124.2	81%	0.807	70%	0.7	S	S	*	*	S	Bend	trans	-106.3	19.9	-176	-85.5	-30.3	0	0	0	116.3
492	S	32.4	Very low	33.1	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	71%	0.712	S	S	*	*			trans	-127.3	76.1	174.4	72.4	0	0	0	0	113.3
493	L	29.2	Very low	32.3	Very low	182 Å²	182	128.6 Å²	128.6	95%	0.953	72%	0.722	S	S	*	*			trans	-138.2	102.9	164.4	-89.6	160.8	0	0	0	109.9
494	G	26.3	Very low	31.6	Very low	75 Å²	75	131.7 Å²	131.7	77%	0.773	74%	0.738	S	S	*	*			trans	151.3	139.9	162.3	0	0	0	0	0	114.9
495	P	32.6	Very low	30.7	Very low	119 Å²	119	130 Å²	130	77%	0.773	74%	0.743	S	S	*	*			trans	-118.6	161.9	-140.6	36.2	-20.9	0	0	0	117
496	N	26.1	Very low	29.9	Very low	160 Å²	160	128.2 Å²	128.2	86%	0.856	74%	0.741	S	S	*	*			trans	55.4	118.8	151.1	-66.8	-14.5	0	0	0	121.2
497	S	25.1	Very low	29.2	Very low	123 Å²	123	130.6 Å²	130.6	86%	0.86	75%	0.754	S	S	*	*				-175.8	147.7	119.9	59.9	0	0	0	0	113.1
498	F	25.9	Very low	28.5	Very low	204 Å²	204	132.3 Å²	132.3	90%	0.895	76%	0.763	S	S	*	*			trans	-63.1	159.4	-179.6	-92.2	-101.7	0	0	0	116.4
499	S	23.7	Very low	27.7	Very low	102 Å²	102	132.6 Å²	132.6	71%	0.713	76%	0.764	S	S	*	*				118.9	119.2	129.4	90.4	0	0	0	0	119
500	T	23.8	Very low	27.4	Very low	120 Å²	120	137.4 Å²	137.4	74%	0.736	77%	0.772	S	S	*	*			trans	57.6	126.2	133.2	9.8	0	0	0	0	125.1
501	T	24.7	Very low	27	Very low	110 Å²	110	138.3 Å²	138.3	68%	0.675	78%	0.78	S	S	*	*			trans	66.6	129.3	137.7	24.3	0	0	0	0	124
502	N	25.1	Very low	26.7	Very low	135 Å²	135	135 Å²	135	72%	0.722	77%	0.773	S	S	*	*			trans	72.9	133.2	134.7	-72.7	-8.9	0	0	0	123.7
503	N	25	Very low	26.5	Very low	138 Å²	138	135 Å²	135	74%	0.738	77%	0.773	S	S	*	*			trans	85	115.2	139.6	-73.5	-11	0	0	0	122.4
504	V	24.7	Very low	26.4	Very low	127 Å²	127	136.6 Å²	136.6	77%	0.77	77%	0.767	S	S	*	*				42.1	116	116.9	-172.7	0	0	0	0	117.9
505	C	24.6	Very low	26.6	Very low	105 Å²	105	140.7 Å²	140.7	71%	0.709	77%	0.765	S	S	*	*				163.8	130.7	105.3	-155	0	0	0	0	113.1
506	N	26	Very low	26.5	Very low	128 Å²	128	139.9 Å²	139.9	68%	0.684	76%	0.763	S	S	*	*			trans	29.8	131.6	145.8	-72.8	-21.7	0	0	0	122.8
507	Q	26.6	Very low	26.7	Very low	198 Å²	198	137.2 Å²	137.2	93%	0.925	76%	0.757	S	S	*	*				-142.3	114.9	112.8	-111.5	177.7	2.7	0	0	110.7
508	N	26.8	Very low	27.1	Very low	137 Å²	137	138.6 Å²	138.6	73%	0.733	75%	0.754	S	S	*	*			trans	-90.9	144.9	161.4	-85.3	-31.6	0	0	0	108.6
509	Q	26.8	Very low	27.5	Very low	164 Å²	164	138.1 Å²	138.1	77%	0.766	75%	0.751	S	S	*	*				-174.2	112.2	123.5	-104.8	-173.4	-50.5	0	0	109
510	E	29.3	Very low	28	Very low	157 Å²	157	146.1 Å²	146.1	73%	0.734	78%	0.777	S	S	*	*				72.2	123.8	98.2	-77.5	-173.6	140.8	0	0	112.1
511	I	27.7	Very low	28.3	Very low	173 Å²	173	147.4 Å²	147.4	89%	0.887	78%	0.779	S	S	*	*				-144.1	136.6	73.1	-76.3	156.1	0	0	0	111.8
512	A	28.5	Very low	28.5	Very low	80 Å²	80	149.4 Å²	149.4	66%	0.661	79%	0.785	S	S	*	*			trans	-95.2	156.5	171.7	0	0	0	0	0	112.4
513	S	27.9	Very low	28.6	Very low	97 Å²	97	150.2 Å²	150.2	68%	0.678	79%	0.788	S	S	*	*				125	142	119.1	80.6	0	0	0	0	118.5
514	R	28.5	Very low	28.9	Very low	217 Å²	217	150.9 Å²	150.9	82%	0.819	79%	0.791	S	S	*	*			trans	83.7	135.6	156.8	-59.4	176.8	-166.6	-157.5	1.7	116.2
515	H	28.8	Very low	29.1	Very low	160 Å²	160	152.4 Å²	152.4	74%	0.741	79%	0.793	S	S	*	*			cis	-157.8	149.7	22.2	-124.2	-68.3	0	0	0	109.5
516	S	31.4	Very low	29.4	Very low	103 Å²	103	155.5 Å²	155.5	72%	0.72	80%	0.798	S	S	*	*			trans	-85.6	137.7	161.7	54.1	0	0	0	0	111.7
517	S	30.3	Very low	29.7	Very low	103 Å²	103	157.5 Å²	157.5	72%	0.72	81%	0.806	S	S	*	*			trans	175.9	116.8	150	42.8	0	0	0	0	109.8
518	L	32.4	Very low	29.9	Very low	153 Å²	153	154.4 Å²	154.4	80%	0.801	80%	0.797	S	S	*	*				72.6	123.2	99.8	-89.1	154.2	0	0	0	116.5
519	K	34.7	Very low	30.2	Very low	193 Å²	193	155.8 Å²	155.8	84%	0.839	80%	0.802	S	S	*	*			trans	56.6	112	151.8	-70.1	177.7	176.3	-177.9	0	118
520	Q	35.7	Very low	30.5	Very low	270 Å²	270	155.1 Å²	155.1	100%	1.262	81%	0.806	S	S	*	*				-162.1	0	91.8	-141.8	168.6	0.3	0	0	110.6

Retrieved 520 of 520 residues in 1006.5 ms (Link to these results)

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