A0A060XSF0_ONCMY Loading...

DEP domain containing 1B

AlphaFold DB , UniProt , Accession A0A060XSF0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene depdc1b, Length 532 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	39.1	Very low	56.8	Low	243 Å²	243	125.5 Å²	125.5	100%	1.197	69%	0.688	S	S	*	*				0	105.2	0	-76	-174.1	-172.8	0	0	107.6	G3	M1-G3 PolarHBondContact O-N 2.95Å
2	E	35.3	Very low	58.5	Low	205 Å²	205	123.7 Å²	123.7	96%	0.958	66%	0.663	S	S	*	*			trans	-74.7	101	-177.7	-70.5	172.3	154.6	0	0	110.1
3	G	46.2	Very low	59.8	Low	50 Å²	50	120.1 Å²	120.1	52%	0.515	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-77	126.6	173.8	0	0	0	0	0	111.1	M1 M5	M1-G3 PolarHBondContact O-N 2.95Å; G3-M5 PolarHBondContact O-N 3.3Å
4	K	53.9	Low	61.2	Low	195 Å²	195	116.7 Å²	116.7	85%	0.848	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-53.7	123.6	168.9	-86.2	178.5	174	175.6	0	109.7	I6	K4-I6 PolarHBondContact O-N 3.2Å
5	M	58.8	Low	62.4	Low	151 Å²	151	117 Å²	117	74%	0.744	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-63.3	122.9	172.1	-168.1	-178.3	-92.1	0	0	108.9	G3 G7	G3-M5 PolarHBondContact O-N 3.3Å; M5-G7 PolarHBondContact O-N 3.43Å
6	I	68.3	Low	63.7	Low	32 Å²	32	110.8 Å²	110.8	16%	0.164	60%	0.603	C	S	.	*			trans	-84.3	97.9	179.3	-59.6	176.5	0	0	0	107.3	K4 R12 K15 L16 E19 N62	K4-I6 PolarHBondContact O-N 3.2Å; I6-R12 HydrophobicContact CG2-CG 4.27Å; I6-R12 PolarHBondContact O-NE 3Å; I6-K15 HydrophobicContact CD1-CB 4.4Å; I6-K15 HydrophobicContact CG2-CB 4.19Å; I6-K15 HydrophobicContact CG2-CD 4.31Å; I6-L16 HydrophobicContact CB-CD2 4.49Å; I6-L16 HydrophobicContact CD1-CD2 3.83Å; I6-L16 HydrophobicContact CD1-CG 4.26Å; I6-E19 HydrophobicContact CD1-CB 4.5Å; I6-E19 HydrophobicContact CD1-CG 4.07Å; I6-N62 PolarHBondContact N-OD1 3.09Å
7	G	63.4	Low	65	Low	46 Å²	46	108.5 Å²	108.5	47%	0.474	58%	0.584	S	S	.	*			trans	-59.5	160.4	-178.8	0	0	0	0	0	114.1	M5 G9	M5-G7 PolarHBondContact O-N 3.43Å; G7-G9 PolarHBondContact O-N 3.37Å
8	P	61.7	Low	66	Low	131 Å²	131	105.7 Å²	105.7	85%	0.851	57%	0.569	S	S	*	*	S	Bend	trans	-63.7	128.9	176.5	27	-32.4	0	0	0	110.4
9	G	70	Confident	67	Low	41 Å²	41	104.6 Å²	104.6	42%	0.423	56%	0.56	S	S	.	*			trans	-179.3	170.1	-179.1	0	0	0	0	0	111.8	G7 R12	G7-G9 PolarHBondContact O-N 3.37Å; G9-R12 WeakPolarHBondContact O-CB 3.33Å; G9-R12 PolarHBondContact O-N 3.16Å
10	P	55.1	Low	67.9	Low	104 Å²	104	99.5 Å²	99.5	68%	0.675	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	142	178.3	25.3	-33.3	0	0	0	110.4	R12	P10-R12 VanDerWaalsContact C-N 3.29Å; P10-R12 PolarHBondContact O-N 3.05Å
11	Y	72.7	Confident	68.8	Low	183 Å²	183	94.9 Å²	94.9	72%	0.718	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	21.9	-178.3	-44.9	-78	0	0	0	115.8	A13 T14 K15	Y11-A13 VanDerWaalsContact C-N 3.3Å; Y11-A13 PolarHBondContact O-N 3.21Å; Y11-T14 WeakPolarHBondContact O-CB 3.15Å; Y11-T14 PolarHBondContact O-N 3.38Å; Y11-T14 VanDerWaalsContact O-N 3.13Å; Y11-K15 PolarHBondContact O-N 3.47Å
12	R	77.7	Confident	70.9	Confident	103 Å²	103	89.6 Å²	89.6	39%	0.389	48%	0.478	S	S	.	.	H	α-helix	trans	-53.2	-44.2	176.2	178.6	170.9	-179.9	-100.5	-1.4	113	I6 G9 P10 T14 K15 L16	I6-R12 HydrophobicContact CG2-CG 4.27Å; I6-R12 PolarHBondContact O-NE 3Å; G9-R12 WeakPolarHBondContact O-CB 3.33Å; G9-R12 PolarHBondContact O-N 3.16Å; P10-R12 VanDerWaalsContact C-N 3.29Å; P10-R12 PolarHBondContact O-N 3.05Å; R12-T14 VanDerWaalsContact C-N 3.34Å; R12-T14 PolarHBondContact O-N 3.25Å; R12-K15 PolarHBondContact O-N 3.03Å; R12-L16 HydrophobicContact CG-CD1 3.98Å; R12-L16 WeakPolarHBondContact O-CG 3.26Å; R12-L16 PolarHBondContact O-N 3.45Å
13	A	75.3	Confident	73.3	Confident	77 Å²	77	83 Å²	83	64%	0.636	45%	0.449	S	S	*	.	H	α-helix	trans	-60.1	-42.7	177.8	0	0	0	0	0	112.2	Y11 L16 W17	Y11-A13 VanDerWaalsContact C-N 3.3Å; Y11-A13 PolarHBondContact O-N 3.21Å; A13-L16 PolarHBondContact O-N 2.94Å; A13-W17 WeakPolarHBondContact O-CB 3.11Å; A13-W17 PolarHBondContact O-N 3.35Å
14	T	79.9	Confident	75.3	Confident	73 Å²	73	80.6 Å²	80.6	45%	0.448	43%	0.425	S	S	.	.	H	α-helix	trans	-65.9	-38.5	176.9	-44.6	0	0	0	0	112.1	Y11 R12 W17 N18	Y11-T14 WeakPolarHBondContact O-CB 3.15Å; Y11-T14 PolarHBondContact O-N 3.38Å; Y11-T14 VanDerWaalsContact O-N 3.13Å; R12-T14 VanDerWaalsContact C-N 3.34Å; R12-T14 PolarHBondContact O-N 3.25Å; T14-W17 PolarHBondContact O-N 2.95Å; T14-N18 WeakPolarHBondContact O-CB 2.74Å; T14-N18 VanDerWaalsContact O-CG 3.22Å; T14-N18 PolarHBondContact O-N 2.87Å; T14-N18 PolarHBondContact O-ND2 3.38Å
15	K	78.9	Confident	76.7	Confident	121 Å²	121	74.4 Å²	74.4	53%	0.526	40%	0.396	S	S	.	.	H	α-helix	trans	-64.9	-44.5	175	-71.5	-179.5	-179.3	175.5	0	111.9	I6 Y11 R12 N18 E19	I6-K15 HydrophobicContact CD1-CB 4.4Å; I6-K15 HydrophobicContact CG2-CB 4.19Å; I6-K15 HydrophobicContact CG2-CD 4.31Å; Y11-K15 PolarHBondContact O-N 3.47Å; R12-K15 PolarHBondContact O-N 3.03Å; K15-N18 PolarHBondContact O-N 3.1Å; K15-E19 PolarHBondContact O-N 3.43Å
16	L	83.3	Confident	77.8	Confident	17 Å²	17	70.7 Å²	70.7	9%	0.089	40%	0.397	C	S	.	.	H	α-helix	trans	-61.3	-46.3	175.8	-75	166.3	0	0	0	111.3	I6 R12 A13 N18 E19 T20 N62 F63	I6-L16 HydrophobicContact CB-CD2 4.49Å; I6-L16 HydrophobicContact CD1-CD2 3.83Å; I6-L16 HydrophobicContact CD1-CG 4.26Å; R12-L16 HydrophobicContact CG-CD1 3.98Å; R12-L16 WeakPolarHBondContact O-CG 3.26Å; R12-L16 PolarHBondContact O-N 3.45Å; A13-L16 PolarHBondContact O-N 2.94Å; L16-N18 PolarHBondContact O-N 3.14Å; L16-E19 PolarHBondContact O-N 3.36Å; L16-T20 WeakPolarHBondContact O-CB 3.5Å; L16-T20 PolarHBondContact O-N 2.78Å; L16-T20 PolarHBondContact O-OG1 2.68Å; L16-N62 HydrophobicContact CD2-CB 3.53Å; L16-F63 HydrophobicContact CB-CZ 4.07Å; L16-F63 HydrophobicContact CD2-CE2 4.07Å; L16-F63 HydrophobicContact CD2-CZ 4.03Å
17	W	84.8	Confident	78.4	Confident	73 Å²	73	71 Å²	71	28%	0.277	41%	0.408	S	S	.	.	H	α-helix	trans	-55.3	-49.3	175.2	175.8	-92.5	0	0	0	112.3	A13 T14 T20 I21 L75 K78 F79 N82	A13-W17 WeakPolarHBondContact O-CB 3.11Å; A13-W17 PolarHBondContact O-N 3.35Å; T14-W17 PolarHBondContact O-N 2.95Å; W17-T20 PolarHBondContact O-N 2.95Å; W17-I21 HydrophobicContact CD2-CD1 4.26Å; W17-I21 HydrophobicContact CG-CD1 4.29Å; W17-I21 HydrophobicContact CZ2-CD1 4.02Å; W17-I21 WeakPolarHBondContact O-CG1 3.43Å; W17-I21 PolarHBondContact O-N 2.97Å; W17-L75 HydrophobicContact CE3-CD1 3.89Å; W17-L75 HydrophobicContact CH2-CD1 4.41Å; W17-L75 HydrophobicContact CZ3-CD1 3.46Å; W17-L75 VanDerWaalsContact CZ3-CD1 3.46Å; W17-K78 HydrophobicContact CH2-CB 3.62Å; W17-K78 HydrophobicContact CZ3-CB 3.91Å; W17-F79 HydrophobicContact CD2-CE1 4.36Å; W17-F79 HydrophobicContact CE3-CE1 4.1Å; W17-F79 AromaticContact CH2-CD1 3.46Å; W17-F79 HydrophobicContact CH2-CD1 3.46Å; W17-F79 VanDerWaalsContact CH2-CD1 3.46Å; W17-F79 AromaticContact CH2-CE1 3.68Å; W17-F79 HydrophobicContact CH2-CE1 3.68Å; W17-F79 AromaticContact CZ2-CD1 3.83Å; W17-F79 HydrophobicContact CZ2-CD1 3.83Å; W17-F79 AromaticContact CZ2-CE1 3.96Å; W17-F79 HydrophobicContact CZ2-CE1 3.96Å; W17-F79 AromaticContact CZ3-CD1 3.96Å; W17-F79 HydrophobicContact CZ3-CD1 3.96Å; W17-F79 AromaticContact CZ3-CE1 3.77Å; W17-F79 HydrophobicContact CZ3-CE1 3.77Å; W17-N82 HydrophobicContact CZ2-CB 4.26Å
18	N	83.9	Confident	79.6	Confident	58 Å²	58	69.3 Å²	69.3	31%	0.31	39%	0.388	S	S	.	.	H	α-helix	trans	-66.3	-41.9	-178.8	-70.5	-17.1	0	0	0	112.9	T14 K15 L16 I21 K22 L112	T14-N18 WeakPolarHBondContact O-CB 2.74Å; T14-N18 VanDerWaalsContact O-CG 3.22Å; T14-N18 PolarHBondContact O-N 2.87Å; T14-N18 PolarHBondContact O-ND2 3.38Å; K15-N18 PolarHBondContact O-N 3.1Å; L16-N18 PolarHBondContact O-N 3.14Å; N18-I21 PolarHBondContact O-N 3.25Å; N18-K22 WeakPolarHBondContact O-CB 3.38Å; N18-K22 PolarHBondContact O-N 2.78Å; N18-L112 HydrophobicContact CB-CD2 3.93Å; N18-L112 WeakPolarHBondContact O-CD1 3.46Å; N18-L112 VanDerWaalsContact OD1-CD2 3.22Å; N18-L112 WeakPolarHBondContact OD1-CD2 3.49Å
19	E	84	Confident	80.6	Confident	84 Å²	84	66.1 Å²	66.1	39%	0.393	37%	0.367	S	S	.	.	H	α-helix	trans	-64.8	-41.9	176.2	-77.2	-64.8	132.2	0	0	111.4	I6 K15 L16 I21 K22 L23	I6-E19 HydrophobicContact CD1-CB 4.5Å; I6-E19 HydrophobicContact CD1-CG 4.07Å; K15-E19 PolarHBondContact O-N 3.43Å; L16-E19 PolarHBondContact O-N 3.36Å; E19-I21 PolarHBondContact O-N 2.62Å; E19-K22 PolarHBondContact O-N 3.19Å; E19-L23 WeakPolarHBondContact O-CB 3.34Å; E19-L23 WeakPolarHBondContact O-CG 3.44Å; E19-L23 PolarHBondContact O-N 3.36Å
20	T	86	Confident	81.5	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-62.6	-41.9	176.4	-56.4	0	0	0	0	111.7	L16 W17 K22 L23 F24 L53 L57 L75 F79	L16-T20 WeakPolarHBondContact O-CB 3.5Å; L16-T20 PolarHBondContact O-N 2.78Å; L16-T20 PolarHBondContact O-OG1 2.68Å; W17-T20 PolarHBondContact O-N 2.95Å; T20-K22 PolarHBondContact O-N 3.15Å; T20-L23 PolarHBondContact O-N 3.27Å; T20-F24 WeakPolarHBondContact O-CB 3.39Å; T20-F24 PolarHBondContact O-N 3.15Å; T20-L53 HydrophobicContact CG2-CD1 3.83Å; T20-L57 HydrophobicContact CG2-CD2 4.15Å; T20-L75 HydrophobicContact CG2-CD2 4.12Å; T20-F79 HydrophobicContact CG2-CZ 4.03Å
21	I	85.7	Confident	83	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-42.4	175.2	-68.2	168	0	0	0	111.3	W17 N18 E19 F24 R25 F79 V84 L112	W17-I21 HydrophobicContact CD2-CD1 4.26Å; W17-I21 HydrophobicContact CG-CD1 4.29Å; W17-I21 HydrophobicContact CZ2-CD1 4.02Å; W17-I21 WeakPolarHBondContact O-CG1 3.43Å; W17-I21 PolarHBondContact O-N 2.97Å; N18-I21 PolarHBondContact O-N 3.25Å; E19-I21 PolarHBondContact O-N 2.62Å; I21-F24 PolarHBondContact O-N 2.73Å; I21-R25 HydrophobicContact CG2-CG 4.34Å; I21-R25 PolarHBondContact O-N 3.34Å; I21-F79 HydrophobicContact CD1-CE1 4.2Å; I21-F79 HydrophobicContact CG1-CD1 4.3Å; I21-F79 HydrophobicContact CG1-CE1 3.62Å; I21-F79 HydrophobicContact CG1-CE2 4.15Å; I21-F79 HydrophobicContact CG1-CZ 3.53Å; I21-V84 HydrophobicContact CD1-CG2 3.71Å; I21-V84 HydrophobicContact CG1-CG1 4.23Å; I21-V84 HydrophobicContact CG1-CG2 4.1Å; I21-V84 HydrophobicContact CG2-CG1 3.83Å; I21-V84 HydrophobicContact CG2-CG2 4.48Å; I21-L112 HydrophobicContact CB-CD1 3.86Å; I21-L112 HydrophobicContact CB-CD2 4.31Å; I21-L112 HydrophobicContact CB-CG 4.09Å; I21-L112 HydrophobicContact CD1-CD2 4.17Å; I21-L112 HydrophobicContact CG2-CD1 3.61Å; I21-L112 HydrophobicContact CG2-CD2 4.31Å; I21-L112 HydrophobicContact CG2-CG 3.64Å
22	K	84.8	Confident	83.6	Confident	132 Å²	132	67.8 Å²	67.8	57%	0.574	35%	0.353	S	S	*	.	H	α-helix	trans	-62.7	-45.7	-179.7	-176.2	-179.9	176.2	-174.4	0	111.4	N18 E19 T20 G26 L112	N18-K22 WeakPolarHBondContact O-CB 3.38Å; N18-K22 PolarHBondContact O-N 2.78Å; E19-K22 PolarHBondContact O-N 3.19Å; T20-K22 PolarHBondContact O-N 3.15Å; K22-G26 PolarHBondContact O-N 2.97Å; K22-L112 HydrophobicContact CB-CD1 4Å
23	L	84.6	Confident	83.9	Confident	67 Å²	67	64.3 Å²	64.3	35%	0.351	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-43	176.2	-68.6	171.2	0	0	0	111.1	E19 T20 G26 G27 W52 L56	E19-L23 WeakPolarHBondContact O-CB 3.34Å; E19-L23 WeakPolarHBondContact O-CG 3.44Å; E19-L23 PolarHBondContact O-N 3.36Å; T20-L23 PolarHBondContact O-N 3.27Å; L23-G26 PolarHBondContact O-N 3.49Å; L23-G27 PolarHBondContact O-N 3.48Å; L23-W52 VanDerWaalsContact O-CH2 3.28Å; L23-W52 WeakPolarHBondContact O-CH2 2.92Å; L23-L56 HydrophobicContact CB-CD1 4.22Å; L23-L56 HydrophobicContact CB-CD2 3.62Å; L23-L56 HydrophobicContact CD1-CD1 4.32Å; L23-L56 HydrophobicContact CD1-CD2 4.31Å
24	F	88.3	Confident	84.1	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-50.7	179	-175.3	-113	0	0	0	112.5	T20 I21 G26 M28 A49 W52 L53 L76 F79 V85 F106	T20-F24 WeakPolarHBondContact O-CB 3.39Å; T20-F24 PolarHBondContact O-N 3.15Å; I21-F24 PolarHBondContact O-N 2.73Å; F24-G26 VanDerWaalsContact C-N 3.33Å; F24-G26 PolarHBondContact O-N 3.09Å; F24-M28 HydrophobicContact CE2-CB 4.46Å; F24-M28 HydrophobicContact CE2-CG 4.35Å; F24-M28 HydrophobicContact CE2-SD 4.01Å; F24-M28 WeakPolarHBondContact O-CB 3.3Å; F24-M28 PolarHBondContact O-N 3.32Å; F24-M28 VanDerWaalsContact O-N 3.07Å; F24-A49 HydrophobicContact CE2-CB 4.41Å; F24-A49 HydrophobicContact CZ-CB 4.08Å; F24-W52 HydrophobicContact CB-CZ3 4.17Å; F24-W52 AromaticContact CD2-CE3 3.6Å; F24-W52 HydrophobicContact CD2-CE3 3.6Å; F24-W52 AromaticContact CD2-CZ3 3.61Å; F24-W52 HydrophobicContact CD2-CZ3 3.61Å; F24-W52 HydrophobicContact CE2-CE3 4.07Å; F24-W52 HydrophobicContact CG-CZ3 4.36Å; F24-L53 HydrophobicContact CB-CD1 4.4Å; F24-L53 HydrophobicContact CD2-CB 4.11Å; F24-L53 HydrophobicContact CD2-CD1 3.88Å; F24-L53 HydrophobicContact CD2-CG 4.4Å; F24-L53 HydrophobicContact CE2-CB 4.06Å; F24-L53 HydrophobicContact CG-CD1 4.38Å; F24-L76 HydrophobicContact CE1-CD2 4.07Å; F24-L76 HydrophobicContact CE2-CD2 4.22Å; F24-L76 HydrophobicContact CZ-CD2 3.67Å; F24-F79 HydrophobicContact CB-CE2 4.25Å; F24-F79 AromaticContact CD1-CD2 3.88Å; F24-F79 HydrophobicContact CD1-CD2 3.88Å; F24-F79 AromaticContact CD1-CE2 3.83Å; F24-F79 HydrophobicContact CD1-CE2 3.83Å; F24-F79 HydrophobicContact CE1-CD2 4.09Å; F24-F79 HydrophobicContact CE1-CE2 4.44Å; F24-F79 HydrophobicContact CG-CE2 4.1Å; F24-V85 HydrophobicContact CE1-CG2 3.78Å; F24-F106 AromaticContact CD1-CE1 3.72Å; F24-F106 HydrophobicContact CD1-CE1 3.72Å; F24-F106 AromaticContact CD1-CZ 3.87Å; F24-F106 HydrophobicContact CD1-CZ 3.87Å; F24-F106 AromaticContact CE1-CE1 3.47Å; F24-F106 HydrophobicContact CE1-CE1 3.47Å; F24-F106 VanDerWaalsContact CE1-CE1 3.47Å; F24-F106 AromaticContact CE1-CZ 3.64Å; F24-F106 HydrophobicContact CE1-CZ 3.64Å; F24-F106 HydrophobicContact CZ-CE1 4.37Å; F24-F106 HydrophobicContact CZ-CZ 4.18Å
25	R	83.3	Confident	83.9	Confident	64 Å²	64	66.8 Å²	66.8	24%	0.242	33%	0.331	C	S	.	.	H	α-helix	trans	-67.6	-31.8	177.6	-71.3	-168.9	68	110.9	-5.1	113.6	I21 V84 F106 P107	I21-R25 HydrophobicContact CG2-CG 4.34Å; I21-R25 PolarHBondContact O-N 3.34Å; R25-V84 PolarHBondContact NH1-O 3.46Å; R25-F106 HydrophobicContact CG-CD1 3.96Å; R25-F106 HydrophobicContact CG-CE1 3.8Å; R25-F106 HydrophobicContact CG-CZ 4.31Å; R25-P107 PolarHBondContact NH1-O 3.38Å; R25-P107 PolarHBondContact NH2-O 2.99Å
26	G	81.4	Confident	83.7	Confident	74 Å²	74	66.7 Å²	66.7	76%	0.763	33%	0.328	S	S	*	.	H	α-helix	trans	-84.9	-22	-177.4	0	0	0	0	0	114.7	K22 L23 F24	K22-G26 PolarHBondContact O-N 2.97Å; L23-G26 PolarHBondContact O-N 3.49Å; F24-G26 VanDerWaalsContact C-N 3.33Å; F24-G26 PolarHBondContact O-N 3.09Å
27	G	82.4	Confident	83.2	Confident	39 Å²	39	75.1 Å²	75.1	40%	0.402	36%	0.364	S	S	.	.	H	α-helix	trans	-118.8	-14.5	-172.4	0	0	0	0	0	115.7	L23 W52	L23-G27 PolarHBondContact O-N 3.48Å; G27-W52 VanDerWaalsContact O-CE2 3.3Å; G27-W52 VanDerWaalsContact O-CZ2 3.28Å; G27-W52 WeakPolarHBondContact O-CZ2 3.18Å; G27-W52 PolarHBondContact O-NE1 3.49Å; G27-W52 VanDerWaalsContact O-NE1 3.13Å
28	M	87.7	Confident	82.8	Confident	10 Å²	10	80.1 Å²	80.1	5%	0.049	38%	0.383	C	S	.	.	S	Bend	trans	-66.7	123.6	178.8	-178.3	68.1	-169.2	0	0	110.5	F24 L30 F44 E48 A49 W52 F106	F24-M28 HydrophobicContact CE2-CB 4.46Å; F24-M28 HydrophobicContact CE2-CG 4.35Å; F24-M28 HydrophobicContact CE2-SD 4.01Å; F24-M28 WeakPolarHBondContact O-CB 3.3Å; F24-M28 PolarHBondContact O-N 3.32Å; F24-M28 VanDerWaalsContact O-N 3.07Å; M28-L30 PolarHBondContact O-N 3.35Å; M28-F44 HydrophobicContact CE-CB 3.64Å; M28-F44 HydrophobicContact CE-CD2 4.1Å; M28-F44 HydrophobicContact CE-CG 3.9Å; M28-F44 HydrophobicContact CG-CD1 4.39Å; M28-E48 HydrophobicContact CE-CB 3.99Å; M28-A49 VanDerWaalsContact CE-CA 3.49Å; M28-A49 HydrophobicContact CE-CB 4.09Å; M28-W52 HydrophobicContact CB-CD2 4.48Å; M28-W52 HydrophobicContact CE-CB 4.35Å; M28-W52 HydrophobicContact SD-CB 3.52Å; M28-W52 VanDerWaalsContact SD-CB 3.52Å; M28-W52 HydrophobicContact SD-CD2 3.9Å; M28-W52 HydrophobicContact SD-CE3 4.21Å; M28-W52 HydrophobicContact SD-CG 3.59Å; M28-W52 VanDerWaalsContact SD-CG 3.59Å; M28-F106 HydrophobicContact CB-CE2 3.99Å; M28-F106 HydrophobicContact CB-CZ 3.96Å; M28-F106 HydrophobicContact CG-CE2 4.18Å; M28-F106 HydrophobicContact CG-CZ 4.16Å
29	P	83.9	Confident	82.5	Confident	64 Å²	64	79.9 Å²	79.9	42%	0.416	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-68.8	124.3	177.5	27.4	-33.6	0	0	0	110.4
30	L	87.4	Confident	82.4	Confident	71 Å²	71	78.2 Å²	78.2	37%	0.372	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-99.4	129.3	176	-59.7	-180	0	0	0	109.5	M28 N42 F44 F106	M28-L30 PolarHBondContact O-N 3.35Å; L30-N42 HydrophobicContact CB-CB 4.5Å; L30-N42 HydrophobicContact CD1-CB 4.2Å; L30-F44 HydrophobicContact CD2-CD1 3.55Å; L30-F44 HydrophobicContact CD2-CE1 4.19Å; L30-F106 HydrophobicContact CD1-CD2 4.18Å; L30-F106 HydrophobicContact CD2-CD2 3.77Å; L30-F106 HydrophobicContact CD2-CE2 3.74Å; L30-F106 HydrophobicContact CG-CD2 4.49Å
31	K	86.8	Confident	82	Confident	106 Å²	106	83.2 Å²	83.2	46%	0.461	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	173.8	-179.7	-59.2	174.2	-168.8	159.5	0	110.4	H33 N42 S43 E48	K31-H33 PolarHBondContact O-CD2 3.07Å; K31-N42 PolarHBondContact O-N 3.18Å; K31-S43 PolarHBondContact N-O 2.99Å; K31-S43 PolarHBondContact O-N 2.94Å; K31-S43 PolarHBondContact O-OG 3.21Å; K31-E48 IonicContact NZ-OE1 3.43Å; K31-E48 PolarHBondContact NZ-OE1 3.49Å
32	R	85.4	Confident	82	Confident	185 Å²	185	88.5 Å²	88.5	70%	0.698	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87	122.6	170.3	-172.8	171.6	74.6	169.4	0.4	109.6	Y40 D41	R32-Y40 WeakPolarHBondContact CA-O 3.41Å; R32-D41 WeakPolarHBondContact CD-OD1 3.36Å; R32-D41 WeakPolarHBondContact CG-OD1 3.49Å
33	H	85.1	Confident	82.1	Confident	31 Å²	31	82.2 Å²	82.2	14%	0.144	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	144.6	178.2	-66.2	-92	0	0	0	110.9	K31 Y40 S43 E48 V103	K31-H33 PolarHBondContact O-CD2 3.07Å; H33-Y40 PolarHBondContact N-O 3.48Å; H33-Y40 PolarHBondContact O-N 3.15Å; H33-S43 PolarHBondContact CD2-O 3.06Å; H33-S43 VanDerWaalsContact CD2-O 3.29Å; H33-S43 PolarHBondContact CD2-OG 3.4Å; H33-S43 VanDerWaalsContact CD2-OG 3.28Å; H33-S43 PolarHBondContact NE2-O 2.83Å; H33-E48 IonicContact CE1-OE1 2.85Å; H33-E48 IonicContact CE1-OE2 3.51Å; H33-E48 PolarHBondContact CE1-OE2 3.02Å; H33-E48 IonicContact NE2-OE2 3.59Å; H33-E48 PolarHBondContact NE2-OE2 3.28Å; H33-V103 HydrophobicContact CB-CG1 3.98Å; H33-V103 HydrophobicContact CB-CG2 3.95Å
34	W	77.9	Confident	82.4	Confident	183 Å²	183	79 Å²	79	69%	0.693	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.6	175.5	-168.3	-86.1	0	0	0	109.8
35	A	76.7	Confident	82.5	Confident	19 Å²	19	80.1 Å²	80.1	16%	0.157	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.3	177.4	0	0	0	0	0	110.3	F37 R38 Y40 V103	A35-F37 PolarHBondContact O-N 3.49Å; A35-R38 PolarHBondContact N-O 3.31Å; A35-R38 PolarHBondContact O-N 3.17Å; A35-Y40 HydrophobicContact CB-CD2 4.28Å; A35-Y40 HydrophobicContact CB-CE2 4.1Å; A35-Y40 WeakPolarHBondContact O-CE2 2.98Å; A35-V103 HydrophobicContact CB-CB 4.4Å; A35-V103 HydrophobicContact CB-CG2 3.73Å
36	Y	75.3	Confident	82.8	Confident	118 Å²	118	77 Å²	77	46%	0.463	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	40.7	179.5	-50.3	-70.5	0	0	0	114	R38 Y40 V88	Y36-R38 PolarHBondContact O-N 3.13Å; Y36-Y40 HydrophobicContact CD2-CE2 4.43Å; Y36-V88 HydrophobicContact CD2-CG2 4.18Å; Y36-V88 HydrophobicContact CE2-CG2 3.83Å
37	F	72.4	Confident	83.1	Confident	195 Å²	195	75.2 Å²	75.2	86%	0.855	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	23.1	-177.2	-57.8	-84.5	0	0	0	115	A35	A35-F37 PolarHBondContact O-N 3.49Å
38	R	75.9	Confident	83.5	Confident	177 Å²	177	75.6 Å²	75.6	67%	0.668	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.9	176.1	-63.6	-174	-179.9	-156.3	-0.9	110.7	A35 Y36 Y40	A35-R38 PolarHBondContact N-O 3.31Å; A35-R38 PolarHBondContact O-N 3.17Å; Y36-R38 PolarHBondContact O-N 3.13Å; R38-Y40 HydrophobicContact CB-CE2 4.26Å
39	S	78.4	Confident	83.7	Confident	54 Å²	54	75.1 Å²	75.1	38%	0.378	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	130.7	168.3	55.6	0	0	0	0	110.5
40	Y	80.8	Confident	84.1	Confident	49 Å²	49	72 Å²	72	19%	0.192	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.4	171.6	-60.9	-81.3	0	0	0	109.4	R32 H33 A35 Y36 R38 S43 V88	R32-Y40 WeakPolarHBondContact CA-O 3.41Å; H33-Y40 PolarHBondContact N-O 3.48Å; H33-Y40 PolarHBondContact O-N 3.15Å; A35-Y40 HydrophobicContact CB-CD2 4.28Å; A35-Y40 HydrophobicContact CB-CE2 4.1Å; A35-Y40 WeakPolarHBondContact O-CE2 2.98Å; Y36-Y40 HydrophobicContact CD2-CE2 4.43Å; R38-Y40 HydrophobicContact CB-CE2 4.26Å; Y40-S43 PolarHBondContact O-OG 3.48Å; Y40-V88 HydrophobicContact CD1-CB 4.15Å; Y40-V88 HydrophobicContact CD1-CG1 4.09Å; Y40-V88 HydrophobicContact CD2-CB 4.44Å; Y40-V88 HydrophobicContact CD2-CG1 4.08Å; Y40-V88 HydrophobicContact CE1-CB 4.03Å; Y40-V88 HydrophobicContact CE1-CG1 4.45Å; Y40-V88 HydrophobicContact CE2-CB 4.32Å; Y40-V88 HydrophobicContact CE2-CG1 4.44Å; Y40-V88 HydrophobicContact CE2-CG2 4.28Å; Y40-V88 HydrophobicContact CG-CB 4.36Å; Y40-V88 HydrophobicContact CG-CG1 3.9Å
41	D	78.8	Confident	84.3	Confident	107 Å²	107	72.2 Å²	72.2	57%	0.572	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	153.4	172.7	-65.8	-44.8	0	0	0	110.5	R32 S43	R32-D41 WeakPolarHBondContact CD-OD1 3.36Å; R32-D41 WeakPolarHBondContact CG-OD1 3.49Å; D41-S43 VanDerWaalsContact C-N 3.33Å; D41-S43 PolarHBondContact O-N 3.18Å
42	N	83.9	Confident	84.5	Confident	113 Å²	113	70.1 Å²	70.1	60%	0.604	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.8	38.9	-179.6	-57.4	-48.3	0	0	0	114.5	L30 K31	L30-N42 HydrophobicContact CB-CB 4.5Å; L30-N42 HydrophobicContact CD1-CB 4.2Å; K31-N42 PolarHBondContact O-N 3.18Å
43	S	87.5	Confident	84.7	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.007	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	170.2	-179.6	61.7	0	0	0	0	112.3	K31 H33 Y40 D41 V103 Y104	K31-S43 PolarHBondContact N-O 2.99Å; K31-S43 PolarHBondContact O-N 2.94Å; K31-S43 PolarHBondContact O-OG 3.21Å; H33-S43 PolarHBondContact CD2-O 3.06Å; H33-S43 VanDerWaalsContact CD2-O 3.29Å; H33-S43 PolarHBondContact CD2-OG 3.4Å; H33-S43 VanDerWaalsContact CD2-OG 3.28Å; H33-S43 PolarHBondContact NE2-O 2.83Å; Y40-S43 PolarHBondContact O-OG 3.48Å; D41-S43 VanDerWaalsContact C-N 3.33Å; D41-S43 PolarHBondContact O-N 3.18Å; S43-V103 VanDerWaalsContact CB-CG1 3.48Å; S43-V103 WeakPolarHBondContact OG-CG1 3.35Å; S43-Y104 WeakPolarHBondContact CA-O 3.3Å; S43-Y104 VanDerWaalsContact CB-O 3.32Å; S43-Y104 WeakPolarHBondContact CB-O 3.35Å
44	F	91	Very high	85	Confident	0 Å²	0	61 Å²	61	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	155.7	176	54.7	-93.1	0	0	0	110.4	M28 L30 A49 V85 Y104 F106	M28-F44 HydrophobicContact CE-CB 3.64Å; M28-F44 HydrophobicContact CE-CD2 4.1Å; M28-F44 HydrophobicContact CE-CG 3.9Å; M28-F44 HydrophobicContact CG-CD1 4.39Å; L30-F44 HydrophobicContact CD2-CD1 3.55Å; L30-F44 HydrophobicContact CD2-CE1 4.19Å; F44-A49 HydrophobicContact CD2-CB 3.64Å; F44-A49 HydrophobicContact CE2-CB 3.66Å; F44-V85 HydrophobicContact CE2-CG1 4.06Å; F44-V85 HydrophobicContact CZ-CB 4.47Å; F44-V85 HydrophobicContact CZ-CG1 3.64Å; F44-V85 HydrophobicContact CZ-CG2 3.98Å; F44-Y104 PolarHBondContact N-O 2.94Å; F44-Y104 PolarHBondContact O-N 3.46Å; F44-F106 HydrophobicContact CD1-CD2 4.48Å; F44-F106 HydrophobicContact CD1-CE2 4.17Å; F44-F106 HydrophobicContact CE1-CD1 4.14Å; F44-F106 AromaticContact CE1-CD2 3.81Å; F44-F106 HydrophobicContact CE1-CD2 3.81Å; F44-F106 AromaticContact CE1-CE1 3.96Å; F44-F106 HydrophobicContact CE1-CE1 3.96Å; F44-F106 AromaticContact CE1-CE2 3.6Å; F44-F106 HydrophobicContact CE1-CE2 3.6Å; F44-F106 HydrophobicContact CE1-CG 4.07Å; F44-F106 AromaticContact CE1-CZ 3.67Å; F44-F106 HydrophobicContact CE1-CZ 3.67Å; F44-F106 HydrophobicContact CZ-CD1 4.41Å; F44-F106 HydrophobicContact CZ-CE1 4.05Å; F44-F106 HydrophobicContact CZ-CE2 4.43Å; F44-F106 HydrophobicContact CZ-CZ 4.06Å
45	T	90.3	Very high	85.4	Confident	22 Å²	22	57.1 Å²	57.1	14%	0.135	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	157.7	173.7	59.7	0	0	0	0	112.5	S47 E48 A49 Q102	T45-S47 VanDerWaalsContact C-N 3.28Å; T45-S47 PolarHBondContact O-N 3.39Å; T45-E48 PolarHBondContact N-OE2 3.24Å; T45-E48 PolarHBondContact O-N 3.09Å; T45-E48 WeakPolarHBondContact OG1-CB 3.09Å; T45-E48 VanDerWaalsContact OG1-CD 3.29Å; T45-E48 WeakPolarHBondContact OG1-CG 3.48Å; T45-E48 PolarHBondContact OG1-N 2.61Å; T45-E48 PolarHBondContact OG1-OE2 3.25Å; T45-A49 PolarHBondContact O-N 3.06Å; T45-Q102 CarbonylContact C-O 3.51Å; T45-Q102 VanDerWaalsContact CA-O 3.3Å; T45-Q102 WeakPolarHBondContact CA-O 3.34Å
46	G	89.4	Confident	85.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-54.3	-45	175	0	0	0	0	0	112.3	A49 V50 S100 Q102	G46-A49 PolarHBondContact O-N 2.88Å; G46-V50 VanDerWaalsContact O-CG2 3.31Å; G46-V50 WeakPolarHBondContact O-CG2 3.32Å; G46-V50 PolarHBondContact O-N 3.42Å; G46-S100 WeakPolarHBondContact CA-O 3.22Å; G46-S100 PolarHBondContact N-O 3.45Å; G46-S100 VanDerWaalsContact N-O 3.11Å; G46-Q102 PolarHBondContact N-O 2.85Å
47	S	89.3	Confident	86.5	Confident	35 Å²	35	52.4 Å²	52.4	25%	0.245	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-42	177.6	-60.4	0	0	0	0	113.8	T45 A49 V50 D51 D99 S100	T45-S47 VanDerWaalsContact C-N 3.28Å; T45-S47 PolarHBondContact O-N 3.39Å; S47-A49 VanDerWaalsContact C-N 3.31Å; S47-A49 PolarHBondContact O-N 3.27Å; S47-V50 PolarHBondContact O-N 3.23Å; S47-D51 VanDerWaalsContact O-CG 3.24Å; S47-D51 PolarHBondContact O-N 3.46Å; S47-D99 WeakPolarHBondContact CA-OD1 3.36Å; S47-D99 VanDerWaalsContact CB-OD1 3.25Å; S47-D99 WeakPolarHBondContact CB-OD1 3.25Å; S47-D99 PolarHBondContact OG-OD1 3.39Å; S47-S100 PolarHBondContact N-O 3.27Å; S47-S100 PolarHBondContact OG-N 2.89Å; S47-S100 PolarHBondContact OG-O 2.68Å
48	E	90.6	Very high	87.1	Confident	47 Å²	47	47.7 Å²	47.7	22%	0.22	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-39.5	175.1	-75.8	170	132.1	0	0	111.8	M28 K31 H33 T45 D51 W52	M28-E48 HydrophobicContact CE-CB 3.99Å; K31-E48 IonicContact NZ-OE1 3.43Å; K31-E48 PolarHBondContact NZ-OE1 3.49Å; H33-E48 IonicContact CE1-OE1 2.85Å; H33-E48 IonicContact CE1-OE2 3.51Å; H33-E48 PolarHBondContact CE1-OE2 3.02Å; H33-E48 IonicContact NE2-OE2 3.59Å; H33-E48 PolarHBondContact NE2-OE2 3.28Å; T45-E48 PolarHBondContact N-OE2 3.24Å; T45-E48 PolarHBondContact O-N 3.09Å; T45-E48 WeakPolarHBondContact OG1-CB 3.09Å; T45-E48 VanDerWaalsContact OG1-CD 3.29Å; T45-E48 WeakPolarHBondContact OG1-CG 3.48Å; T45-E48 PolarHBondContact OG1-N 2.61Å; T45-E48 PolarHBondContact OG1-OE2 3.25Å; E48-D51 PolarHBondContact O-N 2.99Å; E48-W52 WeakPolarHBondContact O-CB 3.39Å; E48-W52 PolarHBondContact O-N 3.35Å
49	A	91.8	Very high	87.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-40.2	176.6	0	0	0	0	0	112.6	F24 M28 F44 T45 G46 S47 L53 L76 F97	F24-A49 HydrophobicContact CE2-CB 4.41Å; F24-A49 HydrophobicContact CZ-CB 4.08Å; M28-A49 VanDerWaalsContact CE-CA 3.49Å; M28-A49 HydrophobicContact CE-CB 4.09Å; F44-A49 HydrophobicContact CD2-CB 3.64Å; F44-A49 HydrophobicContact CE2-CB 3.66Å; T45-A49 PolarHBondContact O-N 3.06Å; G46-A49 PolarHBondContact O-N 2.88Å; S47-A49 VanDerWaalsContact C-N 3.31Å; S47-A49 PolarHBondContact O-N 3.27Å; A49-L53 VanDerWaalsContact O-CB 3.23Å; A49-L53 WeakPolarHBondContact O-CB 3.39Å; A49-L53 PolarHBondContact O-N 2.95Å; A49-L76 HydrophobicContact CB-CD1 4.25Å; A49-L76 HydrophobicContact CB-CD2 4.44Å; A49-F97 HydrophobicContact CB-CZ 4.12Å
50	V	92	Very high	87.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-47.5	176	175.2	0	0	0	0	110.2	G46 S47 W52 H54 R69 T72 L73 L76 F97 D99	G46-V50 VanDerWaalsContact O-CG2 3.31Å; G46-V50 WeakPolarHBondContact O-CG2 3.32Å; G46-V50 PolarHBondContact O-N 3.42Å; S47-V50 PolarHBondContact O-N 3.23Å; V50-W52 PolarHBondContact O-N 2.81Å; V50-H54 WeakPolarHBondContact O-CB 3.35Å; V50-H54 PolarHBondContact O-N 3.43Å; V50-R69 HydrophobicContact CG1-CG 3.54Å; V50-T72 HydrophobicContact CG1-CG2 4.47Å; V50-L73 HydrophobicContact CG2-CD1 4.01Å; V50-L76 HydrophobicContact CB-CD1 4.25Å; V50-L76 HydrophobicContact CG2-CD1 3.55Å; V50-F97 HydrophobicContact CG2-CE1 4.03Å; V50-D99 HydrophobicContact CG2-CB 4.12Å
51	D	90.2	Very high	87.1	Confident	75 Å²	75	51.3 Å²	51.3	40%	0.401	25%	0.245	S	C	.	.	H	α-helix	trans	-56.6	-51.9	179	-71.2	-23.9	0	0	0	111.3	S47 E48 H54 E55 R69	S47-D51 VanDerWaalsContact O-CG 3.24Å; S47-D51 PolarHBondContact O-N 3.46Å; E48-D51 PolarHBondContact O-N 2.99Å; D51-H54 PolarHBondContact O-N 3Å; D51-E55 PolarHBondContact O-N 3.21Å; D51-R69 IonicContact OD1-CZ 2.96Å; D51-R69 IonicContact OD1-NH1 2.71Å; D51-R69 PolarHBondContact OD1-NH1 2.88Å; D51-R69 IonicContact OD1-NH2 3.05Å; D51-R69 PolarHBondContact OD1-NH2 3.12Å
52	W	91.8	Very high	86.9	Confident	61 Å²	61	47.6 Å²	47.6	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-66.8	-46.3	-176.1	-171.6	96.6	0	0	0	112	L23 F24 G27 M28 E48 V50 H54 E55 L56	L23-W52 VanDerWaalsContact O-CH2 3.28Å; L23-W52 WeakPolarHBondContact O-CH2 2.92Å; F24-W52 HydrophobicContact CB-CZ3 4.17Å; F24-W52 AromaticContact CD2-CE3 3.6Å; F24-W52 HydrophobicContact CD2-CE3 3.6Å; F24-W52 AromaticContact CD2-CZ3 3.61Å; F24-W52 HydrophobicContact CD2-CZ3 3.61Å; F24-W52 HydrophobicContact CE2-CE3 4.07Å; F24-W52 HydrophobicContact CG-CZ3 4.36Å; G27-W52 VanDerWaalsContact O-CE2 3.3Å; G27-W52 VanDerWaalsContact O-CZ2 3.28Å; G27-W52 WeakPolarHBondContact O-CZ2 3.18Å; G27-W52 PolarHBondContact O-NE1 3.49Å; G27-W52 VanDerWaalsContact O-NE1 3.13Å; M28-W52 HydrophobicContact CB-CD2 4.48Å; M28-W52 HydrophobicContact CE-CB 4.35Å; M28-W52 HydrophobicContact SD-CB 3.52Å; M28-W52 VanDerWaalsContact SD-CB 3.52Å; M28-W52 HydrophobicContact SD-CD2 3.9Å; M28-W52 HydrophobicContact SD-CE3 4.21Å; M28-W52 HydrophobicContact SD-CG 3.59Å; M28-W52 VanDerWaalsContact SD-CG 3.59Å; E48-W52 WeakPolarHBondContact O-CB 3.39Å; E48-W52 PolarHBondContact O-N 3.35Å; V50-W52 PolarHBondContact O-N 2.81Å; W52-H54 VanDerWaalsContact C-N 3.29Å; W52-H54 PolarHBondContact O-N 3.19Å; W52-E55 PolarHBondContact O-N 3.43Å; W52-L56 HydrophobicContact CE3-CB 4.35Å; W52-L56 HydrophobicContact CH2-CB 4.27Å; W52-L56 HydrophobicContact CH2-CD1 3.97Å; W52-L56 HydrophobicContact CH2-CD2 3.83Å; W52-L56 HydrophobicContact CH2-CG 4.22Å; W52-L56 HydrophobicContact CZ3-CB 3.92Å; W52-L56 HydrophobicContact CZ3-CD1 4.4Å; W52-L56 HydrophobicContact CZ3-CD2 3.6Å; W52-L56 HydrophobicContact CZ3-CG 4.15Å; W52-L56 PolarHBondContact O-N 3.33Å
53	L	90.2	Very high	86.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-33.8	180	-175.3	62.2	0	0	0	111.2	T20 F24 A49 L56 L57 T72 L75 L76 F79	T20-L53 HydrophobicContact CG2-CD1 3.83Å; F24-L53 HydrophobicContact CB-CD1 4.4Å; F24-L53 HydrophobicContact CD2-CB 4.11Å; F24-L53 HydrophobicContact CD2-CD1 3.88Å; F24-L53 HydrophobicContact CD2-CG 4.4Å; F24-L53 HydrophobicContact CE2-CB 4.06Å; F24-L53 HydrophobicContact CG-CD1 4.38Å; A49-L53 VanDerWaalsContact O-CB 3.23Å; A49-L53 WeakPolarHBondContact O-CB 3.39Å; A49-L53 PolarHBondContact O-N 2.95Å; L53-L56 HydrophobicContact CD1-CD2 4.07Å; L53-L56 PolarHBondContact O-N 2.85Å; L53-L57 HydrophobicContact CD1-CG 4.39Å; L53-L57 HydrophobicContact CG-CD1 4.2Å; L53-L57 HydrophobicContact CG-CG 4.38Å; L53-L57 VanDerWaalsContact O-CG 3.27Å; L53-L57 WeakPolarHBondContact O-CG 3.41Å; L53-L57 PolarHBondContact O-N 3.44Å; L53-T72 HydrophobicContact CB-CG2 3.71Å; L53-T72 HydrophobicContact CD2-CG2 3.8Å; L53-T72 HydrophobicContact CG-CG2 3.74Å; L53-L75 HydrophobicContact CD2-CD2 4.14Å; L53-L75 HydrophobicContact CD2-CG 4.41Å; L53-L76 HydrophobicContact CD2-CD1 4.18Å; L53-L76 HydrophobicContact CD2-CD2 3.81Å; L53-L76 HydrophobicContact CD2-CG 3.67Å; L53-F79 HydrophobicContact CD2-CE2 4.34Å
54	H	90.1	Very high	85.7	Confident	24 Å²	24	46.8 Å²	46.8	11%	0.111	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-42.6	176.4	-174.6	71.5	0	0	0	111.8	V50 D51 W52 L57 K58 V67 T68 R69 T72	V50-H54 WeakPolarHBondContact O-CB 3.35Å; V50-H54 PolarHBondContact O-N 3.43Å; D51-H54 PolarHBondContact O-N 3Å; W52-H54 VanDerWaalsContact C-N 3.29Å; W52-H54 PolarHBondContact O-N 3.19Å; H54-L57 PolarHBondContact O-N 2.65Å; H54-K58 WeakPolarHBondContact NE2-CE 3.32Å; H54-K58 PolarHBondContact NE2-NZ 3Å; H54-K58 WeakPolarHBondContact O-CG 3.37Å; H54-K58 PolarHBondContact O-N 3.35Å; H54-K58 VanDerWaalsContact O-N 3.11Å; H54-V67 PolarHBondContact CE1-O 2.82Å; H54-T68 VanDerWaalsContact CE1-C 3.5Å; H54-R69 PolarHBondContact CE1-N 3.05Å; H54-R69 VanDerWaalsContact CE1-N 3.32Å; H54-T72 HydrophobicContact CB-CG2 4.08Å; H54-T72 PolarHBondContact ND1-OG1 2.79Å; H54-T72 VanDerWaalsContact ND1-OG1 3.17Å
55	E	87.9	Confident	84.9	Confident	102 Å²	102	51.7 Å²	51.7	48%	0.477	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-42.3	170.9	-72.9	-144.5	145.4	0	0	112.2	D51 W52 L57 K58 R59	D51-E55 PolarHBondContact O-N 3.21Å; W52-E55 PolarHBondContact O-N 3.43Å; E55-L57 PolarHBondContact O-N 3.17Å; E55-K58 PolarHBondContact O-N 3.22Å; E55-R59 WeakPolarHBondContact O-CG 3Å; E55-R59 PolarHBondContact O-N 3.3Å; E55-R59 IonicContact OE1-NH2 2.61Å; E55-R59 IonicContact OE2-CZ 3.03Å; E55-R59 IonicContact OE2-NH1 3.13Å; E55-R59 IonicContact OE2-NH2 2.8Å; E55-R59 PolarHBondContact OE2-NH2 2.87Å
56	L	86.8	Confident	84.3	Confident	33 Å²	33	59 Å²	59	17%	0.173	29%	0.286	C	S	.	.	H	α-helix	trans	-60.5	-46.6	178.8	-176.3	75.8	0	0	0	111.5	L23 W52 L53 R59 N60	L23-L56 HydrophobicContact CB-CD1 4.22Å; L23-L56 HydrophobicContact CB-CD2 3.62Å; L23-L56 HydrophobicContact CD1-CD1 4.32Å; L23-L56 HydrophobicContact CD1-CD2 4.31Å; W52-L56 HydrophobicContact CE3-CB 4.35Å; W52-L56 HydrophobicContact CH2-CB 4.27Å; W52-L56 HydrophobicContact CH2-CD1 3.97Å; W52-L56 HydrophobicContact CH2-CD2 3.83Å; W52-L56 HydrophobicContact CH2-CG 4.22Å; W52-L56 HydrophobicContact CZ3-CB 3.92Å; W52-L56 HydrophobicContact CZ3-CD1 4.4Å; W52-L56 HydrophobicContact CZ3-CD2 3.6Å; W52-L56 HydrophobicContact CZ3-CG 4.15Å; W52-L56 PolarHBondContact O-N 3.33Å; L53-L56 HydrophobicContact CD1-CD2 4.07Å; L53-L56 PolarHBondContact O-N 2.85Å; L56-R59 PolarHBondContact O-N 3.1Å; L56-N60 WeakPolarHBondContact O-CB 3.3Å; L56-N60 PolarHBondContact O-N 3.02Å; L56-N60 VanDerWaalsContact O-N 3.17Å
57	L	86.9	Confident	84	Confident	6 Å²	6	60 Å²	60	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-40.8	-179.1	-69.1	174.1	0	0	0	111.4	T20 L53 H54 E55 R59 N60 F63 V67 T72 L75	T20-L57 HydrophobicContact CG2-CD2 4.15Å; L53-L57 HydrophobicContact CD1-CG 4.39Å; L53-L57 HydrophobicContact CG-CD1 4.2Å; L53-L57 HydrophobicContact CG-CG 4.38Å; L53-L57 VanDerWaalsContact O-CG 3.27Å; L53-L57 WeakPolarHBondContact O-CG 3.41Å; L53-L57 PolarHBondContact O-N 3.44Å; H54-L57 PolarHBondContact O-N 2.65Å; E55-L57 PolarHBondContact O-N 3.17Å; L57-R59 PolarHBondContact O-N 2.96Å; L57-N60 PolarHBondContact O-N 2.87Å; L57-F63 HydrophobicContact CD2-CD1 4.28Å; L57-F63 HydrophobicContact CD2-CD2 3.72Å; L57-F63 HydrophobicContact CD2-CE1 4.36Å; L57-F63 HydrophobicContact CD2-CE2 3.8Å; L57-F63 HydrophobicContact CD2-CG 3.97Å; L57-F63 HydrophobicContact CD2-CZ 4.13Å; L57-V67 HydrophobicContact CB-CB 4.46Å; L57-V67 HydrophobicContact CB-CG1 4.2Å; L57-V67 HydrophobicContact CB-CG2 4.35Å; L57-V67 HydrophobicContact CD1-CG1 3.99Å; L57-T72 HydrophobicContact CD1-CG2 4.33Å; L57-L75 HydrophobicContact CD1-CD2 4.08Å; L57-L75 HydrophobicContact CD2-CD2 4.43Å
58	K	85	Confident	84	Confident	95 Å²	95	61.4 Å²	61.4	41%	0.413	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-36.8	176.3	-79.4	-179.8	162.3	172.1	0	113.4	H54 E55 N60	H54-K58 WeakPolarHBondContact NE2-CE 3.32Å; H54-K58 PolarHBondContact NE2-NZ 3Å; H54-K58 WeakPolarHBondContact O-CG 3.37Å; H54-K58 PolarHBondContact O-N 3.35Å; H54-K58 VanDerWaalsContact O-N 3.11Å; E55-K58 PolarHBondContact O-N 3.22Å; K58-N60 VanDerWaalsContact C-N 3.3Å
59	R	80.8	Confident	83.9	Confident	179 Å²	179	63.5 Å²	63.5	68%	0.675	31%	0.305	S	S	*	.	H	α-helix	trans	-77.7	-14.2	177.8	-70.6	-178.3	-176	151.5	14.1	113.3	E55 L56 L57	E55-R59 WeakPolarHBondContact O-CG 3Å; E55-R59 PolarHBondContact O-N 3.3Å; E55-R59 IonicContact OE1-NH2 2.61Å; E55-R59 IonicContact OE2-CZ 3.03Å; E55-R59 IonicContact OE2-NH1 3.13Å; E55-R59 IonicContact OE2-NH2 2.8Å; E55-R59 PolarHBondContact OE2-NH2 2.87Å; L56-R59 PolarHBondContact O-N 3.1Å; L57-R59 PolarHBondContact O-N 2.96Å
60	N	80.1	Confident	83.7	Confident	26 Å²	26	70.7 Å²	70.7	14%	0.139	33%	0.333	C	S	.	.			trans	-87	118.7	-177	-168	-20.7	0	0	0	110.7	L56 L57 K58 N62 F63 G64	L56-N60 WeakPolarHBondContact O-CB 3.3Å; L56-N60 PolarHBondContact O-N 3.02Å; L56-N60 VanDerWaalsContact O-N 3.17Å; L57-N60 PolarHBondContact O-N 2.87Å; K58-N60 VanDerWaalsContact C-N 3.3Å; N60-N62 PolarHBondContact O-N 2.96Å; N60-N62 PolarHBondContact OD1-N 2.82Å; N60-N62 PolarHBondContact OD1-ND2 3.41Å; N60-F63 HydrophobicContact CB-CD2 4.05Å; N60-F63 PolarHBondContact O-N 3.49Å; N60-F63 VanDerWaalsContact O-N 3.09Å; N60-G64 PolarHBondContact O-N 3.22Å
61	H	74.4	Confident	83.6	Confident	152 Å²	152	75.8 Å²	75.8	70%	0.704	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.9	178.4	-63.8	135.7	0	0	0	114.4
62	N	75.7	Confident	83.6	Confident	29 Å²	29	72.2 Å²	72.2	16%	0.155	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-21.2	179.2	-62.2	-73.6	0	0	0	114.8	I6 L16 N60	I6-N62 PolarHBondContact N-OD1 3.09Å; L16-N62 HydrophobicContact CD2-CB 3.53Å; N60-N62 PolarHBondContact O-N 2.96Å; N60-N62 PolarHBondContact OD1-N 2.82Å; N60-N62 PolarHBondContact OD1-ND2 3.41Å
63	F	75.9	Confident	83.5	Confident	75 Å²	75	70.2 Å²	70.2	33%	0.329	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-28.7	-176.7	-63.8	-83.6	0	0	0	112.8	L16 L57 N60 V67	L16-F63 HydrophobicContact CB-CZ 4.07Å; L16-F63 HydrophobicContact CD2-CE2 4.07Å; L16-F63 HydrophobicContact CD2-CZ 4.03Å; L57-F63 HydrophobicContact CD2-CD1 4.28Å; L57-F63 HydrophobicContact CD2-CD2 3.72Å; L57-F63 HydrophobicContact CD2-CE1 4.36Å; L57-F63 HydrophobicContact CD2-CE2 3.8Å; L57-F63 HydrophobicContact CD2-CG 3.97Å; L57-F63 HydrophobicContact CD2-CZ 4.13Å; N60-F63 HydrophobicContact CB-CD2 4.05Å; N60-F63 PolarHBondContact O-N 3.49Å; N60-F63 VanDerWaalsContact O-N 3.09Å; F63-V67 HydrophobicContact CB-CG2 3.91Å
64	G	68.9	Low	83.5	Confident	21 Å²	21	72.9 Å²	72.9	22%	0.216	34%	0.344	C	S	.	.			trans	79.5	170	176.4	0	0	0	0	0	114.5	N60 E66	N60-G64 PolarHBondContact O-N 3.22Å; G64-E66 PolarHBondContact O-N 2.95Å
65	P	74.7	Confident	83.5	Confident	103 Å²	103	73.3 Å²	73.3	67%	0.669	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-9.6	-176.7	29.9	-35.1	0	0	0	114.4	V67	P65-V67 VanDerWaalsContact C-N 3.3Å; P65-V67 PolarHBondContact O-N 3.15Å
66	E	77.2	Confident	83.6	Confident	177 Å²	177	68.5 Å²	68.5	83%	0.827	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-4.8	-175.2	-60.2	-171.3	174.1	0	0	114.5	G64 T68	G64-E66 PolarHBondContact O-N 2.95Å; E66-T68 PolarHBondContact O-N 3.41Å
67	V	84.3	Confident	83.7	Confident	19 Å²	19	69.9 Å²	69.9	12%	0.115	33%	0.328	C	S	.	.			trans	-62.4	125.3	178.8	-179.4	0	0	0	0	109.8	H54 L57 F63 P65 Q71	H54-V67 PolarHBondContact CE1-O 2.82Å; L57-V67 HydrophobicContact CB-CB 4.46Å; L57-V67 HydrophobicContact CB-CG1 4.2Å; L57-V67 HydrophobicContact CB-CG2 4.35Å; L57-V67 HydrophobicContact CD1-CG1 3.99Å; F63-V67 HydrophobicContact CB-CG2 3.91Å; P65-V67 VanDerWaalsContact C-N 3.3Å; P65-V67 PolarHBondContact O-N 3.15Å; V67-Q71 HydrophobicContact CG1-CB 4.34Å
68	T	88.6	Confident	83.8	Confident	66 Å²	66	73.4 Å²	73.4	41%	0.405	34%	0.343	S	S	.	.			trans	-85.2	154.3	177.5	64.1	0	0	0	0	111.5	H54 E66 Y70 Q71 T72	H54-T68 VanDerWaalsContact CE1-C 3.5Å; E66-T68 PolarHBondContact O-N 3.41Å; T68-Y70 PolarHBondContact O-N 2.86Å; T68-Q71 PolarHBondContact O-N 3.35Å; T68-Q71 VanDerWaalsContact O-N 3.13Å; T68-Q71 VanDerWaalsContact OG1-CD 3.25Å; T68-Q71 VanDerWaalsContact OG1-CG 3.23Å; T68-Q71 WeakPolarHBondContact OG1-CG 3.18Å; T68-Q71 PolarHBondContact OG1-N 2.97Å; T68-Q71 PolarHBondContact OG1-OE1 3.39Å; T68-T72 PolarHBondContact O-N 2.83Å; T68-T72 VanDerWaalsContact O-N 3.14Å; T68-T72 PolarHBondContact O-OG1 3.48Å
69	R	89.6	Confident	84	Confident	91 Å²	91	68.9 Å²	68.9	34%	0.343	32%	0.323	S	S	.	.	H	α-helix	trans	-58.4	-36.1	175.5	-169	-175.3	-176.9	86.3	5.4	111.9	V50 D51 H54 T72 L73 D99	V50-R69 HydrophobicContact CG1-CG 3.54Å; D51-R69 IonicContact OD1-CZ 2.96Å; D51-R69 IonicContact OD1-NH1 2.71Å; D51-R69 PolarHBondContact OD1-NH1 2.88Å; D51-R69 IonicContact OD1-NH2 3.05Å; D51-R69 PolarHBondContact OD1-NH2 3.12Å; H54-R69 PolarHBondContact CE1-N 3.05Å; H54-R69 VanDerWaalsContact CE1-N 3.32Å; R69-T72 WeakPolarHBondContact O-CB 3.31Å; R69-T72 PolarHBondContact O-N 3.26Å; R69-L73 PolarHBondContact O-N 3.4Å; R69-D99 IonicContact CZ-OD2 2.72Å; R69-D99 VanDerWaalsContact CZ-OD2 3.27Å; R69-D99 IonicContact NE-OD2 3.56Å; R69-D99 PolarHBondContact NE-OD2 2.79Å; R69-D99 IonicContact NH2-OD1 3.27Å; R69-D99 PolarHBondContact NH2-OD1 3.32Å; R69-D99 IonicContact NH2-OD2 2.84Å; R69-D99 PolarHBondContact NH2-OD2 3.19Å
70	Y	88	Confident	84.2	Confident	150 Å²	150	60.5 Å²	60.5	59%	0.588	29%	0.292	S	S	*	.	H	α-helix	trans	-64.1	-40.7	176.2	-177.5	-104.8	0	0	0	112.6	T68 T72 L73 Q74	T68-Y70 PolarHBondContact O-N 2.86Å; Y70-T72 VanDerWaalsContact C-N 3.34Å; Y70-T72 PolarHBondContact O-N 3.31Å; Y70-L73 WeakPolarHBondContact O-CB 3.39Å; Y70-L73 PolarHBondContact O-N 3.45Å; Y70-Q74 HydrophobicContact CD1-CG 4.39Å; Y70-Q74 HydrophobicContact CE1-CG 4.06Å; Y70-Q74 VanDerWaalsContact CZ-NE2 3.34Å; Y70-Q74 WeakPolarHBondContact O-CG 3.33Å; Y70-Q74 PolarHBondContact O-N 3.47Å; Y70-Q74 PolarHBondContact OH-NE2 3.18Å; Y70-Q74 VanDerWaalsContact OH-NE2 3.07Å
71	Q	88.1	Confident	84.4	Confident	107 Å²	107	64.2 Å²	64.2	50%	0.5	31%	0.307	S	S	.	.	H	α-helix	trans	-65.3	-37.3	174.4	-73.6	162.7	-33.5	0	0	112	V67 T68 L73 Q74 L75	V67-Q71 HydrophobicContact CG1-CB 4.34Å; T68-Q71 PolarHBondContact O-N 3.35Å; T68-Q71 VanDerWaalsContact O-N 3.13Å; T68-Q71 VanDerWaalsContact OG1-CD 3.25Å; T68-Q71 VanDerWaalsContact OG1-CG 3.23Å; T68-Q71 WeakPolarHBondContact OG1-CG 3.18Å; T68-Q71 PolarHBondContact OG1-N 2.97Å; T68-Q71 PolarHBondContact OG1-OE1 3.39Å; Q71-L73 VanDerWaalsContact C-N 3.32Å; Q71-L73 PolarHBondContact O-N 3.34Å; Q71-Q74 PolarHBondContact O-N 3.21Å; Q71-L75 PolarHBondContact O-N 2.85Å
72	T	90.7	Very high	84.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-43.4	171.9	-54.8	0	0	0	0	111.4	V50 L53 H54 L57 T68 R69 Y70 Q74 L75 L76	V50-T72 HydrophobicContact CG1-CG2 4.47Å; L53-T72 HydrophobicContact CB-CG2 3.71Å; L53-T72 HydrophobicContact CD2-CG2 3.8Å; L53-T72 HydrophobicContact CG-CG2 3.74Å; H54-T72 HydrophobicContact CB-CG2 4.08Å; H54-T72 PolarHBondContact ND1-OG1 2.79Å; H54-T72 VanDerWaalsContact ND1-OG1 3.17Å; L57-T72 HydrophobicContact CD1-CG2 4.33Å; T68-T72 PolarHBondContact O-N 2.83Å; T68-T72 VanDerWaalsContact O-N 3.14Å; T68-T72 PolarHBondContact O-OG1 3.48Å; R69-T72 WeakPolarHBondContact O-CB 3.31Å; R69-T72 PolarHBondContact O-N 3.26Å; Y70-T72 VanDerWaalsContact C-N 3.34Å; Y70-T72 PolarHBondContact O-N 3.31Å; T72-Q74 PolarHBondContact O-N 2.85Å; T72-L75 WeakPolarHBondContact O-CB 3.32Å; T72-L75 PolarHBondContact O-N 3.17Å; T72-L76 HydrophobicContact CG2-CD1 4.37Å; T72-L76 PolarHBondContact O-N 3.02Å
73	L	90.5	Very high	85.2	Confident	20 Å²	20	61.6 Å²	61.6	11%	0.105	30%	0.297	C	S	.	.	H	α-helix	trans	-62.2	-42.2	176.9	-177.8	65.7	0	0	0	111.9	V50 R69 Y70 Q71 L75 L76 R77 F97 D99	V50-L73 HydrophobicContact CG2-CD1 4.01Å; R69-L73 PolarHBondContact O-N 3.4Å; Y70-L73 WeakPolarHBondContact O-CB 3.39Å; Y70-L73 PolarHBondContact O-N 3.45Å; Q71-L73 VanDerWaalsContact C-N 3.32Å; Q71-L73 PolarHBondContact O-N 3.34Å; L73-L75 VanDerWaalsContact C-N 3.29Å; L73-L75 PolarHBondContact O-N 3.39Å; L73-L76 PolarHBondContact O-N 3.46Å; L73-R77 WeakPolarHBondContact O-CG 3.13Å; L73-R77 PolarHBondContact O-N 2.86Å; L73-F97 HydrophobicContact CD1-CD1 3.6Å; L73-F97 HydrophobicContact CD1-CE1 3.89Å; L73-D99 HydrophobicContact CD1-CB 4.13Å; L73-D99 HydrophobicContact CD2-CB 4.48Å
74	Q	88.8	Confident	85.6	Confident	55 Å²	55	58.1 Å²	58.1	26%	0.257	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-38.3	174.8	-68.8	-64.6	-28.8	0	0	111.9	Y70 Q71 T72 R77 K78	Y70-Q74 HydrophobicContact CD1-CG 4.39Å; Y70-Q74 HydrophobicContact CE1-CG 4.06Å; Y70-Q74 VanDerWaalsContact CZ-NE2 3.34Å; Y70-Q74 WeakPolarHBondContact O-CG 3.33Å; Y70-Q74 PolarHBondContact O-N 3.47Å; Y70-Q74 PolarHBondContact OH-NE2 3.18Å; Y70-Q74 VanDerWaalsContact OH-NE2 3.07Å; Q71-Q74 PolarHBondContact O-N 3.21Å; T72-Q74 PolarHBondContact O-N 2.85Å; Q74-R77 PolarHBondContact O-N 3.3Å; Q74-K78 WeakPolarHBondContact O-CG 3.22Å; Q74-K78 PolarHBondContact O-N 3.43Å; Q74-K78 VanDerWaalsContact O-N 3.16Å
75	L	90.7	Very high	86.5	Confident	34 Å²	34	57.1 Å²	57.1	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-41.5	174.9	-175.8	58.3	0	0	0	111.9	W17 T20 L53 L57 Q71 T72 L73 R77 K78 F79	W17-L75 HydrophobicContact CE3-CD1 3.89Å; W17-L75 HydrophobicContact CH2-CD1 4.41Å; W17-L75 HydrophobicContact CZ3-CD1 3.46Å; W17-L75 VanDerWaalsContact CZ3-CD1 3.46Å; T20-L75 HydrophobicContact CG2-CD2 4.12Å; L53-L75 HydrophobicContact CD2-CD2 4.14Å; L53-L75 HydrophobicContact CD2-CG 4.41Å; L57-L75 HydrophobicContact CD1-CD2 4.08Å; L57-L75 HydrophobicContact CD2-CD2 4.43Å; Q71-L75 PolarHBondContact O-N 2.85Å; T72-L75 WeakPolarHBondContact O-CB 3.32Å; T72-L75 PolarHBondContact O-N 3.17Å; L73-L75 VanDerWaalsContact C-N 3.29Å; L73-L75 PolarHBondContact O-N 3.39Å; L75-R77 PolarHBondContact O-N 2.99Å; L75-K78 CarbonylContact O-C 3.49Å; L75-K78 WeakPolarHBondContact O-CB 3.44Å; L75-K78 PolarHBondContact O-N 2.97Å; L75-K78 VanDerWaalsContact O-N 3.14Å; L75-F79 HydrophobicContact CD1-CD1 4.25Å; L75-F79 HydrophobicContact CD1-CE1 3.74Å; L75-F79 HydrophobicContact CD1-CZ 4.33Å; L75-F79 HydrophobicContact CD2-CZ 4.36Å; L75-F79 HydrophobicContact CG-CD1 4.41Å; L75-F79 HydrophobicContact CG-CE1 3.95Å; L75-F79 HydrophobicContact CG-CZ 4.13Å; L75-F79 WeakPolarHBondContact O-CD1 3.35Å; L75-F79 PolarHBondContact O-N 3.3Å
76	L	89.6	Confident	87	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-65.3	-36.2	176.1	-76.4	164.4	0	0	0	112.8	F24 A49 V50 L53 T72 L73 K78 F79 M80 F97	F24-L76 HydrophobicContact CE1-CD2 4.07Å; F24-L76 HydrophobicContact CE2-CD2 4.22Å; F24-L76 HydrophobicContact CZ-CD2 3.67Å; A49-L76 HydrophobicContact CB-CD1 4.25Å; A49-L76 HydrophobicContact CB-CD2 4.44Å; V50-L76 HydrophobicContact CB-CD1 4.25Å; V50-L76 HydrophobicContact CG2-CD1 3.55Å; L53-L76 HydrophobicContact CD2-CD1 4.18Å; L53-L76 HydrophobicContact CD2-CD2 3.81Å; L53-L76 HydrophobicContact CD2-CG 3.67Å; T72-L76 HydrophobicContact CG2-CD1 4.37Å; T72-L76 PolarHBondContact O-N 3.02Å; L73-L76 PolarHBondContact O-N 3.46Å; L76-K78 VanDerWaalsContact C-N 3.3Å; L76-K78 PolarHBondContact O-N 3.49Å; L76-F79 HydrophobicContact CD2-CD2 4.11Å; L76-F79 WeakPolarHBondContact O-CA 3.17Å; L76-F79 WeakPolarHBondContact O-CB 3.32Å; L76-F79 PolarHBondContact O-N 3.05Å; L76-M80 PolarHBondContact O-N 2.64Å; L76-F97 HydrophobicContact CB-CD1 3.64Å; L76-F97 HydrophobicContact CB-CE1 3.65Å; L76-F97 HydrophobicContact CB-CG 4.13Å; L76-F97 HydrophobicContact CB-CZ 4.12Å; L76-F97 HydrophobicContact CD1-CD1 4.49Å; L76-F97 HydrophobicContact CD1-CE1 3.68Å; L76-F97 HydrophobicContact CD1-CZ 3.97Å; L76-F97 HydrophobicContact CD2-CZ 4.42Å; L76-F97 HydrophobicContact CG-CE1 4.18Å; L76-F97 HydrophobicContact CG-CZ 4.39Å
77	R	89.3	Confident	87.4	Confident	61 Å²	61	44.7 Å²	44.7	23%	0.23	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-41.8	170.1	-73.9	176.8	177.8	-179.8	-3	111.9	L73 Q74 L75 F79 M80 K81 E95 F97	L73-R77 WeakPolarHBondContact O-CG 3.13Å; L73-R77 PolarHBondContact O-N 2.86Å; Q74-R77 PolarHBondContact O-N 3.3Å; L75-R77 PolarHBondContact O-N 2.99Å; R77-F79 VanDerWaalsContact C-N 3.32Å; R77-F79 PolarHBondContact O-N 3.35Å; R77-M80 PolarHBondContact O-N 3.12Å; R77-K81 PolarHBondContact O-N 2.92Å; R77-E95 HydrophobicContact CB-CB 4.11Å; R77-E95 WeakPolarHBondContact CD-O 3.29Å; R77-F97 HydrophobicContact CB-CB 4.46Å; R77-F97 HydrophobicContact CG-CB 3.77Å; R77-F97 WeakPolarHBondContact CG-O 3.31Å; R77-F97 PolarHBondContact NE-O 3.12Å
78	K	88.2	Confident	87.2	Confident	80 Å²	80	44.1 Å²	44.1	35%	0.348	20%	0.201	S	C	.	.	H	α-helix	trans	-68	-31	173.6	-60.7	-62.2	-179.1	-165.4	0	112.2	W17 Q74 L75 L76 N82 E95	W17-K78 HydrophobicContact CH2-CB 3.62Å; W17-K78 HydrophobicContact CZ3-CB 3.91Å; Q74-K78 WeakPolarHBondContact O-CG 3.22Å; Q74-K78 PolarHBondContact O-N 3.43Å; Q74-K78 VanDerWaalsContact O-N 3.16Å; L75-K78 CarbonylContact O-C 3.49Å; L75-K78 WeakPolarHBondContact O-CB 3.44Å; L75-K78 PolarHBondContact O-N 2.97Å; L75-K78 VanDerWaalsContact O-N 3.14Å; L76-K78 VanDerWaalsContact C-N 3.3Å; L76-K78 PolarHBondContact O-N 3.49Å; K78-N82 PolarHBondContact O-N 2.77Å; K78-N82 VanDerWaalsContact O-N 3.11Å; K78-N82 PolarHBondContact O-ND2 2.88Å; K78-E95 IonicContact NZ-OE1 3.53Å; K78-E95 PolarHBondContact NZ-OE1 3.31Å; K78-E95 IonicContact NZ-OE2 2.89Å; K78-E95 PolarHBondContact NZ-OE2 3.01Å
79	F	89.3	Confident	86.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-42.5	173.4	-80.2	13.2	0	0	0	111.5	W17 T20 I21 F24 L53 L75 L76 R77 N82 H83 V84	W17-F79 HydrophobicContact CD2-CE1 4.36Å; W17-F79 HydrophobicContact CE3-CE1 4.1Å; W17-F79 AromaticContact CH2-CD1 3.46Å; W17-F79 HydrophobicContact CH2-CD1 3.46Å; W17-F79 VanDerWaalsContact CH2-CD1 3.46Å; W17-F79 AromaticContact CH2-CE1 3.68Å; W17-F79 HydrophobicContact CH2-CE1 3.68Å; W17-F79 AromaticContact CZ2-CD1 3.83Å; W17-F79 HydrophobicContact CZ2-CD1 3.83Å; W17-F79 AromaticContact CZ2-CE1 3.96Å; W17-F79 HydrophobicContact CZ2-CE1 3.96Å; W17-F79 AromaticContact CZ3-CD1 3.96Å; W17-F79 HydrophobicContact CZ3-CD1 3.96Å; W17-F79 AromaticContact CZ3-CE1 3.77Å; W17-F79 HydrophobicContact CZ3-CE1 3.77Å; T20-F79 HydrophobicContact CG2-CZ 4.03Å; I21-F79 HydrophobicContact CD1-CE1 4.2Å; I21-F79 HydrophobicContact CG1-CD1 4.3Å; I21-F79 HydrophobicContact CG1-CE1 3.62Å; I21-F79 HydrophobicContact CG1-CE2 4.15Å; I21-F79 HydrophobicContact CG1-CZ 3.53Å; F24-F79 HydrophobicContact CB-CE2 4.25Å; F24-F79 AromaticContact CD1-CD2 3.88Å; F24-F79 HydrophobicContact CD1-CD2 3.88Å; F24-F79 AromaticContact CD1-CE2 3.83Å; F24-F79 HydrophobicContact CD1-CE2 3.83Å; F24-F79 HydrophobicContact CE1-CD2 4.09Å; F24-F79 HydrophobicContact CE1-CE2 4.44Å; F24-F79 HydrophobicContact CG-CE2 4.1Å; L53-F79 HydrophobicContact CD2-CE2 4.34Å; L75-F79 HydrophobicContact CD1-CD1 4.25Å; L75-F79 HydrophobicContact CD1-CE1 3.74Å; L75-F79 HydrophobicContact CD1-CZ 4.33Å; L75-F79 HydrophobicContact CD2-CZ 4.36Å; L75-F79 HydrophobicContact CG-CD1 4.41Å; L75-F79 HydrophobicContact CG-CE1 3.95Å; L75-F79 HydrophobicContact CG-CZ 4.13Å; L75-F79 WeakPolarHBondContact O-CD1 3.35Å; L75-F79 PolarHBondContact O-N 3.3Å; L76-F79 HydrophobicContact CD2-CD2 4.11Å; L76-F79 WeakPolarHBondContact O-CA 3.17Å; L76-F79 WeakPolarHBondContact O-CB 3.32Å; L76-F79 PolarHBondContact O-N 3.05Å; R77-F79 VanDerWaalsContact C-N 3.32Å; R77-F79 PolarHBondContact O-N 3.35Å; F79-N82 CarbonylContact O-C 3.56Å; F79-N82 PolarHBondContact O-N 2.93Å; F79-H83 PolarHBondContact O-N 2.99Å; F79-V84 HydrophobicContact CB-CB 3.76Å; F79-V84 HydrophobicContact CB-CG1 4.2Å; F79-V84 HydrophobicContact CB-CG2 4.16Å; F79-V84 HydrophobicContact CD1-CG2 4.22Å; F79-V84 HydrophobicContact CD2-CB 4.37Å; F79-V84 HydrophobicContact CD2-CG1 3.88Å; F79-V84 HydrophobicContact CE2-CG1 4.45Å; F79-V84 HydrophobicContact CG-CB 4.01Å; F79-V84 HydrophobicContact CG-CG1 4.02Å; F79-V84 HydrophobicContact CG-CG2 4.14Å; F79-V84 WeakPolarHBondContact O-CB 3.44Å; F79-V84 PolarHBondContact O-N 2.99Å
80	M	85.3	Confident	85.8	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.02	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-39.9	176.1	-170.1	167.3	-177.4	0	0	112.5	L76 R77 N82 H83 D87 G93 D96 F97 Y104	L76-M80 PolarHBondContact O-N 2.64Å; R77-M80 PolarHBondContact O-N 3.12Å; M80-N82 PolarHBondContact O-N 3.03Å; M80-H83 PolarHBondContact O-N 2.93Å; M80-D87 HydrophobicContact CE-CB 4.47Å; M80-G93 PolarHBondContact O-N 2.78Å; M80-G93 VanDerWaalsContact O-N 3.16Å; M80-D96 VanDerWaalsContact CE-OD1 3.27Å; M80-D96 WeakPolarHBondContact CE-OD1 3.23Å; M80-F97 HydrophobicContact CB-CB 4.29Å; M80-F97 HydrophobicContact SD-CB 3.72Å; M80-F97 HydrophobicContact SD-CD2 4.1Å; M80-F97 HydrophobicContact SD-CG 4.42Å; M80-Y104 HydrophobicContact CE-CE1 4.04Å; M80-Y104 HydrophobicContact SD-CE1 3.99Å
81	K	85.2	Confident	85.3	Confident	104 Å²	104	43.1 Å²	43.1	45%	0.452	20%	0.2	S	C	.	.	H	α-helix	trans	-62.2	-40.3	173.9	-178.2	172.7	-174	175.3	0	113.3	R77 H83 E95	R77-K81 PolarHBondContact O-N 2.92Å; K81-H83 VanDerWaalsContact C-N 3.3Å; K81-H83 PolarHBondContact O-N 3.49Å; K81-E95 HydrophobicContact CB-CG 4.01Å; K81-E95 HydrophobicContact CD-CG 3.8Å; K81-E95 WeakPolarHBondContact CD-OE1 3.16Å; K81-E95 HydrophobicContact CG-CG 4.46Å; K81-E95 IonicContact NZ-OE1 3.17Å; K81-E95 PolarHBondContact NZ-OE1 3.4Å
82	N	83	Confident	84.9	Confident	88 Å²	88	44.1 Å²	44.1	47%	0.471	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	19.3	-177.8	-67	-72.3	0	0	0	113.4	W17 K78 F79 M80 V84	W17-N82 HydrophobicContact CZ2-CB 4.26Å; K78-N82 PolarHBondContact O-N 2.77Å; K78-N82 VanDerWaalsContact O-N 3.11Å; K78-N82 PolarHBondContact O-ND2 2.88Å; F79-N82 CarbonylContact O-C 3.56Å; F79-N82 PolarHBondContact O-N 2.93Å; M80-N82 PolarHBondContact O-N 3.03Å; N82-V84 VanDerWaalsContact C-N 3.27Å; N82-V84 PolarHBondContact O-N 3.31Å
83	H	84	Confident	83.9	Confident	38 Å²	38	45.9 Å²	45.9	18%	0.176	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	35.1	176.8	-165.7	-118.6	0	0	0	114.1	F79 M80 K81 E86 Y92 P107 P111	F79-H83 PolarHBondContact O-N 2.99Å; M80-H83 PolarHBondContact O-N 2.93Å; K81-H83 VanDerWaalsContact C-N 3.3Å; K81-H83 PolarHBondContact O-N 3.49Å; H83-E86 IonicContact NE2-OE2 3.43Å; H83-Y92 HydrophobicContact CB-CD2 3.81Å; H83-Y92 HydrophobicContact CB-CE2 3.99Å; H83-Y92 HydrophobicContact CB-CG 4.45Å; H83-Y92 AromaticContact CD2-CD1 3.3Å; H83-Y92 WeakPolarHBondContact CD2-CD1 3.39Å; H83-Y92 AromaticContact CD2-CD2 3.36Å; H83-Y92 WeakPolarHBondContact CD2-CD2 3.48Å; H83-Y92 AromaticContact CD2-CE1 3.46Å; H83-Y92 VanDerWaalsContact CD2-CE1 3.46Å; H83-Y92 WeakPolarHBondContact CD2-CE1 3.37Å; H83-Y92 AromaticContact CD2-CE2 3.51Å; H83-Y92 AromaticContact CD2-CG 3.25Å; H83-Y92 AromaticContact CD2-CZ 3.56Å; H83-Y92 AromaticContact CG-CD2 3.83Å; H83-Y92 AromaticContact CG-CE2 3.82Å; H83-Y92 AromaticContact NE2-CD1 3.65Å; H83-Y92 AromaticContact NE2-CE1 3.49Å; H83-Y92 WeakPolarHBondContact NE2-CE1 3.47Å; H83-Y92 AromaticContact NE2-CZ 3.79Å; H83-P107 VanDerWaalsContact CE1-CB 3.45Å; H83-P107 WeakPolarHBondContact CE1-CB 3.47Å; H83-P107 WeakPolarHBondContact NE2-CG 3.26Å; H83-P111 WeakPolarHBondContact O-CG 3.35Å
84	V	84.4	Confident	83.1	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	25%	0.245	C	C	.	.	S	Bend	trans	-80.8	-34.8	169.4	-177.5	0	0	0	0	110.8	I21 R25 F79 N82 F106 P107 P111	I21-V84 HydrophobicContact CD1-CG2 3.71Å; I21-V84 HydrophobicContact CG1-CG1 4.23Å; I21-V84 HydrophobicContact CG1-CG2 4.1Å; I21-V84 HydrophobicContact CG2-CG1 3.83Å; I21-V84 HydrophobicContact CG2-CG2 4.48Å; R25-V84 PolarHBondContact NH1-O 3.46Å; F79-V84 HydrophobicContact CB-CB 3.76Å; F79-V84 HydrophobicContact CB-CG1 4.2Å; F79-V84 HydrophobicContact CB-CG2 4.16Å; F79-V84 HydrophobicContact CD1-CG2 4.22Å; F79-V84 HydrophobicContact CD2-CB 4.37Å; F79-V84 HydrophobicContact CD2-CG1 3.88Å; F79-V84 HydrophobicContact CE2-CG1 4.45Å; F79-V84 HydrophobicContact CG-CB 4.01Å; F79-V84 HydrophobicContact CG-CG1 4.02Å; F79-V84 HydrophobicContact CG-CG2 4.14Å; F79-V84 WeakPolarHBondContact O-CB 3.44Å; F79-V84 PolarHBondContact O-N 2.99Å; N82-V84 VanDerWaalsContact C-N 3.27Å; N82-V84 PolarHBondContact O-N 3.31Å; V84-F106 WeakPolarHBondContact O-CD1 3.45Å; V84-P107 WeakPolarHBondContact O-CD 3.49Å; V84-P111 HydrophobicContact CB-CG 4Å; V84-P111 HydrophobicContact CG1-CG 4.45Å; V84-P111 HydrophobicContact CG2-CB 4.47Å; V84-P111 HydrophobicContact CG2-CG 3.54Å
85	V	86.3	Confident	82.8	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-132.6	145.7	178.3	179.3	0	0	0	0	107.8	F24 F44 Y104 F106	F24-V85 HydrophobicContact CE1-CG2 3.78Å; F44-V85 HydrophobicContact CE2-CG1 4.06Å; F44-V85 HydrophobicContact CZ-CB 4.47Å; F44-V85 HydrophobicContact CZ-CG1 3.64Å; F44-V85 HydrophobicContact CZ-CG2 3.98Å; V85-Y104 HydrophobicContact CG1-CD1 4.07Å; V85-Y104 HydrophobicContact CG1-CG 4.18Å; V85-F106 HydrophobicContact CG2-CD1 4.22Å; V85-F106 HydrophobicContact CG2-CE1 3.96Å
86	E	87	Confident	82.3	Confident	11 Å²	11	54.7 Å²	54.7	5%	0.051	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	153.9	173.3	62.1	179.2	-168.9	0	0	110.8	H83 Y104 R105 P107	H83-E86 IonicContact NE2-OE2 3.43Å; E86-Y104 WeakPolarHBondContact O-CA 3.24Å; E86-R105 HydrophobicContact CG-CG 3.71Å; E86-R105 PolarHBondContact N-O 2.95Å; E86-R105 PolarHBondContact O-N 3.06Å; E86-R105 IonicContact OE1-CZ 2.82Å; E86-R105 IonicContact OE1-NE 3.66Å; E86-R105 PolarHBondContact OE1-NE 3.44Å; E86-R105 IonicContact OE1-NH2 3.23Å; E86-R105 PolarHBondContact OE1-NH2 3.28Å; E86-P107 HydrophobicContact CB-CG 4.13Å; E86-P107 HydrophobicContact CG-CG 3.83Å
87	D	85.4	Confident	82.3	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.043	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	153.9	167.8	-177.5	-0.9	0	0	0	109.4	M80 K89 G90 R91	M80-D87 HydrophobicContact CE-CB 4.47Å; D87-K89 PolarHBondContact O-N 2.92Å; D87-G90 WeakPolarHBondContact O-CA 3.48Å; D87-G90 PolarHBondContact O-N 3.5Å; D87-R91 HydrophobicContact CB-CB 4.22Å; D87-R91 PolarHBondContact N-O 3.01Å; D87-R91 IonicContact OD2-CZ 3.86Å; D87-R91 IonicContact OD2-NE 3.3Å; D87-R91 PolarHBondContact OD2-NE 3.39Å; D87-R91 IonicContact OD2-NH2 2.85Å; D87-R91 PolarHBondContact OD2-NH2 3.48Å
88	V	79.2	Confident	82	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.042	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-21.9	174.9	-76.3	0	0	0	0	113.5	Y36 Y40 G90 V103	Y36-V88 HydrophobicContact CD2-CG2 4.18Å; Y36-V88 HydrophobicContact CE2-CG2 3.83Å; Y40-V88 HydrophobicContact CD1-CB 4.15Å; Y40-V88 HydrophobicContact CD1-CG1 4.09Å; Y40-V88 HydrophobicContact CD2-CB 4.44Å; Y40-V88 HydrophobicContact CD2-CG1 4.08Å; Y40-V88 HydrophobicContact CE1-CB 4.03Å; Y40-V88 HydrophobicContact CE1-CG1 4.45Å; Y40-V88 HydrophobicContact CE2-CB 4.32Å; Y40-V88 HydrophobicContact CE2-CG1 4.44Å; Y40-V88 HydrophobicContact CE2-CG2 4.28Å; Y40-V88 HydrophobicContact CG-CB 4.36Å; Y40-V88 HydrophobicContact CG-CG1 3.9Å; V88-G90 VanDerWaalsContact C-N 3.33Å; V88-V103 HydrophobicContact CG1-CB 3.83Å; V88-V103 HydrophobicContact CG1-CG1 3.49Å; V88-V103 VanDerWaalsContact CG1-CG1 3.49Å; V88-V103 WeakPolarHBondContact CG1-O 3.36Å; V88-V103 PolarHBondContact N-O 2.99Å
89	K	75.4	Confident	82	Confident	119 Å²	119	55.2 Å²	55.2	52%	0.517	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	4.5	173.4	-63.5	-178.4	-178.9	175.9	0	114.4	D87 R91	D87-K89 PolarHBondContact O-N 2.92Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 HydrophobicContact CB-CG 4.47Å
90	G	73.1	Confident	81.9	Confident	26 Å²	26	56.5 Å²	56.5	27%	0.268	28%	0.276	S	S	.	.	S	Bend	trans	73.9	19.7	-178.8	0	0	0	0	0	114.4	D87 V88	D87-G90 WeakPolarHBondContact O-CA 3.48Å; D87-G90 PolarHBondContact O-N 3.5Å; V88-G90 VanDerWaalsContact C-N 3.33Å
91	R	77.4	Confident	81.9	Confident	141 Å²	141	59.4 Å²	59.4	53%	0.532	31%	0.306	S	S	.	.			trans	-89.3	133.1	177.5	-62.8	-176.7	-63.4	173.7	4.7	110	D87 K89	D87-R91 HydrophobicContact CB-CB 4.22Å; D87-R91 PolarHBondContact N-O 3.01Å; D87-R91 IonicContact OD2-CZ 3.86Å; D87-R91 IonicContact OD2-NE 3.3Å; D87-R91 PolarHBondContact OD2-NE 3.39Å; D87-R91 IonicContact OD2-NH2 2.85Å; D87-R91 PolarHBondContact OD2-NH2 3.48Å; K89-R91 VanDerWaalsContact C-N 3.33Å; K89-R91 HydrophobicContact CB-CG 4.47Å
92	Y	80.1	Confident	81.9	Confident	128 Å²	128	58.1 Å²	58.1	50%	0.502	30%	0.302	S	S	.	.			trans	-153	177.2	178.8	64.9	-91.6	0	0	0	110.4	H83	H83-Y92 HydrophobicContact CB-CD2 3.81Å; H83-Y92 HydrophobicContact CB-CE2 3.99Å; H83-Y92 HydrophobicContact CB-CG 4.45Å; H83-Y92 AromaticContact CD2-CD1 3.3Å; H83-Y92 WeakPolarHBondContact CD2-CD1 3.39Å; H83-Y92 AromaticContact CD2-CD2 3.36Å; H83-Y92 WeakPolarHBondContact CD2-CD2 3.48Å; H83-Y92 AromaticContact CD2-CE1 3.46Å; H83-Y92 VanDerWaalsContact CD2-CE1 3.46Å; H83-Y92 WeakPolarHBondContact CD2-CE1 3.37Å; H83-Y92 AromaticContact CD2-CE2 3.51Å; H83-Y92 AromaticContact CD2-CG 3.25Å; H83-Y92 AromaticContact CD2-CZ 3.56Å; H83-Y92 AromaticContact CG-CD2 3.83Å; H83-Y92 AromaticContact CG-CE2 3.82Å; H83-Y92 AromaticContact NE2-CD1 3.65Å; H83-Y92 AromaticContact NE2-CE1 3.49Å; H83-Y92 WeakPolarHBondContact NE2-CE1 3.47Å; H83-Y92 AromaticContact NE2-CZ 3.79Å
93	G	68.8	Low	82.1	Confident	38 Å²	38	54.4 Å²	54.4	39%	0.392	28%	0.282	S	S	.	.	S	Bend	trans	94	-9.1	175.3	0	0	0	0	0	115.2	M80	M80-G93 PolarHBondContact O-N 2.78Å; M80-G93 VanDerWaalsContact O-N 3.16Å
94	K	75.2	Confident	82.3	Confident	150 Å²	150	52.7 Å²	52.7	65%	0.652	27%	0.274	S	S	*	.	S	Bend	trans	-103.7	156.7	169.7	-65.9	-176.7	-178.5	-177.7	0	110.3	D96	K94-D96 HydrophobicContact CB-CB 4.38Å; K94-D96 WeakPolarHBondContact CB-OD1 3.36Å; K94-D96 PolarHBondContact O-N 3.27Å
95	E	82.3	Confident	82.5	Confident	64 Å²	64	57.1 Å²	57.1	30%	0.299	29%	0.291	S	S	.	.	S	Bend	trans	-92.6	38.1	177.4	-66.7	-175.7	-159.5	0	0	110.8	R77 K78 K81 F97	R77-E95 HydrophobicContact CB-CB 4.11Å; R77-E95 WeakPolarHBondContact CD-O 3.29Å; K78-E95 IonicContact NZ-OE1 3.53Å; K78-E95 PolarHBondContact NZ-OE1 3.31Å; K78-E95 IonicContact NZ-OE2 2.89Å; K78-E95 PolarHBondContact NZ-OE2 3.01Å; K81-E95 HydrophobicContact CB-CG 4.01Å; K81-E95 HydrophobicContact CD-CG 3.8Å; K81-E95 WeakPolarHBondContact CD-OE1 3.16Å; K81-E95 HydrophobicContact CG-CG 4.46Å; K81-E95 IonicContact NZ-OE1 3.17Å; K81-E95 PolarHBondContact NZ-OE1 3.4Å; E95-F97 VanDerWaalsContact C-N 3.34Å
96	D	80.8	Confident	82.6	Confident	80 Å²	80	58.4 Å²	58.4	43%	0.428	30%	0.297	S	S	.	.			trans	-92.3	14	-174.8	56.9	-21.2	0	0	0	113.6	M80 K94 E98	M80-D96 VanDerWaalsContact CE-OD1 3.27Å; M80-D96 WeakPolarHBondContact CE-OD1 3.23Å; K94-D96 HydrophobicContact CB-CB 4.38Å; K94-D96 WeakPolarHBondContact CB-OD1 3.36Å; K94-D96 PolarHBondContact O-N 3.27Å; D96-E98 PolarHBondContact O-N 3.04Å
97	F	87.8	Confident	82.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.294	C	S	.	.			trans	-65.5	132	175	-170.7	-82.9	0	0	0	111.4	A49 V50 L73 L76 R77 M80 E95 Y104	A49-F97 HydrophobicContact CB-CZ 4.12Å; V50-F97 HydrophobicContact CG2-CE1 4.03Å; L73-F97 HydrophobicContact CD1-CD1 3.6Å; L73-F97 HydrophobicContact CD1-CE1 3.89Å; L76-F97 HydrophobicContact CB-CD1 3.64Å; L76-F97 HydrophobicContact CB-CE1 3.65Å; L76-F97 HydrophobicContact CB-CG 4.13Å; L76-F97 HydrophobicContact CB-CZ 4.12Å; L76-F97 HydrophobicContact CD1-CD1 4.49Å; L76-F97 HydrophobicContact CD1-CE1 3.68Å; L76-F97 HydrophobicContact CD1-CZ 3.97Å; L76-F97 HydrophobicContact CD2-CZ 4.42Å; L76-F97 HydrophobicContact CG-CE1 4.18Å; L76-F97 HydrophobicContact CG-CZ 4.39Å; R77-F97 HydrophobicContact CB-CB 4.46Å; R77-F97 HydrophobicContact CG-CB 3.77Å; R77-F97 WeakPolarHBondContact CG-O 3.31Å; R77-F97 PolarHBondContact NE-O 3.12Å; M80-F97 HydrophobicContact CB-CB 4.29Å; M80-F97 HydrophobicContact SD-CB 3.72Å; M80-F97 HydrophobicContact SD-CD2 4.1Å; M80-F97 HydrophobicContact SD-CG 4.42Å; E95-F97 VanDerWaalsContact C-N 3.34Å; F97-Y104 HydrophobicContact CD2-CD1 4.03Å; F97-Y104 HydrophobicContact CD2-CD2 4.43Å; F97-Y104 AromaticContact CD2-CE1 3.61Å; F97-Y104 HydrophobicContact CD2-CE1 3.61Å; F97-Y104 HydrophobicContact CD2-CE2 4.08Å; F97-Y104 HydrophobicContact CD2-CG 4.42Å; F97-Y104 AromaticContact CD2-CZ 3.64Å; F97-Y104 AromaticContact CE2-CD1 3.98Å; F97-Y104 HydrophobicContact CE2-CD1 3.98Å; F97-Y104 AromaticContact CE2-CD2 3.75Å; F97-Y104 HydrophobicContact CE2-CD2 3.75Å; F97-Y104 AromaticContact CE2-CE1 3.9Å; F97-Y104 HydrophobicContact CE2-CE1 3.9Å; F97-Y104 AromaticContact CE2-CE2 3.69Å; F97-Y104 HydrophobicContact CE2-CE2 3.69Å; F97-Y104 AromaticContact CE2-CG 3.9Å; F97-Y104 HydrophobicContact CE2-CG 3.9Å; F97-Y104 AromaticContact CE2-CZ 3.76Å; F97-Y104 HydrophobicContact CZ-CD2 4.39Å; F97-Y104 HydrophobicContact CZ-CE2 4.23Å
98	E	84.8	Confident	81.4	Confident	96 Å²	96	63.4 Å²	63.4	45%	0.449	33%	0.331	S	S	.	.			trans	-126.7	144.2	-177.5	-69.6	-179.9	172.2	0	0	112.1	D96 S100	D96-E98 PolarHBondContact O-N 3.04Å; E98-S100 PolarHBondContact O-N 3.47Å
99	D	87.6	Confident	80.5	Confident	57 Å²	57	67.6 Å²	67.6	31%	0.305	36%	0.356	S	S	.	.	S	Bend	trans	-73.5	80.1	168.7	-170.5	-5.9	0	0	0	109	S47 V50 R69 L73	S47-D99 WeakPolarHBondContact CA-OD1 3.36Å; S47-D99 VanDerWaalsContact CB-OD1 3.25Å; S47-D99 WeakPolarHBondContact CB-OD1 3.25Å; S47-D99 PolarHBondContact OG-OD1 3.39Å; V50-D99 HydrophobicContact CG2-CB 4.12Å; R69-D99 IonicContact CZ-OD2 2.72Å; R69-D99 VanDerWaalsContact CZ-OD2 3.27Å; R69-D99 IonicContact NE-OD2 3.56Å; R69-D99 PolarHBondContact NE-OD2 2.79Å; R69-D99 IonicContact NH2-OD1 3.27Å; R69-D99 PolarHBondContact NH2-OD1 3.32Å; R69-D99 IonicContact NH2-OD2 2.84Å; R69-D99 PolarHBondContact NH2-OD2 3.19Å; L73-D99 HydrophobicContact CD1-CB 4.13Å; L73-D99 HydrophobicContact CD2-CB 4.48Å
100	S	87.9	Confident	79.5	Confident	27 Å²	27	64.3 Å²	64.3	19%	0.189	35%	0.349	C	S	.	.	S	Bend	trans	-145	174.5	-175.4	69.1	0	0	0	0	111.8	G46 S47 E98 Q102	G46-S100 WeakPolarHBondContact CA-O 3.22Å; G46-S100 PolarHBondContact N-O 3.45Å; G46-S100 VanDerWaalsContact N-O 3.11Å; S47-S100 PolarHBondContact N-O 3.27Å; S47-S100 PolarHBondContact OG-N 2.89Å; S47-S100 PolarHBondContact OG-O 2.68Å; E98-S100 PolarHBondContact O-N 3.47Å; S100-Q102 PolarHBondContact O-N 2.71Å; S100-Q102 VanDerWaalsContact O-N 3.15Å; S100-Q102 WeakPolarHBondContact OG-CB 3.19Å; S100-Q102 WeakPolarHBondContact OG-CG 3.4Å; S100-Q102 PolarHBondContact OG-N 3.23Å
101	G	83.6	Confident	78.7	Confident	64 Å²	64	65.5 Å²	65.5	66%	0.66	35%	0.351	S	S	*	.	S	Bend	trans	-72	7.2	172.1	0	0	0	0	0	114.9
102	Q	86	Confident	77.2	Confident	78 Å²	78	60.5 Å²	60.5	36%	0.364	34%	0.335	S	S	.	.			trans	-62.8	140.6	173.6	-69.8	-179.4	17.8	0	0	110.5	T45 G46 S100 Y104	T45-Q102 CarbonylContact C-O 3.51Å; T45-Q102 VanDerWaalsContact CA-O 3.3Å; T45-Q102 WeakPolarHBondContact CA-O 3.34Å; G46-Q102 PolarHBondContact N-O 2.85Å; S100-Q102 PolarHBondContact O-N 2.71Å; S100-Q102 VanDerWaalsContact O-N 3.15Å; S100-Q102 WeakPolarHBondContact OG-CB 3.19Å; S100-Q102 WeakPolarHBondContact OG-CG 3.4Å; S100-Q102 PolarHBondContact OG-N 3.23Å; Q102-Y104 HydrophobicContact CB-CE2 3.81Å; Q102-Y104 VanDerWaalsContact O-CD2 3.29Å; Q102-Y104 WeakPolarHBondContact O-CD2 3.43Å; Q102-Y104 WeakPolarHBondContact O-CE2 3.15Å; Q102-Y104 PolarHBondContact OE1-OH 2.78Å
103	V	87.9	Confident	75.6	Confident	9 Å²	9	63.4 Å²	63.4	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.5	-174.9	-173.6	0	0	0	0	109.8	H33 A35 S43 V88	H33-V103 HydrophobicContact CB-CG1 3.98Å; H33-V103 HydrophobicContact CB-CG2 3.95Å; A35-V103 HydrophobicContact CB-CB 4.4Å; A35-V103 HydrophobicContact CB-CG2 3.73Å; S43-V103 VanDerWaalsContact CB-CG1 3.48Å; S43-V103 WeakPolarHBondContact OG-CG1 3.35Å; V88-V103 HydrophobicContact CG1-CB 3.83Å; V88-V103 HydrophobicContact CG1-CG1 3.49Å; V88-V103 VanDerWaalsContact CG1-CG1 3.49Å; V88-V103 WeakPolarHBondContact CG1-O 3.36Å; V88-V103 PolarHBondContact N-O 2.99Å
104	Y	88.1	Confident	74.2	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.008	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	160.3	178.7	-62.2	-89	0	0	0	110.1	S43 F44 M80 V85 E86 F97 Q102	S43-Y104 WeakPolarHBondContact CA-O 3.3Å; S43-Y104 VanDerWaalsContact CB-O 3.32Å; S43-Y104 WeakPolarHBondContact CB-O 3.35Å; F44-Y104 PolarHBondContact N-O 2.94Å; F44-Y104 PolarHBondContact O-N 3.46Å; M80-Y104 HydrophobicContact CE-CE1 4.04Å; M80-Y104 HydrophobicContact SD-CE1 3.99Å; V85-Y104 HydrophobicContact CG1-CD1 4.07Å; V85-Y104 HydrophobicContact CG1-CG 4.18Å; E86-Y104 WeakPolarHBondContact O-CA 3.24Å; F97-Y104 HydrophobicContact CD2-CD1 4.03Å; F97-Y104 HydrophobicContact CD2-CD2 4.43Å; F97-Y104 AromaticContact CD2-CE1 3.61Å; F97-Y104 HydrophobicContact CD2-CE1 3.61Å; F97-Y104 HydrophobicContact CD2-CE2 4.08Å; F97-Y104 HydrophobicContact CD2-CG 4.42Å; F97-Y104 AromaticContact CD2-CZ 3.64Å; F97-Y104 AromaticContact CE2-CD1 3.98Å; F97-Y104 HydrophobicContact CE2-CD1 3.98Å; F97-Y104 AromaticContact CE2-CD2 3.75Å; F97-Y104 HydrophobicContact CE2-CD2 3.75Å; F97-Y104 AromaticContact CE2-CE1 3.9Å; F97-Y104 HydrophobicContact CE2-CE1 3.9Å; F97-Y104 AromaticContact CE2-CE2 3.69Å; F97-Y104 HydrophobicContact CE2-CE2 3.69Å; F97-Y104 AromaticContact CE2-CG 3.9Å; F97-Y104 HydrophobicContact CE2-CG 3.9Å; F97-Y104 AromaticContact CE2-CZ 3.76Å; F97-Y104 HydrophobicContact CZ-CD2 4.39Å; F97-Y104 HydrophobicContact CZ-CE2 4.23Å; Q102-Y104 HydrophobicContact CB-CE2 3.81Å; Q102-Y104 VanDerWaalsContact O-CD2 3.29Å; Q102-Y104 WeakPolarHBondContact O-CD2 3.43Å; Q102-Y104 WeakPolarHBondContact O-CE2 3.15Å; Q102-Y104 PolarHBondContact OE1-OH 2.78Å
105	R	87.7	Confident	72.2	Confident	95 Å²	95	67 Å²	67	36%	0.358	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	162.1	174.8	69.6	-178	-167.9	-167.6	1.2	111	E86	E86-R105 HydrophobicContact CG-CG 3.71Å; E86-R105 PolarHBondContact N-O 2.95Å; E86-R105 PolarHBondContact O-N 3.06Å; E86-R105 IonicContact OE1-CZ 2.82Å; E86-R105 IonicContact OE1-NE 3.66Å; E86-R105 PolarHBondContact OE1-NE 3.44Å; E86-R105 IonicContact OE1-NH2 3.23Å; E86-R105 PolarHBondContact OE1-NH2 3.28Å
106	F	87.8	Confident	69.9	Low	26 Å²	26	69.7 Å²	69.7	11%	0.114	40%	0.396	C	S	.	.			trans	-82.3	132.6	170.8	-71.8	-56.6	0	0	0	110.3	F24 R25 M28 L30 F44 V84 V85	F24-F106 AromaticContact CD1-CE1 3.72Å; F24-F106 HydrophobicContact CD1-CE1 3.72Å; F24-F106 AromaticContact CD1-CZ 3.87Å; F24-F106 HydrophobicContact CD1-CZ 3.87Å; F24-F106 AromaticContact CE1-CE1 3.47Å; F24-F106 HydrophobicContact CE1-CE1 3.47Å; F24-F106 VanDerWaalsContact CE1-CE1 3.47Å; F24-F106 AromaticContact CE1-CZ 3.64Å; F24-F106 HydrophobicContact CE1-CZ 3.64Å; F24-F106 HydrophobicContact CZ-CE1 4.37Å; F24-F106 HydrophobicContact CZ-CZ 4.18Å; R25-F106 HydrophobicContact CG-CD1 3.96Å; R25-F106 HydrophobicContact CG-CE1 3.8Å; R25-F106 HydrophobicContact CG-CZ 4.31Å; M28-F106 HydrophobicContact CB-CE2 3.99Å; M28-F106 HydrophobicContact CB-CZ 3.96Å; M28-F106 HydrophobicContact CG-CE2 4.18Å; M28-F106 HydrophobicContact CG-CZ 4.16Å; L30-F106 HydrophobicContact CD1-CD2 4.18Å; L30-F106 HydrophobicContact CD2-CD2 3.77Å; L30-F106 HydrophobicContact CD2-CE2 3.74Å; L30-F106 HydrophobicContact CG-CD2 4.49Å; F44-F106 HydrophobicContact CD1-CD2 4.48Å; F44-F106 HydrophobicContact CD1-CE2 4.17Å; F44-F106 HydrophobicContact CE1-CD1 4.14Å; F44-F106 AromaticContact CE1-CD2 3.81Å; F44-F106 HydrophobicContact CE1-CD2 3.81Å; F44-F106 AromaticContact CE1-CE1 3.96Å; F44-F106 HydrophobicContact CE1-CE1 3.96Å; F44-F106 AromaticContact CE1-CE2 3.6Å; F44-F106 HydrophobicContact CE1-CE2 3.6Å; F44-F106 HydrophobicContact CE1-CG 4.07Å; F44-F106 AromaticContact CE1-CZ 3.67Å; F44-F106 HydrophobicContact CE1-CZ 3.67Å; F44-F106 HydrophobicContact CZ-CD1 4.41Å; F44-F106 HydrophobicContact CZ-CE1 4.05Å; F44-F106 HydrophobicContact CZ-CE2 4.43Å; F44-F106 HydrophobicContact CZ-CZ 4.06Å; V84-F106 WeakPolarHBondContact O-CD1 3.45Å; V85-F106 HydrophobicContact CG2-CD1 4.22Å; V85-F106 HydrophobicContact CG2-CE1 3.96Å
107	P	81.3	Confident	67.5	Low	0 Å²	0	74.1 Å²	74.1	0%	0	41%	0.414	C	S	.	.			trans	-58.5	146.3	171.2	-24.4	32.3	0	0	0	111.3	R25 H83 V84 E86 T109	R25-P107 PolarHBondContact NH1-O 3.38Å; R25-P107 PolarHBondContact NH2-O 2.99Å; H83-P107 VanDerWaalsContact CE1-CB 3.45Å; H83-P107 WeakPolarHBondContact CE1-CB 3.47Å; H83-P107 WeakPolarHBondContact NE2-CG 3.26Å; V84-P107 WeakPolarHBondContact O-CD 3.49Å; E86-P107 HydrophobicContact CB-CG 4.13Å; E86-P107 HydrophobicContact CG-CG 3.83Å; P107-T109 PolarHBondContact O-N 2.92Å
108	P	67.8	Low	64.8	Low	125 Å²	125	84.4 Å²	84.4	81%	0.812	45%	0.453	S	S	*	.	S	Bend	trans	-62	-27.9	179.4	23.8	-32.5	0	0	0	112.4
109	T	59.6	Low	62.3	Low	94 Å²	94	84.9 Å²	84.9	58%	0.577	46%	0.462	S	S	*	.	S	Bend	trans	-99	117.4	173.5	46.7	0	0	0	0	110.7	P107	P107-T109 PolarHBondContact O-N 2.92Å
110	S	54.6	Low	59.6	Low	51 Å²	51	87.9 Å²	87.9	36%	0.357	49%	0.485	S	S	.	.			trans	-67.5	132.7	175.3	166.1	0	0	0	0	111.3	L112	S110-L112 CarbonylContact O-C 3.53Å; S110-L112 PolarHBondContact O-N 3.4Å; S110-L112 PolarHBondContact OG-N 3.29Å; S110-L112 PolarHBondContact OG-O 3.48Å; S110-L112 VanDerWaalsContact OG-O 3.05Å
111	P	55.3	Low	57.1	Low	50 Å²	50	92.3 Å²	92.3	33%	0.325	51%	0.511	S	S	.	.	S	Bend	trans	-73.1	-17.8	175.4	31.4	-37.6	0	0	0	112.9	H83 V84 K113	H83-P111 WeakPolarHBondContact O-CG 3.35Å; V84-P111 HydrophobicContact CB-CG 4Å; V84-P111 HydrophobicContact CG1-CG 4.45Å; V84-P111 HydrophobicContact CG2-CB 4.47Å; V84-P111 HydrophobicContact CG2-CG 3.54Å; P111-K113 VanDerWaalsContact C-N 3.28Å; P111-K113 PolarHBondContact O-N 3.43Å
112	L	47.4	Very low	54.8	Low	37 Å²	37	92.9 Å²	92.9	19%	0.194	51%	0.505	C	S	.	.	S	Bend	trans	-70	97.5	156.6	-59.5	179.1	0	0	0	106	N18 I21 K22 S110 P114	N18-L112 HydrophobicContact CB-CD2 3.93Å; N18-L112 WeakPolarHBondContact O-CD1 3.46Å; N18-L112 VanDerWaalsContact OD1-CD2 3.22Å; N18-L112 WeakPolarHBondContact OD1-CD2 3.49Å; I21-L112 HydrophobicContact CB-CD1 3.86Å; I21-L112 HydrophobicContact CB-CD2 4.31Å; I21-L112 HydrophobicContact CB-CG 4.09Å; I21-L112 HydrophobicContact CD1-CD2 4.17Å; I21-L112 HydrophobicContact CG2-CD1 3.61Å; I21-L112 HydrophobicContact CG2-CD2 4.31Å; I21-L112 HydrophobicContact CG2-CG 3.64Å; K22-L112 HydrophobicContact CB-CD1 4Å; S110-L112 CarbonylContact O-C 3.53Å; S110-L112 PolarHBondContact O-N 3.4Å; S110-L112 PolarHBondContact OG-N 3.29Å; S110-L112 PolarHBondContact OG-O 3.48Å; S110-L112 VanDerWaalsContact OG-O 3.05Å; L112-P114 VanDerWaalsContact O-CD 3.28Å; L112-P114 WeakPolarHBondContact O-CD 3.32Å
113	K	46.6	Very low	52.3	Low	189 Å²	189	96.6 Å²	96.6	82%	0.822	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-48.7	117.9	155	-76.5	-176.3	178.4	-178.9	0	104.5	P111 L115	P111-K113 VanDerWaalsContact C-N 3.28Å; P111-K113 PolarHBondContact O-N 3.43Å; K113-L115 PolarHBondContact O-N 3.07Å
114	P	38.2	Very low	50.1	Low	115 Å²	115	100.4 Å²	100.4	75%	0.747	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-51.1	117.4	169.3	18.8	-27.6	0	0	0	105.2	L112 P116	L112-P114 VanDerWaalsContact O-CD 3.28Å; L112-P114 WeakPolarHBondContact O-CD 3.32Å; P114-P116 WeakPolarHBondContact O-CD 3.38Å; P114-P116 VanDerWaalsContact O-N 3.1Å
115	L	34.3	Very low	47.5	Very low	149 Å²	149	105.3 Å²	105.3	78%	0.78	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-46.8	126.6	160.9	-88	155	0	0	0	103.8	K113 Q117	K113-L115 PolarHBondContact O-N 3.07Å; L115-Q117 PolarHBondContact O-N 2.85Å
116	P	34.1	Very low	45.2	Very low	120 Å²	120	106.8 Å²	106.8	78%	0.779	59%	0.591	S	S	*	*			trans	-61.4	89	173.8	22.5	-29.5	0	0	0	106.3	P114 R118	P114-P116 WeakPolarHBondContact O-CD 3.38Å; P114-P116 VanDerWaalsContact O-N 3.1Å; P116-R118 PolarHBondContact O-N 3.29Å
117	Q	29.6	Very low	42.9	Very low	173 Å²	173	112.8 Å²	112.8	81%	0.808	62%	0.623	S	S	*	*			trans	-60.8	103.5	154.3	-94.5	-172.8	-24.2	0	0	102.3	L115 T119	L115-Q117 PolarHBondContact O-N 2.85Å; Q117-T119 PolarHBondContact O-N 3.27Å
118	R	31.6	Very low	40.8	Very low	216 Å²	216	116.1 Å²	116.1	82%	0.815	65%	0.645	S	S	*	*			trans	-52.9	87.5	149.8	-81.7	-175.5	169.7	176.3	-2.5	105.5	P116	P116-R118 PolarHBondContact O-N 3.29Å
119	T	31.2	Very low	39.3	Very low	105 Å²	105	121.7 Å²	121.7	64%	0.644	65%	0.649	S	S	*	*			trans	-55.2	127.3	140.4	22.2	0	0	0	0	103.8	Q117 V121	Q117-T119 PolarHBondContact O-N 3.27Å; T119-V121 VanDerWaalsContact C-N 3.3Å; T119-V121 PolarHBondContact O-N 3.21Å
120	P	31.8	Very low	38.4	Very low	121 Å²	121	123.1 Å²	123.1	79%	0.786	65%	0.653	S	S	*	*			trans	-52	112.3	166.2	21.4	-28.1	0	0	0	104.6	S122	P120-S122 VanDerWaalsContact C-N 3.25Å; P120-S122 PolarHBondContact O-N 3Å
121	V	34.4	Very low	37.6	Very low	119 Å²	119	125.1 Å²	125.1	72%	0.721	66%	0.659	S	S	*	*			trans	-55.8	105.7	170.7	171.7	0	0	0	0	102.9	T119 E123	T119-V121 VanDerWaalsContact C-N 3.3Å; T119-V121 PolarHBondContact O-N 3.21Å; V121-E123 PolarHBondContact O-N 3.47Å; V121-E123 VanDerWaalsContact O-N 3.09Å
122	S	34.8	Very low	36.6	Very low	77 Å²	77	131.1 Å²	131.1	54%	0.538	68%	0.675	S	S	.	*			trans	-49.3	120.7	158.5	179.4	0	0	0	0	103.9	P120 N124	P120-S122 VanDerWaalsContact C-N 3.25Å; P120-S122 PolarHBondContact O-N 3Å; S122-N124 PolarHBondContact O-N 2.81Å
123	E	34.5	Very low	36.2	Very low	156 Å²	156	135.9 Å²	135.9	73%	0.729	69%	0.69	S	S	*	*	S	Bend	trans	-59.3	16	-174.7	-70	174.2	135.7	0	0	114.1	V121 Y433	V121-E123 PolarHBondContact O-N 3.47Å; V121-E123 VanDerWaalsContact O-N 3.09Å; E123-Y433 PolarHBondContact OE2-OH 2.84Å
124	N	40.8	Very low	35.9	Very low	88 Å²	88	131.9 Å²	131.9	47%	0.471	68%	0.678	S	S	.	*			trans	-123.4	54.2	-172	-68.5	-13.4	0	0	0	112.5	S122	S122-N124 PolarHBondContact O-N 2.81Å
125	C	35.2	Very low	35.7	Very low	106 Å²	106	132.1 Å²	132.1	72%	0.716	67%	0.673	S	S	*	*	S	Bend	trans	-129	115.9	155.3	-83.2	0	0	0	0	109.2
126	D	39	Very low	36.1	Very low	125 Å²	125	128.7 Å²	128.7	67%	0.668	65%	0.65	S	S	*	*			trans	81.6	46.4	164.8	-46.1	-36.3	0	0	0	118.1
127	L	39.6	Very low	36.3	Very low	153 Å²	153	131 Å²	131	80%	0.801	65%	0.65	S	S	*	*	S	Bend	trans	-65.5	136.2	140.1	-71.7	172.6	0	0	0	107.8	R129	L127-R129 PolarHBondContact O-N 3.31Å; L127-R129 VanDerWaalsContact O-N 3.17Å
128	P	36.2	Very low	36.6	Very low	69 Å²	69	131.7 Å²	131.7	45%	0.448	65%	0.654	S	S	.	*			trans	-52.1	129.6	170.6	21	-30	0	0	0	107.8	L130	P128-L130 PolarHBondContact O-N 3Å
129	R	37.5	Very low	36.8	Very low	242 Å²	242	128.3 Å²	128.3	91%	0.913	65%	0.651	S	S	*	*			trans	-41.3	119.2	174.8	-71.3	-178.9	-179.7	173.3	-0.6	107.7	L127 I131	L127-R129 PolarHBondContact O-N 3.31Å; L127-R129 VanDerWaalsContact O-N 3.17Å; R129-I131 PolarHBondContact O-N 3.45Å
130	L	39.9	Very low	37	Very low	125 Å²	125	129 Å²	129	65%	0.654	66%	0.657	S	S	*	*			trans	-51.8	128.4	168.2	-149.5	89.8	0	0	0	105.7	P128 R132	P128-L130 PolarHBondContact O-N 3Å; L130-R132 PolarHBondContact O-N 3.24Å; L130-R132 VanDerWaalsContact O-N 3.17Å
131	I	36.7	Very low	37.2	Very low	92 Å²	92	129.9 Å²	129.9	47%	0.472	65%	0.651	S	S	.	*			trans	-45.7	125.7	-178.4	-64.6	175.4	0	0	0	108.2	R129 D135 L412	R129-I131 PolarHBondContact O-N 3.45Å; I131-D135 HydrophobicContact CG2-CB 4Å; I131-L412 HydrophobicContact CD1-CD2 3.34Å; I131-L412 HydrophobicContact CG1-CD2 4.35Å
132	R	36.2	Very low	37.3	Very low	176 Å²	176	130 Å²	130	66%	0.664	66%	0.655	S	S	*	*			trans	-66.1	142.6	179.6	-139.2	177.2	79	-152.4	3.9	107.1	L130 D134 D135	L130-R132 PolarHBondContact O-N 3.24Å; L130-R132 VanDerWaalsContact O-N 3.17Å; R132-D134 IonicContact CZ-OD2 3.86Å; R132-D134 IonicContact NE-OD2 2.68Å; R132-D134 PolarHBondContact NE-OD2 3.44Å; R132-D134 IonicContact NH2-OD2 3.12Å; R132-D134 PolarHBondContact NH2-OD2 3.28Å; R132-D134 PolarHBondContact O-N 2.93Å; R132-D135 PolarHBondContact O-N 2.82Å
133	W	37.8	Very low	37.4	Very low	137 Å²	137	135.3 Å²	135.3	52%	0.519	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.5	4.9	-176.3	-65	90.6	0	0	0	115.2	Y136	W133-Y136 HydrophobicContact CE3-CE2 4.38Å; W133-Y136 WeakPolarHBondContact O-CD2 3.17Å; W133-Y136 WeakPolarHBondContact O-CE2 3.39Å
134	D	39.9	Very low	37.5	Very low	105 Å²	105	137 Å²	137	56%	0.561	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-1.5	-174.2	-52.9	-37.4	0	0	0	113.1	R132 Y136	R132-D134 IonicContact CZ-OD2 3.86Å; R132-D134 IonicContact NE-OD2 2.68Å; R132-D134 PolarHBondContact NE-OD2 3.44Å; R132-D134 IonicContact NH2-OD2 3.12Å; R132-D134 PolarHBondContact NH2-OD2 3.28Å; R132-D134 PolarHBondContact O-N 2.93Å; D134-Y136 VanDerWaalsContact C-N 3.34Å; D134-Y136 PolarHBondContact O-N 2.66Å
135	D	35.2	Very low	37.4	Very low	120 Å²	120	140.1 Å²	140.1	64%	0.642	69%	0.69	S	S	*	*			trans	-89.7	24.8	-175.3	-69.2	-22.9	0	0	0	114.3	I131 R132	I131-D135 HydrophobicContact CG2-CB 4Å; R132-D135 PolarHBondContact O-N 2.82Å
136	Y	41.3	Very low	37.4	Very low	78 Å²	78	140.6 Å²	140.6	31%	0.306	69%	0.693	S	S	.	*			trans	-96.1	136.2	-176.1	-61.3	-78.1	0	0	0	113.3	W133 D134 I174	W133-Y136 HydrophobicContact CE3-CE2 4.38Å; W133-Y136 WeakPolarHBondContact O-CD2 3.17Å; W133-Y136 WeakPolarHBondContact O-CE2 3.39Å; D134-Y136 VanDerWaalsContact C-N 3.34Å; D134-Y136 PolarHBondContact O-N 2.66Å; Y136-I174 HydrophobicContact CD1-CG2 3.77Å; Y136-I174 HydrophobicContact CE1-CG2 3.74Å
137	E	38.5	Very low	37.3	Very low	167 Å²	167	143.4 Å²	143.4	78%	0.78	70%	0.704	S	S	*	*			trans	-77.7	115.7	159.7	-80.2	-174.9	158.7	0	0	109.2	L139	E137-L139 PolarHBondContact O-N 3.26Å
138	E	36	Very low	37.1	Very low	189 Å²	189	145.6 Å²	145.6	88%	0.883	71%	0.707	S	S	*	*			trans	-71.7	104.7	167.2	-72.4	-171.6	151.9	0	0	109.2
139	L	35.9	Very low	36.9	Very low	144 Å²	144	147.1 Å²	147.1	75%	0.754	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-72.8	144.8	167.4	-71.2	173.5	0	0	0	110.1	E137 Q141	E137-L139 PolarHBondContact O-N 3.26Å; L139-Q141 PolarHBondContact O-N 3.22Å
140	P	35.2	Very low	36.9	Very low	119 Å²	119	143.5 Å²	143.5	77%	0.773	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56.8	132.6	175.1	-19.2	29.8	0	0	0	110.6
141	Q	36.9	Very low	37.2	Very low	141 Å²	141	144.4 Å²	144.4	66%	0.659	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-58.5	133.7	176.1	-66.6	-175.5	-0.4	0	0	110.1	L139	L139-Q141 PolarHBondContact O-N 3.22Å
142	P	37	Very low	37.3	Very low	122 Å²	122	146.3 Å²	146.3	79%	0.792	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-63.9	137.6	161.9	26.7	-29.8	0	0	0	108.6	K144	P142-K144 PolarHBondContact O-N 3.02Å
143	E	35.8	Very low	37.6	Very low	188 Å²	188	144.1 Å²	144.1	88%	0.879	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-46.5	135	-179.2	-71.6	173.5	145.8	0	0	111.7	I145	E143-I145 PolarHBondContact O-N 3Å
144	K	36	Very low	37.9	Very low	192 Å²	192	143 Å²	143	84%	0.835	75%	0.746	S	S	*	*			trans	-45.5	109.9	179.8	-67.3	174.5	178	179.1	0	110.5	P142 P146	P142-K144 PolarHBondContact O-N 3.02Å; K144-P146 WeakPolarHBondContact O-CD 3.33Å
145	I	40	Very low	38.1	Very low	152 Å²	152	147 Å²	147	78%	0.779	76%	0.761	S	S	*	*			trans	-68.6	118.7	163.8	-58.4	171.1	0	0	0	106	E143 M147	E143-I145 PolarHBondContact O-N 3Å; I145-M147 PolarHBondContact O-N 3.14Å
146	P	33.8	Very low	38.6	Very low	117 Å²	117	146 Å²	146	76%	0.76	76%	0.76	S	S	*	*			trans	-72	100	-178.5	28.2	-31.1	0	0	0	109	K144 K148	K144-P146 WeakPolarHBondContact O-CD 3.33Å; P146-K148 PolarHBondContact O-N 3.39Å
147	M	37.1	Very low	38.7	Very low	184 Å²	184	151.3 Å²	151.3	91%	0.906	78%	0.779	S	S	*	*			trans	-70.6	107.5	162.1	-83.6	-174.2	-179.2	0	0	108	I145 S149	I145-M147 PolarHBondContact O-N 3.14Å; M147-S149 PolarHBondContact O-N 2.99Å
148	K	36.5	Very low	38.9	Very low	198 Å²	198	150.6 Å²	150.6	86%	0.861	78%	0.781	S	S	*	*			trans	-58.6	124.4	166.4	-87.3	180	172.9	177.2	0	108.6	P146 L150	P146-K148 PolarHBondContact O-N 3.39Å; K148-L150 PolarHBondContact O-N 2.95Å; K148-L150 VanDerWaalsContact O-N 3.16Å
149	S	31.8	Very low	39.4	Very low	102 Å²	102	151 Å²	151	71%	0.713	78%	0.78	S	S	*	*			trans	-63.6	116.3	167.4	60.2	0	0	0	0	108.5	M147 I151	M147-S149 PolarHBondContact O-N 2.99Å; S149-I151 PolarHBondContact O-N 2.92Å; S149-I151 VanDerWaalsContact O-N 3.09Å
150	L	38.5	Very low	39.6	Very low	165 Å²	165	154.1 Å²	154.1	86%	0.864	78%	0.782	S	S	*	*			trans	-73.1	97.3	164.7	-89.7	146.2	0	0	0	106.7	K148 L152	K148-L150 PolarHBondContact O-N 2.95Å; K148-L150 VanDerWaalsContact O-N 3.16Å; L150-L152 PolarHBondContact O-N 2.78Å
151	I	44.6	Very low	39.9	Very low	145 Å²	145	158.2 Å²	158.2	74%	0.744	79%	0.79	S	S	*	*			trans	-64.6	105.7	166.8	-59.6	174.5	0	0	0	106.3	S149	S149-I151 PolarHBondContact O-N 2.92Å; S149-I151 VanDerWaalsContact O-N 3.09Å
152	L	38.7	Very low	40.4	Very low	132 Å²	132	155.6 Å²	155.6	69%	0.691	79%	0.787	S	S	*	*			trans	-87.7	117.4	-179.9	-166.2	70.7	0	0	0	108.9	L150	L150-L152 PolarHBondContact O-N 2.78Å
153	N	44	Very low	40.7	Very low	130 Å²	130	157 Å²	157	70%	0.695	79%	0.786	S	S	*	*			trans	-63	142.8	-178.7	-66.8	-17.7	0	0	0	112.3	E155	N153-E155 PolarHBondContact O-N 3.2Å
154	S	43.7	Very low	40.9	Very low	113 Å²	113	152.1 Å²	152.1	79%	0.79	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-5.7	-169.4	-175.6	0	0	0	0	117.2
155	E	43.9	Very low	41.1	Very low	188 Å²	188	149.5 Å²	149.5	88%	0.879	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-6.1	-169.1	-66.8	-174.8	164.6	0	0	114.7	N153	N153-E155 PolarHBondContact O-N 3.2Å
156	T	46	Very low	41.2	Very low	99 Å²	99	145 Å²	145	61%	0.607	76%	0.763	S	S	*	*	S	Bend	trans	-109.7	-0.6	-177.9	55.5	0	0	0	0	114.9	N158	T156-N158 VanDerWaalsContact C-N 3.35Å; T156-N158 PolarHBondContact O-N 3.01Å
157	W	42.5	Very low	41.7	Very low	190 Å²	190	148 Å²	148	72%	0.72	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-67.8	-27.4	-172.8	-173.2	-99.5	0	0	0	114.4	K159	W157-K159 VanDerWaalsContact C-N 3.27Å; W157-K159 PolarHBondContact O-N 3.42Å
158	N	43.8	Very low	42.1	Very low	152 Å²	152	144.3 Å²	144.3	81%	0.813	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-80.3	13.1	-167.6	-70.6	-23.1	0	0	0	116.3	T156	T156-N158 VanDerWaalsContact C-N 3.35Å; T156-N158 PolarHBondContact O-N 3.01Å
159	K	45.2	Very low	42.5	Very low	197 Å²	197	140.4 Å²	140.4	86%	0.857	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-128.6	13.9	-178.3	-77	-171.7	180	176.7	0	116.5	W157	W157-K159 VanDerWaalsContact C-N 3.27Å; W157-K159 PolarHBondContact O-N 3.42Å
160	R	41.5	Very low	43.3	Very low	211 Å²	211	142.6 Å²	142.6	80%	0.796	74%	0.738	S	S	*	*			trans	-125.6	109.9	173.4	-70.1	-173.3	179.7	172.7	1.2	110.5	S162	R160-S162 PolarHBondContact O-N 3.31Å
161	H	41.7	Very low	43.7	Very low	205 Å²	205	137.8 Å²	137.8	95%	0.949	72%	0.717	S	S	*	*			trans	-69	49.6	158.3	-67.6	98.9	0	0	0	110.2
162	S	46.8	Very low	44.1	Very low	85 Å²	85	136.1 Å²	136.1	59%	0.594	71%	0.705	S	S	*	*			trans	-91.3	107.6	168.4	-57.2	0	0	0	0	105.3	R160 A164	R160-S162 PolarHBondContact O-N 3.31Å; S162-A164 PolarHBondContact O-N 2.97Å
163	I	42.9	Very low	44.9	Very low	152 Å²	152	135.5 Å²	135.5	78%	0.779	70%	0.701	S	S	*	*			trans	-37.9	125.1	171.4	-64.9	158.5	0	0	0	108.4	I165	I163-I165 VanDerWaalsContact C-N 3.27Å; I163-I165 PolarHBondContact O-N 3.48Å
164	A	40.7	Very low	45.5	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	68%	0.678	S	S	*	*			trans	-58.5	94.8	172	0	0	0	0	0	108.2	S162 G166	S162-A164 PolarHBondContact O-N 2.97Å; A164-G166 PolarHBondContact O-N 3.29Å
165	I	39.8	Very low	45.9	Very low	137 Å²	137	136 Å²	136	70%	0.703	68%	0.678	S	S	*	*			trans	-75.7	101.3	162.7	-56.9	175.5	0	0	0	103.1	I163 V168	I163-I165 VanDerWaalsContact C-N 3.27Å; I163-I165 PolarHBondContact O-N 3.48Å; I165-V168 HydrophobicContact CG2-CG2 3.71Å
166	G	41.8	Very low	46.5	Very low	58 Å²	58	129.4 Å²	129.4	60%	0.598	65%	0.645	S	S	*	*			trans	-51.5	161.2	168.7	0	0	0	0	0	110.6	A164 V168	A164-G166 PolarHBondContact O-N 3.29Å; G166-V168 PolarHBondContact O-N 3.46Å
167	E	44.5	Very low	47	Very low	180 Å²	180	128.8 Å²	128.8	84%	0.841	65%	0.645	S	S	*	*			trans	-29.2	107.5	-177.3	-70.8	-179.3	153.1	0	0	112.7	H169	E167-H169 PolarHBondContact O-N 3.3Å; E167-H169 PolarHBondContact O-ND1 2.98Å
168	V	44.4	Very low	48.2	Very low	106 Å²	106	127 Å²	127	64%	0.642	65%	0.65	S	S	*	*			trans	-63.5	109.1	178.5	179.9	0	0	0	0	106.5	I165 G166 E170	I165-V168 HydrophobicContact CG2-CG2 3.71Å; G166-V168 PolarHBondContact O-N 3.46Å; V168-E170 PolarHBondContact O-N 3.49Å
169	H	45.8	Very low	49.7	Very low	116 Å²	116	121.6 Å²	121.6	54%	0.537	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-57.3	137.9	179.9	-65.4	18.6	0	0	0	108.7	E167 C171 A420	E167-H169 PolarHBondContact O-N 3.3Å; E167-H169 PolarHBondContact O-ND1 2.98Å; H169-C171 PolarHBondContact O-N 3.47Å; H169-A420 HydrophobicContact CB-CB 4.3Å; H169-A420 VanDerWaalsContact CB-O 3.26Å; H169-A420 WeakPolarHBondContact CB-O 3.36Å; H169-A420 PolarHBondContact CD2-O 2.99Å
170	E	48.9	Very low	51.6	Low	149 Å²	149	115.3 Å²	115.3	70%	0.696	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-49.8	116.4	-174.8	-72.6	-176.7	165.2	0	0	111.1	V168 K172 A420	V168-E170 PolarHBondContact O-N 3.49Å; E170-K172 PolarHBondContact O-N 2.97Å; E170-A420 PolarHBondContact O-N 2.92Å
171	C	46.2	Very low	53.7	Low	63 Å²	63	110.2 Å²	110.2	43%	0.426	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.4	116.5	174.9	-65.3	0	0	0	0	109.1	H169 I417 Y419	H169-C171 PolarHBondContact O-N 3.47Å; C171-I417 HydrophobicContact CB-CG2 4.35Å; C171-Y419 WeakPolarHBondContact SG-CD1 3.36Å; C171-Y419 WeakPolarHBondContact SG-CE1 3.29Å
172	K	54.3	Low	55.9	Low	111 Å²	111	108.5 Å²	108.5	48%	0.483	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.3	116.4	170.2	-68.1	-177	-179.3	177.6	0	109.1	E170 I174 K418	E170-K172 PolarHBondContact O-N 2.97Å; K172-I174 PolarHBondContact O-N 3.34Å; K172-K418 PolarHBondContact N-O 3.17Å; K172-K418 PolarHBondContact O-N 3.04Å; K172-K418 VanDerWaalsContact O-N 3.1Å
173	I	54.2	Low	57.8	Low	119 Å²	119	108.7 Å²	108.7	61%	0.61	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.7	103.6	170.5	-59.6	175	0	0	0	107	R175 V415	I173-R175 HydrophobicContact CG2-CG 4.4Å; I173-R175 PolarHBondContact O-N 3.49Å; I173-V415 HydrophobicContact CG2-CG1 3.72Å
174	I	57.1	Low	60	Low	40 Å²	40	102.9 Å²	102.9	21%	0.205	55%	0.546	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	104.3	173	-56.8	175.7	0	0	0	106.8	Y136 K172 R176 Q416 K418	Y136-I174 HydrophobicContact CD1-CG2 3.77Å; Y136-I174 HydrophobicContact CE1-CG2 3.74Å; K172-I174 PolarHBondContact O-N 3.34Å; I174-R176 PolarHBondContact O-N 3.31Å; I174-Q416 PolarHBondContact N-O 2.93Å; I174-K418 HydrophobicContact CD1-CB 3.87Å; I174-K418 HydrophobicContact CD1-CD 3.71Å; I174-K418 HydrophobicContact CD1-CG 4.44Å; I174-K418 HydrophobicContact CG1-CB 4.41Å
175	R	50.9	Low	62.4	Low	212 Å²	212	100.9 Å²	100.9	80%	0.8	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-72.8	125.5	168.2	-68.1	-173.6	178.7	-172.9	0.6	107.6	I173	I173-R175 HydrophobicContact CG2-CG 4.4Å; I173-R175 PolarHBondContact O-N 3.49Å
176	R	56.6	Low	64.8	Low	50 Å²	50	99.6 Å²	99.6	19%	0.189	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-72.1	143	173.9	-70.3	-173.2	170.8	179.8	1.6	109.5	I174 H411 L412 R414	I174-R176 PolarHBondContact O-N 3.31Å; R176-H411 PolarHBondContact NH1-O 3.06Å; R176-L412 WeakPolarHBondContact CD-O 3.27Å; R176-L412 PolarHBondContact NH1-O 3.33Å; R176-R414 WeakPolarHBondContact CD-O 3.3Å; R176-R414 PolarHBondContact NE-O 3.47Å
177	S	57.7	Low	67.1	Low	87 Å²	87	97.7 Å²	97.7	61%	0.608	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-53.9	137.9	173.9	-40.5	0	0	0	0	110.1	I179	S177-I179 PolarHBondContact O-N 3.36Å
178	D	66.4	Low	69.4	Low	153 Å²	153	89.6 Å²	89.6	82%	0.818	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-58.9	129.5	178.4	-72.9	-41.3	0	0	0	110.5	T180	D178-T180 PolarHBondContact O-N 2.88Å; D178-T180 VanDerWaalsContact O-N 3.09Å
179	I	77.1	Confident	71.8	Confident	38 Å²	38	86.9 Å²	86.9	20%	0.195	43%	0.432	C	S	.	.			trans	-69.1	112.8	-179.3	-53.7	177.4	0	0	0	108.4	S177 Q183 V184 L409 L412 R413	S177-I179 PolarHBondContact O-N 3.36Å; I179-Q183 HydrophobicContact CG2-CB 3.86Å; I179-V184 HydrophobicContact CG2-CG2 3.7Å; I179-L409 HydrophobicContact CD1-CD2 4.18Å; I179-L412 HydrophobicContact CD1-CB 3.49Å; I179-L412 VanDerWaalsContact CD1-CB 3.49Å; I179-L412 HydrophobicContact CD1-CD1 4.24Å; I179-L412 HydrophobicContact CG1-CB 4.41Å; I179-R413 HydrophobicContact CD1-CG 3.63Å; I179-R413 HydrophobicContact CG1-CG 4.37Å
180	T	84.3	Confident	73.9	Confident	64 Å²	64	88.2 Å²	88.2	39%	0.393	44%	0.436	S	S	.	.			trans	-68.4	151.7	178	63.9	0	0	0	0	111	D178 K182 Q183 V184	D178-T180 PolarHBondContact O-N 2.88Å; D178-T180 VanDerWaalsContact O-N 3.09Å; T180-K182 PolarHBondContact O-N 3.21Å; T180-K182 VanDerWaalsContact O-N 3.15Å; T180-Q183 WeakPolarHBondContact O-CB 3.43Å; T180-Q183 PolarHBondContact O-N 3.19Å; T180-Q183 VanDerWaalsContact OG1-CG 3.3Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.41Å; T180-Q183 PolarHBondContact OG1-N 2.95Å; T180-Q183 PolarHBondContact OG1-OE1 3.38Å; T180-Q183 VanDerWaalsContact OG1-OE1 3.13Å; T180-V184 PolarHBondContact O-N 2.9Å; T180-V184 VanDerWaalsContact O-N 3.15Å
181	P	86.2	Confident	76	Confident	105 Å²	105	82.7 Å²	82.7	68%	0.682	41%	0.41	S	S	*	.	H	α-helix	trans	-54.9	-34.3	175.2	-27.1	34.6	0	0	0	113.5	Q183 V184 D185	P181-Q183 PolarHBondContact O-N 2.84Å; P181-V184 WeakPolarHBondContact O-CB 3.41Å; P181-V184 PolarHBondContact O-N 3.38Å; P181-D185 PolarHBondContact O-N 2.87Å
182	K	87.4	Confident	78.2	Confident	168 Å²	168	79.7 Å²	79.7	73%	0.73	39%	0.39	S	S	*	.	H	α-helix	trans	-65.2	-36.6	176	-67.7	-177	-179.7	177	0	112.6	T180 D185 Q186	T180-K182 PolarHBondContact O-N 3.21Å; T180-K182 VanDerWaalsContact O-N 3.15Å; K182-D185 PolarHBondContact O-N 3.05Å; K182-Q186 WeakPolarHBondContact O-CG 3.36Å; K182-Q186 PolarHBondContact O-N 3.49Å
183	Q	86.2	Confident	80	Confident	89 Å²	89	75.6 Å²	75.6	42%	0.416	37%	0.373	S	S	.	.	H	α-helix	trans	-68.5	-39.7	175	-74.9	164.3	-27.8	0	0	110.9	I179 T180 P181 D185 Q186 I187	I179-Q183 HydrophobicContact CG2-CB 3.86Å; T180-Q183 WeakPolarHBondContact O-CB 3.43Å; T180-Q183 PolarHBondContact O-N 3.19Å; T180-Q183 VanDerWaalsContact OG1-CG 3.3Å; T180-Q183 WeakPolarHBondContact OG1-CG 3.41Å; T180-Q183 PolarHBondContact OG1-N 2.95Å; T180-Q183 PolarHBondContact OG1-OE1 3.38Å; T180-Q183 VanDerWaalsContact OG1-OE1 3.13Å; P181-Q183 PolarHBondContact O-N 2.84Å; Q183-D185 VanDerWaalsContact C-N 3.34Å; Q183-D185 PolarHBondContact O-N 3.19Å; Q183-Q186 PolarHBondContact O-N 3.29Å; Q183-I187 WeakPolarHBondContact O-CD1 3.4Å; Q183-I187 VanDerWaalsContact O-CG1 3.22Å; Q183-I187 WeakPolarHBondContact O-CG1 3.41Å; Q183-I187 PolarHBondContact O-N 3.48Å
184	V	88.7	Confident	81.7	Confident	30 Å²	30	71.9 Å²	71.9	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-58.7	-46.8	173.8	178.4	0	0	0	0	110.9	I179 T180 P181 Q186 I187 W188 L409	I179-V184 HydrophobicContact CG2-CG2 3.7Å; T180-V184 PolarHBondContact O-N 2.9Å; T180-V184 VanDerWaalsContact O-N 3.15Å; P181-V184 WeakPolarHBondContact O-CB 3.41Å; P181-V184 PolarHBondContact O-N 3.38Å; V184-Q186 VanDerWaalsContact C-N 3.34Å; V184-Q186 PolarHBondContact O-N 3.06Å; V184-I187 PolarHBondContact O-N 3.04Å; V184-W188 PolarHBondContact O-N 3.39Å; V184-L409 HydrophobicContact CG1-CD1 4.46Å; V184-L409 HydrophobicContact CG2-CD2 4.15Å
185	D	91.6	Very high	83.4	Confident	43 Å²	43	70.6 Å²	70.6	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-56.7	-46.6	175.7	-76.5	1.4	0	0	0	111.8	P181 K182 Q183 I187 W188 K189 A216 I220	P181-D185 PolarHBondContact O-N 2.87Å; K182-D185 PolarHBondContact O-N 3.05Å; Q183-D185 VanDerWaalsContact C-N 3.34Å; Q183-D185 PolarHBondContact O-N 3.19Å; D185-I187 PolarHBondContact O-N 3.36Å; D185-W188 PolarHBondContact O-N 3.36Å; D185-K189 WeakPolarHBondContact O-CB 3.3Å; D185-K189 PolarHBondContact O-N 3.21Å; D185-A216 HydrophobicContact CB-CB 3.63Å; D185-A216 WeakPolarHBondContact O-CB 3.37Å; D185-I220 WeakPolarHBondContact OD1-CD1 3.27Å
186	Q	90.8	Very high	85.4	Confident	110 Å²	110	60.5 Å²	60.5	51%	0.514	32%	0.315	S	S	.	.	H	α-helix	trans	-64.8	-38.2	177.9	-74	-178.4	3	0	0	112.8	K182 Q183 V184 K189 K190	K182-Q186 WeakPolarHBondContact O-CG 3.36Å; K182-Q186 PolarHBondContact O-N 3.49Å; Q183-Q186 PolarHBondContact O-N 3.29Å; V184-Q186 VanDerWaalsContact C-N 3.34Å; V184-Q186 PolarHBondContact O-N 3.06Å; Q186-K189 PolarHBondContact O-N 3.23Å; Q186-K190 WeakPolarHBondContact O-CB 3.19Å; Q186-K190 VanDerWaalsContact O-CG 3.32Å; Q186-K190 WeakPolarHBondContact O-CG 3.33Å; Q186-K190 PolarHBondContact O-N 3.15Å
187	I	89.8	Confident	87	Confident	19 Å²	19	60 Å²	60	10%	0.097	32%	0.315	C	S	.	.	H	α-helix	trans	-62.6	-51.1	176.9	-71.7	163.4	0	0	0	109.8	Q183 V184 D185 K189 K190 M191 V405 L409 L412	Q183-I187 WeakPolarHBondContact O-CD1 3.4Å; Q183-I187 VanDerWaalsContact O-CG1 3.22Å; Q183-I187 WeakPolarHBondContact O-CG1 3.41Å; Q183-I187 PolarHBondContact O-N 3.48Å; V184-I187 PolarHBondContact O-N 3.04Å; D185-I187 PolarHBondContact O-N 3.36Å; I187-K189 VanDerWaalsContact C-N 3.3Å; I187-K189 PolarHBondContact O-N 2.91Å; I187-K190 PolarHBondContact O-N 2.88Å; I187-M191 HydrophobicContact CG2-CG 4.26Å; I187-M191 HydrophobicContact CG2-SD 3.71Å; I187-M191 WeakPolarHBondContact O-CB 3.39Å; I187-M191 VanDerWaalsContact O-CG 3.31Å; I187-M191 WeakPolarHBondContact O-CG 3.34Å; I187-M191 PolarHBondContact O-N 3.33Å; I187-V405 HydrophobicContact CG2-CG1 4.07Å; I187-L409 HydrophobicContact CD1-CD2 3.59Å; I187-L409 HydrophobicContact CG2-CD2 4.48Å; I187-L412 HydrophobicContact CD1-CD1 3.52Å
188	W	93.6	Very high	88.6	Confident	9 Å²	9	62.5 Å²	62.5	3%	0.034	31%	0.311	C	S	.	.	H	α-helix	trans	-55.7	-46.8	176.6	-87	103	0	0	0	111.7	V184 D185 T192 I219 I220 V223 F224 L401 H402 V405	V184-W188 PolarHBondContact O-N 3.39Å; D185-W188 PolarHBondContact O-N 3.36Å; W188-T192 VanDerWaalsContact O-CB 3.23Å; W188-T192 WeakPolarHBondContact O-CB 3.48Å; W188-T192 PolarHBondContact O-N 3.33Å; W188-T192 PolarHBondContact O-OG1 3.33Å; W188-I219 HydrophobicContact CE3-CG2 3.91Å; W188-I220 HydrophobicContact CB-CD1 4.33Å; W188-I220 HydrophobicContact CB-CG1 4.04Å; W188-I220 HydrophobicContact CD2-CG1 4.15Å; W188-I220 HydrophobicContact CG-CD1 4.1Å; W188-I220 HydrophobicContact CG-CG1 3.63Å; W188-V223 HydrophobicContact CH2-CG1 3.9Å; W188-V223 HydrophobicContact CH2-CG2 4.33Å; W188-V223 HydrophobicContact CZ3-CG1 4.39Å; W188-V223 HydrophobicContact CZ3-CG2 3.99Å; W188-F224 HydrophobicContact CH2-CE2 4.33Å; W188-F224 HydrophobicContact CH2-CZ 4.4Å; W188-F224 AromaticContact CZ2-CE2 3.62Å; W188-F224 HydrophobicContact CZ2-CE2 3.62Å; W188-F224 AromaticContact CZ2-CZ 3.73Å; W188-F224 HydrophobicContact CZ2-CZ 3.73Å; W188-L401 HydrophobicContact CZ3-CG 4.41Å; W188-H402 HydrophobicContact CH2-CB 4.39Å; W188-H402 AromaticContact CH2-CD2 3.89Å; W188-V405 HydrophobicContact CD2-CB 4.42Å; W188-V405 HydrophobicContact CD2-CG1 3.8Å; W188-V405 HydrophobicContact CD2-CG2 4.2Å; W188-V405 VanDerWaalsContact CE2-CG1 3.45Å; W188-V405 HydrophobicContact CE3-CB 4.41Å; W188-V405 HydrophobicContact CE3-CG1 4.27Å; W188-V405 HydrophobicContact CE3-CG2 3.86Å; W188-V405 HydrophobicContact CG-CG1 4.24Å; W188-V405 HydrophobicContact CH2-CB 3.99Å; W188-V405 HydrophobicContact CH2-CG1 4.13Å; W188-V405 HydrophobicContact CH2-CG2 4.15Å; W188-V405 HydrophobicContact CZ2-CB 3.99Å; W188-V405 HydrophobicContact CZ2-CG1 3.64Å; W188-V405 HydrophobicContact CZ2-CG2 4.47Å; W188-V405 HydrophobicContact CZ3-CB 4.2Å; W188-V405 HydrophobicContact CZ3-CG1 4.43Å; W188-V405 HydrophobicContact CZ3-CG2 3.84Å
189	K	93.3	Very high	89.7	Confident	50 Å²	50	55.7 Å²	55.7	22%	0.217	28%	0.275	C	S	.	.	H	α-helix	trans	-60.4	-52.9	177.6	177.2	167.9	174.5	162	0	112.2	D185 Q186 I187 T192 I193 P211 V214 A216	D185-K189 WeakPolarHBondContact O-CB 3.3Å; D185-K189 PolarHBondContact O-N 3.21Å; Q186-K189 PolarHBondContact O-N 3.23Å; I187-K189 VanDerWaalsContact C-N 3.3Å; I187-K189 PolarHBondContact O-N 2.91Å; K189-T192 PolarHBondContact O-N 3.17Å; K189-I193 HydrophobicContact CG-CD1 3.9Å; K189-I193 VanDerWaalsContact O-CG1 3.29Å; K189-I193 WeakPolarHBondContact O-CG1 3.33Å; K189-I193 PolarHBondContact O-N 2.67Å; K189-P211 WeakPolarHBondContact CE-O 3.24Å; K189-P211 PolarHBondContact NZ-O 3.49Å; K189-V214 HydrophobicContact CD-CB 4.4Å; K189-V214 HydrophobicContact CD-CG1 4.25Å; K189-V214 WeakPolarHBondContact CE-O 3.17Å; K189-V214 HydrophobicContact CG-CB 4.45Å; K189-V214 HydrophobicContact CG-CG1 3.94Å; K189-V214 PolarHBondContact NZ-O 2.96Å; K189-A216 HydrophobicContact CB-CB 4.22Å
190	K	91.2	Very high	90.2	Very high	144 Å²	144	54.7 Å²	54.7	63%	0.626	27%	0.27	S	S	*	.	H	α-helix	trans	-60.9	-48	-178.9	-76.1	179.8	178.8	-179.8	0	111.8	Q186 I187 T192 I193 A194	Q186-K190 WeakPolarHBondContact O-CB 3.19Å; Q186-K190 VanDerWaalsContact O-CG 3.32Å; Q186-K190 WeakPolarHBondContact O-CG 3.33Å; Q186-K190 PolarHBondContact O-N 3.15Å; I187-K190 PolarHBondContact O-N 2.88Å; K190-T192 PolarHBondContact O-N 3.23Å; K190-I193 PolarHBondContact O-N 3.11Å; K190-A194 WeakPolarHBondContact O-CB 3.4Å; K190-A194 PolarHBondContact O-N 3.09Å
191	M	91.6	Very high	90.3	Very high	33 Å²	33	54.8 Å²	54.8	16%	0.163	28%	0.283	C	S	.	.	H	α-helix	trans	-68.3	-35.8	-177.9	-66.3	-171.2	71	0	0	112.3	I187 H195 L401 H404 V405 H408	I187-M191 HydrophobicContact CG2-CG 4.26Å; I187-M191 HydrophobicContact CG2-SD 3.71Å; I187-M191 WeakPolarHBondContact O-CB 3.39Å; I187-M191 VanDerWaalsContact O-CG 3.31Å; I187-M191 WeakPolarHBondContact O-CG 3.34Å; I187-M191 PolarHBondContact O-N 3.33Å; M191-H195 WeakPolarHBondContact O-CB 3.43Å; M191-H195 PolarHBondContact O-N 2.56Å; M191-L401 HydrophobicContact CB-CD1 4.39Å; M191-H404 HydrophobicContact CE-CB 3.81Å; M191-H404 WeakPolarHBondContact CE-O 3.44Å; M191-V405 HydrophobicContact CB-CG2 3.89Å; M191-V405 HydrophobicContact CE-CG2 4.05Å; M191-V405 HydrophobicContact CG-CG2 4.36Å; M191-V405 HydrophobicContact SD-CB 4.18Å; M191-V405 HydrophobicContact SD-CG2 3.66Å; M191-H408 HydrophobicContact CE-CB 4.2Å; M191-H408 HydrophobicContact SD-CB 3.9Å
192	T	93.8	Very high	90.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-44.5	175.7	-55.1	0	0	0	0	111.3	W188 K189 K190 H195 L196 I219 V316 L320 L401	W188-T192 VanDerWaalsContact O-CB 3.23Å; W188-T192 WeakPolarHBondContact O-CB 3.48Å; W188-T192 PolarHBondContact O-N 3.33Å; W188-T192 PolarHBondContact O-OG1 3.33Å; K189-T192 PolarHBondContact O-N 3.17Å; K190-T192 PolarHBondContact O-N 3.23Å; T192-H195 PolarHBondContact O-N 3.43Å; T192-L196 WeakPolarHBondContact O-CB 3.41Å; T192-L196 PolarHBondContact O-N 2.77Å; T192-I219 HydrophobicContact CG2-CD1 4.15Å; T192-V316 HydrophobicContact CG2-CG1 3.92Å; T192-L320 HydrophobicContact CG2-CD2 3.87Å; T192-L401 HydrophobicContact CG2-CD2 4.17Å
193	I	92.1	Very high	89.9	Confident	24 Å²	24	53.6 Å²	53.6	12%	0.123	27%	0.27	C	S	.	.	H	α-helix	trans	-65	-46	177.7	-66.2	168.3	0	0	0	110.7	K189 K190 H195 L196 Q197 M205 L209 P211 V214	K189-I193 HydrophobicContact CG-CD1 3.9Å; K189-I193 VanDerWaalsContact O-CG1 3.29Å; K189-I193 WeakPolarHBondContact O-CG1 3.33Å; K189-I193 PolarHBondContact O-N 2.67Å; K190-I193 PolarHBondContact O-N 3.11Å; I193-H195 VanDerWaalsContact C-N 3.29Å; I193-H195 PolarHBondContact O-N 3.44Å; I193-L196 PolarHBondContact O-N 3.44Å; I193-Q197 WeakPolarHBondContact O-CB 3.41Å; I193-Q197 PolarHBondContact O-N 3.14Å; I193-M205 HydrophobicContact CG2-CG 4.02Å; I193-L209 HydrophobicContact CG1-CD2 4.4Å; I193-P211 HydrophobicContact CD1-CB 4.4Å; I193-V214 HydrophobicContact CD1-CB 4.36Å; I193-V214 HydrophobicContact CD1-CG1 4.37Å; I193-V214 HydrophobicContact CD1-CG2 4.14Å; I193-V214 HydrophobicContact CG1-CG2 4.47Å
194	A	90.4	Very high	89.8	Confident	42 Å²	42	53 Å²	53	35%	0.347	27%	0.273	S	S	.	.	H	α-helix	trans	-60.8	-40.2	177.3	0	0	0	0	0	111.7	K190 Q197 R198	K190-A194 WeakPolarHBondContact O-CB 3.4Å; K190-A194 PolarHBondContact O-N 3.09Å; A194-Q197 PolarHBondContact O-N 3.07Å; A194-R198 WeakPolarHBondContact O-CB 3.43Å; A194-R198 PolarHBondContact O-N 3.47Å
195	H	91.6	Very high	89.6	Confident	13 Å²	13	52.1 Å²	52.1	6%	0.06	27%	0.267	C	S	.	.	H	α-helix	trans	-65.5	-43.6	175.8	-170.3	105.4	0	0	0	111.6	M191 T192 I193 R198 V199 E312 V316 L401	M191-H195 WeakPolarHBondContact O-CB 3.43Å; M191-H195 PolarHBondContact O-N 2.56Å; T192-H195 PolarHBondContact O-N 3.43Å; I193-H195 VanDerWaalsContact C-N 3.29Å; I193-H195 PolarHBondContact O-N 3.44Å; H195-R198 PolarHBondContact CD2-NH2 2.61Å; H195-R198 PolarHBondContact CE1-NH2 3.1Å; H195-R198 PolarHBondContact ND1-NH2 3.21Å; H195-R198 VanDerWaalsContact ND1-NH2 3.19Å; H195-R198 PolarHBondContact NE2-NH2 3.24Å; H195-R198 PolarHBondContact O-N 3.16Å; H195-V199 VanDerWaalsContact O-CG2 3.27Å; H195-V199 WeakPolarHBondContact O-CG2 3.45Å; H195-V199 PolarHBondContact O-N 3.1Å; H195-E312 IonicContact CE1-OE1 3.37Å; H195-E312 IonicContact NE2-OE1 3.19Å; H195-E312 PolarHBondContact NE2-OE1 2.68Å; H195-V316 WeakPolarHBondContact CD2-CG2 3.41Å; H195-L401 HydrophobicContact CB-CD1 4.02Å
196	L	92.1	Very high	89	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-47.1	175.9	178.6	57.8	0	0	0	111.7	T192 I193 R198 V199 L200 M205 L209 V296 V316 C317 L320	T192-L196 WeakPolarHBondContact O-CB 3.41Å; T192-L196 PolarHBondContact O-N 2.77Å; I193-L196 PolarHBondContact O-N 3.44Å; L196-R198 VanDerWaalsContact C-N 3.3Å; L196-R198 PolarHBondContact O-N 3.34Å; L196-V199 PolarHBondContact O-N 3.19Å; L196-V199 VanDerWaalsContact O-N 3.17Å; L196-L200 HydrophobicContact CD1-CD1 3.75Å; L196-L200 HydrophobicContact CD1-CD2 4.46Å; L196-L200 HydrophobicContact CD1-CG 3.84Å; L196-L200 HydrophobicContact CG-CD1 3.88Å; L196-L200 HydrophobicContact CG-CG 4.33Å; L196-L200 WeakPolarHBondContact O-CB 3.41Å; L196-L200 WeakPolarHBondContact O-CG 3.43Å; L196-L200 PolarHBondContact O-N 2.81Å; L196-M205 HydrophobicContact CD2-CE 3.85Å; L196-M205 HydrophobicContact CG-CE 4.13Å; L196-L209 HydrophobicContact CD2-CD2 4.11Å; L196-V296 HydrophobicContact CD1-CG1 4.39Å; L196-V296 HydrophobicContact CD2-CG1 3.85Å; L196-V316 HydrophobicContact CB-CG1 3.91Å; L196-V316 HydrophobicContact CD1-CG1 4.44Å; L196-C317 WeakPolarHBondContact CD1-SG 3.27Å; L196-L320 HydrophobicContact CD2-CD1 4.02Å
197	Q	91.2	Very high	88.4	Confident	40 Å²	40	54.4 Å²	54.4	19%	0.187	30%	0.3	C	S	.	.	H	α-helix	trans	-56.2	-45.2	177.6	-177.2	-179.6	-31.5	0	0	111.7	I193 A194 L200 G201 L202 K203 M205	I193-Q197 WeakPolarHBondContact O-CB 3.41Å; I193-Q197 PolarHBondContact O-N 3.14Å; A194-Q197 PolarHBondContact O-N 3.07Å; Q197-L200 PolarHBondContact O-N 3.19Å; Q197-G201 PolarHBondContact O-N 2.91Å; Q197-L202 HydrophobicContact CG-CB 4.37Å; Q197-L202 WeakPolarHBondContact CG-O 3.46Å; Q197-L202 PolarHBondContact NE2-O 2.96Å; Q197-L202 PolarHBondContact O-N 3.04Å; Q197-L202 VanDerWaalsContact O-N 3.1Å; Q197-K203 PolarHBondContact NE2-O 2.9Å; Q197-M205 HydrophobicContact CB-CG 3.9Å; Q197-M205 HydrophobicContact CB-SD 3.67Å; Q197-M205 HydrophobicContact CG-CG 4.12Å; Q197-M205 HydrophobicContact CG-SD 4.05Å
198	R	90.3	Very high	88.1	Confident	139 Å²	139	54.4 Å²	54.4	53%	0.525	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-44.7	176.5	179.6	-166.9	58.7	80.7	5.9	112.2	A194 H195 L196 G201 E312	A194-R198 WeakPolarHBondContact O-CB 3.43Å; A194-R198 PolarHBondContact O-N 3.47Å; H195-R198 PolarHBondContact CD2-NH2 2.61Å; H195-R198 PolarHBondContact CE1-NH2 3.1Å; H195-R198 PolarHBondContact ND1-NH2 3.21Å; H195-R198 VanDerWaalsContact ND1-NH2 3.19Å; H195-R198 PolarHBondContact NE2-NH2 3.24Å; H195-R198 PolarHBondContact O-N 3.16Å; L196-R198 VanDerWaalsContact C-N 3.3Å; L196-R198 PolarHBondContact O-N 3.34Å; R198-G201 PolarHBondContact O-N 3.33Å; R198-E312 IonicContact CZ-OE1 3.88Å; R198-E312 IonicContact NH1-OE1 2.96Å; R198-E312 IonicContact NH2-OE1 2.99Å; R198-E312 PolarHBondContact NH2-OE1 2.76Å
199	V	90.9	Very high	87.8	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.055	30%	0.3	C	S	.	.	H	α-helix	trans	-68.5	-38.9	-178.8	177.7	0	0	0	0	111.2	H195 L196 G201 V309 E312 A313	H195-V199 VanDerWaalsContact O-CG2 3.27Å; H195-V199 WeakPolarHBondContact O-CG2 3.45Å; H195-V199 PolarHBondContact O-N 3.1Å; L196-V199 PolarHBondContact O-N 3.19Å; L196-V199 VanDerWaalsContact O-N 3.17Å; V199-G201 PolarHBondContact O-N 3.15Å; V199-V309 HydrophobicContact CG1-CG1 3.92Å; V199-E312 HydrophobicContact CG1-CB 4.25Å; V199-E312 HydrophobicContact CG1-CG 4.33Å; V199-E312 HydrophobicContact CG2-CG 3.88Å; V199-E312 WeakPolarHBondContact CG2-OE1 3.49Å; V199-A313 HydrophobicContact CG1-CB 3.66Å
200	L	88	Confident	87.4	Confident	18 Å²	18	55 Å²	55	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-72.8	-13.6	174.9	-64.6	178.8	0	0	0	113.1	L196 Q197 L202 M205 V296 I300 L303 A313	L196-L200 HydrophobicContact CD1-CD1 3.75Å; L196-L200 HydrophobicContact CD1-CD2 4.46Å; L196-L200 HydrophobicContact CD1-CG 3.84Å; L196-L200 HydrophobicContact CG-CD1 3.88Å; L196-L200 HydrophobicContact CG-CG 4.33Å; L196-L200 WeakPolarHBondContact O-CB 3.41Å; L196-L200 WeakPolarHBondContact O-CG 3.43Å; L196-L200 PolarHBondContact O-N 2.81Å; Q197-L200 PolarHBondContact O-N 3.19Å; L200-L202 VanDerWaalsContact C-N 3.27Å; L200-L202 HydrophobicContact CB-CD1 3.84Å; L200-L202 HydrophobicContact CB-CG 3.76Å; L200-L202 HydrophobicContact CD1-CD1 3.86Å; L200-L202 PolarHBondContact O-N 3.3Å; L200-M205 HydrophobicContact CD1-CE 4.35Å; L200-V296 HydrophobicContact CD1-CG1 4.35Å; L200-I300 HydrophobicContact CD2-CG1 3.81Å; L200-L303 HydrophobicContact CD2-CD1 3.74Å; L200-A313 HydrophobicContact CD2-CB 4.31Å
201	G	85.3	Confident	87	Confident	65 Å²	65	51.2 Å²	51.2	67%	0.67	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	26.2	-177.8	0	0	0	0	0	113.5	Q197 R198 V199	Q197-G201 PolarHBondContact O-N 2.91Å; R198-G201 PolarHBondContact O-N 3.33Å; V199-G201 PolarHBondContact O-N 3.15Å
202	L	85.8	Confident	86.6	Confident	50 Å²	50	58.2 Å²	58.2	26%	0.262	33%	0.326	S	S	.	.			trans	-90.5	144.3	-177.4	-61	175	0	0	0	111.2	Q197 L200 T204 M205 V208	Q197-L202 HydrophobicContact CG-CB 4.37Å; Q197-L202 WeakPolarHBondContact CG-O 3.46Å; Q197-L202 PolarHBondContact NE2-O 2.96Å; Q197-L202 PolarHBondContact O-N 3.04Å; Q197-L202 VanDerWaalsContact O-N 3.1Å; L200-L202 VanDerWaalsContact C-N 3.27Å; L200-L202 HydrophobicContact CB-CD1 3.84Å; L200-L202 HydrophobicContact CB-CG 3.76Å; L200-L202 HydrophobicContact CD1-CD1 3.86Å; L200-L202 PolarHBondContact O-N 3.3Å; L202-T204 WeakPolarHBondContact CB-O 3.34Å; L202-M205 HydrophobicContact CD1-SD 4.12Å; L202-V208 HydrophobicContact CD1-CB 4.42Å; L202-V208 HydrophobicContact CD1-CG1 4.28Å; L202-V208 HydrophobicContact CD1-CG2 3.99Å
203	K	79.9	Confident	86	Confident	198 Å²	198	63.1 Å²	63.1	86%	0.861	35%	0.349	S	S	*	.	S	Bend	trans	-76.2	-34.2	174.8	-69.4	-173.5	178.7	-176.9	0	112.6	Q197	Q197-K203 PolarHBondContact NE2-O 2.9Å
204	T	84.4	Confident	85.9	Confident	78 Å²	78	62.4 Å²	62.4	48%	0.479	35%	0.346	S	S	.	.			trans	-141.8	157.7	175	62.1	0	0	0	0	108.8	L202 D206	L202-T204 WeakPolarHBondContact CB-O 3.34Å; T204-D206 VanDerWaalsContact C-N 3.31Å
205	M	83.7	Confident	85.9	Confident	11 Å²	11	63.3 Å²	63.3	5%	0.054	35%	0.345	C	S	.	.			trans	-91.1	5.6	174.9	-67.3	-63.1	-61.3	0	0	112.6	I193 L196 Q197 L200 L202 G207 V208 L209	I193-M205 HydrophobicContact CG2-CG 4.02Å; L196-M205 HydrophobicContact CD2-CE 3.85Å; L196-M205 HydrophobicContact CG-CE 4.13Å; Q197-M205 HydrophobicContact CB-CG 3.9Å; Q197-M205 HydrophobicContact CB-SD 3.67Å; Q197-M205 HydrophobicContact CG-CG 4.12Å; Q197-M205 HydrophobicContact CG-SD 4.05Å; L200-M205 HydrophobicContact CD1-CE 4.35Å; L202-M205 HydrophobicContact CD1-SD 4.12Å; M205-G207 PolarHBondContact O-N 3.28Å; M205-V208 HydrophobicContact CE-CB 4.41Å; M205-V208 HydrophobicContact CE-CG1 4.07Å; M205-V208 PolarHBondContact O-N 3.11Å; M205-L209 HydrophobicContact CE-CB 3.64Å; M205-L209 HydrophobicContact CE-CD2 4.14Å; M205-L209 PolarHBondContact O-N 3.37Å
206	D	79.8	Confident	86	Confident	126 Å²	126	63.2 Å²	63.2	67%	0.674	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	130.7	-178	-61.5	-39	0	0	0	110.8	T204 V208	T204-D206 VanDerWaalsContact C-N 3.31Å; D206-V208 PolarHBondContact O-N 2.75Å
207	G	77.8	Confident	86	Confident	74 Å²	74	69.9 Å²	69.9	76%	0.763	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	-8.9	-174.9	0	0	0	0	0	115.1	M205	M205-G207 PolarHBondContact O-N 3.28Å
208	V	82.9	Confident	86.2	Confident	19 Å²	19	70.4 Å²	70.4	12%	0.115	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-44.2	178.8	179.7	0	0	0	0	111.8	L202 M205 D206 V296	L202-V208 HydrophobicContact CD1-CB 4.42Å; L202-V208 HydrophobicContact CD1-CG1 4.28Å; L202-V208 HydrophobicContact CD1-CG2 3.99Å; M205-V208 HydrophobicContact CE-CB 4.41Å; M205-V208 HydrophobicContact CE-CG1 4.07Å; M205-V208 PolarHBondContact O-N 3.11Å; D206-V208 PolarHBondContact O-N 2.75Å; V208-V296 HydrophobicContact CG1-CB 4.45Å; V208-V296 HydrophobicContact CG1-CG2 4.07Å; V208-V296 VanDerWaalsContact O-CG2 3.26Å; V208-V296 WeakPolarHBondContact O-CG2 3.45Å
209	L	87.4	Confident	86.4	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.026	35%	0.353	C	S	.	.			trans	-147.1	114.9	178.1	-178.5	64.7	0	0	0	109.6	I193 L196 M205 P211 V214 L293 V296 L320	I193-L209 HydrophobicContact CG1-CD2 4.4Å; L196-L209 HydrophobicContact CD2-CD2 4.11Å; M205-L209 HydrophobicContact CE-CB 3.64Å; M205-L209 HydrophobicContact CE-CD2 4.14Å; M205-L209 PolarHBondContact O-N 3.37Å; L209-P211 VanDerWaalsContact O-CD 3.3Å; L209-P211 WeakPolarHBondContact O-CD 3.26Å; L209-V214 HydrophobicContact CD1-CG2 3.93Å; L209-V214 HydrophobicContact CD2-CG2 3.72Å; L209-V214 HydrophobicContact CG-CG2 3.91Å; L209-L293 HydrophobicContact CD1-CD2 3.43Å; L209-L293 VanDerWaalsContact CD1-CD2 3.43Å; L209-V296 HydrophobicContact CB-CG2 3.99Å; L209-V296 HydrophobicContact CD1-CG2 4.08Å; L209-V296 HydrophobicContact CG-CG2 4.49Å; L209-L320 HydrophobicContact CD2-CD1 3.92Å
210	D	84.4	Confident	86.6	Confident	68 Å²	68	65.2 Å²	65.2	36%	0.364	36%	0.36	S	S	.	.			trans	-75.3	119.4	170.5	174.7	0	0	0	0	109.5	K212 H213	D210-K212 PolarHBondContact O-N 3.02Å; D210-K212 WeakPolarHBondContact OD1-CB 3.34Å; D210-K212 WeakPolarHBondContact OD1-CG 3.19Å; D210-K212 PolarHBondContact OD1-N 2.97Å; D210-H213 WeakPolarHBondContact CB-ND1 3.16Å; D210-H213 PolarHBondContact O-N 2.83Å; D210-H213 VanDerWaalsContact O-N 3.1Å; D210-H213 IonicContact OD2-CE1 2.73Å; D210-H213 PolarHBondContact OD2-CE1 3.03Å; D210-H213 IonicContact OD2-ND1 3.22Å; D210-H213 PolarHBondContact OD2-ND1 3.24Å
211	P	82.9	Confident	86.9	Confident	64 Å²	64	65.6 Å²	65.6	42%	0.416	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-55	-24.5	179.2	-25.2	34.7	0	0	0	113.8	K189 I193 L209 H213 V214	K189-P211 WeakPolarHBondContact CE-O 3.24Å; K189-P211 PolarHBondContact NZ-O 3.49Å; I193-P211 HydrophobicContact CD1-CB 4.4Å; L209-P211 VanDerWaalsContact O-CD 3.3Å; L209-P211 WeakPolarHBondContact O-CD 3.26Å; P211-H213 VanDerWaalsContact C-N 3.31Å; P211-H213 PolarHBondContact O-N 3.19Å; P211-V214 PolarHBondContact O-N 2.99Å
212	K	83.8	Confident	87.3	Confident	179 Å²	179	62.5 Å²	62.5	78%	0.778	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.1	-35	179.2	-66.4	175.5	-176.8	173.3	0	112.7	D210 V214	D210-K212 PolarHBondContact O-N 3.02Å; D210-K212 WeakPolarHBondContact OD1-CB 3.34Å; D210-K212 WeakPolarHBondContact OD1-CG 3.19Å; D210-K212 PolarHBondContact OD1-N 2.97Å; K212-V214 VanDerWaalsContact C-N 3.29Å; K212-V214 PolarHBondContact O-N 2.95Å
213	H	81.2	Confident	87.7	Confident	103 Å²	103	60.7 Å²	60.7	48%	0.477	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-78.2	-13.3	-178.6	-60.4	99.3	0	0	0	113.1	D210 P211 N215	D210-H213 WeakPolarHBondContact CB-ND1 3.16Å; D210-H213 PolarHBondContact O-N 2.83Å; D210-H213 VanDerWaalsContact O-N 3.1Å; D210-H213 IonicContact OD2-CE1 2.73Å; D210-H213 PolarHBondContact OD2-CE1 3.03Å; D210-H213 IonicContact OD2-ND1 3.22Å; D210-H213 PolarHBondContact OD2-ND1 3.24Å; P211-H213 VanDerWaalsContact C-N 3.31Å; P211-H213 PolarHBondContact O-N 3.19Å; H213-N215 PolarHBondContact O-N 2.84Å
214	V	89.2	Confident	88.4	Confident	9 Å²	9	56.7 Å²	56.7	6%	0.055	30%	0.303	C	S	.	.			trans	-78.5	116.1	179.2	179.6	0	0	0	0	111.3	K189 I193 L209 P211 K212 I219 L320	K189-V214 HydrophobicContact CD-CB 4.4Å; K189-V214 HydrophobicContact CD-CG1 4.25Å; K189-V214 WeakPolarHBondContact CE-O 3.17Å; K189-V214 HydrophobicContact CG-CB 4.45Å; K189-V214 HydrophobicContact CG-CG1 3.94Å; K189-V214 PolarHBondContact NZ-O 2.96Å; I193-V214 HydrophobicContact CD1-CB 4.36Å; I193-V214 HydrophobicContact CD1-CG1 4.37Å; I193-V214 HydrophobicContact CD1-CG2 4.14Å; I193-V214 HydrophobicContact CG1-CG2 4.47Å; L209-V214 HydrophobicContact CD1-CG2 3.93Å; L209-V214 HydrophobicContact CD2-CG2 3.72Å; L209-V214 HydrophobicContact CG-CG2 3.91Å; P211-V214 PolarHBondContact O-N 2.99Å; K212-V214 VanDerWaalsContact C-N 3.29Å; K212-V214 PolarHBondContact O-N 2.95Å; V214-I219 HydrophobicContact CG1-CD1 3.84Å; V214-L320 HydrophobicContact CG1-CD2 3.88Å
215	N	92.1	Very high	88.8	Confident	62 Å²	62	54.3 Å²	54.3	33%	0.332	29%	0.289	S	S	.	.			trans	-95.3	113.1	176	-170.8	-19.9	0	0	0	111.7	H213 K217 H218 I219	H213-N215 PolarHBondContact O-N 2.84Å; N215-K217 PolarHBondContact O-N 3.3Å; N215-K217 WeakPolarHBondContact OD1-CB 3.24Å; N215-K217 PolarHBondContact OD1-N 3.05Å; N215-H218 HydrophobicContact CB-CB 4.41Å; N215-H218 PolarHBondContact ND2-NE2 3.34Å; N215-H218 WeakPolarHBondContact O-CB 3.26Å; N215-H218 PolarHBondContact O-N 3.46Å; N215-H218 VanDerWaalsContact O-N 3.17Å; N215-I219 PolarHBondContact O-N 2.82Å
216	A	92.4	Very high	89.3	Confident	10 Å²	10	56 Å²	56	8%	0.083	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-34.5	178.5	0	0	0	0	0	113.5	D185 K189 H218 I219 I220	D185-A216 HydrophobicContact CB-CB 3.63Å; D185-A216 WeakPolarHBondContact O-CB 3.37Å; K189-A216 HydrophobicContact CB-CB 4.22Å; A216-H218 VanDerWaalsContact C-N 3.29Å; A216-H218 PolarHBondContact O-N 3.34Å; A216-I219 WeakPolarHBondContact O-CB 3.03Å; A216-I219 PolarHBondContact O-N 3.44Å; A216-I220 WeakPolarHBondContact O-CG1 3.34Å; A216-I220 PolarHBondContact O-N 3.21Å
217	K	93.1	Very high	89.8	Confident	140 Å²	140	52.7 Å²	52.7	61%	0.609	28%	0.282	S	S	*	.	H	α-helix	trans	-65.7	-34.1	-179.7	-61.4	-179.3	178.4	177.7	0	111.8	N215 H221	N215-K217 PolarHBondContact O-N 3.3Å; N215-K217 WeakPolarHBondContact OD1-CB 3.24Å; N215-K217 PolarHBondContact OD1-N 3.05Å; K217-H221 WeakPolarHBondContact O-CB 3.42Å; K217-H221 PolarHBondContact O-N 3.34Å
218	H	94.7	Very high	90.4	Very high	52 Å²	52	59.8 Å²	59.8	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-45.7	174.6	-64.2	175	0	0	0	110.7	N215 A216 H221 N222	N215-H218 HydrophobicContact CB-CB 4.41Å; N215-H218 PolarHBondContact ND2-NE2 3.34Å; N215-H218 WeakPolarHBondContact O-CB 3.26Å; N215-H218 PolarHBondContact O-N 3.46Å; N215-H218 VanDerWaalsContact O-N 3.17Å; A216-H218 VanDerWaalsContact C-N 3.29Å; A216-H218 PolarHBondContact O-N 3.34Å; H218-H221 PolarHBondContact O-N 3.17Å; H218-N222 VanDerWaalsContact O-CB 3.24Å; H218-N222 WeakPolarHBondContact O-CB 3.49Å; H218-N222 PolarHBondContact O-N 3.43Å; H218-N222 PolarHBondContact O-ND2 2.87Å
219	I	94.8	Very high	90.5	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58	-54.6	178.7	-61.9	168	0	0	0	110.2	W188 T192 V214 N215 A216 H221 N222 V223 L319 L320	W188-I219 HydrophobicContact CE3-CG2 3.91Å; T192-I219 HydrophobicContact CG2-CD1 4.15Å; V214-I219 HydrophobicContact CG1-CD1 3.84Å; N215-I219 PolarHBondContact O-N 2.82Å; A216-I219 WeakPolarHBondContact O-CB 3.03Å; A216-I219 PolarHBondContact O-N 3.44Å; I219-H221 VanDerWaalsContact C-N 3.32Å; I219-H221 PolarHBondContact O-N 3.28Å; I219-N222 PolarHBondContact O-N 3.05Å; I219-V223 VanDerWaalsContact O-CG2 3.27Å; I219-V223 WeakPolarHBondContact O-CG2 3.2Å; I219-V223 PolarHBondContact O-N 3.42Å; I219-L319 WeakPolarHBondContact CA-O 3.35Å; I219-L319 HydrophobicContact CG2-CB 4.29Å; I219-L319 HydrophobicContact CG2-CD1 4.48Å; I219-L320 HydrophobicContact CD1-CD2 3.79Å; I219-L320 HydrophobicContact CG1-CD2 4Å
220	I	94.2	Very high	90.6	Very high	39 Å²	39	63.7 Å²	63.7	20%	0.2	32%	0.321	C	S	.	.	H	α-helix	trans	-59.6	-46	-178.7	-65.8	168.7	0	0	0	110.2	D185 W188 A216 N222 V223 F224	D185-I220 WeakPolarHBondContact OD1-CD1 3.27Å; W188-I220 HydrophobicContact CB-CD1 4.33Å; W188-I220 HydrophobicContact CB-CG1 4.04Å; W188-I220 HydrophobicContact CD2-CG1 4.15Å; W188-I220 HydrophobicContact CG-CD1 4.1Å; W188-I220 HydrophobicContact CG-CG1 3.63Å; A216-I220 WeakPolarHBondContact O-CG1 3.34Å; A216-I220 PolarHBondContact O-N 3.21Å; I220-N222 PolarHBondContact O-N 3.01Å; I220-V223 PolarHBondContact O-N 3.34Å; I220-F224 HydrophobicContact CG2-CD2 3.75Å; I220-F224 HydrophobicContact CG2-CE2 4.13Å; I220-F224 VanDerWaalsContact O-CD2 3.27Å; I220-F224 WeakPolarHBondContact O-CD2 3.36Å; I220-F224 PolarHBondContact O-N 3.32Å
221	H	94.8	Very high	90.9	Very high	26 Å²	26	61.3 Å²	61.3	12%	0.12	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-46	177.8	-177.2	-77.7	0	0	0	112	K217 H218 I219 V223 F224 S225 I233 P323	K217-H221 WeakPolarHBondContact O-CB 3.42Å; K217-H221 PolarHBondContact O-N 3.34Å; H218-H221 PolarHBondContact O-N 3.17Å; I219-H221 VanDerWaalsContact C-N 3.32Å; I219-H221 PolarHBondContact O-N 3.28Å; H221-V223 PolarHBondContact O-N 3.33Å; H221-F224 PolarHBondContact O-N 3.45Å; H221-S225 WeakPolarHBondContact O-CA 3.45Å; H221-S225 WeakPolarHBondContact O-CB 3.34Å; H221-S225 PolarHBondContact O-N 3.24Å; H221-S225 PolarHBondContact O-OG 2.89Å; H221-I233 PolarHBondContact CE1-O 2.86Å; H221-I233 PolarHBondContact NE2-O 2.91Å; H221-P323 HydrophobicContact CB-CG 4.09Å; H221-P323 VanDerWaalsContact ND1-CB 3.33Å; H221-P323 WeakPolarHBondContact ND1-CB 3.48Å; H221-P323 WeakPolarHBondContact ND1-CG 3.3Å
222	N	95	Very high	91.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-67.4	-22.1	-179.6	-75.4	-26.1	0	0	0	113.8	H218 I219 I220 V226 L319 L321 P323 V397	H218-N222 VanDerWaalsContact O-CB 3.24Å; H218-N222 WeakPolarHBondContact O-CB 3.49Å; H218-N222 PolarHBondContact O-N 3.43Å; H218-N222 PolarHBondContact O-ND2 2.87Å; I219-N222 PolarHBondContact O-N 3.05Å; I220-N222 PolarHBondContact O-N 3.01Å; N222-V226 WeakPolarHBondContact O-CG1 3.33Å; N222-L319 HydrophobicContact CB-CD2 4.33Å; N222-L319 PolarHBondContact ND2-O 3.17Å; N222-L321 PolarHBondContact ND2-O 3.31Å; N222-P323 WeakPolarHBondContact OD1-CA 3.25Å; N222-V397 WeakPolarHBondContact O-CG2 3.4Å
223	V	93.9	Very high	91.9	Very high	12 Å²	12	53.9 Å²	53.9	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-82.5	-49	175	170.5	0	0	0	0	111.1	W188 I219 I220 H221 L319 V397	W188-V223 HydrophobicContact CH2-CG1 3.9Å; W188-V223 HydrophobicContact CH2-CG2 4.33Å; W188-V223 HydrophobicContact CZ3-CG1 4.39Å; W188-V223 HydrophobicContact CZ3-CG2 3.99Å; I219-V223 VanDerWaalsContact O-CG2 3.27Å; I219-V223 WeakPolarHBondContact O-CG2 3.2Å; I219-V223 PolarHBondContact O-N 3.42Å; I220-V223 PolarHBondContact O-N 3.34Å; H221-V223 PolarHBondContact O-N 3.33Å; V223-L319 HydrophobicContact CG2-CD1 4.04Å; V223-L319 HydrophobicContact CG2-CD2 3.89Å; V223-V397 HydrophobicContact CB-CG1 4.28Å; V223-V397 HydrophobicContact CG1-CG1 4.05Å; V223-V397 HydrophobicContact CG2-CG1 4.1Å
224	F	93.4	Very high	92.4	Very high	114 Å²	114	49.8 Å²	49.8	50%	0.5	26%	0.255	S	S	.	.	H	α-helix	trans	-96.6	-26.3	-169.7	-66.5	-72.6	0	0	0	114.6	W188 I220 H221 V226 H402	W188-F224 HydrophobicContact CH2-CE2 4.33Å; W188-F224 HydrophobicContact CH2-CZ 4.4Å; W188-F224 AromaticContact CZ2-CE2 3.62Å; W188-F224 HydrophobicContact CZ2-CE2 3.62Å; W188-F224 AromaticContact CZ2-CZ 3.73Å; W188-F224 HydrophobicContact CZ2-CZ 3.73Å; I220-F224 HydrophobicContact CG2-CD2 3.75Å; I220-F224 HydrophobicContact CG2-CE2 4.13Å; I220-F224 VanDerWaalsContact O-CD2 3.27Å; I220-F224 WeakPolarHBondContact O-CD2 3.36Å; I220-F224 PolarHBondContact O-N 3.32Å; H221-F224 PolarHBondContact O-N 3.45Å; F224-V226 PolarHBondContact O-N 3.29Å; F224-H402 AromaticContact CE1-CD2 3.81Å; F224-H402 AromaticContact CE1-NE2 3.3Å; F224-H402 VanDerWaalsContact CE1-NE2 3.3Å; F224-H402 WeakPolarHBondContact CE1-NE2 3.18Å; F224-H402 AromaticContact CZ-CD2 3.76Å; F224-H402 AromaticContact CZ-NE2 3.56Å
225	S	93.9	Very high	92.3	Very high	28 Å²	28	57.5 Å²	57.5	20%	0.196	29%	0.288	C	S	.	.	S	Bend	trans	-97.1	59.3	-175.7	-52.6	0	0	0	0	111.2	H221 I233	H221-S225 WeakPolarHBondContact O-CA 3.45Å; H221-S225 WeakPolarHBondContact O-CB 3.34Å; H221-S225 PolarHBondContact O-N 3.24Å; H221-S225 PolarHBondContact O-OG 2.89Å; S225-I233 PolarHBondContact O-N 3.05Å
226	V	93.2	Very high	92.2	Very high	46 Å²	46	58.1 Å²	58.1	28%	0.279	29%	0.291	S	S	.	.	B	Isolated β-bridge	trans	-120.3	147.7	179.6	-63.7	0	0	0	0	111.7	N222 F224 I231 V232 V397	N222-V226 WeakPolarHBondContact O-CG1 3.33Å; F224-V226 PolarHBondContact O-N 3.29Å; V226-I231 CarbonylContact C-O 3.59Å; V226-I231 WeakPolarHBondContact CA-O 3.49Å; V226-V232 HydrophobicContact CG1-CG2 4.16Å; V226-V397 HydrophobicContact CG1-CG2 4.14Å
227	N	91.5	Very high	91.8	Very high	56 Å²	56	66.7 Å²	66.7	30%	0.299	33%	0.326	S	S	.	.			trans	-79.3	175.7	175	77.7	5.5	0	0	0	111.8	T229 G230 I231 I233	N227-T229 VanDerWaalsContact CG-OG1 3.28Å; N227-T229 PolarHBondContact ND2-OG1 3.31Å; N227-T229 VanDerWaalsContact ND2-OG1 3.12Å; N227-T229 PolarHBondContact O-N 3.5Å; N227-T229 VanDerWaalsContact OD1-C 3.27Å; N227-T229 VanDerWaalsContact OD1-CA 3.3Å; N227-T229 WeakPolarHBondContact OD1-CA 3.47Å; N227-T229 WeakPolarHBondContact OD1-CB 3.48Å; N227-T229 PolarHBondContact OD1-N 3.45Å; N227-T229 PolarHBondContact OD1-OG1 3.21Å; N227-G230 PolarHBondContact O-N 2.72Å; N227-G230 PolarHBondContact OD1-N 2.84Å; N227-I231 PolarHBondContact N-O 3.44Å; N227-I231 PolarHBondContact OD1-N 3.49Å; N227-I233 HydrophobicContact CB-CD1 4.21Å; N227-I233 HydrophobicContact CB-CG1 4.26Å
228	K	88.9	Confident	91.6	Very high	224 Å²	224	64.2 Å²	64.2	97%	0.974	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.4	177.7	-63.3	-175.8	-180	-178.2	0	114.1
229	T	86.6	Confident	91.2	Very high	81 Å²	81	66.7 Å²	66.7	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	6	178.1	69.3	0	0	0	0	113.4	N227 I231 R334	N227-T229 VanDerWaalsContact CG-OG1 3.28Å; N227-T229 PolarHBondContact ND2-OG1 3.31Å; N227-T229 VanDerWaalsContact ND2-OG1 3.12Å; N227-T229 PolarHBondContact O-N 3.5Å; N227-T229 VanDerWaalsContact OD1-C 3.27Å; N227-T229 VanDerWaalsContact OD1-CA 3.3Å; N227-T229 WeakPolarHBondContact OD1-CA 3.47Å; N227-T229 WeakPolarHBondContact OD1-CB 3.48Å; N227-T229 PolarHBondContact OD1-N 3.45Å; N227-T229 PolarHBondContact OD1-OG1 3.21Å; T229-I231 WeakPolarHBondContact OG1-CD1 3.46Å; T229-R334 PolarHBondContact O-NH2 3.09Å
230	G	88.1	Confident	90.9	Very high	25 Å²	25	68 Å²	68	26%	0.258	35%	0.351	S	S	.	.	S	Bend	trans	77.1	11	-178.4	0	0	0	0	0	115.9	N227 Q330	N227-G230 PolarHBondContact O-N 2.72Å; N227-G230 PolarHBondContact OD1-N 2.84Å; G230-Q330 PolarHBondContact O-NE2 3.02Å
231	I	92.1	Very high	90.9	Very high	17 Å²	17	66.5 Å²	66.5	9%	0.087	34%	0.343	C	S	.	.			trans	-81.4	133.6	174.4	-57.1	165.7	0	0	0	109.4	V226 N227 T229 R327 L331	V226-I231 CarbonylContact C-O 3.59Å; V226-I231 WeakPolarHBondContact CA-O 3.49Å; N227-I231 PolarHBondContact N-O 3.44Å; N227-I231 PolarHBondContact OD1-N 3.49Å; T229-I231 WeakPolarHBondContact OG1-CD1 3.46Å; I231-R327 HydrophobicContact CG2-CG 4.28Å; I231-L331 HydrophobicContact CD1-CD2 3.93Å
232	V	94.1	Very high	90.9	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-63.9	136	175.7	179.2	0	0	0	0	111.4	V226 P323 R326 R327	V226-V232 HydrophobicContact CG1-CG2 4.16Å; V232-P323 HydrophobicContact CG1-CB 4.01Å; V232-R326 HydrophobicContact CG2-CB 4.48Å; V232-R326 HydrophobicContact CG2-CG 3.76Å; V232-R327 HydrophobicContact CB-CB 4.35Å; V232-R327 WeakPolarHBondContact O-CD 3.39Å; V232-R327 PolarHBondContact O-NH1 2.95Å
233	I	93.2	Very high	90.7	Very high	87 Å²	87	75.1 Å²	75.1	45%	0.446	38%	0.382	S	S	.	.			trans	-97.9	112.5	176.9	-57.2	172.8	0	0	0	107.9	H221 S225 N227	H221-I233 PolarHBondContact CE1-O 2.86Å; H221-I233 PolarHBondContact NE2-O 2.91Å; S225-I233 PolarHBondContact O-N 3.05Å; N227-I233 HydrophobicContact CB-CD1 4.21Å; N227-I233 HydrophobicContact CB-CG1 4.26Å
234	V	91.9	Very high	90.7	Very high	17 Å²	17	80.5 Å²	80.5	10%	0.103	40%	0.401	C	S	.	.			trans	-80.7	125.1	177.5	177.2	0	0	0	0	109.2	N236 E239 A324 R327	V234-N236 VanDerWaalsContact CG1-O 3.22Å; V234-N236 WeakPolarHBondContact CG1-O 3.3Å; V234-E239 HydrophobicContact CG1-CB 4.18Å; V234-A324 HydrophobicContact CG2-CB 4.26Å; V234-R327 HydrophobicContact CG2-CB 4.04Å; V234-R327 HydrophobicContact CG2-CG 4.39Å
235	K	87.3	Confident	90.8	Very high	172 Å²	172	75.1 Å²	75.1	75%	0.748	38%	0.377	S	S	*	.	S	Bend	trans	-68.4	-42.5	179.7	-69	-178.2	179.5	-176.2	0	112.5
236	N	89.3	Confident	90.8	Very high	74 Å²	74	75.3 Å²	75.3	40%	0.396	38%	0.376	S	S	.	.			trans	-90.1	108.3	179.8	-175.1	0.9	0	0	0	110.8	V234 A238 E239	V234-N236 VanDerWaalsContact CG1-O 3.22Å; V234-N236 WeakPolarHBondContact CG1-O 3.3Å; N236-A238 PolarHBondContact O-N 3.19Å; N236-A238 WeakPolarHBondContact OD1-CB 3.32Å; N236-A238 PolarHBondContact OD1-N 3.01Å; N236-A238 VanDerWaalsContact OD1-N 3.12Å; N236-E239 HydrophobicContact CB-CB 4.31Å; N236-E239 HydrophobicContact CB-CG 4.23Å; N236-E239 PolarHBondContact ND2-OE1 3.46Å; N236-E239 PolarHBondContact O-N 2.8Å
237	K	84.9	Confident	90.8	Very high	190 Å²	190	74.7 Å²	74.7	83%	0.826	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-61.5	-26.8	-179.4	-69	-173.9	-179.7	178.3	0	113.4	E239 D240	K237-E239 PolarHBondContact O-N 3.25Å; K237-D240 PolarHBondContact O-N 3.03Å
238	A	86.9	Confident	90.8	Very high	89 Å²	89	72.8 Å²	72.8	74%	0.736	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-68.5	-26	177.5	0	0	0	0	0	112.5	N236	N236-A238 PolarHBondContact O-N 3.19Å; N236-A238 WeakPolarHBondContact OD1-CB 3.32Å; N236-A238 PolarHBondContact OD1-N 3.01Å; N236-A238 VanDerWaalsContact OD1-N 3.12Å
239	E	87	Confident	91.1	Very high	103 Å²	103	62.7 Å²	62.7	48%	0.481	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-87	-7.8	175.7	-71.8	170.1	-140.2	0	0	112.9	V234 N236 K237 A324 R328	V234-E239 HydrophobicContact CG1-CB 4.18Å; N236-E239 HydrophobicContact CB-CB 4.31Å; N236-E239 HydrophobicContact CB-CG 4.23Å; N236-E239 PolarHBondContact ND2-OE1 3.46Å; N236-E239 PolarHBondContact O-N 2.8Å; K237-E239 PolarHBondContact O-N 3.25Å; E239-A324 HydrophobicContact CB-CB 4.22Å; E239-A324 WeakPolarHBondContact O-CB 3.49Å; E239-R328 VanDerWaalsContact O-CZ 3.3Å; E239-R328 PolarHBondContact O-NH1 2.89Å; E239-R328 PolarHBondContact O-NH2 3.37Å
240	D	89.8	Confident	91.4	Very high	28 Å²	28	64.5 Å²	64.5	15%	0.15	32%	0.323	C	S	.	.	S	Bend	trans	-80.1	173.2	175.9	-158.2	3.7	0	0	0	111.1	K237 R327 R328	K237-D240 PolarHBondContact O-N 3.03Å; D240-R327 VanDerWaalsContact OD1-CD 3.31Å; D240-R327 WeakPolarHBondContact OD1-CD 3.39Å; D240-R327 IonicContact OD1-CZ 3.18Å; D240-R327 IonicContact OD1-NE 2.68Å; D240-R327 PolarHBondContact OD1-NE 3.07Å; D240-R327 IonicContact OD2-CZ 2.61Å; D240-R327 IonicContact OD2-NE 3.2Å; D240-R327 PolarHBondContact OD2-NE 3.07Å; D240-R327 IonicContact OD2-NH2 3.7Å; D240-R327 PolarHBondContact OD2-NH2 3.37Å; D240-R328 PolarHBondContact O-NH2 3.36Å
241	M	92.5	Very high	91.5	Very high	8 Å²	8	64.5 Å²	64.5	4%	0.039	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-67.8	141.7	172.8	-71.5	-173.4	-76.4	0	0	111.3	V245 L246 M249 Y280 F281 R328 L331	M241-V245 HydrophobicContact CB-CB 4.45Å; M241-V245 HydrophobicContact SD-CG1 4.03Å; M241-L246 HydrophobicContact CB-CD2 4.33Å; M241-L246 HydrophobicContact CB-CG 4.14Å; M241-L246 HydrophobicContact CE-CD2 3.72Å; M241-M249 HydrophobicContact CE-SD 4.15Å; M241-M249 HydrophobicContact SD-SD 4.09Å; M241-Y280 HydrophobicContact CG-CE1 4Å; M241-Y280 HydrophobicContact SD-CE1 4.09Å; M241-F281 HydrophobicContact SD-CE1 4.38Å; M241-F281 HydrophobicContact SD-CZ 3.75Å; M241-R328 HydrophobicContact CE-CG 4.29Å; M241-R328 HydrophobicContact CG-CG 3.6Å; M241-R328 HydrophobicContact SD-CB 4.46Å; M241-R328 HydrophobicContact SD-CG 3.86Å; M241-L331 HydrophobicContact CE-CB 3.88Å; M241-L331 HydrophobicContact CE-CD1 3.29Å; M241-L331 HydrophobicContact CE-CG 4.19Å
242	P	94.6	Very high	91.4	Very high	48 Å²	48	63.7 Å²	63.7	31%	0.312	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-53.6	146.3	171.6	-25	33.2	0	0	0	112.2	W244 V245 L246 Y280	P242-W244 VanDerWaalsContact CB-CD1 3.47Å; P242-W244 HydrophobicContact CB-CD2 4.46Å; P242-W244 HydrophobicContact CB-CG 4.19Å; P242-W244 VanDerWaalsContact CB-NE1 3.26Å; P242-W244 PolarHBondContact O-N 3.42Å; P242-V245 HydrophobicContact CB-CG2 4.15Å; P242-V245 HydrophobicContact CG-CG2 4.18Å; P242-V245 WeakPolarHBondContact O-CB 3.45Å; P242-V245 PolarHBondContact O-N 2.77Å; P242-L246 PolarHBondContact O-N 3.14Å; P242-Y280 HydrophobicContact CG-CE2 4.06Å
243	Y	91.9	Very high	91.3	Very high	159 Å²	159	64.9 Å²	64.9	62%	0.624	33%	0.325	S	S	*	.	H	α-helix	trans	-55	-38.4	-179.1	176.7	-99.1	0	0	0	113.1	V245 L246 S247	Y243-V245 VanDerWaalsContact C-N 3.34Å; Y243-V245 PolarHBondContact O-N 3.36Å; Y243-L246 PolarHBondContact O-N 2.9Å; Y243-S247 WeakPolarHBondContact CE1-OG 3.39Å; Y243-S247 WeakPolarHBondContact O-CB 3.33Å; Y243-S247 PolarHBondContact O-N 3.05Å; Y243-S247 PolarHBondContact O-OG 3.02Å
244	W	93.8	Very high	91	Very high	125 Å²	125	65.1 Å²	65.1	47%	0.473	33%	0.327	S	S	.	.	H	α-helix	trans	-63.6	-38.2	178.9	66.7	-103.3	0	0	0	112.1	P242 S247 A248 T276 Y280	P242-W244 VanDerWaalsContact CB-CD1 3.47Å; P242-W244 HydrophobicContact CB-CD2 4.46Å; P242-W244 HydrophobicContact CB-CG 4.19Å; P242-W244 VanDerWaalsContact CB-NE1 3.26Å; P242-W244 PolarHBondContact O-N 3.42Å; W244-S247 PolarHBondContact O-N 3.49Å; W244-A248 WeakPolarHBondContact O-CB 3.47Å; W244-A248 PolarHBondContact O-N 2.78Å; W244-T276 HydrophobicContact CE3-CG2 4.37Å; W244-T276 HydrophobicContact CH2-CG2 4.46Å; W244-T276 HydrophobicContact CZ3-CG2 3.74Å; W244-Y280 HydrophobicContact CH2-CD2 4.05Å; W244-Y280 HydrophobicContact CH2-CG 4.2Å; W244-Y280 HydrophobicContact CZ2-CD2 4Å
245	V	95.9	Very high	90.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.8	-50	176.6	-178.8	0	0	0	0	109	M241 P242 Y243 S247 A248 M249 Y280	M241-V245 HydrophobicContact CB-CB 4.45Å; M241-V245 HydrophobicContact SD-CG1 4.03Å; P242-V245 HydrophobicContact CB-CG2 4.15Å; P242-V245 HydrophobicContact CG-CG2 4.18Å; P242-V245 WeakPolarHBondContact O-CB 3.45Å; P242-V245 PolarHBondContact O-N 2.77Å; Y243-V245 VanDerWaalsContact C-N 3.34Å; Y243-V245 PolarHBondContact O-N 3.36Å; V245-S247 PolarHBondContact O-N 3.23Å; V245-A248 PolarHBondContact O-N 2.97Å; V245-M249 HydrophobicContact CG1-CG 4.19Å; V245-M249 HydrophobicContact CG1-SD 3.96Å; V245-M249 VanDerWaalsContact O-CG 3.23Å; V245-M249 WeakPolarHBondContact O-CG 3.29Å; V245-M249 PolarHBondContact O-N 3.43Å; V245-Y280 HydrophobicContact CG1-CD1 3.78Å; V245-Y280 HydrophobicContact CG1-CE1 4.1Å; V245-Y280 HydrophobicContact CG1-CG 4.24Å; V245-Y280 HydrophobicContact CG2-CD1 3.9Å; V245-Y280 HydrophobicContact CG2-CD2 3.64Å; V245-Y280 HydrophobicContact CG2-CE1 4.19Å; V245-Y280 HydrophobicContact CG2-CE2 3.96Å; V245-Y280 HydrophobicContact CG2-CG 3.61Å
246	L	94	Very high	90.3	Very high	32 Å²	32	59.4 Å²	59.4	17%	0.168	31%	0.305	C	S	.	.	H	α-helix	trans	-58.2	-37.5	178.9	-70.4	171.6	0	0	0	112	M241 P242 Y243 K250 L331	M241-L246 HydrophobicContact CB-CD2 4.33Å; M241-L246 HydrophobicContact CB-CG 4.14Å; M241-L246 HydrophobicContact CE-CD2 3.72Å; P242-L246 PolarHBondContact O-N 3.14Å; Y243-L246 PolarHBondContact O-N 2.9Å; L246-K250 WeakPolarHBondContact O-CB 3.38Å; L246-K250 WeakPolarHBondContact O-CD 3.31Å; L246-K250 WeakPolarHBondContact O-CG 3.47Å; L246-K250 PolarHBondContact O-N 2.91Å; L246-L331 HydrophobicContact CD2-CD1 3.88Å
247	S	91.8	Very high	89.3	Confident	34 Å²	34	61.2 Å²	61.2	24%	0.238	32%	0.315	C	S	.	.	H	α-helix	trans	-71	-43.5	178.2	-57.4	0	0	0	0	111.7	Y243 W244 V245 K250 C251	Y243-S247 WeakPolarHBondContact CE1-OG 3.39Å; Y243-S247 WeakPolarHBondContact O-CB 3.33Å; Y243-S247 PolarHBondContact O-N 3.05Å; Y243-S247 PolarHBondContact O-OG 3.02Å; W244-S247 PolarHBondContact O-N 3.49Å; V245-S247 PolarHBondContact O-N 3.23Å; S247-K250 PolarHBondContact O-N 3.33Å; S247-C251 WeakPolarHBondContact O-CB 3.39Å; S247-C251 PolarHBondContact O-N 3.17Å
248	A	93.1	Very high	88.2	Confident	16 Å²	16	52.9 Å²	52.9	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-45.8	173.6	0	0	0	0	0	112.1	W244 V245 K250 C251 L252 V273 V277	W244-A248 WeakPolarHBondContact O-CB 3.47Å; W244-A248 PolarHBondContact O-N 2.78Å; V245-A248 PolarHBondContact O-N 2.97Å; A248-K250 PolarHBondContact O-N 3.38Å; A248-C251 WeakPolarHBondContact O-CB 3.4Å; A248-C251 PolarHBondContact O-N 3.1Å; A248-L252 PolarHBondContact O-N 3.21Å; A248-L252 VanDerWaalsContact O-N 3.17Å; A248-V273 HydrophobicContact CB-CG1 3.82Å; A248-V273 WeakPolarHBondContact O-CG1 3.3Å; A248-V277 HydrophobicContact CB-CG2 3.6Å
249	M	95.1	Very high	86.5	Confident	12 Å²	12	60.8 Å²	60.8	6%	0.059	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-42.8	174.9	-63.1	-179.8	76.6	0	0	111.5	M241 V245 C251 L252 A253 V277 F281 L331 L332 L335	M241-M249 HydrophobicContact CE-SD 4.15Å; M241-M249 HydrophobicContact SD-SD 4.09Å; V245-M249 HydrophobicContact CG1-CG 4.19Å; V245-M249 HydrophobicContact CG1-SD 3.96Å; V245-M249 VanDerWaalsContact O-CG 3.23Å; V245-M249 WeakPolarHBondContact O-CG 3.29Å; V245-M249 PolarHBondContact O-N 3.43Å; M249-C251 VanDerWaalsContact C-N 3.31Å; M249-C251 PolarHBondContact O-N 3.09Å; M249-L252 PolarHBondContact O-N 3.48Å; M249-A253 VanDerWaalsContact O-CB 3.29Å; M249-A253 WeakPolarHBondContact O-CB 3.46Å; M249-A253 PolarHBondContact O-N 2.89Å; M249-V277 HydrophobicContact CG-CG1 4.06Å; M249-V277 HydrophobicContact CG-CG2 4.17Å; M249-F281 HydrophobicContact CE-CE2 4.49Å; M249-F281 HydrophobicContact CE-CZ 4.5Å; M249-F281 HydrophobicContact SD-CE2 4.33Å; M249-F281 HydrophobicContact SD-CZ 4.44Å; M249-L331 HydrophobicContact CE-CB 4.04Å; M249-L331 WeakPolarHBondContact CE-O 3.17Å; M249-L332 HydrophobicContact CE-CB 4.46Å; M249-L335 HydrophobicContact CB-CD1 4.41Å; M249-L335 HydrophobicContact CB-CD2 4.05Å; M249-L335 HydrophobicContact CE-CB 3.8Å; M249-L335 HydrophobicContact CE-CD2 3.7Å; M249-L335 HydrophobicContact CE-CG 4.37Å; M249-L335 HydrophobicContact CG-CD2 3.8Å; M249-L335 WeakPolarHBondContact O-CD1 3.32Å
250	K	92	Very high	85	Confident	119 Å²	119	63.7 Å²	63.7	52%	0.517	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-35.2	176.2	-77	169.7	-175.2	174.6	0	112.7	L246 S247 A248 N254	L246-K250 WeakPolarHBondContact O-CB 3.38Å; L246-K250 WeakPolarHBondContact O-CD 3.31Å; L246-K250 WeakPolarHBondContact O-CG 3.47Å; L246-K250 PolarHBondContact O-N 2.91Å; S247-K250 PolarHBondContact O-N 3.33Å; A248-K250 PolarHBondContact O-N 3.38Å; K250-N254 WeakPolarHBondContact O-CB 3.38Å; K250-N254 PolarHBondContact O-N 3.07Å; K250-N254 VanDerWaalsContact O-N 3.14Å; K250-N254 PolarHBondContact O-ND2 2.9Å
251	C	89.4	Confident	83.1	Confident	24 Å²	24	65.4 Å²	65.4	16%	0.162	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-51.6	176.7	-179.5	0	0	0	0	110.5	S247 A248 M249 W255	S247-C251 WeakPolarHBondContact O-CB 3.39Å; S247-C251 PolarHBondContact O-N 3.17Å; A248-C251 WeakPolarHBondContact O-CB 3.4Å; A248-C251 PolarHBondContact O-N 3.1Å; M249-C251 VanDerWaalsContact C-N 3.31Å; M249-C251 PolarHBondContact O-N 3.09Å; C251-W255 PolarHBondContact O-N 3.12Å
252	L	91.3	Very high	81.4	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-65.2	-43.5	177.4	-69.4	173.3	0	0	0	112.8	A248 M249 N254 W255 E270 V273 L274 L335 V339	A248-L252 PolarHBondContact O-N 3.21Å; A248-L252 VanDerWaalsContact O-N 3.17Å; M249-L252 PolarHBondContact O-N 3.48Å; L252-N254 VanDerWaalsContact C-N 3.3Å; L252-N254 PolarHBondContact O-N 3.28Å; L252-W255 PolarHBondContact O-N 2.81Å; L252-E270 HydrophobicContact CD2-CB 4.28Å; L252-V273 HydrophobicContact CD1-CG1 3.91Å; L252-V273 HydrophobicContact CD2-CB 4.22Å; L252-V273 HydrophobicContact CD2-CG1 4.12Å; L252-V273 HydrophobicContact CG-CB 4.3Å; L252-V273 HydrophobicContact CG-CG1 3.67Å; L252-L274 HydrophobicContact CD1-CB 4.2Å; L252-L274 HydrophobicContact CD1-CD1 4.24Å; L252-L335 HydrophobicContact CB-CD1 3.83Å; L252-V339 HydrophobicContact CB-CG2 4.03Å
253	A	91.2	Very high	79.6	Confident	25 Å²	25	79 Å²	79	21%	0.207	38%	0.375	C	S	.	.	H	α-helix	trans	-67.4	-27.9	-175.9	0	0	0	0	0	113.8	M249 L335 R338	M249-A253 VanDerWaalsContact O-CB 3.29Å; M249-A253 WeakPolarHBondContact O-CB 3.46Å; M249-A253 PolarHBondContact O-N 2.89Å; A253-L335 HydrophobicContact CB-CD1 4.01Å; A253-R338 HydrophobicContact CB-CB 4.31Å
254	N	88.1	Confident	78.2	Confident	93 Å²	93	74.6 Å²	74.6	50%	0.497	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	18.2	-178	-57.5	-64.4	0	0	0	112.8	K250 L252 N257 G258	K250-N254 WeakPolarHBondContact O-CB 3.38Å; K250-N254 PolarHBondContact O-N 3.07Å; K250-N254 VanDerWaalsContact O-N 3.14Å; K250-N254 PolarHBondContact O-ND2 2.9Å; L252-N254 VanDerWaalsContact C-N 3.3Å; L252-N254 PolarHBondContact O-N 3.28Å; N254-N257 CarbonylContact O-C 3.34Å; N254-N257 PolarHBondContact O-N 3.43Å; N254-G258 PolarHBondContact O-N 2.81Å
255	W	86.1	Confident	77	Confident	22 Å²	22	74.7 Å²	74.7	8%	0.083	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	139.2	-177.8	-174	-87.2	0	0	0	112.6	C251 L252 P264 F269 E270 N342 A344 L345	C251-W255 PolarHBondContact O-N 3.12Å; L252-W255 PolarHBondContact O-N 2.81Å; W255-P264 HydrophobicContact CH2-CB 3.61Å; W255-P264 HydrophobicContact CZ2-CB 3.88Å; W255-P264 HydrophobicContact CZ2-CG 4.31Å; W255-F269 HydrophobicContact CH2-CD1 4.04Å; W255-F269 AromaticContact CZ3-CD1 3.77Å; W255-F269 HydrophobicContact CZ3-CD1 3.77Å; W255-F269 HydrophobicContact CZ3-CE1 4.18Å; W255-E270 HydrophobicContact CE3-CB 4.46Å; W255-E270 HydrophobicContact CH2-CB 3.87Å; W255-E270 HydrophobicContact CZ2-CB 4.36Å; W255-E270 HydrophobicContact CZ3-CB 3.96Å; W255-N342 PolarHBondContact O-ND2 3.27Å; W255-A344 VanDerWaalsContact CD1-O 3.3Å; W255-A344 PolarHBondContact NE1-O 3.47Å; W255-L345 HydrophobicContact CB-CD1 3.66Å; W255-L345 HydrophobicContact CD2-CD1 3.65Å; W255-L345 HydrophobicContact CE3-CD1 4.27Å; W255-L345 HydrophobicContact CG-CD1 3.34Å
256	P	76.8	Confident	76.4	Confident	46 Å²	46	79.5 Å²	79.5	30%	0.299	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86	-5.2	-2.2	33.2	-34.5	0	0	0	114	G258	P256-G258 PolarHBondContact O-N 3.37Å
257	N	69.3	Low	75.8	Confident	113 Å²	113	84.1 Å²	84.1	60%	0.604	42%	0.423	S	S	*	.			trans	-97.2	47	-166.2	-62.1	-34.4	0	0	0	113.3	N254 R259	N254-N257 CarbonylContact O-C 3.34Å; N254-N257 PolarHBondContact O-N 3.43Å; N257-R259 PolarHBondContact O-N 3.1Å
258	G	61.1	Low	75.6	Confident	14 Å²	14	83.4 Å²	83.4	14%	0.144	42%	0.422	C	S	.	.			trans	-57.3	137.5	168.1	0	0	0	0	0	109.9	N254 P256 E260 T261	N254-G258 PolarHBondContact O-N 2.81Å; P256-G258 PolarHBondContact O-N 3.37Å; G258-E260 PolarHBondContact O-N 3.16Å; G258-T261 PolarHBondContact O-N 3.47Å; G258-T261 VanDerWaalsContact O-N 3.16Å
259	R	52.8	Low	75.4	Confident	255 Å²	255	84 Å²	84	96%	0.962	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-10.8	-167.8	-73.7	-174.1	177.1	-160.3	-2.9	116.7	N257	N257-R259 PolarHBondContact O-N 3.1Å
260	E	53.7	Low	75.2	Confident	164 Å²	164	84.1 Å²	84.1	77%	0.766	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.9	-15.2	-174.3	-69.8	175.9	-175.6	0	0	114.9	G258	G258-E260 PolarHBondContact O-N 3.16Å
261	T	51.9	Low	75.2	Confident	65 Å²	65	82.1 Å²	82.1	40%	0.399	41%	0.411	S	S	.	.			trans	-147	111.7	-179.4	34.2	0	0	0	0	110.2	G258 Q263	G258-T261 PolarHBondContact O-N 3.47Å; G258-T261 VanDerWaalsContact O-N 3.16Å; T261-Q263 PolarHBondContact O-N 3.03Å
262	K	54.8	Low	75.4	Confident	189 Å²	189	83.7 Å²	83.7	82%	0.822	42%	0.418	S	S	*	.	S	Bend	trans	-72.1	0.2	179.4	-66.9	-178	178.1	178.8	0	113.5
263	Q	57.6	Low	75.5	Confident	153 Å²	153	84.4 Å²	84.4	72%	0.715	42%	0.422	S	S	*	.	S	Bend	trans	-146.2	146.5	-179	-71	-179.1	-16.7	0	0	111.4	T261 M265	T261-Q263 PolarHBondContact O-N 3.03Å; Q263-M265 PolarHBondContact O-N 3.22Å
264	P	63.4	Low	75.7	Confident	65 Å²	65	83.7 Å²	83.7	42%	0.422	41%	0.414	S	S	.	.			trans	-58.4	132.5	166.7	24.8	-32.3	0	0	0	110.1	W255 Y266	W255-P264 HydrophobicContact CH2-CB 3.61Å; W255-P264 HydrophobicContact CZ2-CB 3.88Å; W255-P264 HydrophobicContact CZ2-CG 4.31Å; P264-Y266 VanDerWaalsContact C-N 3.26Å; P264-Y266 PolarHBondContact O-N 3.45Å
265	M	68.6	Low	76	Confident	128 Å²	128	86.4 Å²	86.4	63%	0.631	42%	0.418	S	S	*	.	S	Bend	trans	-66.1	-30.4	-177.5	-66.8	-163.1	-66.6	0	0	112.7	Q263 F269	Q263-M265 PolarHBondContact O-N 3.22Å; M265-F269 HydrophobicContact CE-CD2 4.1Å; M265-F269 HydrophobicContact CE-CE2 3.52Å; M265-F269 HydrophobicContact CE-CZ 4.03Å
266	Y	83.4	Confident	76.5	Confident	101 Å²	101	88.2 Å²	88.2	40%	0.396	43%	0.432	S	S	.	.	S	Bend	trans	-161.8	162.2	177.7	57.6	-90.4	0	0	0	110.5	P264 G268 F269 D272	P264-Y266 VanDerWaalsContact C-N 3.26Å; P264-Y266 PolarHBondContact O-N 3.45Å; Y266-G268 PolarHBondContact O-N 3.3Å; Y266-F269 HydrophobicContact CD1-CB 4.33Å; Y266-F269 HydrophobicContact CD1-CD2 4.4Å; Y266-F269 HydrophobicContact CD2-CB 4.19Å; Y266-F269 HydrophobicContact CE1-CB 4.13Å; Y266-F269 AromaticContact CE1-CD2 3.64Å; Y266-F269 HydrophobicContact CE1-CD2 3.64Å; Y266-F269 HydrophobicContact CE1-CG 4.31Å; Y266-F269 HydrophobicContact CE2-CB 3.98Å; Y266-F269 HydrophobicContact CG-CB 4.35Å; Y266-F269 AromaticContact CZ-CD2 3.79Å; Y266-F269 VanDerWaalsContact O-CB 3.28Å; Y266-F269 WeakPolarHBondContact O-CB 3.46Å; Y266-F269 PolarHBondContact O-N 2.75Å; Y266-D272 WeakPolarHBondContact CE2-OD2 3.32Å; Y266-D272 PolarHBondContact OH-OD2 3.4Å
267	P	81.3	Confident	77.5	Confident	128 Å²	128	86 Å²	86	83%	0.831	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	129.4	176.3	-22.2	33.9	0	0	0	112.4
268	G	86.6	Confident	78.8	Confident	20 Å²	20	81 Å²	81	21%	0.206	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	88	0.8	-179.1	0	0	0	0	0	114.6	Y266 E270 R271 D272	Y266-G268 PolarHBondContact O-N 3.3Å; G268-E270 PolarHBondContact O-N 2.77Å; G268-R271 WeakPolarHBondContact O-CB 3.28Å; G268-R271 PolarHBondContact O-N 2.94Å; G268-D272 PolarHBondContact O-N 3.4Å
269	F	89.3	Confident	80.5	Confident	29 Å²	29	83.9 Å²	83.9	13%	0.127	40%	0.401	C	S	.	.	H	α-helix	trans	-51.9	-39.8	175.6	172.1	-110.9	0	0	0	112.5	W255 M265 Y266 R271 D272 V273	W255-F269 HydrophobicContact CH2-CD1 4.04Å; W255-F269 AromaticContact CZ3-CD1 3.77Å; W255-F269 HydrophobicContact CZ3-CD1 3.77Å; W255-F269 HydrophobicContact CZ3-CE1 4.18Å; M265-F269 HydrophobicContact CE-CD2 4.1Å; M265-F269 HydrophobicContact CE-CE2 3.52Å; M265-F269 HydrophobicContact CE-CZ 4.03Å; Y266-F269 HydrophobicContact CD1-CB 4.33Å; Y266-F269 HydrophobicContact CD1-CD2 4.4Å; Y266-F269 HydrophobicContact CD2-CB 4.19Å; Y266-F269 HydrophobicContact CE1-CB 4.13Å; Y266-F269 AromaticContact CE1-CD2 3.64Å; Y266-F269 HydrophobicContact CE1-CD2 3.64Å; Y266-F269 HydrophobicContact CE1-CG 4.31Å; Y266-F269 HydrophobicContact CE2-CB 3.98Å; Y266-F269 HydrophobicContact CG-CB 4.35Å; Y266-F269 AromaticContact CZ-CD2 3.79Å; Y266-F269 VanDerWaalsContact O-CB 3.28Å; Y266-F269 WeakPolarHBondContact O-CB 3.46Å; Y266-F269 PolarHBondContact O-N 2.75Å; F269-R271 VanDerWaalsContact C-N 3.28Å; F269-R271 PolarHBondContact O-N 2.8Å; F269-D272 PolarHBondContact O-N 3.44Å; F269-V273 HydrophobicContact CD1-CG2 4.2Å; F269-V273 HydrophobicContact CD2-CG2 4.02Å; F269-V273 HydrophobicContact CE1-CG2 3.78Å; F269-V273 HydrophobicContact CE2-CG2 3.58Å; F269-V273 HydrophobicContact CG-CG2 4.32Å; F269-V273 HydrophobicContact CZ-CG2 3.45Å; F269-V273 VanDerWaalsContact CZ-CG2 3.45Å; F269-V273 VanDerWaalsContact O-CG2 3.28Å; F269-V273 WeakPolarHBondContact O-CG2 3.47Å; F269-V273 PolarHBondContact O-N 3.49Å
270	E	90.6	Very high	82.6	Confident	13 Å²	13	73.3 Å²	73.3	6%	0.061	36%	0.362	C	S	.	.	H	α-helix	trans	-60.7	-34.8	176.5	70	-68.9	163.8	0	0	113.3	L252 W255 G268 L274 L345 L348	L252-E270 HydrophobicContact CD2-CB 4.28Å; W255-E270 HydrophobicContact CE3-CB 4.46Å; W255-E270 HydrophobicContact CH2-CB 3.87Å; W255-E270 HydrophobicContact CZ2-CB 4.36Å; W255-E270 HydrophobicContact CZ3-CB 3.96Å; G268-E270 PolarHBondContact O-N 2.77Å; E270-L274 WeakPolarHBondContact O-CB 3.46Å; E270-L274 PolarHBondContact O-N 2.88Å; E270-L345 HydrophobicContact CB-CD1 4.19Å; E270-L348 HydrophobicContact CB-CD2 3.95Å; E270-L348 HydrophobicContact CG-CD2 3.48Å; E270-L348 VanDerWaalsContact CG-CD2 3.48Å
271	R	92.9	Very high	84.6	Confident	77 Å²	77	65.6 Å²	65.6	29%	0.291	33%	0.325	S	S	.	.	H	α-helix	trans	-70	-40.5	177.9	-57.9	-178.1	178.6	-168.2	-8.1	110.4	G268 F269 L274 R275 P347 D350	G268-R271 WeakPolarHBondContact O-CB 3.28Å; G268-R271 PolarHBondContact O-N 2.94Å; F269-R271 VanDerWaalsContact C-N 3.28Å; F269-R271 PolarHBondContact O-N 2.8Å; R271-L274 PolarHBondContact O-N 3.48Å; R271-R275 WeakPolarHBondContact O-CB 3.37Å; R271-R275 PolarHBondContact O-N 3.49Å; R271-P347 PolarHBondContact NE-O 3.26Å; R271-P347 PolarHBondContact NH2-O 3.27Å; R271-D350 IonicContact CZ-OD1 2.63Å; R271-D350 IonicContact CZ-OD2 2.94Å; R271-D350 IonicContact NH1-OD1 3.21Å; R271-D350 IonicContact NH1-OD2 3.88Å; R271-D350 PolarHBondContact NH1-OD2 2.65Å; R271-D350 IonicContact NH2-OD1 3.57Å; R271-D350 PolarHBondContact NH2-OD1 3.47Å; R271-D350 IonicContact NH2-OD2 3.31Å
272	D	92.8	Very high	86.6	Confident	58 Å²	58	67.9 Å²	67.9	31%	0.31	33%	0.332	S	S	.	.	H	α-helix	trans	-68.9	-40.8	177.3	-67.2	-22.6	0	0	0	112	Y266 G268 F269 L274 R275 T276	Y266-D272 WeakPolarHBondContact CE2-OD2 3.32Å; Y266-D272 PolarHBondContact OH-OD2 3.4Å; G268-D272 PolarHBondContact O-N 3.4Å; F269-D272 PolarHBondContact O-N 3.44Å; D272-L274 VanDerWaalsContact C-N 3.34Å; D272-L274 PolarHBondContact O-N 2.56Å; D272-R275 PolarHBondContact O-N 2.85Å; D272-T276 WeakPolarHBondContact O-CB 3.17Å; D272-T276 PolarHBondContact O-N 2.83Å; D272-T276 PolarHBondContact O-OG1 3.39Å
273	V	93.1	Very high	88.5	Confident	14 Å²	14	67.9 Å²	67.9	9%	0.085	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-44.1	174.5	178.3	0	0	0	0	110.2	A248 L252 F269 T276 V277	A248-V273 HydrophobicContact CB-CG1 3.82Å; A248-V273 WeakPolarHBondContact O-CG1 3.3Å; L252-V273 HydrophobicContact CD1-CG1 3.91Å; L252-V273 HydrophobicContact CD2-CB 4.22Å; L252-V273 HydrophobicContact CD2-CG1 4.12Å; L252-V273 HydrophobicContact CG-CB 4.3Å; L252-V273 HydrophobicContact CG-CG1 3.67Å; F269-V273 HydrophobicContact CD1-CG2 4.2Å; F269-V273 HydrophobicContact CD2-CG2 4.02Å; F269-V273 HydrophobicContact CE1-CG2 3.78Å; F269-V273 HydrophobicContact CE2-CG2 3.58Å; F269-V273 HydrophobicContact CG-CG2 4.32Å; F269-V273 HydrophobicContact CZ-CG2 3.45Å; F269-V273 VanDerWaalsContact CZ-CG2 3.45Å; F269-V273 VanDerWaalsContact O-CG2 3.28Å; F269-V273 WeakPolarHBondContact O-CG2 3.47Å; F269-V273 PolarHBondContact O-N 3.49Å; V273-T276 PolarHBondContact O-N 3.49Å; V273-V277 WeakPolarHBondContact O-CG2 3.44Å; V273-V277 PolarHBondContact O-N 2.75Å
274	L	95.5	Very high	90.1	Very high	10 Å²	10	63.1 Å²	63.1	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-60	-47.5	174.7	179.1	65.1	0	0	0	111.5	L252 E270 R271 D272 T276 V277 A278 L348 L357 M358 F362	L252-L274 HydrophobicContact CD1-CB 4.2Å; L252-L274 HydrophobicContact CD1-CD1 4.24Å; E270-L274 WeakPolarHBondContact O-CB 3.46Å; E270-L274 PolarHBondContact O-N 2.88Å; R271-L274 PolarHBondContact O-N 3.48Å; D272-L274 VanDerWaalsContact C-N 3.34Å; D272-L274 PolarHBondContact O-N 2.56Å; L274-T276 VanDerWaalsContact C-N 3.3Å; L274-T276 PolarHBondContact O-N 3.37Å; L274-V277 PolarHBondContact O-N 2.92Å; L274-A278 WeakPolarHBondContact O-CB 3.37Å; L274-A278 PolarHBondContact O-N 3.07Å; L274-L348 HydrophobicContact CD2-CB 4.18Å; L274-L348 HydrophobicContact CD2-CD1 3.79Å; L274-L348 HydrophobicContact CD2-CG 4.46Å; L274-L357 HydrophobicContact CD2-CD2 3.81Å; L274-L357 HydrophobicContact CD2-CG 4.49Å; L274-M358 HydrophobicContact CD1-CE 3.71Å; L274-M358 HydrophobicContact CD1-SD 4.01Å; L274-M358 HydrophobicContact CD2-CE 4.32Å; L274-F362 HydrophobicContact CD1-CE2 4.19Å; L274-F362 HydrophobicContact CD1-CZ 4.24Å
275	R	95.5	Very high	91.4	Very high	150 Å²	150	70 Å²	70	57%	0.566	33%	0.329	S	S	*	.	H	α-helix	trans	-56.5	-46.1	178	-173.7	-167.1	-56.6	-104.4	-0.2	111	R271 D272 V277 A278 E279	R271-R275 WeakPolarHBondContact O-CB 3.37Å; R271-R275 PolarHBondContact O-N 3.49Å; D272-R275 PolarHBondContact O-N 2.85Å; R275-V277 VanDerWaalsContact C-N 3.34Å; R275-V277 PolarHBondContact O-N 3.32Å; R275-A278 WeakPolarHBondContact O-CB 3.42Å; R275-A278 PolarHBondContact O-N 3.19Å; R275-E279 WeakPolarHBondContact O-CG 3.19Å; R275-E279 PolarHBondContact O-N 3.44Å
276	T	95.6	Very high	92.5	Very high	61 Å²	61	67.1 Å²	67.1	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-62.4	-41.5	179.5	-50.8	0	0	0	0	111.7	W244 D272 V273 L274 Y280	W244-T276 HydrophobicContact CE3-CG2 4.37Å; W244-T276 HydrophobicContact CH2-CG2 4.46Å; W244-T276 HydrophobicContact CZ3-CG2 3.74Å; D272-T276 WeakPolarHBondContact O-CB 3.17Å; D272-T276 PolarHBondContact O-N 2.83Å; D272-T276 PolarHBondContact O-OG1 3.39Å; V273-T276 PolarHBondContact O-N 3.49Å; L274-T276 VanDerWaalsContact C-N 3.3Å; L274-T276 PolarHBondContact O-N 3.37Å; T276-Y280 PolarHBondContact O-N 3.34Å
277	V	97	Very high	93	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-43.7	174.2	175	0	0	0	0	110.8	A248 M249 V273 L274 R275 Y280 F281 L335 F362	A248-V277 HydrophobicContact CB-CG2 3.6Å; M249-V277 HydrophobicContact CG-CG1 4.06Å; M249-V277 HydrophobicContact CG-CG2 4.17Å; V273-V277 WeakPolarHBondContact O-CG2 3.44Å; V273-V277 PolarHBondContact O-N 2.75Å; L274-V277 PolarHBondContact O-N 2.92Å; R275-V277 VanDerWaalsContact C-N 3.34Å; R275-V277 PolarHBondContact O-N 3.32Å; V277-Y280 WeakPolarHBondContact O-CB 3.4Å; V277-Y280 PolarHBondContact O-N 2.9Å; V277-F281 HydrophobicContact CG1-CD2 3.95Å; V277-F281 HydrophobicContact CG1-CE2 3.86Å; V277-F281 VanDerWaalsContact O-CD2 3.31Å; V277-F281 WeakPolarHBondContact O-CD2 3.38Å; V277-F281 PolarHBondContact O-N 3.22Å; V277-L335 HydrophobicContact CG1-CD2 4.15Å; V277-F362 HydrophobicContact CG1-CE1 4.38Å; V277-F362 HydrophobicContact CG1-CZ 4.14Å
278	A	96.9	Very high	93.6	Very high	7 Å²	7	56.7 Å²	56.7	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-59.9	-46.9	177.9	0	0	0	0	0	111.7	L274 R275 Y280 F281 Q282 T361 F362	L274-A278 WeakPolarHBondContact O-CB 3.37Å; L274-A278 PolarHBondContact O-N 3.07Å; R275-A278 WeakPolarHBondContact O-CB 3.42Å; R275-A278 PolarHBondContact O-N 3.19Å; A278-Y280 VanDerWaalsContact C-N 3.29Å; A278-Y280 PolarHBondContact O-N 3.3Å; A278-F281 PolarHBondContact O-N 3.08Å; A278-F281 VanDerWaalsContact O-N 3.17Å; A278-Q282 WeakPolarHBondContact O-CB 3.46Å; A278-Q282 VanDerWaalsContact O-CG 3.25Å; A278-Q282 WeakPolarHBondContact O-CG 3.23Å; A278-Q282 PolarHBondContact O-N 3.48Å; A278-T361 HydrophobicContact CB-CG2 3.44Å; A278-T361 VanDerWaalsContact CB-CG2 3.44Å; A278-F362 HydrophobicContact CB-CE1 4.34Å; A278-F362 HydrophobicContact CB-CZ 4.4Å
279	E	96.8	Very high	94	Very high	75 Å²	75	55.8 Å²	55.8	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-58.6	-38.9	177.4	-76.6	-176.8	-148.9	0	0	112.5	R275 R283	R275-E279 WeakPolarHBondContact O-CG 3.19Å; R275-E279 PolarHBondContact O-N 3.44Å; E279-R283 WeakPolarHBondContact O-CB 3.24Å; E279-R283 WeakPolarHBondContact O-CG 3.27Å; E279-R283 PolarHBondContact O-N 3.13Å; E279-R283 IonicContact OE2-CZ 2.76Å; E279-R283 IonicContact OE2-NH2 3.41Å; E279-R283 PolarHBondContact OE2-NH2 3.19Å
280	Y	96.6	Very high	94.2	Very high	33 Å²	33	54.8 Å²	54.8	13%	0.129	25%	0.245	C	C	.	.	H	α-helix	trans	-58.1	-51.3	174.8	172.9	-105.3	0	0	0	111.9	M241 P242 W244 V245 T276 V277 A278 R283 R328	M241-Y280 HydrophobicContact CG-CE1 4Å; M241-Y280 HydrophobicContact SD-CE1 4.09Å; P242-Y280 HydrophobicContact CG-CE2 4.06Å; W244-Y280 HydrophobicContact CH2-CD2 4.05Å; W244-Y280 HydrophobicContact CH2-CG 4.2Å; W244-Y280 HydrophobicContact CZ2-CD2 4Å; V245-Y280 HydrophobicContact CG1-CD1 3.78Å; V245-Y280 HydrophobicContact CG1-CE1 4.1Å; V245-Y280 HydrophobicContact CG1-CG 4.24Å; V245-Y280 HydrophobicContact CG2-CD1 3.9Å; V245-Y280 HydrophobicContact CG2-CD2 3.64Å; V245-Y280 HydrophobicContact CG2-CE1 4.19Å; V245-Y280 HydrophobicContact CG2-CE2 3.96Å; V245-Y280 HydrophobicContact CG2-CG 3.61Å; T276-Y280 PolarHBondContact O-N 3.34Å; V277-Y280 WeakPolarHBondContact O-CB 3.4Å; V277-Y280 PolarHBondContact O-N 2.9Å; A278-Y280 VanDerWaalsContact C-N 3.29Å; A278-Y280 PolarHBondContact O-N 3.3Å; Y280-R283 PolarHBondContact O-N 3.03Å; Y280-R328 PolarHBondContact OH-NE 2.9Å
281	F	96.3	Very high	94.3	Very high	1 Å²	1	57.9 Å²	57.9	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-71.7	-33.1	-176.7	-78.1	-76.7	0	0	0	112.5	M241 M249 V277 A278 R283 L284 L288 R328 L332 F362 C365	M241-F281 HydrophobicContact SD-CE1 4.38Å; M241-F281 HydrophobicContact SD-CZ 3.75Å; M249-F281 HydrophobicContact CE-CE2 4.49Å; M249-F281 HydrophobicContact CE-CZ 4.5Å; M249-F281 HydrophobicContact SD-CE2 4.33Å; M249-F281 HydrophobicContact SD-CZ 4.44Å; V277-F281 HydrophobicContact CG1-CD2 3.95Å; V277-F281 HydrophobicContact CG1-CE2 3.86Å; V277-F281 VanDerWaalsContact O-CD2 3.31Å; V277-F281 WeakPolarHBondContact O-CD2 3.38Å; V277-F281 PolarHBondContact O-N 3.22Å; A278-F281 PolarHBondContact O-N 3.08Å; A278-F281 VanDerWaalsContact O-N 3.17Å; F281-R283 VanDerWaalsContact C-N 3.34Å; F281-L284 HydrophobicContact CD1-CD1 3.8Å; F281-L284 WeakPolarHBondContact O-CB 3.28Å; F281-L284 WeakPolarHBondContact O-CG 3.38Å; F281-L284 PolarHBondContact O-N 2.68Å; F281-L288 HydrophobicContact CD1-CD1 4.09Å; F281-L288 HydrophobicContact CD1-CD2 4.47Å; F281-L288 HydrophobicContact CE1-CD1 4.01Å; F281-L288 HydrophobicContact CE1-CD2 4.4Å; F281-R328 HydrophobicContact CE1-CB 4.25Å; F281-L332 HydrophobicContact CD1-CD2 4.06Å; F281-L332 HydrophobicContact CD2-CD1 4.21Å; F281-L332 HydrophobicContact CD2-CD2 4.5Å; F281-L332 HydrophobicContact CE1-CB 4.4Å; F281-L332 HydrophobicContact CE1-CD2 4.03Å; F281-L332 HydrophobicContact CE2-CD1 3.91Å; F281-L332 HydrophobicContact CE2-CD2 4.48Å; F281-L332 HydrophobicContact CG-CD2 4.31Å; F281-L332 HydrophobicContact CZ-CB 4.09Å; F281-L332 HydrophobicContact CZ-CD1 4.22Å; F281-L332 HydrophobicContact CZ-CD2 4.25Å; F281-L332 HydrophobicContact CZ-CG 4.42Å; F281-F362 HydrophobicContact CB-CD1 4.28Å; F281-F362 HydrophobicContact CB-CE1 4.28Å; F281-F362 HydrophobicContact CD2-CD1 4.41Å; F281-F362 AromaticContact CD2-CE1 3.88Å; F281-F362 HydrophobicContact CD2-CE1 3.88Å; F281-F362 HydrophobicContact CG-CD1 4.49Å; F281-F362 HydrophobicContact CG-CE1 4.35Å; F281-C365 HydrophobicContact CB-CB 4.14Å; F281-C365 WeakPolarHBondContact O-CB 3.19Å
282	Q	93.8	Very high	94.1	Very high	114 Å²	114	59.6 Å²	59.6	53%	0.533	27%	0.27	S	S	.	.	H	α-helix	trans	-71.5	-26.8	176.4	-71.2	171.1	-1.8	0	0	112.9	A278 L284 T361	A278-Q282 WeakPolarHBondContact O-CB 3.46Å; A278-Q282 VanDerWaalsContact O-CG 3.25Å; A278-Q282 WeakPolarHBondContact O-CG 3.23Å; A278-Q282 PolarHBondContact O-N 3.48Å; Q282-L284 VanDerWaalsContact C-N 3.27Å; Q282-L284 PolarHBondContact O-N 3.28Å; Q282-T361 PolarHBondContact NE2-O 3.42Å
283	R	94.3	Very high	94	Very high	189 Å²	189	57.4 Å²	57.4	71%	0.713	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.1	175.1	-71.9	175.2	-167.3	-156.5	11.2	113.8	E279 Y280 F281 K285	E279-R283 WeakPolarHBondContact O-CB 3.24Å; E279-R283 WeakPolarHBondContact O-CG 3.27Å; E279-R283 PolarHBondContact O-N 3.13Å; E279-R283 IonicContact OE2-CZ 2.76Å; E279-R283 IonicContact OE2-NH2 3.41Å; E279-R283 PolarHBondContact OE2-NH2 3.19Å; Y280-R283 PolarHBondContact O-N 3.03Å; F281-R283 VanDerWaalsContact C-N 3.34Å; R283-K285 PolarHBondContact O-N 3.05Å
284	L	92.7	Very high	93.9	Very high	52 Å²	52	57.6 Å²	57.6	27%	0.272	26%	0.257	S	S	.	.			trans	-66.1	134.2	175.1	-63.7	176.4	0	0	0	109.7	F281 Q282 E286 L288	F281-L284 HydrophobicContact CD1-CD1 3.8Å; F281-L284 WeakPolarHBondContact O-CB 3.28Å; F281-L284 WeakPolarHBondContact O-CG 3.38Å; F281-L284 PolarHBondContact O-N 2.68Å; Q282-L284 VanDerWaalsContact C-N 3.27Å; Q282-L284 PolarHBondContact O-N 3.28Å; L284-E286 PolarHBondContact O-N 3.25Å; L284-L288 HydrophobicContact CD1-CD2 3.86Å
285	K	89.1	Confident	93.6	Very high	209 Å²	209	61.2 Å²	61.2	91%	0.909	27%	0.274	S	S	*	.	S	Bend	trans	-68.5	-20.4	-179.6	-64.7	-175.5	177.6	-176.2	0	113.5	R283	R283-K285 PolarHBondContact O-N 3.05Å
286	E	91.6	Very high	93.4	Very high	69 Å²	69	54 Å²	54	32%	0.322	25%	0.247	S	C	.	.	S	Bend	trans	-138.1	142.8	-176.3	-171.2	-179.8	-162.5	0	0	109.2	L284 T290 F291	L284-E286 PolarHBondContact O-N 3.25Å; E286-T290 VanDerWaalsContact OE1-CA 3.25Å; E286-T290 WeakPolarHBondContact OE1-CA 3.28Å; E286-T290 WeakPolarHBondContact OE1-CB 3.3Å; E286-F291 HydrophobicContact CB-CE2 4.21Å; E286-F291 HydrophobicContact CG-CD2 3.68Å; E286-F291 HydrophobicContact CG-CE2 3.84Å; E286-F291 HydrophobicContact CG-CG 4.37Å; E286-F291 PolarHBondContact OE1-N 3.24Å
287	P	94.1	Very high	93.1	Very high	8 Å²	8	51.2 Å²	51.2	5%	0.052	23%	0.229	C	C	.	.			trans	-60.6	153.4	172.2	25.6	-35.7	0	0	0	111.7	L289 T290 F291 C365	P287-L289 PolarHBondContact O-N 3.41Å; P287-T290 WeakPolarHBondContact O-CA 3.44Å; P287-T290 PolarHBondContact O-N 3.24Å; P287-F291 HydrophobicContact CG-CD1 3.75Å; P287-F291 HydrophobicContact CG-CE1 3.66Å; P287-F291 HydrophobicContact CG-CG 4.3Å; P287-F291 HydrophobicContact CG-CZ 4.14Å; P287-C365 CarbonylContact C-O 3.23Å; P287-C365 VanDerWaalsContact CA-O 3.28Å; P287-C365 WeakPolarHBondContact CA-O 3.38Å
288	L	95.8	Very high	92.7	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.01	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.5	-179.3	-64.9	177.3	0	0	0	112.5	F281 L284 T290 N325 R328 L329 L332 C365 I366	F281-L288 HydrophobicContact CD1-CD1 4.09Å; F281-L288 HydrophobicContact CD1-CD2 4.47Å; F281-L288 HydrophobicContact CE1-CD1 4.01Å; F281-L288 HydrophobicContact CE1-CD2 4.4Å; L284-L288 HydrophobicContact CD1-CD2 3.86Å; L288-T290 VanDerWaalsContact C-N 3.26Å; L288-N325 WeakPolarHBondContact O-CB 3.45Å; L288-R328 HydrophobicContact CD2-CB 3.65Å; L288-R328 HydrophobicContact CD2-CG 4.44Å; L288-L329 HydrophobicContact CB-CB 4.41Å; L288-L329 HydrophobicContact CB-CD1 4.31Å; L288-L329 HydrophobicContact CD1-CB 4.29Å; L288-L329 HydrophobicContact CD1-CD1 4.12Å; L288-L332 HydrophobicContact CD1-CD2 3.74Å; L288-C365 WeakPolarHBondContact CG-O 3.27Å; L288-C365 PolarHBondContact N-O 2.81Å; L288-I366 HydrophobicContact CD1-CG1 4.19Å
289	L	94.9	Very high	92.4	Very high	1 Å²	1	55 Å²	55	1%	0.005	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	0.3	174.8	-63.1	-178.8	0	0	0	114	P287 F297 L321 L329 I366 L367 L383 M387	P287-L289 PolarHBondContact O-N 3.41Å; L289-F297 HydrophobicContact CB-CD2 3.84Å; L289-F297 HydrophobicContact CB-CE2 3.8Å; L289-F297 HydrophobicContact CB-CZ 4.43Å; L289-F297 HydrophobicContact CD1-CB 4.42Å; L289-F297 HydrophobicContact CD1-CD1 3.93Å; L289-F297 HydrophobicContact CD1-CD2 4.04Å; L289-F297 HydrophobicContact CD1-CE1 4.21Å; L289-F297 HydrophobicContact CD1-CE2 4.33Å; L289-F297 HydrophobicContact CD1-CG 3.86Å; L289-F297 HydrophobicContact CD1-CZ 4.43Å; L289-F297 HydrophobicContact CD2-CD1 4.44Å; L289-F297 HydrophobicContact CD2-CD2 4.4Å; L289-F297 HydrophobicContact CD2-CE1 3.88Å; L289-F297 HydrophobicContact CD2-CE2 3.86Å; L289-F297 HydrophobicContact CD2-CZ 3.59Å; L289-F297 HydrophobicContact CG-CD2 4.31Å; L289-F297 HydrophobicContact CG-CE2 4.2Å; L289-F297 HydrophobicContact CG-CZ 4.35Å; L289-L321 HydrophobicContact CD2-CD1 4Å; L289-L321 HydrophobicContact CD2-CD2 4.36Å; L289-L329 HydrophobicContact CD2-CD2 3.54Å; L289-I366 VanDerWaalsContact CB-O 3.24Å; L289-I366 WeakPolarHBondContact CB-O 3.44Å; L289-I366 HydrophobicContact CD1-CG2 3.87Å; L289-I366 HydrophobicContact CG-CG2 4.02Å; L289-I366 WeakPolarHBondContact CG-O 3.41Å; L289-I366 PolarHBondContact N-O 3.39Å; L289-L367 HydrophobicContact CB-CD1 4.41Å; L289-L367 HydrophobicContact CD1-CB 4.22Å; L289-L367 HydrophobicContact CD1-CD1 3.86Å; L289-L383 HydrophobicContact CD1-CD2 4.48Å; L289-M387 HydrophobicContact CD1-SD 4.34Å; L289-M387 HydrophobicContact CD2-CE 4.36Å
290	T	93.6	Very high	92.1	Very high	7 Å²	7	51.4 Å²	51.4	4%	0.043	23%	0.233	C	C	.	.			trans	63.5	150.6	-176.8	71.9	0	0	0	0	113.8	E286 P287 L288 Q292 L293 L321 P322	E286-T290 VanDerWaalsContact OE1-CA 3.25Å; E286-T290 WeakPolarHBondContact OE1-CA 3.28Å; E286-T290 WeakPolarHBondContact OE1-CB 3.3Å; P287-T290 WeakPolarHBondContact O-CA 3.44Å; P287-T290 PolarHBondContact O-N 3.24Å; L288-T290 VanDerWaalsContact C-N 3.26Å; T290-Q292 VanDerWaalsContact C-N 3.3Å; T290-Q292 PolarHBondContact O-N 2.84Å; T290-L293 WeakPolarHBondContact OG1-CG 3.47Å; T290-L321 HydrophobicContact CG2-CD2 4.29Å; T290-P322 HydrophobicContact CG2-CG 4.15Å
291	F	91.3	Very high	91.6	Very high	78 Å²	78	50.8 Å²	50.8	34%	0.342	23%	0.232	S	C	.	.	S	Bend	trans	-68.7	-33.5	176.2	-65.4	-58.5	0	0	0	111.7	E286 P287 L293 Y294 G368 S369 A370	E286-F291 HydrophobicContact CB-CE2 4.21Å; E286-F291 HydrophobicContact CG-CD2 3.68Å; E286-F291 HydrophobicContact CG-CE2 3.84Å; E286-F291 HydrophobicContact CG-CG 4.37Å; E286-F291 PolarHBondContact OE1-N 3.24Å; P287-F291 HydrophobicContact CG-CD1 3.75Å; P287-F291 HydrophobicContact CG-CE1 3.66Å; P287-F291 HydrophobicContact CG-CG 4.3Å; P287-F291 HydrophobicContact CG-CZ 4.14Å; F291-L293 VanDerWaalsContact C-N 3.27Å; F291-L293 PolarHBondContact O-N 3.25Å; F291-Y294 VanDerWaalsContact O-CB 3.24Å; F291-Y294 WeakPolarHBondContact O-CB 3.43Å; F291-Y294 PolarHBondContact O-N 3.22Å; F291-G368 WeakPolarHBondContact CD1-O 3.49Å; F291-S369 WeakPolarHBondContact CE1-O 3.49Å; F291-A370 HydrophobicContact CB-CB 4.36Å; F291-A370 HydrophobicContact CD1-CB 4.02Å; F291-A370 HydrophobicContact CE1-CB 4.47Å; F291-A370 HydrophobicContact CG-CB 4.12Å
292	Q	89.5	Confident	91.1	Very high	114 Å²	114	55.1 Å²	55.1	53%	0.533	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-26.6	-175.7	-64.5	169.1	11.7	0	0	113.7	T290	T290-Q292 VanDerWaalsContact C-N 3.3Å; T290-Q292 PolarHBondContact O-N 2.84Å
293	L	91	Very high	90.9	Very high	11 Å²	11	50.8 Å²	50.8	6%	0.058	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	5.2	-179.5	-56.9	175	0	0	0	112.3	L209 T290 F291 E295 V296 F297 L320 L321	L209-L293 HydrophobicContact CD1-CD2 3.43Å; L209-L293 VanDerWaalsContact CD1-CD2 3.43Å; T290-L293 WeakPolarHBondContact OG1-CG 3.47Å; F291-L293 VanDerWaalsContact C-N 3.27Å; F291-L293 PolarHBondContact O-N 3.25Å; L293-E295 PolarHBondContact O-N 3.46Å; L293-V296 HydrophobicContact CD2-CG2 4.35Å; L293-V296 WeakPolarHBondContact O-CB 3.48Å; L293-V296 PolarHBondContact O-N 3.42Å; L293-F297 HydrophobicContact CB-CD2 3.99Å; L293-F297 HydrophobicContact CB-CE2 3.75Å; L293-F297 HydrophobicContact CD1-CE2 4.3Å; L293-F297 WeakPolarHBondContact O-CD2 3.42Å; L293-F297 PolarHBondContact O-N 3.39Å; L293-F297 VanDerWaalsContact O-N 3.15Å; L293-L320 HydrophobicContact CD1-CB 3.92Å; L293-L320 HydrophobicContact CD2-CB 4.37Å; L293-L320 HydrophobicContact CD2-CD1 4.18Å; L293-L321 HydrophobicContact CD1-CD2 3.75Å; L293-L321 HydrophobicContact CD1-CG 4.41Å
294	Y	90.2	Very high	90.6	Very high	19 Å²	19	42.7 Å²	42.7	8%	0.075	21%	0.213	C	C	.	.	H	α-helix	trans	-51.3	-53.5	-177.4	176.6	-104.3	0	0	0	111.7	F291 V296 F297 V298 L367 G368 D374 L375	F291-Y294 VanDerWaalsContact O-CB 3.24Å; F291-Y294 WeakPolarHBondContact O-CB 3.43Å; F291-Y294 PolarHBondContact O-N 3.22Å; Y294-V296 VanDerWaalsContact C-N 3.26Å; Y294-V296 PolarHBondContact O-N 2.88Å; Y294-F297 PolarHBondContact O-N 3.16Å; Y294-V298 HydrophobicContact CD1-CG2 4.08Å; Y294-V298 HydrophobicContact CD2-CG2 4.26Å; Y294-V298 HydrophobicContact CE1-CG2 3.66Å; Y294-V298 HydrophobicContact CE2-CG2 3.82Å; Y294-V298 HydrophobicContact CG-CG2 4.37Å; Y294-V298 WeakPolarHBondContact O-CG2 3.37Å; Y294-V298 PolarHBondContact O-N 3.47Å; Y294-L367 HydrophobicContact CD2-CD1 3.77Å; Y294-L367 HydrophobicContact CD2-CG 4.11Å; Y294-L367 HydrophobicContact CE2-CD1 4.13Å; Y294-L367 HydrophobicContact CE2-CD2 4.31Å; Y294-L367 HydrophobicContact CE2-CG 4Å; Y294-G368 WeakPolarHBondContact CD2-O 3.38Å; Y294-D374 PolarHBondContact OH-O 3.07Å; Y294-L375 HydrophobicContact CE2-CD1 3.84Å
295	E	88.8	Confident	90.3	Very high	85 Å²	85	49 Å²	49	40%	0.397	24%	0.242	S	C	.	.	H	α-helix	trans	-55.7	-39.3	178.5	-70.1	-56.6	142	0	0	112.8	L293 F297 V298 N299	L293-E295 PolarHBondContact O-N 3.46Å; E295-F297 PolarHBondContact O-N 3.46Å; E295-V298 PolarHBondContact O-N 3.06Å; E295-N299 PolarHBondContact O-N 3.24Å; E295-N299 PolarHBondContact O-ND2 3.05Å
296	V	90.9	Very high	90.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.3	-46.3	177.8	-169.8	0	0	0	0	110.7	L196 L200 V208 L209 L293 Y294 N299 I300 C317	L196-V296 HydrophobicContact CD1-CG1 4.39Å; L196-V296 HydrophobicContact CD2-CG1 3.85Å; L200-V296 HydrophobicContact CD1-CG1 4.35Å; V208-V296 HydrophobicContact CG1-CB 4.45Å; V208-V296 HydrophobicContact CG1-CG2 4.07Å; V208-V296 VanDerWaalsContact O-CG2 3.26Å; V208-V296 WeakPolarHBondContact O-CG2 3.45Å; L209-V296 HydrophobicContact CB-CG2 3.99Å; L209-V296 HydrophobicContact CD1-CG2 4.08Å; L209-V296 HydrophobicContact CG-CG2 4.49Å; L293-V296 HydrophobicContact CD2-CG2 4.35Å; L293-V296 WeakPolarHBondContact O-CB 3.48Å; L293-V296 PolarHBondContact O-N 3.42Å; Y294-V296 VanDerWaalsContact C-N 3.26Å; Y294-V296 PolarHBondContact O-N 2.88Å; V296-N299 PolarHBondContact O-N 3.41Å; V296-I300 WeakPolarHBondContact O-CG1 3.49Å; V296-I300 PolarHBondContact O-N 3.13Å; V296-C317 WeakPolarHBondContact CG1-SG 3.28Å
297	F	91.2	Very high	90.3	Very high	1 Å²	1	46.4 Å²	46.4	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-71.1	-32.9	-180	-73.5	-72.3	0	0	0	112.7	L289 L293 Y294 E295 I300 L301 L314 C317 L321 L367 L383	L289-F297 HydrophobicContact CB-CD2 3.84Å; L289-F297 HydrophobicContact CB-CE2 3.8Å; L289-F297 HydrophobicContact CB-CZ 4.43Å; L289-F297 HydrophobicContact CD1-CB 4.42Å; L289-F297 HydrophobicContact CD1-CD1 3.93Å; L289-F297 HydrophobicContact CD1-CD2 4.04Å; L289-F297 HydrophobicContact CD1-CE1 4.21Å; L289-F297 HydrophobicContact CD1-CE2 4.33Å; L289-F297 HydrophobicContact CD1-CG 3.86Å; L289-F297 HydrophobicContact CD1-CZ 4.43Å; L289-F297 HydrophobicContact CD2-CD1 4.44Å; L289-F297 HydrophobicContact CD2-CD2 4.4Å; L289-F297 HydrophobicContact CD2-CE1 3.88Å; L289-F297 HydrophobicContact CD2-CE2 3.86Å; L289-F297 HydrophobicContact CD2-CZ 3.59Å; L289-F297 HydrophobicContact CG-CD2 4.31Å; L289-F297 HydrophobicContact CG-CE2 4.2Å; L289-F297 HydrophobicContact CG-CZ 4.35Å; L293-F297 HydrophobicContact CB-CD2 3.99Å; L293-F297 HydrophobicContact CB-CE2 3.75Å; L293-F297 HydrophobicContact CD1-CE2 4.3Å; L293-F297 WeakPolarHBondContact O-CD2 3.42Å; L293-F297 PolarHBondContact O-N 3.39Å; L293-F297 VanDerWaalsContact O-N 3.15Å; Y294-F297 PolarHBondContact O-N 3.16Å; E295-F297 PolarHBondContact O-N 3.46Å; F297-I300 HydrophobicContact CD1-CD1 4.11Å; F297-I300 HydrophobicContact CE1-CD1 4.48Å; F297-I300 WeakPolarHBondContact O-CB 3.43Å; F297-I300 PolarHBondContact O-N 3.35Å; F297-L301 PolarHBondContact O-N 2.92Å; F297-L314 HydrophobicContact CD1-CD2 3.86Å; F297-L314 HydrophobicContact CE1-CD2 3.83Å; F297-C317 HydrophobicContact CE1-CB 3.81Å; F297-C317 HydrophobicContact CZ-CB 3.73Å; F297-L321 HydrophobicContact CE2-CD2 4.41Å; F297-L367 HydrophobicContact CB-CD1 3.89Å; F297-L383 HydrophobicContact CB-CD2 3.93Å; F297-L383 HydrophobicContact CD1-CD2 4.39Å
298	V	88.4	Confident	90.1	Very high	41 Å²	41	53.5 Å²	53.5	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-42.1	171.4	172.9	0	0	0	0	110.7	Y294 E295 I300 L301	Y294-V298 HydrophobicContact CD1-CG2 4.08Å; Y294-V298 HydrophobicContact CD2-CG2 4.26Å; Y294-V298 HydrophobicContact CE1-CG2 3.66Å; Y294-V298 HydrophobicContact CE2-CG2 3.82Å; Y294-V298 HydrophobicContact CG-CG2 4.37Å; Y294-V298 WeakPolarHBondContact O-CG2 3.37Å; Y294-V298 PolarHBondContact O-N 3.47Å; E295-V298 PolarHBondContact O-N 3.06Å; V298-I300 VanDerWaalsContact C-N 3.26Å; V298-I300 PolarHBondContact O-N 3Å; V298-L301 HydrophobicContact CG1-CD1 4.3Å; V298-L301 WeakPolarHBondContact O-CB 3.46Å; V298-L301 PolarHBondContact O-N 3.01Å
299	N	88.9	Confident	89.9	Confident	46 Å²	46	55.2 Å²	55.2	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-33.3	176.5	-83.9	-81.4	0	0	0	112.6	E295 V296 L301 S302	E295-N299 PolarHBondContact O-N 3.24Å; E295-N299 PolarHBondContact O-ND2 3.05Å; V296-N299 PolarHBondContact O-N 3.41Å; N299-L301 PolarHBondContact O-N 3.4Å; N299-S302 WeakPolarHBondContact O-CB 3.25Å; N299-S302 PolarHBondContact O-N 3.4Å; N299-S302 PolarHBondContact O-OG 3.35Å
300	I	91.1	Very high	89.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-26.8	175	-66.9	172.8	0	0	0	112.2	L200 V296 F297 V298 S302 L303 L304 A313 L314 C317 L383	L200-I300 HydrophobicContact CD2-CG1 3.81Å; V296-I300 WeakPolarHBondContact O-CG1 3.49Å; V296-I300 PolarHBondContact O-N 3.13Å; F297-I300 HydrophobicContact CD1-CD1 4.11Å; F297-I300 HydrophobicContact CE1-CD1 4.48Å; F297-I300 WeakPolarHBondContact O-CB 3.43Å; F297-I300 PolarHBondContact O-N 3.35Å; V298-I300 VanDerWaalsContact C-N 3.26Å; V298-I300 PolarHBondContact O-N 3Å; I300-S302 PolarHBondContact O-N 3.47Å; I300-S302 VanDerWaalsContact O-N 3.16Å; I300-L303 WeakPolarHBondContact O-CA 3.37Å; I300-L303 WeakPolarHBondContact O-CB 3.39Å; I300-L303 PolarHBondContact O-N 3.48Å; I300-L304 PolarHBondContact O-N 2.91Å; I300-A313 HydrophobicContact CD1-CB 3.85Å; I300-A313 HydrophobicContact CG1-CB 3.82Å; I300-A313 HydrophobicContact CG2-CB 4.45Å; I300-L314 HydrophobicContact CD1-CD2 3.9Å; I300-L314 HydrophobicContact CD1-CG 4.25Å; I300-L314 HydrophobicContact CG2-CD2 4.14Å; I300-L314 HydrophobicContact CG2-CG 4.02Å; I300-C317 HydrophobicContact CD1-CB 4.29Å; I300-L383 HydrophobicContact CG2-CD1 4.32Å
301	L	87.5	Confident	89.9	Confident	20 Å²	20	55.2 Å²	55.2	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-55.9	-35	177.2	-71.7	166.8	0	0	0	112.7	F297 V298 N299 L303 L304 L379 L383	F297-L301 PolarHBondContact O-N 2.92Å; V298-L301 HydrophobicContact CG1-CD1 4.3Å; V298-L301 WeakPolarHBondContact O-CB 3.46Å; V298-L301 PolarHBondContact O-N 3.01Å; N299-L301 PolarHBondContact O-N 3.4Å; L301-L303 PolarHBondContact O-N 2.71Å; L301-L304 HydrophobicContact CD2-CD1 3.7Å; L301-L304 WeakPolarHBondContact O-CG 3.5Å; L301-L304 PolarHBondContact O-N 3.03Å; L301-L379 HydrophobicContact CD1-CB 3.73Å; L301-L379 HydrophobicContact CD1-CD1 4.26Å; L301-L379 HydrophobicContact CD1-CD2 4.42Å; L301-L379 HydrophobicContact CD1-CG 4.36Å; L301-L379 WeakPolarHBondContact CD2-O 3.26Å; L301-L383 HydrophobicContact CD2-CB 3.63Å; L301-L383 HydrophobicContact CD2-CD1 4.29Å; L301-L383 HydrophobicContact CD2-CG 4.45Å
302	S	85.3	Confident	90	Very high	91 Å²	91	53.9 Å²	53.9	64%	0.636	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.8	177.4	73.4	0	0	0	0	112.8	N299 I300	N299-S302 WeakPolarHBondContact O-CB 3.25Å; N299-S302 PolarHBondContact O-N 3.4Å; N299-S302 PolarHBondContact O-OG 3.35Å; I300-S302 PolarHBondContact O-N 3.47Å; I300-S302 VanDerWaalsContact O-N 3.16Å
303	L	88.4	Confident	90.3	Very high	24 Å²	24	48.5 Å²	48.5	13%	0.126	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-6.4	-177.3	-56	177.6	0	0	0	113.3	L200 I300 L301 Q305 Q306 V309 A310 A313	L200-L303 HydrophobicContact CD2-CD1 3.74Å; I300-L303 WeakPolarHBondContact O-CA 3.37Å; I300-L303 WeakPolarHBondContact O-CB 3.39Å; I300-L303 PolarHBondContact O-N 3.48Å; L301-L303 PolarHBondContact O-N 2.71Å; L303-Q305 PolarHBondContact O-N 2.8Å; L303-Q306 CarbonylContact O-C 3.53Å; L303-Q306 WeakPolarHBondContact O-CA 3.47Å; L303-Q306 PolarHBondContact O-N 2.61Å; L303-V309 HydrophobicContact CD1-CG1 4.31Å; L303-A310 HydrophobicContact CB-CB 4.25Å; L303-A313 HydrophobicContact CD1-CB 4.36Å
304	L	88.1	Confident	90.5	Very high	19 Å²	19	48 Å²	48	10%	0.099	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.3	-175.5	-67.4	-176.8	0	0	0	114.3	I300 L301 Q306 A310 K382 L383 F386	I300-L304 PolarHBondContact O-N 2.91Å; L301-L304 HydrophobicContact CD2-CD1 3.7Å; L301-L304 WeakPolarHBondContact O-CG 3.5Å; L301-L304 PolarHBondContact O-N 3.03Å; L304-Q306 VanDerWaalsContact C-N 3.25Å; L304-Q306 PolarHBondContact O-N 2.86Å; L304-A310 HydrophobicContact CD2-CB 4.19Å; L304-K382 HydrophobicContact CD1-CD 4.18Å; L304-K382 HydrophobicContact CD1-CG 3.93Å; L304-L383 HydrophobicContact CD2-CD1 4.19Å; L304-F386 HydrophobicContact CD2-CB 3.98Å; L304-F386 HydrophobicContact CD2-CD1 3.62Å; L304-F386 HydrophobicContact CD2-CD2 3.99Å; L304-F386 HydrophobicContact CD2-CE1 4.06Å; L304-F386 HydrophobicContact CD2-CE2 4.38Å; L304-F386 HydrophobicContact CD2-CG 3.58Å; L304-F386 HydrophobicContact CD2-CZ 4.43Å
305	Q	86.7	Confident	90.7	Very high	185 Å²	185	48.8 Å²	48.8	86%	0.864	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-28.3	172.3	-64.5	-172.6	-3.3	0	0	112.4	L303	L303-Q305 PolarHBondContact O-N 2.8Å
306	Q	90.4	Very high	91	Very high	100 Å²	100	44.8 Å²	44.8	47%	0.467	23%	0.227	S	C	.	.	S	Bend	trans	-105.3	84.7	178.9	-63.2	178.2	31.1	0	0	109.2	L303 L304 E308 V309 A310	L303-Q306 CarbonylContact O-C 3.53Å; L303-Q306 WeakPolarHBondContact O-CA 3.47Å; L303-Q306 PolarHBondContact O-N 2.61Å; L304-Q306 VanDerWaalsContact C-N 3.25Å; L304-Q306 PolarHBondContact O-N 2.86Å; Q306-E308 VanDerWaalsContact C-N 3.29Å; Q306-E308 PolarHBondContact O-N 3.12Å; Q306-E308 VanDerWaalsContact O-N 3.15Å; Q306-V309 HydrophobicContact CB-CB 4.08Å; Q306-V309 HydrophobicContact CB-CG2 4.1Å; Q306-V309 PolarHBondContact O-N 2.67Å; Q306-V309 VanDerWaalsContact O-N 3.07Å; Q306-A310 PolarHBondContact O-N 2.89Å
307	K	90.1	Very high	91.2	Very high	122 Å²	122	44.8 Å²	44.8	53%	0.53	23%	0.227	S	C	.	.	H	α-helix	trans	-49.8	-45.1	-171.8	-60.5	-169.5	177.6	-172.8	0	113.8	A311 F386	K307-A311 VanDerWaalsContact O-CB 3.26Å; K307-A311 WeakPolarHBondContact O-CB 3.27Å; K307-A311 PolarHBondContact O-N 3.05Å; K307-F386 HydrophobicContact CB-CE2 4.43Å; K307-F386 HydrophobicContact CG-CE2 4.22Å
308	E	90.6	Very high	91.3	Very high	157 Å²	157	44.8 Å²	44.8	73%	0.734	23%	0.227	S	C	*	.	H	α-helix	trans	-66	-43.6	-178.9	-60.8	-54.2	145.3	0	0	112.5	Q306 A311 E312	Q306-E308 VanDerWaalsContact C-N 3.29Å; Q306-E308 PolarHBondContact O-N 3.12Å; Q306-E308 VanDerWaalsContact O-N 3.15Å; E308-A311 PolarHBondContact O-N 2.83Å; E308-E312 WeakPolarHBondContact O-CB 3.37Å; E308-E312 PolarHBondContact O-N 3.25Å
309	V	91.6	Very high	91.7	Very high	38 Å²	38	42.8 Å²	42.8	23%	0.23	22%	0.215	C	C	.	.	H	α-helix	trans	-70.2	-40.7	-180	-174.7	0	0	0	0	110.5	V199 L303 Q306 A311 E312 A313	V199-V309 HydrophobicContact CG1-CG1 3.92Å; L303-V309 HydrophobicContact CD1-CG1 4.31Å; Q306-V309 HydrophobicContact CB-CB 4.08Å; Q306-V309 HydrophobicContact CB-CG2 4.1Å; Q306-V309 PolarHBondContact O-N 2.67Å; Q306-V309 VanDerWaalsContact O-N 3.07Å; V309-A311 VanDerWaalsContact C-N 3.35Å; V309-E312 PolarHBondContact O-N 3.31Å; V309-A313 WeakPolarHBondContact O-CB 3.28Å; V309-A313 PolarHBondContact O-N 2.95Å
310	A	93.6	Very high	92	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-41.4	173.6	0	0	0	0	0	111.9	L303 L304 Q306 A313 L314 F386	L303-A310 HydrophobicContact CB-CB 4.25Å; L304-A310 HydrophobicContact CD2-CB 4.19Å; Q306-A310 PolarHBondContact O-N 2.89Å; A310-A313 PolarHBondContact O-N 3.34Å; A310-L314 WeakPolarHBondContact O-CB 3.41Å; A310-L314 VanDerWaalsContact O-CG 3.31Å; A310-L314 WeakPolarHBondContact O-CG 3.49Å; A310-L314 PolarHBondContact O-N 2.86Å; A310-F386 HydrophobicContact CB-CE1 4.02Å; A310-F386 HydrophobicContact CB-CZ 3.92Å
311	A	94	Very high	92.2	Very high	8 Å²	8	41.2 Å²	41.2	7%	0.066	21%	0.207	C	C	.	.	H	α-helix	trans	-64.1	-44.9	175.4	0	0	0	0	0	111.6	K307 E308 V309 A313 L314 Q315 V394	K307-A311 VanDerWaalsContact O-CB 3.26Å; K307-A311 WeakPolarHBondContact O-CB 3.27Å; K307-A311 PolarHBondContact O-N 3.05Å; E308-A311 PolarHBondContact O-N 2.83Å; V309-A311 VanDerWaalsContact C-N 3.35Å; A311-A313 VanDerWaalsContact C-N 3.32Å; A311-A313 PolarHBondContact O-N 3Å; A311-L314 PolarHBondContact O-N 2.89Å; A311-Q315 WeakPolarHBondContact O-CB 3.36Å; A311-Q315 WeakPolarHBondContact O-CG 3.46Å; A311-Q315 PolarHBondContact O-N 2.9Å; A311-V394 HydrophobicContact CB-CG1 4.23Å
312	E	93.9	Very high	92.5	Very high	51 Å²	51	41.9 Å²	41.9	24%	0.238	21%	0.212	C	C	.	.	H	α-helix	trans	-59	-43.5	174.5	-170.3	-179	172.7	0	0	111.2	H195 R198 V199 E308 V309 Q315 V316	H195-E312 IonicContact CE1-OE1 3.37Å; H195-E312 IonicContact NE2-OE1 3.19Å; H195-E312 PolarHBondContact NE2-OE1 2.68Å; R198-E312 IonicContact CZ-OE1 3.88Å; R198-E312 IonicContact NH1-OE1 2.96Å; R198-E312 IonicContact NH2-OE1 2.99Å; R198-E312 PolarHBondContact NH2-OE1 2.76Å; V199-E312 HydrophobicContact CG1-CB 4.25Å; V199-E312 HydrophobicContact CG1-CG 4.33Å; V199-E312 HydrophobicContact CG2-CG 3.88Å; V199-E312 WeakPolarHBondContact CG2-OE1 3.49Å; E308-E312 WeakPolarHBondContact O-CB 3.37Å; E308-E312 PolarHBondContact O-N 3.25Å; V309-E312 PolarHBondContact O-N 3.31Å; E312-Q315 PolarHBondContact O-N 3Å; E312-V316 WeakPolarHBondContact O-CG2 3.08Å; E312-V316 PolarHBondContact O-N 2.83Å; E312-V316 VanDerWaalsContact O-N 3.09Å
313	A	94.6	Very high	93	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-47.6	177.8	0	0	0	0	0	111.6	V199 L200 I300 L303 V309 A310 A311 Q315 V316 C317	V199-A313 HydrophobicContact CG1-CB 3.66Å; L200-A313 HydrophobicContact CD2-CB 4.31Å; I300-A313 HydrophobicContact CD1-CB 3.85Å; I300-A313 HydrophobicContact CG1-CB 3.82Å; I300-A313 HydrophobicContact CG2-CB 4.45Å; L303-A313 HydrophobicContact CD1-CB 4.36Å; V309-A313 WeakPolarHBondContact O-CB 3.28Å; V309-A313 PolarHBondContact O-N 2.95Å; A310-A313 PolarHBondContact O-N 3.34Å; A311-A313 VanDerWaalsContact C-N 3.32Å; A311-A313 PolarHBondContact O-N 3Å; A313-Q315 VanDerWaalsContact C-N 3.34Å; A313-Q315 PolarHBondContact O-N 2.95Å; A313-V316 PolarHBondContact O-N 3.21Å; A313-C317 WeakPolarHBondContact O-CB 3.28Å; A313-C317 PolarHBondContact O-N 3.42Å; A313-C317 PolarHBondContact O-SG 2.88Å
314	L	96	Very high	93.3	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.1	-39.6	177.7	-72.8	168.2	0	0	0	112.2	F297 I300 A310 A311 V316 C317 S318 L383 F386 M387 V394	F297-L314 HydrophobicContact CD1-CD2 3.86Å; F297-L314 HydrophobicContact CE1-CD2 3.83Å; I300-L314 HydrophobicContact CD1-CD2 3.9Å; I300-L314 HydrophobicContact CD1-CG 4.25Å; I300-L314 HydrophobicContact CG2-CD2 4.14Å; I300-L314 HydrophobicContact CG2-CG 4.02Å; A310-L314 WeakPolarHBondContact O-CB 3.41Å; A310-L314 VanDerWaalsContact O-CG 3.31Å; A310-L314 WeakPolarHBondContact O-CG 3.49Å; A310-L314 PolarHBondContact O-N 2.86Å; A311-L314 PolarHBondContact O-N 2.89Å; L314-V316 VanDerWaalsContact C-N 3.33Å; L314-V316 PolarHBondContact O-N 3.19Å; L314-C317 PolarHBondContact O-N 3.45Å; L314-S318 VanDerWaalsContact O-CB 3.23Å; L314-S318 WeakPolarHBondContact O-CB 3.31Å; L314-S318 PolarHBondContact O-N 3.29Å; L314-S318 PolarHBondContact O-OG 3.38Å; L314-L383 HydrophobicContact CD2-CD1 4.37Å; L314-F386 HydrophobicContact CD1-CD1 3.83Å; L314-F386 HydrophobicContact CD1-CE1 3.73Å; L314-M387 HydrophobicContact CD1-CG 3.97Å; L314-M387 HydrophobicContact CD2-CE 4.28Å; L314-M387 HydrophobicContact CD2-CG 4.33Å; L314-M387 HydrophobicContact CD2-SD 4.13Å; L314-V394 CarbonylContact C-O 3.57Å; L314-V394 VanDerWaalsContact C-O 3.23Å; L314-V394 HydrophobicContact CB-CB 4.02Å; L314-V394 HydrophobicContact CD1-CB 3.88Å; L314-V394 HydrophobicContact CD1-CG1 3.77Å
315	Q	95.4	Very high	93.7	Very high	36 Å²	36	38 Å²	38	17%	0.168	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-47	176.8	-76	172.4	-1.7	0	0	110.8	A311 E312 A313 S318 S393 V394 R396 P398	A311-Q315 WeakPolarHBondContact O-CB 3.36Å; A311-Q315 WeakPolarHBondContact O-CG 3.46Å; A311-Q315 PolarHBondContact O-N 2.9Å; E312-Q315 PolarHBondContact O-N 3Å; A313-Q315 VanDerWaalsContact C-N 3.34Å; A313-Q315 PolarHBondContact O-N 2.95Å; Q315-S318 PolarHBondContact O-N 3.35Å; Q315-S318 PolarHBondContact O-OG 3.26Å; Q315-S393 VanDerWaalsContact CG-O 3.28Å; Q315-S393 WeakPolarHBondContact CG-O 3.17Å; Q315-S393 PolarHBondContact NE2-O 2.94Å; Q315-V394 WeakPolarHBondContact CA-O 3.23Å; Q315-V394 PolarHBondContact N-O 2.99Å; Q315-V394 VanDerWaalsContact N-O 3.1Å; Q315-R396 WeakPolarHBondContact CB-O 3.42Å; Q315-R396 VanDerWaalsContact CG-O 3.32Å; Q315-R396 WeakPolarHBondContact CG-O 3.05Å; Q315-P398 HydrophobicContact CB-CB 4.43Å; Q315-P398 HydrophobicContact CB-CG 4.43Å
316	V	94.4	Very high	94.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-69.6	-47.4	-178.5	179	0	0	0	0	110.7	T192 H195 L196 E312 A313 L314 S318 L319 P398	T192-V316 HydrophobicContact CG2-CG1 3.92Å; H195-V316 WeakPolarHBondContact CD2-CG2 3.41Å; L196-V316 HydrophobicContact CB-CG1 3.91Å; L196-V316 HydrophobicContact CD1-CG1 4.44Å; E312-V316 WeakPolarHBondContact O-CG2 3.08Å; E312-V316 PolarHBondContact O-N 2.83Å; E312-V316 VanDerWaalsContact O-N 3.09Å; A313-V316 PolarHBondContact O-N 3.21Å; L314-V316 VanDerWaalsContact C-N 3.33Å; L314-V316 PolarHBondContact O-N 3.19Å; V316-S318 VanDerWaalsContact C-N 3.27Å; V316-S318 PolarHBondContact O-N 3.04Å; V316-L319 WeakPolarHBondContact O-CB 3.32Å; V316-L319 PolarHBondContact O-N 3.13Å; V316-P398 HydrophobicContact CG2-CG 4.15Å
317	C	93.9	Very high	94.4	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.007	13%	0.132	C	C	.	.	H	α-helix	trans	-59.8	-37.8	176.2	-70.7	0	0	0	0	112.5	L196 V296 F297 I300 A313 L314 L319 L320	L196-C317 WeakPolarHBondContact CD1-SG 3.27Å; V296-C317 WeakPolarHBondContact CG1-SG 3.28Å; F297-C317 HydrophobicContact CE1-CB 3.81Å; F297-C317 HydrophobicContact CZ-CB 3.73Å; I300-C317 HydrophobicContact CD1-CB 4.29Å; A313-C317 WeakPolarHBondContact O-CB 3.28Å; A313-C317 PolarHBondContact O-N 3.42Å; A313-C317 PolarHBondContact O-SG 2.88Å; L314-C317 PolarHBondContact O-N 3.45Å; C317-L319 PolarHBondContact O-N 3.42Å; C317-L320 VanDerWaalsContact O-CB 3.3Å; C317-L320 WeakPolarHBondContact O-CB 3.35Å; C317-L320 PolarHBondContact O-N 2.84Å
318	S	94.9	Very high	94.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.8	-23.1	177.6	79	0	0	0	0	112.8	L314 Q315 V316 L320 L321 R326	L314-S318 VanDerWaalsContact O-CB 3.23Å; L314-S318 WeakPolarHBondContact O-CB 3.31Å; L314-S318 PolarHBondContact O-N 3.29Å; L314-S318 PolarHBondContact O-OG 3.38Å; Q315-S318 PolarHBondContact O-N 3.35Å; Q315-S318 PolarHBondContact O-OG 3.26Å; V316-S318 VanDerWaalsContact C-N 3.27Å; V316-S318 PolarHBondContact O-N 3.04Å; S318-L320 VanDerWaalsContact C-N 3.26Å; S318-L320 PolarHBondContact O-N 3.18Å; S318-L321 PolarHBondContact O-N 2.89Å; S318-R326 VanDerWaalsContact O-CD 3.32Å; S318-R326 WeakPolarHBondContact O-CD 3.23Å; S318-R326 PolarHBondContact O-NH1 3.34Å; S318-R326 VanDerWaalsContact OG-CZ 3.32Å; S318-R326 PolarHBondContact OG-NH1 3.45Å; S318-R326 PolarHBondContact OG-NH2 3.48Å
319	L	95.2	Very high	95	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-69.1	-26.4	174.2	-54.3	179.2	0	0	0	112.2	I219 N222 V223 V316 C317 L321 R326 V397 P398 L401	I219-L319 WeakPolarHBondContact CA-O 3.35Å; I219-L319 HydrophobicContact CG2-CB 4.29Å; I219-L319 HydrophobicContact CG2-CD1 4.48Å; N222-L319 HydrophobicContact CB-CD2 4.33Å; N222-L319 PolarHBondContact ND2-O 3.17Å; V223-L319 HydrophobicContact CG2-CD1 4.04Å; V223-L319 HydrophobicContact CG2-CD2 3.89Å; V316-L319 WeakPolarHBondContact O-CB 3.32Å; V316-L319 PolarHBondContact O-N 3.13Å; C317-L319 PolarHBondContact O-N 3.42Å; L319-L321 VanDerWaalsContact C-N 3.32Å; L319-R326 VanDerWaalsContact CA-NH1 3.3Å; L319-V397 HydrophobicContact CD2-CG1 4.5Å; L319-P398 HydrophobicContact CD1-CG 3.9Å; L319-L401 HydrophobicContact CD1-CD2 3.49Å; L319-L401 VanDerWaalsContact CD1-CD2 3.49Å
320	L	95.1	Very high	95.2	Very high	12 Å²	12	13.2 Å²	13.2	6%	0.063	7%	0.067	C	C	.	.	H	α-helix	trans	-74.8	-23.4	-179.6	-52.6	178.9	0	0	0	112.5	T192 L196 L209 V214 I219 L293 C317 S318	T192-L320 HydrophobicContact CG2-CD2 3.87Å; L196-L320 HydrophobicContact CD2-CD1 4.02Å; L209-L320 HydrophobicContact CD2-CD1 3.92Å; V214-L320 HydrophobicContact CG1-CD2 3.88Å; I219-L320 HydrophobicContact CD1-CD2 3.79Å; I219-L320 HydrophobicContact CG1-CD2 4Å; L293-L320 HydrophobicContact CD1-CB 3.92Å; L293-L320 HydrophobicContact CD2-CB 4.37Å; L293-L320 HydrophobicContact CD2-CD1 4.18Å; C317-L320 VanDerWaalsContact O-CB 3.3Å; C317-L320 WeakPolarHBondContact O-CB 3.35Å; C317-L320 PolarHBondContact O-N 2.84Å; S318-L320 VanDerWaalsContact C-N 3.26Å; S318-L320 PolarHBondContact O-N 3.18Å
321	L	95.5	Very high	95.3	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.075	C	C	.	.	S	Bend	trans	-63.3	146.8	-177.9	-66.1	172.1	0	0	0	112	N222 L289 T290 L293 F297 S318 L319 R326 L329	N222-L321 PolarHBondContact ND2-O 3.31Å; L289-L321 HydrophobicContact CD2-CD1 4Å; L289-L321 HydrophobicContact CD2-CD2 4.36Å; T290-L321 HydrophobicContact CG2-CD2 4.29Å; L293-L321 HydrophobicContact CD1-CD2 3.75Å; L293-L321 HydrophobicContact CD1-CG 4.41Å; F297-L321 HydrophobicContact CE2-CD2 4.41Å; S318-L321 PolarHBondContact O-N 2.89Å; L319-L321 VanDerWaalsContact C-N 3.32Å; L321-R326 HydrophobicContact CB-CB 4.15Å; L321-R326 HydrophobicContact CD1-CB 4.42Å; L321-L329 HydrophobicContact CD1-CD2 4.07Å
322	P	95.3	Very high	95.5	Very high	35 Å²	35	14.4 Å²	14.4	23%	0.227	7%	0.072	C	C	.	.			trans	-51.5	135.6	164.8	-24.7	34	0	0	0	110.6	T290 A324 N325 R326	T290-P322 HydrophobicContact CG2-CG 4.15Å; P322-A324 PolarHBondContact O-N 3.17Å; P322-A324 VanDerWaalsContact O-N 3.14Å; P322-N325 HydrophobicContact CB-CB 4.25Å; P322-N325 PolarHBondContact O-N 2.9Å; P322-R326 PolarHBondContact O-N 2.82Å
323	P	95.4	Very high	95.7	Very high	19 Å²	19	12 Å²	12	12%	0.123	6%	0.061	C	C	.	.	H	α-helix	trans	-55.1	-36.4	-175.4	-31	36.7	0	0	0	114.7	H221 N222 V232 R327	H221-P323 HydrophobicContact CB-CG 4.09Å; H221-P323 VanDerWaalsContact ND1-CB 3.33Å; H221-P323 WeakPolarHBondContact ND1-CB 3.48Å; H221-P323 WeakPolarHBondContact ND1-CG 3.3Å; N222-P323 WeakPolarHBondContact OD1-CA 3.25Å; V232-P323 HydrophobicContact CG1-CB 4.01Å; P323-R327 WeakPolarHBondContact O-CB 3.16Å; P323-R327 PolarHBondContact O-N 2.92Å
324	A	95	Very high	95.8	Very high	7 Å²	7	15 Å²	15	6%	0.058	7%	0.072	C	C	.	.	H	α-helix	trans	-66.6	-43	177.3	0	0	0	0	0	112.1	V234 E239 P322 R327 R328	V234-A324 HydrophobicContact CG2-CB 4.26Å; E239-A324 HydrophobicContact CB-CB 4.22Å; E239-A324 WeakPolarHBondContact O-CB 3.49Å; P322-A324 PolarHBondContact O-N 3.17Å; P322-A324 VanDerWaalsContact O-N 3.14Å; A324-R327 PolarHBondContact O-N 3.1Å; A324-R328 VanDerWaalsContact CB-NH1 3.34Å; A324-R328 WeakPolarHBondContact O-CG 3.33Å; A324-R328 PolarHBondContact O-N 2.79Å
325	N	95.7	Very high	95.8	Very high	26 Å²	26	15.1 Å²	15.1	14%	0.139	7%	0.073	C	C	.	.	H	α-helix	trans	-66.1	-43.6	177	-67.3	28.5	0	0	0	111	L288 P322 R327 R328 L329	L288-N325 WeakPolarHBondContact O-CB 3.45Å; P322-N325 HydrophobicContact CB-CB 4.25Å; P322-N325 PolarHBondContact O-N 2.9Å; N325-R327 VanDerWaalsContact C-N 3.34Å; N325-R327 PolarHBondContact O-N 3.32Å; N325-R328 WeakPolarHBondContact O-CB 3.46Å; N325-R328 PolarHBondContact O-N 2.89Å; N325-L329 WeakPolarHBondContact O-CB 3.48Å; N325-L329 PolarHBondContact O-N 3.37Å
326	R	95.7	Very high	95.8	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58.8	-45.4	174.7	175.7	166.8	177.8	159.1	1.5	112	V232 S318 L319 L321 P322 L329 Q330 L395	V232-R326 HydrophobicContact CG2-CB 4.48Å; V232-R326 HydrophobicContact CG2-CG 3.76Å; S318-R326 VanDerWaalsContact O-CD 3.32Å; S318-R326 WeakPolarHBondContact O-CD 3.23Å; S318-R326 PolarHBondContact O-NH1 3.34Å; S318-R326 VanDerWaalsContact OG-CZ 3.32Å; S318-R326 PolarHBondContact OG-NH1 3.45Å; S318-R326 PolarHBondContact OG-NH2 3.48Å; L319-R326 VanDerWaalsContact CA-NH1 3.3Å; L321-R326 HydrophobicContact CB-CB 4.15Å; L321-R326 HydrophobicContact CD1-CB 4.42Å; P322-R326 PolarHBondContact O-N 2.82Å; R326-L329 PolarHBondContact O-N 3.33Å; R326-Q330 HydrophobicContact CG-CG 4.29Å; R326-Q330 WeakPolarHBondContact O-CB 3.3Å; R326-Q330 VanDerWaalsContact O-CG 3.28Å; R326-Q330 WeakPolarHBondContact O-CG 3.5Å; R326-Q330 PolarHBondContact O-N 3.46Å; R326-L395 PolarHBondContact NH2-O 3.03Å
327	R	95.6	Very high	95.9	Very high	46 Å²	46	13.5 Å²	13.5	17%	0.174	7%	0.066	C	C	.	.	H	α-helix	trans	-61.2	-47	177.4	177.5	179.3	171.3	83.5	-6.8	111.6	I231 V232 V234 D240 P323 A324 N325 L329 Q330 L331	I231-R327 HydrophobicContact CG2-CG 4.28Å; V232-R327 HydrophobicContact CB-CB 4.35Å; V232-R327 WeakPolarHBondContact O-CD 3.39Å; V232-R327 PolarHBondContact O-NH1 2.95Å; V234-R327 HydrophobicContact CG2-CB 4.04Å; V234-R327 HydrophobicContact CG2-CG 4.39Å; D240-R327 VanDerWaalsContact OD1-CD 3.31Å; D240-R327 WeakPolarHBondContact OD1-CD 3.39Å; D240-R327 IonicContact OD1-CZ 3.18Å; D240-R327 IonicContact OD1-NE 2.68Å; D240-R327 PolarHBondContact OD1-NE 3.07Å; D240-R327 IonicContact OD2-CZ 2.61Å; D240-R327 IonicContact OD2-NE 3.2Å; D240-R327 PolarHBondContact OD2-NE 3.07Å; D240-R327 IonicContact OD2-NH2 3.7Å; D240-R327 PolarHBondContact OD2-NH2 3.37Å; P323-R327 WeakPolarHBondContact O-CB 3.16Å; P323-R327 PolarHBondContact O-N 2.92Å; A324-R327 PolarHBondContact O-N 3.1Å; N325-R327 VanDerWaalsContact C-N 3.34Å; N325-R327 PolarHBondContact O-N 3.32Å; R327-L329 VanDerWaalsContact C-N 3.33Å; R327-L329 PolarHBondContact O-N 3.34Å; R327-Q330 PolarHBondContact O-N 2.89Å; R327-L331 HydrophobicContact CG-CD1 4.07Å; R327-L331 WeakPolarHBondContact O-CG 3.32Å; R327-L331 PolarHBondContact O-N 3.4Å
328	R	96.5	Very high	95.9	Very high	28 Å²	28	20.9 Å²	20.9	11%	0.106	9%	0.094	C	C	.	.	H	α-helix	trans	-54.3	-49.4	174.4	-77.4	-178.9	-177.5	92.6	9.6	111.4	E239 D240 M241 Y280 F281 L288 A324 N325 L331 L332	E239-R328 VanDerWaalsContact O-CZ 3.3Å; E239-R328 PolarHBondContact O-NH1 2.89Å; E239-R328 PolarHBondContact O-NH2 3.37Å; D240-R328 PolarHBondContact O-NH2 3.36Å; M241-R328 HydrophobicContact CE-CG 4.29Å; M241-R328 HydrophobicContact CG-CG 3.6Å; M241-R328 HydrophobicContact SD-CB 4.46Å; M241-R328 HydrophobicContact SD-CG 3.86Å; Y280-R328 PolarHBondContact OH-NE 2.9Å; F281-R328 HydrophobicContact CE1-CB 4.25Å; L288-R328 HydrophobicContact CD2-CB 3.65Å; L288-R328 HydrophobicContact CD2-CG 4.44Å; A324-R328 VanDerWaalsContact CB-NH1 3.34Å; A324-R328 WeakPolarHBondContact O-CG 3.33Å; A324-R328 PolarHBondContact O-N 2.79Å; N325-R328 WeakPolarHBondContact O-CB 3.46Å; N325-R328 PolarHBondContact O-N 2.89Å; R328-L331 PolarHBondContact O-N 3.2Å; R328-L332 VanDerWaalsContact O-CB 3.31Å; R328-L332 WeakPolarHBondContact O-CB 3.37Å; R328-L332 PolarHBondContact O-N 3.3Å
329	L	97.2	Very high	95.9	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.5	-46.8	178.5	-176.8	68.4	0	0	0	112.5	L288 L289 L321 N325 R326 R327 L331 L332 L333 I366 M387 L395	L288-L329 HydrophobicContact CB-CB 4.41Å; L288-L329 HydrophobicContact CB-CD1 4.31Å; L288-L329 HydrophobicContact CD1-CB 4.29Å; L288-L329 HydrophobicContact CD1-CD1 4.12Å; L289-L329 HydrophobicContact CD2-CD2 3.54Å; L321-L329 HydrophobicContact CD1-CD2 4.07Å; N325-L329 WeakPolarHBondContact O-CB 3.48Å; N325-L329 PolarHBondContact O-N 3.37Å; R326-L329 PolarHBondContact O-N 3.33Å; R327-L329 VanDerWaalsContact C-N 3.33Å; R327-L329 PolarHBondContact O-N 3.34Å; L329-L331 VanDerWaalsContact C-N 3.3Å; L329-L331 PolarHBondContact O-N 3.34Å; L329-L332 PolarHBondContact O-N 3.29Å; L329-L333 HydrophobicContact CD1-CD1 4.16Å; L329-L333 HydrophobicContact CD1-CG 4.15Å; L329-L333 HydrophobicContact CG-CD1 4.1Å; L329-L333 HydrophobicContact CG-CG 4.42Å; L329-L333 WeakPolarHBondContact O-CG 3.31Å; L329-L333 PolarHBondContact O-N 3.49Å; L329-I366 HydrophobicContact CD1-CD1 4.5Å; L329-I366 HydrophobicContact CD1-CG1 4.07Å; L329-I366 HydrophobicContact CD1-CG2 3.79Å; L329-M387 HydrophobicContact CD2-CE 3.98Å; L329-L395 HydrophobicContact CD2-CD1 3.94Å; L329-L395 HydrophobicContact CD2-CD2 3.95Å; L329-L395 HydrophobicContact CG-CD1 3.91Å
330	Q	96.4	Very high	95.8	Very high	7 Å²	7	23.1 Å²	23.1	3%	0.033	11%	0.109	C	C	.	.	H	α-helix	trans	-58.1	-43.1	177.9	-75.9	177.6	-37.6	0	0	111.9	G230 R326 R327 R334 L395	G230-Q330 PolarHBondContact O-NE2 3.02Å; R326-Q330 HydrophobicContact CG-CG 4.29Å; R326-Q330 WeakPolarHBondContact O-CB 3.3Å; R326-Q330 VanDerWaalsContact O-CG 3.28Å; R326-Q330 WeakPolarHBondContact O-CG 3.5Å; R326-Q330 PolarHBondContact O-N 3.46Å; R327-Q330 PolarHBondContact O-N 2.89Å; Q330-R334 WeakPolarHBondContact O-CB 3.23Å; Q330-R334 WeakPolarHBondContact O-CD 3.46Å; Q330-R334 VanDerWaalsContact O-CG 3.23Å; Q330-R334 WeakPolarHBondContact O-CG 3.41Å; Q330-R334 PolarHBondContact O-N 2.96Å; Q330-L395 HydrophobicContact CB-CD1 4.28Å; Q330-L395 HydrophobicContact CG-CB 3.99Å; Q330-L395 HydrophobicContact CG-CD1 3.56Å; Q330-L395 HydrophobicContact CG-CG 4.42Å; Q330-L395 PolarHBondContact NE2-O 2.65Å
331	L	96.4	Very high	95.7	Very high	34 Å²	34	28.6 Å²	28.6	18%	0.178	13%	0.134	C	C	.	.	H	α-helix	trans	-72.8	-38.6	179.6	-68.3	174.6	0	0	0	111.8	I231 M241 L246 M249 R327 R328 L329 L335	I231-L331 HydrophobicContact CD1-CD2 3.93Å; M241-L331 HydrophobicContact CE-CB 3.88Å; M241-L331 HydrophobicContact CE-CD1 3.29Å; M241-L331 HydrophobicContact CE-CG 4.19Å; L246-L331 HydrophobicContact CD2-CD1 3.88Å; M249-L331 HydrophobicContact CE-CB 4.04Å; M249-L331 WeakPolarHBondContact CE-O 3.17Å; R327-L331 HydrophobicContact CG-CD1 4.07Å; R327-L331 WeakPolarHBondContact O-CG 3.32Å; R327-L331 PolarHBondContact O-N 3.4Å; R328-L331 PolarHBondContact O-N 3.2Å; L329-L331 VanDerWaalsContact C-N 3.3Å; L329-L331 PolarHBondContact O-N 3.34Å; L331-L335 WeakPolarHBondContact O-CB 3.25Å; L331-L335 PolarHBondContact O-N 3.16Å
332	L	97.6	Very high	95.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-48.8	178.1	-179.9	58.8	0	0	0	111.9	M249 F281 L288 R328 L329 R334 L335 M336 F362 I366	M249-L332 HydrophobicContact CE-CB 4.46Å; F281-L332 HydrophobicContact CD1-CD2 4.06Å; F281-L332 HydrophobicContact CD2-CD1 4.21Å; F281-L332 HydrophobicContact CD2-CD2 4.5Å; F281-L332 HydrophobicContact CE1-CB 4.4Å; F281-L332 HydrophobicContact CE1-CD2 4.03Å; F281-L332 HydrophobicContact CE2-CD1 3.91Å; F281-L332 HydrophobicContact CE2-CD2 4.48Å; F281-L332 HydrophobicContact CG-CD2 4.31Å; F281-L332 HydrophobicContact CZ-CB 4.09Å; F281-L332 HydrophobicContact CZ-CD1 4.22Å; F281-L332 HydrophobicContact CZ-CD2 4.25Å; F281-L332 HydrophobicContact CZ-CG 4.42Å; L288-L332 HydrophobicContact CD1-CD2 3.74Å; R328-L332 VanDerWaalsContact O-CB 3.31Å; R328-L332 WeakPolarHBondContact O-CB 3.37Å; R328-L332 PolarHBondContact O-N 3.3Å; L329-L332 PolarHBondContact O-N 3.29Å; L332-R334 VanDerWaalsContact C-N 3.31Å; L332-R334 PolarHBondContact O-N 3.45Å; L332-L335 WeakPolarHBondContact O-CB 3.39Å; L332-L335 PolarHBondContact O-N 3.04Å; L332-L335 VanDerWaalsContact O-N 3.13Å; L332-M336 HydrophobicContact CD1-CG 4.24Å; L332-M336 HydrophobicContact CD1-SD 4.29Å; L332-M336 HydrophobicContact CG-CG 4.46Å; L332-M336 HydrophobicContact CG-SD 3.98Å; L332-M336 VanDerWaalsContact O-CG 3.29Å; L332-M336 WeakPolarHBondContact O-CG 3.31Å; L332-M336 PolarHBondContact O-N 2.94Å; L332-F362 HydrophobicContact CD1-CD1 3.76Å; L332-F362 HydrophobicContact CD1-CD2 4.12Å; L332-F362 HydrophobicContact CD1-CE1 3.74Å; L332-F362 HydrophobicContact CD1-CE2 4.11Å; L332-F362 HydrophobicContact CD1-CG 3.96Å; L332-F362 HydrophobicContact CD1-CZ 3.93Å; L332-F362 HydrophobicContact CD2-CB 4.26Å; L332-F362 HydrophobicContact CD2-CD1 3.97Å; L332-F362 HydrophobicContact CD2-CG 4.21Å; L332-F362 HydrophobicContact CG-CD1 4.44Å; L332-F362 HydrophobicContact CG-CG 4.48Å; L332-I366 HydrophobicContact CD2-CD1 4Å; L332-I366 HydrophobicContact CD2-CG1 3.94Å
333	L	97.4	Very high	95	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-39	178.4	-67	176.4	0	0	0	112	L329 M336 A337 I366 M387 M388 H391 L395	L329-L333 HydrophobicContact CD1-CD1 4.16Å; L329-L333 HydrophobicContact CD1-CG 4.15Å; L329-L333 HydrophobicContact CG-CD1 4.1Å; L329-L333 HydrophobicContact CG-CG 4.42Å; L329-L333 WeakPolarHBondContact O-CG 3.31Å; L329-L333 PolarHBondContact O-N 3.49Å; L333-M336 HydrophobicContact CD2-SD 4.26Å; L333-M336 PolarHBondContact O-N 3.24Å; L333-A337 WeakPolarHBondContact O-CB 3.44Å; L333-A337 PolarHBondContact O-N 3.5Å; L333-I366 HydrophobicContact CD2-CD1 4.21Å; L333-M387 HydrophobicContact CD1-CB 4.03Å; L333-M387 HydrophobicContact CD1-CE 4.14Å; L333-M387 HydrophobicContact CD2-CB 4.13Å; L333-M388 HydrophobicContact CD2-CB 4.41Å; L333-H391 HydrophobicContact CB-CB 3.84Å; L333-L395 HydrophobicContact CD1-CD1 3.66Å; L333-L395 HydrophobicContact CD1-CG 4.39Å
334	R	96	Very high	94.6	Very high	62 Å²	62	36.5 Å²	36.5	23%	0.234	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-42.7	173.3	-77.5	174.9	-175.4	-158.2	5.4	111.9	T229 Q330 L332 R338	T229-R334 PolarHBondContact O-NH2 3.09Å; Q330-R334 WeakPolarHBondContact O-CB 3.23Å; Q330-R334 WeakPolarHBondContact O-CD 3.46Å; Q330-R334 VanDerWaalsContact O-CG 3.23Å; Q330-R334 WeakPolarHBondContact O-CG 3.41Å; Q330-R334 PolarHBondContact O-N 2.96Å; L332-R334 VanDerWaalsContact C-N 3.31Å; L332-R334 PolarHBondContact O-N 3.45Å; R334-R338 VanDerWaalsContact O-CB 3.28Å; R334-R338 WeakPolarHBondContact O-CB 3.34Å; R334-R338 WeakPolarHBondContact O-CG 3.39Å; R334-R338 PolarHBondContact O-N 2.87Å
335	L	96.4	Very high	94.2	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-53	174.6	170.9	67.8	0	0	0	110.8	M249 L252 A253 V277 L331 L332 A337 R338 V339	M249-L335 HydrophobicContact CB-CD1 4.41Å; M249-L335 HydrophobicContact CB-CD2 4.05Å; M249-L335 HydrophobicContact CE-CB 3.8Å; M249-L335 HydrophobicContact CE-CD2 3.7Å; M249-L335 HydrophobicContact CE-CG 4.37Å; M249-L335 HydrophobicContact CG-CD2 3.8Å; M249-L335 WeakPolarHBondContact O-CD1 3.32Å; L252-L335 HydrophobicContact CB-CD1 3.83Å; A253-L335 HydrophobicContact CB-CD1 4.01Å; V277-L335 HydrophobicContact CG1-CD2 4.15Å; L331-L335 WeakPolarHBondContact O-CB 3.25Å; L331-L335 PolarHBondContact O-N 3.16Å; L332-L335 WeakPolarHBondContact O-CB 3.39Å; L332-L335 PolarHBondContact O-N 3.04Å; L332-L335 VanDerWaalsContact O-N 3.13Å; L335-A337 VanDerWaalsContact C-N 3.3Å; L335-A337 PolarHBondContact O-N 2.63Å; L335-R338 PolarHBondContact O-N 3.03Å; L335-V339 HydrophobicContact CD1-CG2 3.78Å; L335-V339 HydrophobicContact CG-CG2 4.36Å; L335-V339 WeakPolarHBondContact O-CB 3.28Å; L335-V339 WeakPolarHBondContact O-CG2 3.19Å; L335-V339 PolarHBondContact O-N 3.3Å
336	M	97.1	Very high	93.9	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-55.5	-47.7	-179.2	-68.2	168.2	70.5	0	0	110.7	L332 L333 C340 M358 F362 I366 V384 M388	L332-M336 HydrophobicContact CD1-CG 4.24Å; L332-M336 HydrophobicContact CD1-SD 4.29Å; L332-M336 HydrophobicContact CG-CG 4.46Å; L332-M336 HydrophobicContact CG-SD 3.98Å; L332-M336 VanDerWaalsContact O-CG 3.29Å; L332-M336 WeakPolarHBondContact O-CG 3.31Å; L332-M336 PolarHBondContact O-N 2.94Å; L333-M336 HydrophobicContact CD2-SD 4.26Å; L333-M336 PolarHBondContact O-N 3.24Å; M336-C340 WeakPolarHBondContact O-CB 3.39Å; M336-C340 PolarHBondContact O-N 3.3Å; M336-C340 PolarHBondContact O-SG 2.81Å; M336-M358 HydrophobicContact CB-CB 4.5Å; M336-M358 HydrophobicContact CE-CB 4.12Å; M336-M358 HydrophobicContact CG-CB 4.4Å; M336-M358 HydrophobicContact CG-SD 4.37Å; M336-F362 HydrophobicContact CE-CB 4.22Å; M336-F362 HydrophobicContact CE-CD2 4.33Å; M336-F362 HydrophobicContact CG-CD2 3.94Å; M336-F362 HydrophobicContact CG-CE2 4.36Å; M336-F362 HydrophobicContact SD-CB 4.06Å; M336-F362 HydrophobicContact SD-CD2 4Å; M336-F362 HydrophobicContact SD-CG 4.28Å; M336-I366 HydrophobicContact SD-CD1 4.11Å; M336-V384 HydrophobicContact CE-CG1 4.07Å; M336-M388 HydrophobicContact CB-CG 3.95Å; M336-M388 HydrophobicContact CB-SD 3.79Å; M336-M388 HydrophobicContact CE-CG 4.46Å; M336-M388 HydrophobicContact CE-SD 3.85Å
337	A	95.9	Very high	93.5	Very high	3 Å²	3	42.2 Å²	42.2	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-45.6	178.1	0	0	0	0	0	112.7	L333 L335 V339 C340 Q341 M388 H391	L333-A337 WeakPolarHBondContact O-CB 3.44Å; L333-A337 PolarHBondContact O-N 3.5Å; L335-A337 VanDerWaalsContact C-N 3.3Å; L335-A337 PolarHBondContact O-N 2.63Å; A337-V339 PolarHBondContact O-N 3.28Å; A337-C340 PolarHBondContact O-N 3.21Å; A337-Q341 WeakPolarHBondContact O-CB 3.39Å; A337-Q341 WeakPolarHBondContact O-CG 3.33Å; A337-Q341 PolarHBondContact O-N 2.9Å; A337-M388 HydrophobicContact CB-CG 4.46Å; A337-H391 WeakPolarHBondContact CB-CE1 3.42Å; A337-H391 VanDerWaalsContact CB-ND1 3.31Å; A337-H391 WeakPolarHBondContact CB-ND1 3.47Å
338	R	94.1	Very high	93.3	Very high	155 Å²	155	40.4 Å²	40.4	59%	0.585	22%	0.219	S	C	*	.	H	α-helix	trans	-61.9	-42.7	178.8	-74.3	-72.8	179.2	173.4	-1.5	112.3	A253 R334 L335 Q341 N342	A253-R338 HydrophobicContact CB-CB 4.31Å; R334-R338 VanDerWaalsContact O-CB 3.28Å; R334-R338 WeakPolarHBondContact O-CB 3.34Å; R334-R338 WeakPolarHBondContact O-CG 3.39Å; R334-R338 PolarHBondContact O-N 2.87Å; L335-R338 PolarHBondContact O-N 3.03Å; R338-Q341 PolarHBondContact O-N 2.87Å; R338-N342 WeakPolarHBondContact O-CB 3.32Å; R338-N342 PolarHBondContact O-N 2.92Å
339	V	94.2	Very high	93.1	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.018	23%	0.228	C	C	.	.	H	α-helix	trans	-65.4	-44.6	177	168.5	0	0	0	0	111	L252 L335 A337 Q341 N342 L345 L348 T354 M358	L252-V339 HydrophobicContact CB-CG2 4.03Å; L335-V339 HydrophobicContact CD1-CG2 3.78Å; L335-V339 HydrophobicContact CG-CG2 4.36Å; L335-V339 WeakPolarHBondContact O-CB 3.28Å; L335-V339 WeakPolarHBondContact O-CG2 3.19Å; L335-V339 PolarHBondContact O-N 3.3Å; A337-V339 PolarHBondContact O-N 3.28Å; V339-Q341 PolarHBondContact O-N 2.7Å; V339-N342 PolarHBondContact O-N 3.27Å; V339-L345 HydrophobicContact CB-CD2 4.35Å; V339-L345 HydrophobicContact CG1-CD2 3.38Å; V339-L345 HydrophobicContact CG2-CD2 4.47Å; V339-L348 HydrophobicContact CG1-CD1 3.74Å; V339-T354 HydrophobicContact CG1-CG2 3.75Å; V339-M358 HydrophobicContact CB-CE 3.69Å; V339-M358 HydrophobicContact CG1-CE 3.16Å; V339-M358 HydrophobicContact CG2-CE 4.08Å
340	C	93.3	Very high	92.7	Very high	45 Å²	45	48 Å²	48	30%	0.304	26%	0.262	S	S	.	.	H	α-helix	trans	-64.3	-27.4	178	-66.7	0	0	0	0	113.2	M336 A337	M336-C340 WeakPolarHBondContact O-CB 3.39Å; M336-C340 PolarHBondContact O-N 3.3Å; M336-C340 PolarHBondContact O-SG 2.81Å; A337-C340 PolarHBondContact O-N 3.21Å
341	Q	92.3	Very high	92.5	Very high	127 Å²	127	52.3 Å²	52.3	59%	0.593	30%	0.298	S	S	*	.	H	α-helix	trans	-93.9	-6	-179.1	-67.9	169	10	0	0	113.3	A337 R338 V339 P343	A337-Q341 WeakPolarHBondContact O-CB 3.39Å; A337-Q341 WeakPolarHBondContact O-CG 3.33Å; A337-Q341 PolarHBondContact O-N 2.9Å; R338-Q341 PolarHBondContact O-N 2.87Å; V339-Q341 PolarHBondContact O-N 2.7Å; Q341-P343 WeakPolarHBondContact O-CD 3.46Å
342	N	90.5	Very high	92.3	Very high	32 Å²	32	53.6 Å²	53.6	17%	0.171	30%	0.304	C	S	.	.			trans	-85.9	109.2	-175.7	-171.1	-9.6	0	0	0	110.9	W255 R338 V339 A344 L345	W255-N342 PolarHBondContact O-ND2 3.27Å; R338-N342 WeakPolarHBondContact O-CB 3.32Å; R338-N342 PolarHBondContact O-N 2.92Å; V339-N342 PolarHBondContact O-N 3.27Å; N342-A344 VanDerWaalsContact C-N 3.26Å; N342-A344 PolarHBondContact O-N 3.42Å; N342-A344 WeakPolarHBondContact OD1-CB 3.35Å; N342-A344 PolarHBondContact OD1-N 2.92Å; N342-L345 HydrophobicContact CB-CB 4.25Å
343	P	86	Confident	92.1	Very high	132 Å²	132	56.7 Å²	56.7	86%	0.857	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-18.2	179.9	32.5	-36.6	0	0	0	113	Q341	Q341-P343 WeakPolarHBondContact O-CD 3.46Å
344	A	86.8	Confident	91.9	Very high	56 Å²	56	58.4 Å²	58.4	46%	0.463	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-6.9	-178	0	0	0	0	0	113.2	W255 N342	W255-A344 VanDerWaalsContact CD1-O 3.3Å; W255-A344 PolarHBondContact NE1-O 3.47Å; N342-A344 VanDerWaalsContact C-N 3.26Å; N342-A344 PolarHBondContact O-N 3.42Å; N342-A344 WeakPolarHBondContact OD1-CB 3.35Å; N342-A344 PolarHBondContact OD1-N 2.92Å
345	L	87.9	Confident	91.8	Very high	21 Å²	21	60.9 Å²	60.9	11%	0.11	35%	0.35	C	S	.	.	S	Bend	trans	-83.8	128	179.4	-169.8	74.1	0	0	0	110.2	W255 E270 V339 N342 L348	W255-L345 HydrophobicContact CB-CD1 3.66Å; W255-L345 HydrophobicContact CD2-CD1 3.65Å; W255-L345 HydrophobicContact CE3-CD1 4.27Å; W255-L345 HydrophobicContact CG-CD1 3.34Å; E270-L345 HydrophobicContact CB-CD1 4.19Å; V339-L345 HydrophobicContact CB-CD2 4.35Å; V339-L345 HydrophobicContact CG1-CD2 3.38Å; V339-L345 HydrophobicContact CG2-CD2 4.47Å; N342-L345 HydrophobicContact CB-CB 4.25Å; L345-L348 HydrophobicContact CD2-CD1 3.89Å; L345-L348 HydrophobicContact CD2-CD2 4.01Å; L345-L348 HydrophobicContact CD2-CG 4.06Å; L345-L348 HydrophobicContact CG-CD2 4.29Å
346	P	88	Confident	91.7	Very high	49 Å²	49	63.6 Å²	63.6	32%	0.318	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-59.2	159.1	173.1	-23.2	33.2	0	0	0	112.8	L348	P346-L348 PolarHBondContact O-N 3.25Å; P346-L348 VanDerWaalsContact O-N 3.12Å
347	P	88.7	Confident	91.6	Very high	82 Å²	82	64.7 Å²	64.7	53%	0.532	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-57.5	117.8	172.2	-21.1	32.3	0	0	0	111.1	R271 N349	R271-P347 PolarHBondContact NE-O 3.26Å; R271-P347 PolarHBondContact NH2-O 3.27Å; P347-N349 PolarHBondContact O-N 3.15Å
348	L	90.3	Very high	91.6	Very high	9 Å²	9	64.6 Å²	64.6	5%	0.047	37%	0.372	C	S	.	.	S	Bend	trans	-72.9	-15.4	-179.8	-60.6	176.4	0	0	0	112.7	E270 L274 V339 L345 P346 T354 L357 M358	E270-L348 HydrophobicContact CB-CD2 3.95Å; E270-L348 HydrophobicContact CG-CD2 3.48Å; E270-L348 VanDerWaalsContact CG-CD2 3.48Å; L274-L348 HydrophobicContact CD2-CB 4.18Å; L274-L348 HydrophobicContact CD2-CD1 3.79Å; L274-L348 HydrophobicContact CD2-CG 4.46Å; V339-L348 HydrophobicContact CG1-CD1 3.74Å; L345-L348 HydrophobicContact CD2-CD1 3.89Å; L345-L348 HydrophobicContact CD2-CD2 4.01Å; L345-L348 HydrophobicContact CD2-CG 4.06Å; L345-L348 HydrophobicContact CG-CD2 4.29Å; P346-L348 PolarHBondContact O-N 3.25Å; P346-L348 VanDerWaalsContact O-N 3.12Å; L348-T354 HydrophobicContact CD1-CG2 3.86Å; L348-T354 HydrophobicContact CG-CG2 4.46Å; L348-L357 HydrophobicContact CB-CD2 3.64Å; L348-M358 HydrophobicContact CD1-CE 3.66Å
349	N	91.7	Very high	91.7	Very high	55 Å²	55	57.6 Å²	57.6	29%	0.294	35%	0.346	S	S	.	.			trans	-147.3	145.3	175.1	-173	-76.9	0	0	0	108.9	P347 A351 I352 L357	P347-N349 PolarHBondContact O-N 3.15Å; N349-A351 PolarHBondContact OD1-N 3.4Å; N349-I352 PolarHBondContact OD1-N 3.21Å; N349-L357 HydrophobicContact CB-CD1 4.47Å; N349-L357 HydrophobicContact CB-CD2 3.95Å
350	D	89.4	Confident	91.7	Very high	133 Å²	133	62.7 Å²	62.7	71%	0.711	37%	0.37	S	S	*	.	S	Bend	trans	-83	-23.3	-175.2	-58.4	-50	0	0	0	113.1	R271	R271-D350 IonicContact CZ-OD1 2.63Å; R271-D350 IonicContact CZ-OD2 2.94Å; R271-D350 IonicContact NH1-OD1 3.21Å; R271-D350 IonicContact NH1-OD2 3.88Å; R271-D350 PolarHBondContact NH1-OD2 2.65Å; R271-D350 IonicContact NH2-OD1 3.57Å; R271-D350 PolarHBondContact NH2-OD1 3.47Å; R271-D350 IonicContact NH2-OD2 3.31Å
351	A	92.2	Very high	91.8	Very high	96 Å²	96	61.9 Å²	61.9	79%	0.793	36%	0.363	S	S	*	.	S	Bend	trans	-105.8	-29.1	-176	0	0	0	0	0	113.8	N349	N349-A351 PolarHBondContact OD1-N 3.4Å
352	I	93.3	Very high	92	Very high	61 Å²	61	55.8 Å²	55.8	31%	0.313	34%	0.335	S	S	.	.	S	Bend	trans	-118.2	133.8	-169.9	-54.3	174.1	0	0	0	110.1	N349 T356 L357	N349-I352 PolarHBondContact OD1-N 3.21Å; I352-T356 HydrophobicContact CG2-CG2 3.66Å; I352-L357 HydrophobicContact CG2-CB 4.42Å
353	A	93.1	Very high	92.1	Very high	66 Å²	66	54.7 Å²	54.7	55%	0.545	33%	0.329	S	S	.	.			trans	-59	140.9	174.8	0	0	0	0	0	111.9	R355 T356 L357	A353-R355 PolarHBondContact O-N 2.9Å; A353-R355 VanDerWaalsContact O-N 3.07Å; A353-T356 PolarHBondContact O-N 3.5Å; A353-L357 PolarHBondContact O-N 2.71Å
354	T	93.3	Very high	92.4	Very high	36 Å²	36	55.8 Å²	55.8	22%	0.221	32%	0.317	C	S	.	.	H	α-helix	trans	-50	-40.2	-177.8	-54.6	0	0	0	0	113.2	V339 L348 L357 M358	V339-T354 HydrophobicContact CG1-CG2 3.75Å; L348-T354 HydrophobicContact CD1-CG2 3.86Å; L348-T354 HydrophobicContact CG-CG2 4.46Å; T354-L357 PolarHBondContact O-N 2.92Å; T354-M358 HydrophobicContact CG2-CE 4.49Å; T354-M358 HydrophobicContact CG2-CG 4.49Å; T354-M358 VanDerWaalsContact O-CG 3.29Å; T354-M358 WeakPolarHBondContact O-CG 3.47Å; T354-M358 PolarHBondContact O-N 2.98Å
355	R	93.8	Very high	92.8	Very high	114 Å²	114	53.7 Å²	53.7	43%	0.43	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-48.2	177.3	-173.8	178.4	175.9	-110.9	4	112.3	A353 M358 V359 M388 E389	A353-R355 PolarHBondContact O-N 2.9Å; A353-R355 VanDerWaalsContact O-N 3.07Å; R355-M358 PolarHBondContact O-N 3.42Å; R355-V359 WeakPolarHBondContact O-CG2 3.31Å; R355-V359 PolarHBondContact O-N 3.47Å; R355-V359 VanDerWaalsContact O-N 3.15Å; R355-M388 HydrophobicContact CG-CE 3.75Å; R355-E389 IonicContact CZ-OE1 3.56Å; R355-E389 IonicContact NE-OE1 2.65Å; R355-E389 IonicContact NH2-OE1 2.6Å; R355-E389 PolarHBondContact NH2-OE1 2.97Å
356	T	94.2	Very high	93.1	Very high	61 Å²	61	52.7 Å²	52.7	37%	0.374	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-42.5	178.7	-56.3	0	0	0	0	110.5	I352 A353 M358 V359 Q360	I352-T356 HydrophobicContact CG2-CG2 3.66Å; A353-T356 PolarHBondContact O-N 3.5Å; T356-M358 PolarHBondContact O-N 3.3Å; T356-V359 PolarHBondContact O-N 2.86Å; T356-Q360 HydrophobicContact CG2-CG 4.27Å; T356-Q360 WeakPolarHBondContact O-CB 3.42Å; T356-Q360 WeakPolarHBondContact O-CG 3.48Å; T356-Q360 PolarHBondContact O-N 3.23Å
357	L	95.3	Very high	93.4	Very high	23 Å²	23	50.5 Å²	50.5	12%	0.12	28%	0.279	C	S	.	.	H	α-helix	trans	-56.9	-48	175.1	179.4	68.6	0	0	0	111.4	L274 L348 N349 I352 A353 T354 V359 Q360 T361	L274-L357 HydrophobicContact CD2-CD2 3.81Å; L274-L357 HydrophobicContact CD2-CG 4.49Å; L348-L357 HydrophobicContact CB-CD2 3.64Å; N349-L357 HydrophobicContact CB-CD1 4.47Å; N349-L357 HydrophobicContact CB-CD2 3.95Å; I352-L357 HydrophobicContact CG2-CB 4.42Å; A353-L357 PolarHBondContact O-N 2.71Å; T354-L357 PolarHBondContact O-N 2.92Å; L357-V359 PolarHBondContact O-N 2.99Å; L357-Q360 PolarHBondContact O-N 2.61Å; L357-T361 WeakPolarHBondContact O-CB 3.45Å; L357-T361 PolarHBondContact O-N 3Å; L357-T361 PolarHBondContact O-OG1 2.88Å
358	M	95.9	Very high	93.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-48.5	179.4	-74.8	-58.9	176.7	0	0	112.1	L274 M336 V339 L348 T354 R355 T356 T361 F362	L274-M358 HydrophobicContact CD1-CE 3.71Å; L274-M358 HydrophobicContact CD1-SD 4.01Å; L274-M358 HydrophobicContact CD2-CE 4.32Å; M336-M358 HydrophobicContact CB-CB 4.5Å; M336-M358 HydrophobicContact CE-CB 4.12Å; M336-M358 HydrophobicContact CG-CB 4.4Å; M336-M358 HydrophobicContact CG-SD 4.37Å; V339-M358 HydrophobicContact CB-CE 3.69Å; V339-M358 HydrophobicContact CG1-CE 3.16Å; V339-M358 HydrophobicContact CG2-CE 4.08Å; L348-M358 HydrophobicContact CD1-CE 3.66Å; T354-M358 HydrophobicContact CG2-CE 4.49Å; T354-M358 HydrophobicContact CG2-CG 4.49Å; T354-M358 VanDerWaalsContact O-CG 3.29Å; T354-M358 WeakPolarHBondContact O-CG 3.47Å; T354-M358 PolarHBondContact O-N 2.98Å; R355-M358 PolarHBondContact O-N 3.42Å; T356-M358 PolarHBondContact O-N 3.3Å; M358-T361 PolarHBondContact O-N 3.49Å; M358-F362 WeakPolarHBondContact O-CD2 3.14Å; M358-F362 PolarHBondContact O-N 3.05Å; M358-F362 VanDerWaalsContact O-N 3.13Å; M358-F362 HydrophobicContact SD-CD2 4.18Å; M358-F362 HydrophobicContact SD-CE2 3.72Å
359	V	96.1	Very high	93	Very high	8 Å²	8	47.5 Å²	47.5	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-47.4	-179.8	173.8	0	0	0	0	110.6	R355 T356 L357 T361 F362 S363 T381 V384 M388	R355-V359 WeakPolarHBondContact O-CG2 3.31Å; R355-V359 PolarHBondContact O-N 3.47Å; R355-V359 VanDerWaalsContact O-N 3.15Å; T356-V359 PolarHBondContact O-N 2.86Å; L357-V359 PolarHBondContact O-N 2.99Å; V359-T361 VanDerWaalsContact C-N 3.34Å; V359-T361 PolarHBondContact O-N 3.35Å; V359-F362 PolarHBondContact O-N 3.35Å; V359-S363 WeakPolarHBondContact O-CA 3.47Å; V359-S363 WeakPolarHBondContact O-CB 3.47Å; V359-S363 PolarHBondContact O-N 2.92Å; V359-T381 HydrophobicContact CG1-CG2 3.93Å; V359-V384 HydrophobicContact CG1-CG1 4.44Å; V359-M388 HydrophobicContact CG2-CE 3.76Å; V359-M388 HydrophobicContact CG2-SD 4.25Å
360	Q	93.7	Very high	92.5	Very high	111 Å²	111	48.5 Å²	48.5	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-40.7	178.8	-73.4	177.3	-23.9	0	0	112.4	T356 L357	T356-Q360 HydrophobicContact CG2-CG 4.27Å; T356-Q360 WeakPolarHBondContact O-CB 3.42Å; T356-Q360 WeakPolarHBondContact O-CG 3.48Å; T356-Q360 PolarHBondContact O-N 3.23Å; L357-Q360 PolarHBondContact O-N 2.61Å
361	T	94.8	Very high	91.9	Very high	27 Å²	27	48.3 Å²	48.3	17%	0.166	27%	0.272	C	S	.	.	H	α-helix	trans	-66.6	-40.5	-177.5	-58.7	0	0	0	0	112.3	A278 Q282 L357 M358 V359	A278-T361 HydrophobicContact CB-CG2 3.44Å; A278-T361 VanDerWaalsContact CB-CG2 3.44Å; Q282-T361 PolarHBondContact NE2-O 3.42Å; L357-T361 WeakPolarHBondContact O-CB 3.45Å; L357-T361 PolarHBondContact O-N 3Å; L357-T361 PolarHBondContact O-OG1 2.88Å; M358-T361 PolarHBondContact O-N 3.49Å; V359-T361 VanDerWaalsContact C-N 3.34Å; V359-T361 PolarHBondContact O-N 3.35Å
362	F	96.6	Very high	90.8	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-106.6	-6.4	-171.4	-64.8	-66.5	0	0	0	114.7	L274 V277 A278 F281 L332 M336 M358 V359 R364 C365 I366	L274-F362 HydrophobicContact CD1-CE2 4.19Å; L274-F362 HydrophobicContact CD1-CZ 4.24Å; V277-F362 HydrophobicContact CG1-CE1 4.38Å; V277-F362 HydrophobicContact CG1-CZ 4.14Å; A278-F362 HydrophobicContact CB-CE1 4.34Å; A278-F362 HydrophobicContact CB-CZ 4.4Å; F281-F362 HydrophobicContact CB-CD1 4.28Å; F281-F362 HydrophobicContact CB-CE1 4.28Å; F281-F362 HydrophobicContact CD2-CD1 4.41Å; F281-F362 AromaticContact CD2-CE1 3.88Å; F281-F362 HydrophobicContact CD2-CE1 3.88Å; F281-F362 HydrophobicContact CG-CD1 4.49Å; F281-F362 HydrophobicContact CG-CE1 4.35Å; L332-F362 HydrophobicContact CD1-CD1 3.76Å; L332-F362 HydrophobicContact CD1-CD2 4.12Å; L332-F362 HydrophobicContact CD1-CE1 3.74Å; L332-F362 HydrophobicContact CD1-CE2 4.11Å; L332-F362 HydrophobicContact CD1-CG 3.96Å; L332-F362 HydrophobicContact CD1-CZ 3.93Å; L332-F362 HydrophobicContact CD2-CB 4.26Å; L332-F362 HydrophobicContact CD2-CD1 3.97Å; L332-F362 HydrophobicContact CD2-CG 4.21Å; L332-F362 HydrophobicContact CG-CD1 4.44Å; L332-F362 HydrophobicContact CG-CG 4.48Å; M336-F362 HydrophobicContact CE-CB 4.22Å; M336-F362 HydrophobicContact CE-CD2 4.33Å; M336-F362 HydrophobicContact CG-CD2 3.94Å; M336-F362 HydrophobicContact CG-CE2 4.36Å; M336-F362 HydrophobicContact SD-CB 4.06Å; M336-F362 HydrophobicContact SD-CD2 4Å; M336-F362 HydrophobicContact SD-CG 4.28Å; M358-F362 WeakPolarHBondContact O-CD2 3.14Å; M358-F362 PolarHBondContact O-N 3.05Å; M358-F362 VanDerWaalsContact O-N 3.13Å; M358-F362 HydrophobicContact SD-CD2 4.18Å; M358-F362 HydrophobicContact SD-CE2 3.72Å; V359-F362 PolarHBondContact O-N 3.35Å; F362-R364 PolarHBondContact O-N 3.11Å; F362-C365 PolarHBondContact O-N 2.91Å; F362-C365 PolarHBondContact O-SG 2.87Å; F362-I366 HydrophobicContact CB-CD1 4.06Å; F362-I366 WeakPolarHBondContact O-CG1 3.31Å; F362-I366 PolarHBondContact O-N 3.05Å; F362-I366 VanDerWaalsContact O-N 3.07Å
363	S	94.3	Very high	89.5	Confident	8 Å²	8	55.3 Å²	55.3	6%	0.056	30%	0.296	C	S	.	.	H	α-helix	trans	-56	-52.5	-176.6	-175.8	0	0	0	0	112	V359 C365 I366 L367 T381	V359-S363 WeakPolarHBondContact O-CA 3.47Å; V359-S363 WeakPolarHBondContact O-CB 3.47Å; V359-S363 PolarHBondContact O-N 2.92Å; S363-C365 VanDerWaalsContact C-N 3.33Å; S363-C365 PolarHBondContact O-N 3.49Å; S363-I366 PolarHBondContact O-N 3.49Å; S363-I366 VanDerWaalsContact O-N 3.07Å; S363-L367 PolarHBondContact O-N 3.42Å; S363-T381 PolarHBondContact OG-N 3.37Å
364	R	91.4	Very high	88.5	Confident	156 Å²	156	56.4 Å²	56.4	59%	0.589	29%	0.293	S	S	*	.	H	α-helix	trans	-64.4	-32.2	-176.9	-69.6	-173	171.9	-158.1	3.9	113.9	F362 E377	F362-R364 PolarHBondContact O-N 3.11Å; R364-E377 IonicContact CZ-OE1 3.97Å; R364-E377 IonicContact NE-OE1 2.83Å; R364-E377 PolarHBondContact NE-OE1 3.48Å; R364-E377 IonicContact NH2-OE1 3.21Å; R364-E377 PolarHBondContact NH2-OE1 3.06Å
365	C	94.1	Very high	87.6	Confident	11 Å²	11	56.2 Å²	56.2	7%	0.074	29%	0.29	C	S	.	.	H	α-helix	trans	-81.1	-19.3	176.3	70.2	0	0	0	0	112.8	F281 P287 L288 F362 S363	F281-C365 HydrophobicContact CB-CB 4.14Å; F281-C365 WeakPolarHBondContact O-CB 3.19Å; P287-C365 CarbonylContact C-O 3.23Å; P287-C365 VanDerWaalsContact CA-O 3.28Å; P287-C365 WeakPolarHBondContact CA-O 3.38Å; L288-C365 WeakPolarHBondContact CG-O 3.27Å; L288-C365 PolarHBondContact N-O 2.81Å; F362-C365 PolarHBondContact O-N 2.91Å; F362-C365 PolarHBondContact O-SG 2.87Å; S363-C365 VanDerWaalsContact C-N 3.33Å; S363-C365 PolarHBondContact O-N 3.49Å
366	I	95.6	Very high	87	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-84.5	-55.4	175.7	-68.5	166.1	0	0	0	109.6	L288 L289 L329 L332 L333 M336 F362 S363 V384	L288-I366 HydrophobicContact CD1-CG1 4.19Å; L289-I366 VanDerWaalsContact CB-O 3.24Å; L289-I366 WeakPolarHBondContact CB-O 3.44Å; L289-I366 HydrophobicContact CD1-CG2 3.87Å; L289-I366 HydrophobicContact CG-CG2 4.02Å; L289-I366 WeakPolarHBondContact CG-O 3.41Å; L289-I366 PolarHBondContact N-O 3.39Å; L329-I366 HydrophobicContact CD1-CD1 4.5Å; L329-I366 HydrophobicContact CD1-CG1 4.07Å; L329-I366 HydrophobicContact CD1-CG2 3.79Å; L332-I366 HydrophobicContact CD2-CD1 4Å; L332-I366 HydrophobicContact CD2-CG1 3.94Å; L333-I366 HydrophobicContact CD2-CD1 4.21Å; M336-I366 HydrophobicContact SD-CD1 4.11Å; F362-I366 HydrophobicContact CB-CD1 4.06Å; F362-I366 WeakPolarHBondContact O-CG1 3.31Å; F362-I366 PolarHBondContact O-N 3.05Å; F362-I366 VanDerWaalsContact O-N 3.07Å; S363-I366 PolarHBondContact O-N 3.49Å; S363-I366 VanDerWaalsContact O-N 3.07Å; I366-V384 HydrophobicContact CB-CG2 4.01Å; I366-V384 HydrophobicContact CD1-CG1 3.74Å; I366-V384 HydrophobicContact CD1-CG2 4.33Å; I366-V384 HydrophobicContact CG2-CG2 3.85Å
367	L	92.9	Very high	86.5	Confident	3 Å²	3	56.3 Å²	56.3	2%	0.016	29%	0.294	C	S	.	.	S	Bend	trans	-124.3	123.8	179.6	-172.6	73.6	0	0	0	109.5	L289 Y294 F297 S363 A380 L383	L289-L367 HydrophobicContact CB-CD1 4.41Å; L289-L367 HydrophobicContact CD1-CB 4.22Å; L289-L367 HydrophobicContact CD1-CD1 3.86Å; Y294-L367 HydrophobicContact CD2-CD1 3.77Å; Y294-L367 HydrophobicContact CD2-CG 4.11Å; Y294-L367 HydrophobicContact CE2-CD1 4.13Å; Y294-L367 HydrophobicContact CE2-CD2 4.31Å; Y294-L367 HydrophobicContact CE2-CG 4Å; F297-L367 HydrophobicContact CB-CD1 3.89Å; S363-L367 PolarHBondContact O-N 3.42Å; L367-A380 HydrophobicContact CD2-CB 3.82Å; L367-L383 HydrophobicContact CD2-CD2 4.02Å
368	G	86.8	Confident	86.1	Confident	7 Å²	7	61.6 Å²	61.6	7%	0.072	32%	0.322	C	S	.	.			trans	-149.3	145.9	174	0	0	0	0	0	110.2	F291 Y294	F291-G368 WeakPolarHBondContact CD1-O 3.49Å; Y294-G368 WeakPolarHBondContact CD2-O 3.38Å
369	S	84.9	Confident	85.6	Confident	21 Å²	21	64.9 Å²	64.9	15%	0.147	34%	0.339	C	S	.	.			trans	-86.2	154.5	168.8	-176.9	0	0	0	0	110	F291 E371	F291-S369 WeakPolarHBondContact CE1-O 3.49Å; S369-E371 VanDerWaalsContact C-N 3.26Å; S369-E371 VanDerWaalsContact CB-O 3.26Å; S369-E371 WeakPolarHBondContact CB-O 3.16Å; S369-E371 PolarHBondContact OG-N 3.16Å; S369-E371 PolarHBondContact OG-O 3.14Å
370	A	81.3	Confident	85.2	Confident	76 Å²	76	64.6 Å²	64.6	63%	0.628	34%	0.337	S	S	*	.	S	Bend	trans	-68	-30.9	172.6	0	0	0	0	0	111.6	F291	F291-A370 HydrophobicContact CB-CB 4.36Å; F291-A370 HydrophobicContact CD1-CB 4.02Å; F291-A370 HydrophobicContact CE1-CB 4.47Å; F291-A370 HydrophobicContact CG-CB 4.12Å
371	E	77.1	Confident	85.1	Confident	130 Å²	130	60.9 Å²	60.9	61%	0.607	32%	0.322	S	S	*	.	S	Bend	trans	-105.9	123	173.2	-60.6	-169.1	-169.9	0	0	109.2	S369 V373 D374	S369-E371 VanDerWaalsContact C-N 3.26Å; S369-E371 VanDerWaalsContact CB-O 3.26Å; S369-E371 WeakPolarHBondContact CB-O 3.16Å; S369-E371 PolarHBondContact OG-N 3.16Å; S369-E371 PolarHBondContact OG-O 3.14Å; E371-V373 PolarHBondContact O-N 3.5Å; E371-V373 VanDerWaalsContact O-N 3.1Å; E371-D374 PolarHBondContact O-N 3.42Å; E371-D374 VanDerWaalsContact O-N 3.16Å
372	E	68.4	Low	85	Confident	169 Å²	169	65 Å²	65	79%	0.79	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-60.1	-24.9	-176.2	-70.5	-165.5	150.8	0	0	113.3	D374 L375	E372-D374 VanDerWaalsContact C-N 3.26Å; E372-D374 PolarHBondContact O-N 2.94Å; E372-L375 PolarHBondContact O-N 3.2Å
373	V	66.4	Low	84.9	Confident	134 Å²	134	65 Å²	65	81%	0.812	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-66.5	-28.1	-179	-174.2	0	0	0	0	112.2	E371	E371-V373 PolarHBondContact O-N 3.5Å; E371-V373 VanDerWaalsContact O-N 3.1Å
374	D	71.1	Confident	85	Confident	89 Å²	89	64.6 Å²	64.6	48%	0.476	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-90.6	-8.2	-175.1	-64.3	-32.3	0	0	0	113.4	Y294 E371 E372 D376	Y294-D374 PolarHBondContact OH-O 3.07Å; E371-D374 PolarHBondContact O-N 3.42Å; E371-D374 VanDerWaalsContact O-N 3.16Å; E372-D374 VanDerWaalsContact C-N 3.26Å; E372-D374 PolarHBondContact O-N 2.94Å; D374-D376 PolarHBondContact O-N 2.99Å
375	L	75.1	Confident	85.2	Confident	33 Å²	33	58.6 Å²	58.6	17%	0.173	32%	0.316	C	S	.	.			trans	-87.7	101.9	-179.6	-173.7	66.4	0	0	0	111.1	Y294 E372 E377 A380	Y294-L375 HydrophobicContact CE2-CD1 3.84Å; E372-L375 PolarHBondContact O-N 3.2Å; L375-E377 PolarHBondContact O-N 3.22Å; L375-A380 HydrophobicContact CD1-CB 4.06Å
376	D	81.4	Confident	85.2	Confident	78 Å²	78	58.8 Å²	58.8	42%	0.417	32%	0.315	S	S	.	.			trans	-77.7	104.2	164.6	-176	-33.3	0	0	0	109.5	D374 L378 L379 A380	D374-D376 PolarHBondContact O-N 2.99Å; D376-L378 VanDerWaalsContact C-N 3.25Å; D376-L378 PolarHBondContact O-N 2.91Å; D376-L378 WeakPolarHBondContact OD1-CA 3.48Å; D376-L378 WeakPolarHBondContact OD1-CB 3.49Å; D376-L378 PolarHBondContact OD1-N 3.39Å; D376-L379 HydrophobicContact CB-CB 3.93Å; D376-L379 HydrophobicContact CB-CD1 3.88Å; D376-L379 HydrophobicContact CB-CG 4Å; D376-L379 VanDerWaalsContact CG-CG 3.5Å; D376-L379 PolarHBondContact O-N 3.49Å; D376-L379 PolarHBondContact OD1-N 2.9Å; D376-L379 WeakPolarHBondContact OD2-CD1 3.46Å; D376-L379 WeakPolarHBondContact OD2-CG 3.23Å; D376-A380 WeakPolarHBondContact O-CB 3.17Å; D376-A380 PolarHBondContact O-N 2.99Å
377	E	83.3	Confident	85.3	Confident	98 Å²	98	58.9 Å²	58.9	46%	0.458	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-33.2	-178.5	-62.8	-161.1	139.5	0	0	113.4	R364 L375 T381	R364-E377 IonicContact CZ-OE1 3.97Å; R364-E377 IonicContact NE-OE1 2.83Å; R364-E377 PolarHBondContact NE-OE1 3.48Å; R364-E377 IonicContact NH2-OE1 3.21Å; R364-E377 PolarHBondContact NH2-OE1 3.06Å; L375-E377 PolarHBondContact O-N 3.22Å; E377-T381 WeakPolarHBondContact O-CB 3.48Å; E377-T381 WeakPolarHBondContact O-CG2 3.35Å; E377-T381 PolarHBondContact O-N 2.99Å; E377-T381 PolarHBondContact O-OG1 2.87Å
378	L	86.4	Confident	85.4	Confident	135 Å²	135	59 Å²	59	71%	0.707	32%	0.317	S	S	*	.	H	α-helix	trans	-70.6	-40.2	179.5	-175.8	67.2	0	0	0	110.3	D376 T381 K382	D376-L378 VanDerWaalsContact C-N 3.25Å; D376-L378 PolarHBondContact O-N 2.91Å; D376-L378 WeakPolarHBondContact OD1-CA 3.48Å; D376-L378 WeakPolarHBondContact OD1-CB 3.49Å; D376-L378 PolarHBondContact OD1-N 3.39Å; L378-T381 WeakPolarHBondContact CA-OG1 3.46Å; L378-T381 PolarHBondContact O-OG1 3.46Å; L378-K382 WeakPolarHBondContact O-CB 3.44Å; L378-K382 PolarHBondContact O-N 3.17Å
379	L	85.6	Confident	85.8	Confident	68 Å²	68	63.4 Å²	63.4	36%	0.356	34%	0.335	S	S	.	.	H	α-helix	trans	-67.6	-43.8	174.5	-71.9	-175.6	0	0	0	111.7	L301 D376 T381 K382 L383	L301-L379 HydrophobicContact CD1-CB 3.73Å; L301-L379 HydrophobicContact CD1-CD1 4.26Å; L301-L379 HydrophobicContact CD1-CD2 4.42Å; L301-L379 HydrophobicContact CD1-CG 4.36Å; L301-L379 WeakPolarHBondContact CD2-O 3.26Å; D376-L379 HydrophobicContact CB-CB 3.93Å; D376-L379 HydrophobicContact CB-CD1 3.88Å; D376-L379 HydrophobicContact CB-CG 4Å; D376-L379 VanDerWaalsContact CG-CG 3.5Å; D376-L379 PolarHBondContact O-N 3.49Å; D376-L379 PolarHBondContact OD1-N 2.9Å; D376-L379 WeakPolarHBondContact OD2-CD1 3.46Å; D376-L379 WeakPolarHBondContact OD2-CG 3.23Å; L379-T381 PolarHBondContact O-N 3.34Å; L379-K382 WeakPolarHBondContact O-CB 3.43Å; L379-K382 PolarHBondContact O-N 3.45Å; L379-L383 PolarHBondContact O-N 3.24Å
380	A	88.1	Confident	86.2	Confident	3 Å²	3	64.8 Å²	64.8	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-59.2	-48	176.5	0	0	0	0	0	111.8	L367 L375 D376 K382 L383 V384	L367-A380 HydrophobicContact CD2-CB 3.82Å; L375-A380 HydrophobicContact CD1-CB 4.06Å; D376-A380 WeakPolarHBondContact O-CB 3.17Å; D376-A380 PolarHBondContact O-N 2.99Å; A380-K382 VanDerWaalsContact C-N 3.28Å; A380-K382 PolarHBondContact O-N 3.42Å; A380-L383 PolarHBondContact O-N 3.29Å; A380-V384 VanDerWaalsContact O-CG2 3.31Å; A380-V384 WeakPolarHBondContact O-CG2 3.36Å; A380-V384 PolarHBondContact O-N 3.04Å
381	T	92	Very high	86.8	Confident	32 Å²	32	62 Å²	62	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-34.7	177.1	53.1	0	0	0	0	112.1	V359 S363 E377 L378 L379 V384 T385	V359-T381 HydrophobicContact CG1-CG2 3.93Å; S363-T381 PolarHBondContact OG-N 3.37Å; E377-T381 WeakPolarHBondContact O-CB 3.48Å; E377-T381 WeakPolarHBondContact O-CG2 3.35Å; E377-T381 PolarHBondContact O-N 2.99Å; E377-T381 PolarHBondContact O-OG1 2.87Å; L378-T381 WeakPolarHBondContact CA-OG1 3.46Å; L378-T381 PolarHBondContact O-OG1 3.46Å; L379-T381 PolarHBondContact O-N 3.34Å; T381-V384 PolarHBondContact O-N 2.82Å; T381-T385 VanDerWaalsContact O-CB 3.25Å; T381-T385 WeakPolarHBondContact O-CB 3.29Å; T381-T385 PolarHBondContact O-N 2.71Å; T381-T385 PolarHBondContact O-OG1 3.22Å
382	K	92.5	Very high	87.4	Confident	114 Å²	114	61.2 Å²	61.2	50%	0.496	31%	0.313	S	S	.	.	H	α-helix	trans	-64.1	-44.4	174.1	-171.9	-178.4	-179.3	-178.7	0	112.4	L304 L378 L379 A380 F386	L304-K382 HydrophobicContact CD1-CD 4.18Å; L304-K382 HydrophobicContact CD1-CG 3.93Å; L378-K382 WeakPolarHBondContact O-CB 3.44Å; L378-K382 PolarHBondContact O-N 3.17Å; L379-K382 WeakPolarHBondContact O-CB 3.43Å; L379-K382 PolarHBondContact O-N 3.45Å; A380-K382 VanDerWaalsContact C-N 3.28Å; A380-K382 PolarHBondContact O-N 3.42Å; K382-F386 PolarHBondContact O-N 3.45Å; K382-F386 VanDerWaalsContact O-N 3.1Å
383	L	93.9	Very high	88.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-49.9	175.2	-174.3	61.8	0	0	0	110.9	L289 F297 I300 L301 L304 L314 L367 L379 A380 T385 F386 M387	L289-L383 HydrophobicContact CD1-CD2 4.48Å; F297-L383 HydrophobicContact CB-CD2 3.93Å; F297-L383 HydrophobicContact CD1-CD2 4.39Å; I300-L383 HydrophobicContact CG2-CD1 4.32Å; L301-L383 HydrophobicContact CD2-CB 3.63Å; L301-L383 HydrophobicContact CD2-CD1 4.29Å; L301-L383 HydrophobicContact CD2-CG 4.45Å; L304-L383 HydrophobicContact CD2-CD1 4.19Å; L314-L383 HydrophobicContact CD2-CD1 4.37Å; L367-L383 HydrophobicContact CD2-CD2 4.02Å; L379-L383 PolarHBondContact O-N 3.24Å; A380-L383 PolarHBondContact O-N 3.29Å; L383-T385 VanDerWaalsContact C-N 3.28Å; L383-T385 PolarHBondContact O-N 2.96Å; L383-F386 WeakPolarHBondContact O-CB 3.36Å; L383-F386 PolarHBondContact O-N 2.74Å; L383-F386 VanDerWaalsContact O-N 3.12Å; L383-M387 HydrophobicContact CD1-CG 4.46Å; L383-M387 HydrophobicContact CD1-SD 4.49Å; L383-M387 HydrophobicContact CD2-SD 4.37Å; L383-M387 HydrophobicContact CG-CG 4.35Å; L383-M387 HydrophobicContact CG-SD 3.99Å; L383-M387 WeakPolarHBondContact O-CG 3.43Å; L383-M387 PolarHBondContact O-N 3.42Å
384	V	95.7	Very high	89.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.2	-39.4	-177.7	171.6	0	0	0	0	110.9	M336 V359 I366 A380 T381 M387 M388	M336-V384 HydrophobicContact CE-CG1 4.07Å; V359-V384 HydrophobicContact CG1-CG1 4.44Å; I366-V384 HydrophobicContact CB-CG2 4.01Å; I366-V384 HydrophobicContact CD1-CG1 3.74Å; I366-V384 HydrophobicContact CD1-CG2 4.33Å; I366-V384 HydrophobicContact CG2-CG2 3.85Å; A380-V384 VanDerWaalsContact O-CG2 3.31Å; A380-V384 WeakPolarHBondContact O-CG2 3.36Å; A380-V384 PolarHBondContact O-N 3.04Å; T381-V384 PolarHBondContact O-N 2.82Å; V384-M387 PolarHBondContact O-N 3.35Å; V384-M388 WeakPolarHBondContact O-CB 3.41Å; V384-M388 PolarHBondContact O-N 3.3Å
385	T	95.6	Very high	90.9	Very high	29 Å²	29	45 Å²	45	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-58.8	-49.3	173.3	-60.7	0	0	0	0	111	T381 L383 M387 M388 E389	T381-T385 VanDerWaalsContact O-CB 3.25Å; T381-T385 WeakPolarHBondContact O-CB 3.29Å; T381-T385 PolarHBondContact O-N 2.71Å; T381-T385 PolarHBondContact O-OG1 3.22Å; L383-T385 VanDerWaalsContact C-N 3.28Å; L383-T385 PolarHBondContact O-N 2.96Å; T385-M387 PolarHBondContact O-N 2.92Å; T385-M388 PolarHBondContact O-N 2.92Å; T385-E389 WeakPolarHBondContact O-CG 3.37Å; T385-E389 PolarHBondContact O-N 3.38Å
386	F	95.8	Very high	91.7	Very high	16 Å²	16	51.7 Å²	51.7	7%	0.07	25%	0.253	C	S	.	.	H	α-helix	trans	-60.9	-43.8	177.2	-179.8	-92.6	0	0	0	112.1	L304 K307 A310 L314 K382 L383 M388 E389 H390 V394	L304-F386 HydrophobicContact CD2-CB 3.98Å; L304-F386 HydrophobicContact CD2-CD1 3.62Å; L304-F386 HydrophobicContact CD2-CD2 3.99Å; L304-F386 HydrophobicContact CD2-CE1 4.06Å; L304-F386 HydrophobicContact CD2-CE2 4.38Å; L304-F386 HydrophobicContact CD2-CG 3.58Å; L304-F386 HydrophobicContact CD2-CZ 4.43Å; K307-F386 HydrophobicContact CB-CE2 4.43Å; K307-F386 HydrophobicContact CG-CE2 4.22Å; A310-F386 HydrophobicContact CB-CE1 4.02Å; A310-F386 HydrophobicContact CB-CZ 3.92Å; L314-F386 HydrophobicContact CD1-CD1 3.83Å; L314-F386 HydrophobicContact CD1-CE1 3.73Å; K382-F386 PolarHBondContact O-N 3.45Å; K382-F386 VanDerWaalsContact O-N 3.1Å; L383-F386 WeakPolarHBondContact O-CB 3.36Å; L383-F386 PolarHBondContact O-N 2.74Å; L383-F386 VanDerWaalsContact O-N 3.12Å; F386-M388 VanDerWaalsContact C-N 3.33Å; F386-M388 PolarHBondContact O-N 3.13Å; F386-E389 PolarHBondContact O-N 3.5Å; F386-H390 AromaticContact CD2-CD2 3.57Å; F386-H390 AromaticContact CE2-CD2 3.36Å; F386-H390 WeakPolarHBondContact CE2-CD2 3.22Å; F386-H390 AromaticContact CE2-NE2 3.68Å; F386-H390 AromaticContact CZ-CD2 3.69Å; F386-H390 PolarHBondContact O-CD2 2.99Å; F386-H390 PolarHBondContact O-N 3.04Å; F386-V394 HydrophobicContact CD1-CG1 4.5Å; F386-V394 HydrophobicContact CE1-CG1 3.97Å
387	M	96.6	Very high	92.2	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-37.3	178.2	-69.3	-178.1	75.1	0	0	112.3	L289 L314 L329 L333 L383 V384 T385 H390 H391 V394 L395	L289-M387 HydrophobicContact CD1-SD 4.34Å; L289-M387 HydrophobicContact CD2-CE 4.36Å; L314-M387 HydrophobicContact CD1-CG 3.97Å; L314-M387 HydrophobicContact CD2-CE 4.28Å; L314-M387 HydrophobicContact CD2-CG 4.33Å; L314-M387 HydrophobicContact CD2-SD 4.13Å; L329-M387 HydrophobicContact CD2-CE 3.98Å; L333-M387 HydrophobicContact CD1-CB 4.03Å; L333-M387 HydrophobicContact CD1-CE 4.14Å; L333-M387 HydrophobicContact CD2-CB 4.13Å; L383-M387 HydrophobicContact CD1-CG 4.46Å; L383-M387 HydrophobicContact CD1-SD 4.49Å; L383-M387 HydrophobicContact CD2-SD 4.37Å; L383-M387 HydrophobicContact CG-CG 4.35Å; L383-M387 HydrophobicContact CG-SD 3.99Å; L383-M387 WeakPolarHBondContact O-CG 3.43Å; L383-M387 PolarHBondContact O-N 3.42Å; V384-M387 PolarHBondContact O-N 3.35Å; T385-M387 PolarHBondContact O-N 2.92Å; M387-H390 CarbonylContact O-C 3.45Å; M387-H391 WeakPolarHBondContact O-CA 3.41Å; M387-H391 WeakPolarHBondContact O-CB 3.32Å; M387-H391 PolarHBondContact O-N 2.88Å; M387-V394 HydrophobicContact CB-CG2 4.5Å; M387-L395 HydrophobicContact CE-CD2 4.25Å
388	M	96.1	Very high	92.5	Very high	7 Å²	7	45.2 Å²	45.2	3%	0.034	22%	0.224	C	C	.	.	H	α-helix	trans	-67.7	-44.6	175.9	178.4	-175.7	66.9	0	0	111.6	L333 M336 A337 R355 V359 V384 T385 F386 H390 H391	L333-M388 HydrophobicContact CD2-CB 4.41Å; M336-M388 HydrophobicContact CB-CG 3.95Å; M336-M388 HydrophobicContact CB-SD 3.79Å; M336-M388 HydrophobicContact CE-CG 4.46Å; M336-M388 HydrophobicContact CE-SD 3.85Å; A337-M388 HydrophobicContact CB-CG 4.46Å; R355-M388 HydrophobicContact CG-CE 3.75Å; V359-M388 HydrophobicContact CG2-CE 3.76Å; V359-M388 HydrophobicContact CG2-SD 4.25Å; V384-M388 WeakPolarHBondContact O-CB 3.41Å; V384-M388 PolarHBondContact O-N 3.3Å; T385-M388 PolarHBondContact O-N 2.92Å; F386-M388 VanDerWaalsContact C-N 3.33Å; F386-M388 PolarHBondContact O-N 3.13Å; M388-H390 VanDerWaalsContact C-N 3.31Å; M388-H390 PolarHBondContact O-N 2.91Å; M388-H391 PolarHBondContact O-ND1 2.9Å
389	E	94.1	Very high	92.6	Very high	99 Å²	99	42.9 Å²	42.9	46%	0.463	22%	0.219	S	C	.	.	H	α-helix	trans	-64.6	-36.4	178.8	-72.4	-176.5	155.6	0	0	112.8	R355 T385 F386	R355-E389 IonicContact CZ-OE1 3.56Å; R355-E389 IonicContact NE-OE1 2.65Å; R355-E389 IonicContact NH2-OE1 2.6Å; R355-E389 PolarHBondContact NH2-OE1 2.97Å; T385-E389 WeakPolarHBondContact O-CG 3.37Å; T385-E389 PolarHBondContact O-N 3.38Å; F386-E389 PolarHBondContact O-N 3.5Å
390	H	94.1	Very high	92.6	Very high	50 Å²	50	43.7 Å²	43.7	23%	0.231	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	25.3	-176.1	-62.3	-68.9	0	0	0	112.9	F386 M387 M388 D392 S393 V394	F386-H390 AromaticContact CD2-CD2 3.57Å; F386-H390 AromaticContact CE2-CD2 3.36Å; F386-H390 WeakPolarHBondContact CE2-CD2 3.22Å; F386-H390 AromaticContact CE2-NE2 3.68Å; F386-H390 AromaticContact CZ-CD2 3.69Å; F386-H390 PolarHBondContact O-CD2 2.99Å; F386-H390 PolarHBondContact O-N 3.04Å; M387-H390 CarbonylContact O-C 3.45Å; M388-H390 VanDerWaalsContact C-N 3.31Å; M388-H390 PolarHBondContact O-N 2.91Å; H390-D392 PolarHBondContact O-N 3.42Å; H390-S393 PolarHBondContact O-N 2.86Å; H390-S393 PolarHBondContact O-OG 3.4Å; H390-V394 HydrophobicContact CB-CG1 3.55Å; H390-V394 WeakPolarHBondContact O-CG1 3.44Å; H390-V394 VanDerWaalsContact O-CG2 3.27Å; H390-V394 WeakPolarHBondContact O-CG2 3.42Å; H390-V394 PolarHBondContact O-N 3.01Å
391	H	93.4	Very high	92.7	Very high	18 Å²	18	43.7 Å²	43.7	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-56.3	-27.6	-172.1	67.7	-81.2	0	0	0	114.8	L333 A337 M387 M388	L333-H391 HydrophobicContact CB-CB 3.84Å; A337-H391 WeakPolarHBondContact CB-CE1 3.42Å; A337-H391 VanDerWaalsContact CB-ND1 3.31Å; A337-H391 WeakPolarHBondContact CB-ND1 3.47Å; M387-H391 WeakPolarHBondContact O-CA 3.41Å; M387-H391 WeakPolarHBondContact O-CB 3.32Å; M387-H391 PolarHBondContact O-N 2.88Å; M388-H391 PolarHBondContact O-ND1 2.9Å
392	D	89.8	Confident	92.5	Very high	112 Å²	112	45.3 Å²	45.3	60%	0.599	23%	0.228	S	C	*	.	H	α-helix	trans	-74	-26.4	178.1	-71.3	-40.2	0	0	0	113.6	H390	H390-D392 PolarHBondContact O-N 3.42Å
393	S	91.8	Very high	92.3	Very high	44 Å²	44	45.8 Å²	45.8	31%	0.308	23%	0.227	S	C	.	.	H	α-helix	trans	-104.5	-41.9	-177.8	64.7	0	0	0	0	112.9	Q315 H390 L395 R396	Q315-S393 VanDerWaalsContact CG-O 3.28Å; Q315-S393 WeakPolarHBondContact CG-O 3.17Å; Q315-S393 PolarHBondContact NE2-O 2.94Å; H390-S393 PolarHBondContact O-N 2.86Å; H390-S393 PolarHBondContact O-OG 3.4Å; S393-L395 VanDerWaalsContact C-N 3.27Å; S393-L395 PolarHBondContact O-N 3.17Å; S393-R396 WeakPolarHBondContact O-CB 3.47Å; S393-R396 PolarHBondContact O-N 3.13Å; S393-R396 VanDerWaalsContact O-N 3.13Å
394	V	93.8	Very high	91.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.6	-19.5	-168	-63.4	0	0	0	0	115.1	A311 L314 Q315 F386 M387 H390	A311-V394 HydrophobicContact CB-CG1 4.23Å; L314-V394 CarbonylContact C-O 3.57Å; L314-V394 VanDerWaalsContact C-O 3.23Å; L314-V394 HydrophobicContact CB-CB 4.02Å; L314-V394 HydrophobicContact CD1-CB 3.88Å; L314-V394 HydrophobicContact CD1-CG1 3.77Å; Q315-V394 WeakPolarHBondContact CA-O 3.23Å; Q315-V394 PolarHBondContact N-O 2.99Å; Q315-V394 VanDerWaalsContact N-O 3.1Å; F386-V394 HydrophobicContact CD1-CG1 4.5Å; F386-V394 HydrophobicContact CE1-CG1 3.97Å; M387-V394 HydrophobicContact CB-CG2 4.5Å; H390-V394 HydrophobicContact CB-CG1 3.55Å; H390-V394 WeakPolarHBondContact O-CG1 3.44Å; H390-V394 VanDerWaalsContact O-CG2 3.27Å; H390-V394 WeakPolarHBondContact O-CG2 3.42Å; H390-V394 PolarHBondContact O-N 3.01Å
395	L	93.2	Very high	91.6	Very high	7 Å²	7	49.6 Å²	49.6	4%	0.037	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	13.1	177	-60.6	-179.8	0	0	0	113.3	R326 L329 Q330 L333 M387 S393	R326-L395 PolarHBondContact NH2-O 3.03Å; L329-L395 HydrophobicContact CD2-CD1 3.94Å; L329-L395 HydrophobicContact CD2-CD2 3.95Å; L329-L395 HydrophobicContact CG-CD1 3.91Å; Q330-L395 HydrophobicContact CB-CD1 4.28Å; Q330-L395 HydrophobicContact CG-CB 3.99Å; Q330-L395 HydrophobicContact CG-CD1 3.56Å; Q330-L395 HydrophobicContact CG-CG 4.42Å; Q330-L395 PolarHBondContact NE2-O 2.65Å; L333-L395 HydrophobicContact CD1-CD1 3.66Å; L333-L395 HydrophobicContact CD1-CG 4.39Å; M387-L395 HydrophobicContact CE-CD2 4.25Å; S393-L395 VanDerWaalsContact C-N 3.27Å; S393-L395 PolarHBondContact O-N 3.17Å
396	R	92.8	Very high	91.1	Very high	174 Å²	174	51.7 Å²	51.7	66%	0.657	26%	0.255	S	S	*	.	S	Bend	trans	-71.9	150.5	175.9	-168.4	171.8	178.8	170.3	-0	110.2	Q315 S393 P398	Q315-R396 WeakPolarHBondContact CB-O 3.42Å; Q315-R396 VanDerWaalsContact CG-O 3.32Å; Q315-R396 WeakPolarHBondContact CG-O 3.05Å; S393-R396 WeakPolarHBondContact O-CB 3.47Å; S393-R396 PolarHBondContact O-N 3.13Å; S393-R396 VanDerWaalsContact O-N 3.13Å; R396-P398 WeakPolarHBondContact O-CD 3.49Å
397	V	91.3	Very high	90.6	Very high	32 Å²	32	54.8 Å²	54.8	19%	0.194	27%	0.272	C	S	.	.			trans	-70.1	124.2	173.4	179.4	0	0	0	0	109	N222 V223 V226 L319 S399	N222-V397 WeakPolarHBondContact O-CG2 3.4Å; V223-V397 HydrophobicContact CB-CG1 4.28Å; V223-V397 HydrophobicContact CG1-CG1 4.05Å; V223-V397 HydrophobicContact CG2-CG1 4.1Å; V226-V397 HydrophobicContact CG1-CG2 4.14Å; L319-V397 HydrophobicContact CD2-CG1 4.5Å; V397-S399 PolarHBondContact O-N 2.87Å
398	P	90.5	Very high	89.9	Confident	9 Å²	9	57 Å²	57	6%	0.058	28%	0.282	C	S	.	.			trans	-71.8	108.9	179.3	26.7	-30.9	0	0	0	110.3	Q315 V316 L319 R396 N400 L401 H402	Q315-P398 HydrophobicContact CB-CB 4.43Å; Q315-P398 HydrophobicContact CB-CG 4.43Å; V316-P398 HydrophobicContact CG2-CG 4.15Å; L319-P398 HydrophobicContact CD1-CG 3.9Å; R396-P398 WeakPolarHBondContact O-CD 3.49Å; P398-N400 VanDerWaalsContact C-N 3.26Å; P398-N400 PolarHBondContact O-N 3.49Å; P398-L401 HydrophobicContact CB-CB 4.33Å; P398-L401 HydrophobicContact CG-CB 4.06Å; P398-L401 HydrophobicContact CG-CD2 4.25Å; P398-L401 PolarHBondContact O-N 3.44Å; P398-H402 PolarHBondContact O-N 2.88Å
399	S	87.6	Confident	89.3	Confident	86 Å²	86	57.2 Å²	57.2	60%	0.601	28%	0.283	S	S	*	.	H	α-helix	trans	-62.7	-31.9	-179.2	51.6	0	0	0	0	112.9	V397 H402 R403	V397-S399 PolarHBondContact O-N 2.87Å; S399-H402 PolarHBondContact O-N 3.29Å; S399-R403 WeakPolarHBondContact O-CB 3.39Å; S399-R403 PolarHBondContact O-N 3.44Å
400	N	86.1	Confident	88.7	Confident	84 Å²	84	54.2 Å²	54.2	45%	0.449	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-43.8	177	-69.7	-27.6	0	0	0	112.2	P398 R403 H404	P398-N400 VanDerWaalsContact C-N 3.26Å; P398-N400 PolarHBondContact O-N 3.49Å; N400-R403 PolarHBondContact O-N 3.33Å; N400-H404 VanDerWaalsContact O-CG 3.24Å; N400-H404 PolarHBondContact O-N 2.87Å
401	L	89.3	Confident	88.1	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-45.7	177	178.8	65.1	0	0	0	110.6	W188 M191 T192 H195 L319 P398 R403 H404 V405	W188-L401 HydrophobicContact CZ3-CG 4.41Å; M191-L401 HydrophobicContact CB-CD1 4.39Å; T192-L401 HydrophobicContact CG2-CD2 4.17Å; H195-L401 HydrophobicContact CB-CD1 4.02Å; L319-L401 HydrophobicContact CD1-CD2 3.49Å; L319-L401 VanDerWaalsContact CD1-CD2 3.49Å; P398-L401 HydrophobicContact CB-CB 4.33Å; P398-L401 HydrophobicContact CG-CB 4.06Å; P398-L401 HydrophobicContact CG-CD2 4.25Å; P398-L401 PolarHBondContact O-N 3.44Å; L401-R403 PolarHBondContact O-N 3.43Å; L401-H404 PolarHBondContact O-N 3.46Å; L401-V405 HydrophobicContact CD1-CG2 4.28Å; L401-V405 WeakPolarHBondContact O-CG2 3.46Å; L401-V405 PolarHBondContact O-N 3.1Å
402	H	88.3	Confident	87.1	Confident	67 Å²	67	55 Å²	55	31%	0.31	28%	0.277	S	S	.	.	H	α-helix	trans	-57.9	-48.1	177.2	177.8	-91.1	0	0	0	111.8	W188 F224 P398 S399 H404 V405 D406	W188-H402 HydrophobicContact CH2-CB 4.39Å; W188-H402 AromaticContact CH2-CD2 3.89Å; F224-H402 AromaticContact CE1-CD2 3.81Å; F224-H402 AromaticContact CE1-NE2 3.3Å; F224-H402 VanDerWaalsContact CE1-NE2 3.3Å; F224-H402 WeakPolarHBondContact CE1-NE2 3.18Å; F224-H402 AromaticContact CZ-CD2 3.76Å; F224-H402 AromaticContact CZ-NE2 3.56Å; P398-H402 PolarHBondContact O-N 2.88Å; S399-H402 PolarHBondContact O-N 3.29Å; H402-H404 PolarHBondContact O-N 3.12Å; H402-V405 PolarHBondContact O-N 3.37Å; H402-D406 WeakPolarHBondContact O-CB 3.29Å; H402-D406 PolarHBondContact O-N 3.36Å
403	R	88.8	Confident	86.3	Confident	124 Å²	124	56.8 Å²	56.8	47%	0.468	28%	0.276	S	S	.	.	H	α-helix	trans	-59.9	-46	177.2	-175	176.5	62	76.3	0.4	111.8	S399 N400 L401 V405 D406 D407	S399-R403 WeakPolarHBondContact O-CB 3.39Å; S399-R403 PolarHBondContact O-N 3.44Å; N400-R403 PolarHBondContact O-N 3.33Å; L401-R403 PolarHBondContact O-N 3.43Å; R403-V405 VanDerWaalsContact C-N 3.34Å; R403-V405 PolarHBondContact O-N 3.43Å; R403-D406 PolarHBondContact O-N 2.91Å; R403-D407 IonicContact NH1-OD2 3.84Å; R403-D407 PolarHBondContact NH1-OD2 2.67Å; R403-D407 WeakPolarHBondContact O-CB 3.34Å; R403-D407 PolarHBondContact O-N 2.9Å
404	H	85.8	Confident	85.3	Confident	79 Å²	79	62.4 Å²	62.4	37%	0.366	29%	0.29	S	S	.	.	H	α-helix	trans	-63.1	-39.3	179.1	-68.8	172.1	0	0	0	112.6	M191 N400 L401 H402 H408	M191-H404 HydrophobicContact CE-CB 3.81Å; M191-H404 WeakPolarHBondContact CE-O 3.44Å; N400-H404 VanDerWaalsContact O-CG 3.24Å; N400-H404 PolarHBondContact O-N 2.87Å; L401-H404 PolarHBondContact O-N 3.46Å; H402-H404 PolarHBondContact O-N 3.12Å; H404-H408 WeakPolarHBondContact O-CB 3.48Å; H404-H408 PolarHBondContact O-N 2.85Å
405	V	88.8	Confident	83.6	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-42.4	176.4	176.1	0	0	0	0	110.9	I187 W188 M191 L401 H402 R403 H408 L409	I187-V405 HydrophobicContact CG2-CG1 4.07Å; W188-V405 HydrophobicContact CD2-CB 4.42Å; W188-V405 HydrophobicContact CD2-CG1 3.8Å; W188-V405 HydrophobicContact CD2-CG2 4.2Å; W188-V405 VanDerWaalsContact CE2-CG1 3.45Å; W188-V405 HydrophobicContact CE3-CB 4.41Å; W188-V405 HydrophobicContact CE3-CG1 4.27Å; W188-V405 HydrophobicContact CE3-CG2 3.86Å; W188-V405 HydrophobicContact CG-CG1 4.24Å; W188-V405 HydrophobicContact CH2-CB 3.99Å; W188-V405 HydrophobicContact CH2-CG1 4.13Å; W188-V405 HydrophobicContact CH2-CG2 4.15Å; W188-V405 HydrophobicContact CZ2-CB 3.99Å; W188-V405 HydrophobicContact CZ2-CG1 3.64Å; W188-V405 HydrophobicContact CZ2-CG2 4.47Å; W188-V405 HydrophobicContact CZ3-CB 4.2Å; W188-V405 HydrophobicContact CZ3-CG1 4.43Å; W188-V405 HydrophobicContact CZ3-CG2 3.84Å; M191-V405 HydrophobicContact CB-CG2 3.89Å; M191-V405 HydrophobicContact CE-CG2 4.05Å; M191-V405 HydrophobicContact CG-CG2 4.36Å; M191-V405 HydrophobicContact SD-CB 4.18Å; M191-V405 HydrophobicContact SD-CG2 3.66Å; L401-V405 HydrophobicContact CD1-CG2 4.28Å; L401-V405 WeakPolarHBondContact O-CG2 3.46Å; L401-V405 PolarHBondContact O-N 3.1Å; H402-V405 PolarHBondContact O-N 3.37Å; R403-V405 VanDerWaalsContact C-N 3.34Å; R403-V405 PolarHBondContact O-N 3.43Å; V405-H408 PolarHBondContact O-N 3.36Å; V405-L409 HydrophobicContact CG1-CD1 3.85Å; V405-L409 HydrophobicContact CG1-CG 4.28Å; V405-L409 WeakPolarHBondContact O-CB 3.38Å; V405-L409 VanDerWaalsContact O-CG 3.32Å; V405-L409 WeakPolarHBondContact O-CG 3.38Å; V405-L409 PolarHBondContact O-N 2.88Å
406	D	85.8	Confident	82	Confident	74 Å²	74	68.9 Å²	68.9	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-66.4	-40.7	177.9	-166.8	50.1	0	0	0	112.4	H402 R403 H408 L409 S410	H402-D406 WeakPolarHBondContact O-CB 3.29Å; H402-D406 PolarHBondContact O-N 3.36Å; R403-D406 PolarHBondContact O-N 2.91Å; D406-H408 VanDerWaalsContact C-N 3.32Å; D406-H408 PolarHBondContact O-N 3.07Å; D406-L409 PolarHBondContact O-N 3.15Å; D406-S410 WeakPolarHBondContact O-CB 3.42Å; D406-S410 PolarHBondContact O-N 3.49Å; D406-S410 PolarHBondContact O-OG 3.47Å
407	D	84.1	Confident	80.3	Confident	80 Å²	80	65.2 Å²	65.2	43%	0.428	32%	0.319	S	S	.	.	H	α-helix	trans	-60.2	-43.1	172.9	-74	-23.9	0	0	0	110.8	R403 H411	R403-D407 IonicContact NH1-OD2 3.84Å; R403-D407 PolarHBondContact NH1-OD2 2.67Å; R403-D407 WeakPolarHBondContact O-CB 3.34Å; R403-D407 PolarHBondContact O-N 2.9Å; D407-H411 WeakPolarHBondContact O-CB 3.33Å; D407-H411 PolarHBondContact O-N 3.02Å
408	H	81.8	Confident	78.5	Confident	49 Å²	49	67 Å²	67	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-67.1	-46.4	177.7	-172.6	70.5	0	0	0	112	M191 H404 V405 D406 S410 H411 L412	M191-H408 HydrophobicContact CE-CB 4.2Å; M191-H408 HydrophobicContact SD-CB 3.9Å; H404-H408 WeakPolarHBondContact O-CB 3.48Å; H404-H408 PolarHBondContact O-N 2.85Å; V405-H408 PolarHBondContact O-N 3.36Å; D406-H408 VanDerWaalsContact C-N 3.32Å; D406-H408 PolarHBondContact O-N 3.07Å; H408-S410 VanDerWaalsContact C-N 3.34Å; H408-S410 PolarHBondContact O-N 2.92Å; H408-H411 WeakPolarHBondContact O-CB 3.28Å; H408-H411 PolarHBondContact O-N 3.18Å; H408-L412 VanDerWaalsContact O-CG 3.32Å; H408-L412 WeakPolarHBondContact O-CG 3.28Å; H408-L412 PolarHBondContact O-N 2.81Å
409	L	84.8	Confident	76.6	Confident	11 Å²	11	72.8 Å²	72.8	6%	0.058	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-41.2	175.9	-72.9	170.7	0	0	0	111.7	I179 V184 I187 V405 D406 L412 R413	I179-L409 HydrophobicContact CD1-CD2 4.18Å; V184-L409 HydrophobicContact CG1-CD1 4.46Å; V184-L409 HydrophobicContact CG2-CD2 4.15Å; I187-L409 HydrophobicContact CD1-CD2 3.59Å; I187-L409 HydrophobicContact CG2-CD2 4.48Å; V405-L409 HydrophobicContact CG1-CD1 3.85Å; V405-L409 HydrophobicContact CG1-CG 4.28Å; V405-L409 WeakPolarHBondContact O-CB 3.38Å; V405-L409 VanDerWaalsContact O-CG 3.32Å; V405-L409 WeakPolarHBondContact O-CG 3.38Å; V405-L409 PolarHBondContact O-N 2.88Å; D406-L409 PolarHBondContact O-N 3.15Å; L409-L412 PolarHBondContact O-N 3.47Å; L409-R413 VanDerWaalsContact O-CG 3.3Å; L409-R413 WeakPolarHBondContact O-CG 3.39Å; L409-R413 PolarHBondContact O-N 2.88Å
410	S	81.8	Confident	74.5	Confident	36 Å²	36	70.9 Å²	70.9	25%	0.252	34%	0.335	S	S	.	.	H	α-helix	trans	-63	-43.9	174.7	-68.2	0	0	0	0	111	D406 H408 L412 R413 R414	D406-S410 WeakPolarHBondContact O-CB 3.42Å; D406-S410 PolarHBondContact O-N 3.49Å; D406-S410 PolarHBondContact O-OG 3.47Å; H408-S410 VanDerWaalsContact C-N 3.34Å; H408-S410 PolarHBondContact O-N 2.92Å; S410-L412 VanDerWaalsContact C-N 3.32Å; S410-L412 PolarHBondContact O-N 3Å; S410-R413 PolarHBondContact O-N 2.9Å; S410-R414 WeakPolarHBondContact O-CG 3.12Å; S410-R414 PolarHBondContact O-N 3.02Å; S410-R414 VanDerWaalsContact O-N 3.09Å
411	H	79.5	Confident	72.7	Confident	58 Å²	58	69.7 Å²	69.7	27%	0.269	34%	0.342	S	S	.	.	H	α-helix	trans	-58.4	-46.6	173.7	-175.7	78.5	0	0	0	110.4	R176 D407 H408 R413 R414	R176-H411 PolarHBondContact NH1-O 3.06Å; D407-H411 WeakPolarHBondContact O-CB 3.33Å; D407-H411 PolarHBondContact O-N 3.02Å; H408-H411 WeakPolarHBondContact O-CB 3.28Å; H408-H411 PolarHBondContact O-N 3.18Å; H411-R413 VanDerWaalsContact C-N 3.31Å; H411-R413 PolarHBondContact O-N 2.95Å; H411-R414 PolarHBondContact O-N 3.38Å
412	L	73.6	Confident	70.6	Confident	26 Å²	26	72.1 Å²	72.1	14%	0.136	36%	0.363	C	S	.	.	H	α-helix	trans	-60.8	-35	177.8	-71	177.6	0	0	0	113.1	I131 R176 I179 I187 H408 L409 S410	I131-L412 HydrophobicContact CD1-CD2 3.34Å; I131-L412 HydrophobicContact CG1-CD2 4.35Å; R176-L412 WeakPolarHBondContact CD-O 3.27Å; R176-L412 PolarHBondContact NH1-O 3.33Å; I179-L412 HydrophobicContact CD1-CB 3.49Å; I179-L412 VanDerWaalsContact CD1-CB 3.49Å; I179-L412 HydrophobicContact CD1-CD1 4.24Å; I179-L412 HydrophobicContact CG1-CB 4.41Å; I187-L412 HydrophobicContact CD1-CD1 3.52Å; H408-L412 VanDerWaalsContact O-CG 3.32Å; H408-L412 WeakPolarHBondContact O-CG 3.28Å; H408-L412 PolarHBondContact O-N 2.81Å; L409-L412 PolarHBondContact O-N 3.47Å; S410-L412 VanDerWaalsContact C-N 3.32Å; S410-L412 PolarHBondContact O-N 3Å
413	R	72.8	Confident	68.6	Low	149 Å²	149	72.4 Å²	72.4	56%	0.562	37%	0.367	S	S	*	.	H	α-helix	trans	-80.5	-18.1	178.4	-68.9	170.1	-177.8	157.4	-0.6	114.6	I179 L409 S410 H411 V415	I179-R413 HydrophobicContact CD1-CG 3.63Å; I179-R413 HydrophobicContact CG1-CG 4.37Å; L409-R413 VanDerWaalsContact O-CG 3.3Å; L409-R413 WeakPolarHBondContact O-CG 3.39Å; L409-R413 PolarHBondContact O-N 2.88Å; S410-R413 PolarHBondContact O-N 2.9Å; H411-R413 VanDerWaalsContact C-N 3.31Å; H411-R413 PolarHBondContact O-N 2.95Å; R413-V415 PolarHBondContact O-N 3.39Å
414	R	70.1	Confident	66.4	Low	162 Å²	162	72.9 Å²	72.9	61%	0.611	38%	0.384	S	S	*	.	S	Bend	trans	-66.3	128.5	-178	-80.1	173.4	-167.4	172.8	6.4	111.1	R176 S410 H411	R176-R414 WeakPolarHBondContact CD-O 3.3Å; R176-R414 PolarHBondContact NE-O 3.47Å; S410-R414 WeakPolarHBondContact O-CG 3.12Å; S410-R414 PolarHBondContact O-N 3.02Å; S410-R414 VanDerWaalsContact O-N 3.09Å; H411-R414 PolarHBondContact O-N 3.38Å
415	V	59.2	Low	64.1	Low	88 Å²	88	75.4 Å²	75.4	53%	0.533	40%	0.4	S	S	.	.			trans	-66.8	130.4	171.8	-179.1	0	0	0	0	109.1	I173 R413	I173-V415 HydrophobicContact CG2-CG1 3.72Å; R413-V415 PolarHBondContact O-N 3.39Å
416	Q	58.3	Low	61.8	Low	56 Å²	56	77.7 Å²	77.7	26%	0.262	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.4	173.1	-79.7	179	-49.3	0	0	109.9	I174	I174-Q416 PolarHBondContact N-O 2.93Å
417	I	57.1	Low	59.6	Low	97 Å²	97	79.5 Å²	79.5	50%	0.497	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	117	174.1	-58.3	173.2	0	0	0	106.9	C171 Y419	C171-I417 HydrophobicContact CB-CG2 4.35Å; I417-Y419 HydrophobicContact CG2-CE1 4.43Å; I417-Y419 HydrophobicContact CG2-CE2 4.11Å
418	K	53.4	Low	57.4	Low	69 Å²	69	83 Å²	83	30%	0.3	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	120.2	174.8	-167.7	173.7	-177.9	177.5	0	108.6	K172 I174 D423	K172-K418 PolarHBondContact N-O 3.17Å; K172-K418 PolarHBondContact O-N 3.04Å; K172-K418 VanDerWaalsContact O-N 3.1Å; I174-K418 HydrophobicContact CD1-CB 3.87Å; I174-K418 HydrophobicContact CD1-CD 3.71Å; I174-K418 HydrophobicContact CD1-CG 4.44Å; I174-K418 HydrophobicContact CG1-CB 4.41Å; K418-D423 WeakPolarHBondContact CE-OD1 3.33Å; K418-D423 WeakPolarHBondContact CE-OD2 3.42Å; K418-D423 IonicContact NZ-OD1 2.62Å; K418-D423 IonicContact NZ-OD2 3.89Å; K418-D423 PolarHBondContact NZ-OD2 3.38Å
419	Y	51.7	Low	55.3	Low	130 Å²	130	85.5 Å²	85.5	51%	0.51	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126.2	170.7	-61.9	-86.4	0	0	0	107.9	C171 I417 G421 A422	C171-Y419 WeakPolarHBondContact SG-CD1 3.36Å; C171-Y419 WeakPolarHBondContact SG-CE1 3.29Å; I417-Y419 HydrophobicContact CG2-CE1 4.43Å; I417-Y419 HydrophobicContact CG2-CE2 4.11Å; Y419-G421 PolarHBondContact O-N 3.02Å; Y419-A422 PolarHBondContact O-N 3.45Å
420	A	44.1	Very low	52.9	Low	46 Å²	46	89.6 Å²	89.6	38%	0.38	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	136.8	170.9	0	0	0	0	0	109.5	H169 E170	H169-A420 HydrophobicContact CB-CB 4.3Å; H169-A420 VanDerWaalsContact CB-O 3.26Å; H169-A420 WeakPolarHBondContact CB-O 3.36Å; H169-A420 PolarHBondContact CD2-O 2.99Å; E170-A420 PolarHBondContact O-N 2.92Å
421	G	46.8	Very low	51.1	Low	59 Å²	59	93.7 Å²	93.7	61%	0.608	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-6.1	-179.4	0	0	0	0	0	116.9	Y419 D423 T424	Y419-G421 PolarHBondContact O-N 3.02Å; G421-D423 VanDerWaalsContact C-N 3.32Å; G421-T424 PolarHBondContact O-OG1 3.41Å
422	A	46.6	Very low	49.2	Very low	55 Å²	55	96.4 Å²	96.4	46%	0.455	55%	0.554	S	S	.	*			trans	-79	-13	175	0	0	0	0	0	114.1	Y419 A426	Y419-A422 PolarHBondContact O-N 3.45Å; A422-A426 WeakPolarHBondContact O-CB 3.17Å; A422-A426 PolarHBondContact O-N 3.44Å
423	D	45.5	Very low	47.7	Very low	72 Å²	72	100.5 Å²	100.5	39%	0.385	57%	0.569	S	S	.	*	H	α-helix	trans	-87.2	-11.7	-170.5	-73.6	-6.4	0	0	0	114.9	K418 G421 D425	K418-D423 WeakPolarHBondContact CE-OD1 3.33Å; K418-D423 WeakPolarHBondContact CE-OD2 3.42Å; K418-D423 IonicContact NZ-OD1 2.62Å; K418-D423 IonicContact NZ-OD2 3.89Å; K418-D423 PolarHBondContact NZ-OD2 3.38Å; G421-D423 VanDerWaalsContact C-N 3.32Å; D423-D425 PolarHBondContact O-N 3.42Å
424	T	42	Very low	46.5	Very low	134 Å²	134	99.5 Å²	99.5	82%	0.822	58%	0.583	S	S	*	*	H	α-helix	trans	-71.6	-11.2	176.8	31	0	0	0	0	113.3	G421	G421-T424 PolarHBondContact O-OG1 3.41Å
425	D	38.7	Very low	45.6	Very low	133 Å²	133	98.5 Å²	98.5	71%	0.711	58%	0.58	S	S	*	*	H	α-helix	trans	-128.4	-14.2	175.1	-110.1	-15.2	0	0	0	114.4	D423 S427	D423-D425 PolarHBondContact O-N 3.42Å; D425-S427 PolarHBondContact O-N 2.95Å
426	A	39.7	Very low	45.5	Very low	48 Å²	48	104.1 Å²	104.1	40%	0.397	60%	0.597	S	S	.	*	H	α-helix	trans	-80.7	-12.9	-176.2	0	0	0	0	0	114.6	A422 L428 V429	A422-A426 WeakPolarHBondContact O-CB 3.17Å; A422-A426 PolarHBondContact O-N 3.44Å; A426-L428 PolarHBondContact O-N 2.99Å; A426-L428 VanDerWaalsContact O-N 3.15Å; A426-V429 PolarHBondContact O-N 2.96Å
427	S	39.4	Very low	46	Very low	112 Å²	112	104.6 Å²	104.6	78%	0.783	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-11.5	177.3	-59.3	0	0	0	0	113.6	D425	D425-S427 PolarHBondContact O-N 2.95Å
428	L	38.1	Very low	46.8	Very low	154 Å²	154	102.7 Å²	102.7	81%	0.806	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-7.5	178.5	-76.5	163	0	0	0	114.1	A426 S430	A426-L428 PolarHBondContact O-N 2.99Å; A426-L428 VanDerWaalsContact O-N 3.15Å; L428-S430 VanDerWaalsContact C-N 3.32Å; L428-S430 PolarHBondContact O-N 2.94Å
429	V	37.9	Very low	47.4	Very low	100 Å²	100	109.7 Å²	109.7	61%	0.606	62%	0.62	S	S	*	*			trans	-86	81.6	-177.3	-170.2	0	0	0	0	109.5	A426	A426-V429 PolarHBondContact O-N 2.96Å
430	S	35	Very low	48.3	Very low	98 Å²	98	107 Å²	107	69%	0.685	63%	0.625	S	S	*	*			trans	-48.3	142.4	152.1	-64.6	0	0	0	0	108.7	L428 S432	L428-S430 VanDerWaalsContact C-N 3.32Å; L428-S430 PolarHBondContact O-N 2.94Å; S430-S432 PolarHBondContact O-N 2.83Å; S430-S432 VanDerWaalsContact O-N 3.12Å
431	P	43	Very low	49.6	Very low	122 Å²	122	108.3 Å²	108.3	79%	0.792	62%	0.623	S	S	*	*			trans	-53.1	125.7	-175.9	20.9	-30.9	0	0	0	109.6	Y433	P431-Y433 VanDerWaalsContact C-N 3.28Å; P431-Y433 PolarHBondContact O-N 3.18Å
432	S	40.8	Very low	50.7	Low	114 Å²	114	110.5 Å²	110.5	80%	0.797	62%	0.616	S	S	*	*			trans	-65.5	89.6	-179.6	28.1	0	0	0	0	109.7	S430	S430-S432 PolarHBondContact O-N 2.83Å; S430-S432 VanDerWaalsContact O-N 3.12Å
433	Y	41.1	Very low	51.8	Low	113 Å²	113	111.7 Å²	111.7	44%	0.443	61%	0.612	S	S	.	*			trans	-86.8	114.6	175.6	-175.4	-100.9	0	0	0	109.1	E123 P431 R435	E123-Y433 PolarHBondContact OE2-OH 2.84Å; P431-Y433 VanDerWaalsContact C-N 3.28Å; P431-Y433 PolarHBondContact O-N 3.18Å; Y433-R435 VanDerWaalsContact C-N 3.32Å; Y433-R435 HydrophobicContact CD1-CB 3.88Å; Y433-R435 HydrophobicContact CE1-CB 3.91Å; Y433-R435 HydrophobicContact CE1-CG 4.23Å; Y433-R435 PolarHBondContact O-N 2.72Å
434	C	48	Very low	52.9	Low	128 Å²	128	115 Å²	115	87%	0.865	63%	0.625	S	S	*	*			trans	-73.5	88.2	169.2	-71.5	0	0	0	0	109.6	K436	C434-K436 PolarHBondContact O-N 3.4Å
435	R	52.2	Low	54	Low	141 Å²	141	112.8 Å²	112.8	53%	0.532	61%	0.606	S	S	.	*			trans	-71.5	120.3	169	-166.8	177.9	84.9	169.4	10.2	108.9	Y433 I437 E441	Y433-R435 VanDerWaalsContact C-N 3.32Å; Y433-R435 HydrophobicContact CD1-CB 3.88Å; Y433-R435 HydrophobicContact CE1-CB 3.91Å; Y433-R435 HydrophobicContact CE1-CG 4.23Å; Y433-R435 PolarHBondContact O-N 2.72Å; R435-I437 PolarHBondContact O-N 3.03Å; R435-I437 VanDerWaalsContact O-N 3.12Å; R435-E441 IonicContact NH2-OE1 3.61Å
436	K	56.8	Low	55.3	Low	206 Å²	206	112.3 Å²	112.3	90%	0.896	59%	0.594	S	S	*	*			trans	-63.7	114.2	166.5	-81.6	-176.8	178.8	175.7	0	108.4	C434	C434-K436 PolarHBondContact O-N 3.4Å
437	I	68.6	Low	56.3	Low	65 Å²	65	114.3 Å²	114.3	33%	0.333	60%	0.601	S	S	.	*			trans	-89.5	147.5	172.2	57.3	178.2	0	0	0	109.7	R435 E441 F442	R435-I437 PolarHBondContact O-N 3.03Å; R435-I437 VanDerWaalsContact O-N 3.12Å; I437-E441 HydrophobicContact CB-CB 4.37Å; I437-F442 HydrophobicContact CD1-CB 3.8Å; I437-F442 HydrophobicContact CD1-CD2 3.97Å; I437-F442 HydrophobicContact CD1-CG 4.4Å; I437-F442 HydrophobicContact CG1-CB 4.27Å
438	S	73.6	Confident	57.2	Low	57 Å²	57	113 Å²	113	40%	0.399	59%	0.591	S	S	.	*			trans	-69	159.3	173.5	68.4	0	0	0	0	110.8	A440 E441 F442	S438-A440 PolarHBondContact O-N 3.18Å; S438-E441 WeakPolarHBondContact CB-OE2 3.44Å; S438-E441 PolarHBondContact N-OE2 2.93Å; S438-E441 PolarHBondContact O-N 3.47Å; S438-E441 WeakPolarHBondContact OG-CB 3.27Å; S438-E441 VanDerWaalsContact OG-CG 3.23Å; S438-E441 WeakPolarHBondContact OG-CG 3.34Å; S438-E441 PolarHBondContact OG-N 3.24Å; S438-E441 PolarHBondContact OG-OE2 3.38Å; S438-F442 PolarHBondContact O-N 3.07Å
439	R	66.8	Low	58.1	Low	217 Å²	217	109.8 Å²	109.8	82%	0.819	58%	0.582	S	S	*	*	H	α-helix	trans	-62.8	-29.5	179.7	-163.2	174.2	-178.7	177.7	-0	112.6	E443	R439-E443 WeakPolarHBondContact O-CG 3.42Å; R439-E443 PolarHBondContact O-N 3.31Å; R439-E443 VanDerWaalsContact O-N 3.15Å
440	A	69.5	Low	59.3	Low	73 Å²	73	107.1 Å²	107.1	60%	0.603	57%	0.568	S	S	*	*	H	α-helix	trans	-72.2	-46	175.6	0	0	0	0	0	111.7	S438 F442 E443 E444	S438-A440 PolarHBondContact O-N 3.18Å; A440-F442 VanDerWaalsContact C-N 3.3Å; A440-F442 PolarHBondContact O-N 2.99Å; A440-E443 PolarHBondContact O-N 3.5Å; A440-E444 PolarHBondContact O-N 3.17Å
441	E	72.1	Confident	60.8	Low	74 Å²	74	104.6 Å²	104.6	35%	0.346	55%	0.545	S	S	.	.	H	α-helix	trans	-63.6	-35.3	174.6	-71.2	167.8	138.2	0	0	112	R435 I437 S438 E444 Q445	R435-E441 IonicContact NH2-OE1 3.61Å; I437-E441 HydrophobicContact CB-CB 4.37Å; S438-E441 WeakPolarHBondContact CB-OE2 3.44Å; S438-E441 PolarHBondContact N-OE2 2.93Å; S438-E441 PolarHBondContact O-N 3.47Å; S438-E441 WeakPolarHBondContact OG-CB 3.27Å; S438-E441 VanDerWaalsContact OG-CG 3.23Å; S438-E441 WeakPolarHBondContact OG-CG 3.34Å; S438-E441 PolarHBondContact OG-N 3.24Å; S438-E441 PolarHBondContact OG-OE2 3.38Å; E441-E444 PolarHBondContact O-N 3.49Å; E441-Q445 VanDerWaalsContact O-CB 3.25Å; E441-Q445 WeakPolarHBondContact O-CB 3.21Å; E441-Q445 VanDerWaalsContact O-CG 3.26Å; E441-Q445 WeakPolarHBondContact O-CG 3.2Å; E441-Q445 PolarHBondContact O-N 3.48Å
442	F	70.2	Confident	62	Low	105 Å²	105	100.4 Å²	100.4	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-63.7	-45.3	173.6	172.9	-98.6	0	0	0	112.2	I437 S438 A440 E444 R446	I437-F442 HydrophobicContact CD1-CB 3.8Å; I437-F442 HydrophobicContact CD1-CD2 3.97Å; I437-F442 HydrophobicContact CD1-CG 4.4Å; I437-F442 HydrophobicContact CG1-CB 4.27Å; S438-F442 PolarHBondContact O-N 3.07Å; A440-F442 VanDerWaalsContact C-N 3.3Å; A440-F442 PolarHBondContact O-N 2.99Å; F442-E444 VanDerWaalsContact C-N 3.35Å; F442-R446 WeakPolarHBondContact O-CB 3.36Å; F442-R446 PolarHBondContact O-N 3.37Å
443	E	69.5	Low	63.6	Low	80 Å²	80	98.3 Å²	98.3	37%	0.374	51%	0.508	S	S	.	.	H	α-helix	trans	-62.4	-42.5	176.6	-81	-78.9	167	0	0	111.3	R439 A440 R446 V447	R439-E443 WeakPolarHBondContact O-CG 3.42Å; R439-E443 PolarHBondContact O-N 3.31Å; R439-E443 VanDerWaalsContact O-N 3.15Å; A440-E443 PolarHBondContact O-N 3.5Å; E443-R446 VanDerWaalsContact CD-NH2 3.29Å; E443-R446 WeakPolarHBondContact O-CB 3.25Å; E443-R446 PolarHBondContact O-N 3.05Å; E443-R446 IonicContact OE1-CZ 3.58Å; E443-R446 IonicContact OE1-NH1 3.94Å; E443-R446 IonicContact OE1-NH2 2.77Å; E443-R446 PolarHBondContact OE1-NH2 3.41Å; E443-R446 IonicContact OE2-CZ 3.69Å; E443-R446 VanDerWaalsContact OE2-CZ 3.31Å; E443-R446 IonicContact OE2-NE 3.35Å; E443-R446 IonicContact OE2-NH2 3.65Å; E443-R446 PolarHBondContact OE2-NH2 3.11Å; E443-V447 WeakPolarHBondContact O-CG2 3.26Å; E443-V447 PolarHBondContact O-N 3.29Å
444	E	68.9	Low	65.1	Low	141 Å²	141	95.4 Å²	95.4	66%	0.659	50%	0.499	S	S	*	.	H	α-helix	trans	-67.6	-43	177.9	-170.3	175.7	-166.1	0	0	112.5	A440 E441 F442 V447 S448	A440-E444 PolarHBondContact O-N 3.17Å; E441-E444 PolarHBondContact O-N 3.49Å; F442-E444 VanDerWaalsContact C-N 3.35Å; E444-V447 PolarHBondContact O-N 3.26Å; E444-S448 WeakPolarHBondContact O-CB 3.45Å; E444-S448 PolarHBondContact O-N 3.32Å; E444-S448 PolarHBondContact O-OG 3.02Å
445	Q	64.9	Low	66.3	Low	88 Å²	88	93.4 Å²	93.4	41%	0.411	48%	0.477	S	S	.	.	H	α-helix	trans	-66.4	-36.5	174.3	-76.2	-178.3	-14.5	0	0	112.2	E441 V447 S448 S449	E441-Q445 VanDerWaalsContact O-CB 3.25Å; E441-Q445 WeakPolarHBondContact O-CB 3.21Å; E441-Q445 VanDerWaalsContact O-CG 3.26Å; E441-Q445 WeakPolarHBondContact O-CG 3.2Å; E441-Q445 PolarHBondContact O-N 3.48Å; Q445-V447 VanDerWaalsContact C-N 3.33Å; Q445-V447 PolarHBondContact O-N 3.14Å; Q445-S448 WeakPolarHBondContact CA-OG 3.39Å; Q445-S448 PolarHBondContact O-N 3.23Å; Q445-S448 PolarHBondContact O-OG 3.13Å; Q445-S449 WeakPolarHBondContact O-CB 3.46Å; Q445-S449 PolarHBondContact O-N 3.17Å
446	R	64.5	Low	67.6	Low	122 Å²	122	93.5 Å²	93.5	46%	0.46	48%	0.483	S	S	.	.	H	α-helix	trans	-60.3	-45	173.9	-176.2	-179.2	74.7	162.7	1.3	110.5	F442 E443 S450	F442-R446 WeakPolarHBondContact O-CB 3.36Å; F442-R446 PolarHBondContact O-N 3.37Å; E443-R446 VanDerWaalsContact CD-NH2 3.29Å; E443-R446 WeakPolarHBondContact O-CB 3.25Å; E443-R446 PolarHBondContact O-N 3.05Å; E443-R446 IonicContact OE1-CZ 3.58Å; E443-R446 IonicContact OE1-NH1 3.94Å; E443-R446 IonicContact OE1-NH2 2.77Å; E443-R446 PolarHBondContact OE1-NH2 3.41Å; E443-R446 IonicContact OE2-CZ 3.69Å; E443-R446 VanDerWaalsContact OE2-CZ 3.31Å; E443-R446 IonicContact OE2-NE 3.35Å; E443-R446 IonicContact OE2-NH2 3.65Å; E443-R446 PolarHBondContact OE2-NH2 3.11Å; R446-S450 WeakPolarHBondContact O-CB 3.42Å; R446-S450 PolarHBondContact O-OG 2.88Å
447	V	61.2	Low	68.7	Low	90 Å²	90	87.9 Å²	87.9	55%	0.545	46%	0.462	S	S	.	.	H	α-helix	trans	-73	-40.9	-179.3	177.1	0	0	0	0	111.7	E443 E444 Q445 Q451	E443-V447 WeakPolarHBondContact O-CG2 3.26Å; E443-V447 PolarHBondContact O-N 3.29Å; E444-V447 PolarHBondContact O-N 3.26Å; Q445-V447 VanDerWaalsContact C-N 3.33Å; Q445-V447 PolarHBondContact O-N 3.14Å; V447-Q451 VanDerWaalsContact O-CG 3.27Å; V447-Q451 WeakPolarHBondContact O-CG 3.4Å
448	S	58.8	Low	69.3	Low	84 Å²	84	84.8 Å²	84.8	59%	0.587	45%	0.447	S	S	*	.	H	α-helix	trans	-80.9	-39	-174.5	56.9	0	0	0	0	114.8	E444 Q445	E444-S448 WeakPolarHBondContact O-CB 3.45Å; E444-S448 PolarHBondContact O-N 3.32Å; E444-S448 PolarHBondContact O-OG 3.02Å; Q445-S448 WeakPolarHBondContact CA-OG 3.39Å; Q445-S448 PolarHBondContact O-N 3.23Å; Q445-S448 PolarHBondContact O-OG 3.13Å
449	S	57.3	Low	69.6	Low	87 Å²	87	85.1 Å²	85.1	61%	0.608	44%	0.442	S	S	*	.	H	α-helix	trans	-99.7	-21.3	-172	-62.2	0	0	0	0	114.6	Q445	Q445-S449 WeakPolarHBondContact O-CB 3.46Å; Q445-S449 PolarHBondContact O-N 3.17Å
450	S	62.9	Low	70.2	Confident	44 Å²	44	76.7 Å²	76.7	31%	0.308	42%	0.423	S	S	.	.	H	α-helix	trans	-103.6	-18.1	-173.9	80.1	0	0	0	0	115.3	R446 M454	R446-S450 WeakPolarHBondContact O-CB 3.42Å; R446-S450 PolarHBondContact O-OG 2.88Å; S450-M454 WeakPolarHBondContact O-CB 3.4Å; S450-M454 WeakPolarHBondContact O-CG 3.33Å
451	Q	65.4	Low	70.6	Confident	46 Å²	46	74.6 Å²	74.6	22%	0.215	40%	0.401	C	S	.	.	H	α-helix	trans	-76.6	-41.1	-175.3	-67.6	-71.9	-56.5	0	0	112.8	V447 Q455 I486	V447-Q451 VanDerWaalsContact O-CG 3.27Å; V447-Q451 WeakPolarHBondContact O-CG 3.4Å; Q451-Q455 WeakPolarHBondContact O-CG 3.49Å; Q451-Q455 PolarHBondContact O-N 3.47Å; Q451-I486 VanDerWaalsContact OE1-CG1 3.3Å
452	G	69.3	Low	70.8	Confident	33 Å²	33	72.5 Å²	72.5	34%	0.34	39%	0.392	S	S	.	.	H	α-helix	trans	-63.1	-56.5	-178.3	0	0	0	0	0	113.9	M454 Q455 E456	G452-M454 PolarHBondContact O-N 2.73Å; G452-Q455 WeakPolarHBondContact O-CB 3.4Å; G452-Q455 PolarHBondContact O-N 3.27Å; G452-Q455 VanDerWaalsContact O-N 3.09Å; G452-E456 PolarHBondContact O-N 3.46Å
453	P	74.8	Confident	71.1	Confident	71 Å²	71	71 Å²	71	46%	0.461	40%	0.399	S	S	.	.	H	α-helix	trans	-62.9	-30.6	-179.8	-23.6	33.7	0	0	0	113.4	E456 L457	P453-E456 PolarHBondContact O-N 3.24Å; P453-L457 WeakPolarHBondContact O-CB 3.49Å; P453-L457 PolarHBondContact O-N 3.16Å
454	M	71.3	Confident	71.4	Confident	52 Å²	52	69.9 Å²	69.9	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-75.2	-30.4	177.4	-67.1	-66.4	152.7	0	0	112.3	S450 G452 L458 F479 Y483 I486	S450-M454 WeakPolarHBondContact O-CB 3.4Å; S450-M454 WeakPolarHBondContact O-CG 3.33Å; G452-M454 PolarHBondContact O-N 2.73Å; M454-L458 PolarHBondContact O-N 2.73Å; M454-L458 VanDerWaalsContact O-N 3.14Å; M454-F479 HydrophobicContact CB-CZ 4.5Å; M454-F479 VanDerWaalsContact O-CZ 3.3Å; M454-F479 WeakPolarHBondContact O-CZ 3.42Å; M454-Y483 HydrophobicContact SD-CE1 4.49Å; M454-Y483 HydrophobicContact SD-CE2 4.01Å; M454-I486 HydrophobicContact CB-CD1 3.6Å; M454-I486 HydrophobicContact CG-CD1 4.38Å
455	Q	74.8	Confident	71.5	Confident	85 Å²	85	69.7 Å²	69.7	40%	0.397	40%	0.404	S	S	.	.	H	α-helix	trans	-68.4	-44.9	169	-77	175	-13.3	0	0	110.9	Q451 G452 L457 L458 E459 I486	Q451-Q455 WeakPolarHBondContact O-CG 3.49Å; Q451-Q455 PolarHBondContact O-N 3.47Å; G452-Q455 WeakPolarHBondContact O-CB 3.4Å; G452-Q455 PolarHBondContact O-N 3.27Å; G452-Q455 VanDerWaalsContact O-N 3.09Å; Q455-L457 VanDerWaalsContact C-N 3.31Å; Q455-L457 PolarHBondContact O-N 3.14Å; Q455-L458 WeakPolarHBondContact O-CB 3.46Å; Q455-L458 PolarHBondContact O-N 3.26Å; Q455-L458 VanDerWaalsContact O-N 3.11Å; Q455-E459 WeakPolarHBondContact O-CG 3.34Å; Q455-E459 PolarHBondContact O-N 2.94Å; Q455-I486 HydrophobicContact CG-CG2 3.77Å
456	E	78	Confident	71.8	Confident	143 Å²	143	74.2 Å²	74.2	67%	0.668	43%	0.426	S	S	*	.	H	α-helix	trans	-60.6	-39.1	175.4	-72.2	174.2	-177.6	0	0	112.3	G452 P453 L458 E459 G460	G452-E456 PolarHBondContact O-N 3.46Å; P453-E456 PolarHBondContact O-N 3.24Å; E456-L458 VanDerWaalsContact C-N 3.33Å; E456-L458 PolarHBondContact O-N 2.87Å; E456-E459 PolarHBondContact O-N 3.28Å; E456-G460 PolarHBondContact O-N 3.35Å
457	L	81.1	Confident	72.1	Confident	88 Å²	88	70 Å²	70	46%	0.461	41%	0.412	S	S	.	.	H	α-helix	trans	-66.3	-35.5	175.2	-170.6	139.1	0	0	0	112.2	P453 Q455 L461 F479	P453-L457 WeakPolarHBondContact O-CB 3.49Å; P453-L457 PolarHBondContact O-N 3.16Å; Q455-L457 VanDerWaalsContact C-N 3.31Å; Q455-L457 PolarHBondContact O-N 3.14Å; L457-L461 HydrophobicContact CD2-CD1 3.69Å; L457-L461 WeakPolarHBondContact O-CB 3.43Å; L457-L461 WeakPolarHBondContact O-CG 3.27Å; L457-L461 PolarHBondContact O-N 3.44Å; L457-F479 HydrophobicContact CD2-CD2 3.76Å; L457-F479 HydrophobicContact CD2-CE2 3.56Å
458	L	80.5	Confident	72.8	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.005	41%	0.41	C	S	.	.	H	α-helix	trans	-67.3	-43.7	173.2	-177.4	60.2	0	0	0	111.2	M454 Q455 E456 L461 I462 L476 F479 I486 Y487 R490 F491	M454-L458 PolarHBondContact O-N 2.73Å; M454-L458 VanDerWaalsContact O-N 3.14Å; Q455-L458 WeakPolarHBondContact O-CB 3.46Å; Q455-L458 PolarHBondContact O-N 3.26Å; Q455-L458 VanDerWaalsContact O-N 3.11Å; E456-L458 VanDerWaalsContact C-N 3.33Å; E456-L458 PolarHBondContact O-N 2.87Å; L458-L461 PolarHBondContact O-N 3.23Å; L458-I462 HydrophobicContact CD1-CD1 4.35Å; L458-I462 HydrophobicContact CG-CD1 4.11Å; L458-I462 WeakPolarHBondContact O-CD1 3.43Å; L458-I462 WeakPolarHBondContact O-CG1 3.05Å; L458-I462 PolarHBondContact O-N 2.88Å; L458-I462 VanDerWaalsContact O-N 3.12Å; L458-L476 HydrophobicContact CD1-CD1 3.49Å; L458-L476 VanDerWaalsContact CD1-CD1 3.49Å; L458-F479 HydrophobicContact CB-CE1 4.04Å; L458-F479 HydrophobicContact CB-CE2 4.37Å; L458-F479 HydrophobicContact CB-CZ 3.9Å; L458-F479 HydrophobicContact CD1-CD1 3.79Å; L458-F479 HydrophobicContact CD1-CE1 3.97Å; L458-F479 HydrophobicContact CD1-CG 4.19Å; L458-F479 HydrophobicContact CD2-CD1 4.48Å; L458-F479 HydrophobicContact CD2-CE1 3.98Å; L458-F479 HydrophobicContact CG-CE1 4.22Å; L458-I486 HydrophobicContact CD2-CG2 4.41Å; L458-Y487 HydrophobicContact CD1-CD2 4.46Å; L458-R490 HydrophobicContact CD2-CB 3.77Å; L458-R490 HydrophobicContact CD2-CG 3.98Å; L458-F491 HydrophobicContact CD2-CE2 4.43Å
459	E	80.3	Confident	73.4	Confident	63 Å²	63	67.5 Å²	67.5	29%	0.294	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-41.3	175.1	-66.8	-47.4	129.9	0	0	112.1	Q455 E456 L461 I462 A463 R490	Q455-E459 WeakPolarHBondContact O-CG 3.34Å; Q455-E459 PolarHBondContact O-N 2.94Å; E456-E459 PolarHBondContact O-N 3.28Å; E459-L461 PolarHBondContact O-N 3.46Å; E459-I462 CarbonylContact O-C 3.54Å; E459-I462 WeakPolarHBondContact O-CA 3.46Å; E459-I462 WeakPolarHBondContact O-CB 3.47Å; E459-I462 PolarHBondContact O-N 3.21Å; E459-A463 WeakPolarHBondContact O-CB 3.4Å; E459-A463 PolarHBondContact O-N 3.2Å; E459-R490 VanDerWaalsContact CD-NH2 3.26Å; E459-R490 WeakPolarHBondContact OE1-CD 3.44Å; E459-R490 IonicContact OE1-CZ 3.3Å; E459-R490 IonicContact OE1-NE 3.07Å; E459-R490 PolarHBondContact OE1-NE 3.28Å; E459-R490 IonicContact OE1-NH2 2.71Å; E459-R490 PolarHBondContact OE1-NH2 3.06Å; E459-R490 IonicContact OE2-CZ 3.42Å; E459-R490 IonicContact OE2-NE 3.55Å; E459-R490 IonicContact OE2-NH2 3.3Å; E459-R490 PolarHBondContact OE2-NH2 3.35Å
460	G	79.2	Confident	74	Confident	40 Å²	40	71.3 Å²	71.3	41%	0.412	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-43.9	175	0	0	0	0	0	111.8	E456 I462 A463 D464	E456-G460 PolarHBondContact O-N 3.35Å; G460-I462 PolarHBondContact O-N 3.01Å; G460-A463 PolarHBondContact O-N 3.33Å; G460-D464 VanDerWaalsContact O-CB 3.31Å; G460-D464 WeakPolarHBondContact O-CB 3.37Å; G460-D464 PolarHBondContact O-N 3.31Å
461	L	78.6	Confident	74.5	Confident	30 Å²	30	72.8 Å²	72.8	16%	0.157	41%	0.411	C	S	.	.	H	α-helix	trans	-62.2	-27.6	173.5	-81.3	164.5	0	0	0	113.1	L457 L458 E459 L467 K472 R475 F479	L457-L461 HydrophobicContact CD2-CD1 3.69Å; L457-L461 WeakPolarHBondContact O-CB 3.43Å; L457-L461 WeakPolarHBondContact O-CG 3.27Å; L457-L461 PolarHBondContact O-N 3.44Å; L458-L461 PolarHBondContact O-N 3.23Å; E459-L461 PolarHBondContact O-N 3.46Å; L461-L467 HydrophobicContact CD2-CD1 4.34Å; L461-K472 WeakPolarHBondContact O-CE 3.45Å; L461-R475 HydrophobicContact CD2-CB 4.02Å; L461-F479 HydrophobicContact CD1-CD2 4.24Å
462	I	76.2	Confident	75.1	Confident	29 Å²	29	72.4 Å²	72.4	15%	0.149	41%	0.409	C	S	.	.	H	α-helix	trans	-83.7	-38.2	178.2	-68.7	165.7	0	0	0	111.3	L458 E459 G460 K472 F491 V500	L458-I462 HydrophobicContact CD1-CD1 4.35Å; L458-I462 HydrophobicContact CG-CD1 4.11Å; L458-I462 WeakPolarHBondContact O-CD1 3.43Å; L458-I462 WeakPolarHBondContact O-CG1 3.05Å; L458-I462 PolarHBondContact O-N 2.88Å; L458-I462 VanDerWaalsContact O-N 3.12Å; E459-I462 CarbonylContact O-C 3.54Å; E459-I462 WeakPolarHBondContact O-CA 3.46Å; E459-I462 WeakPolarHBondContact O-CB 3.47Å; E459-I462 PolarHBondContact O-N 3.21Å; G460-I462 PolarHBondContact O-N 3.01Å; I462-K472 VanDerWaalsContact O-CE 3.26Å; I462-K472 WeakPolarHBondContact O-CE 3.47Å; I462-K472 PolarHBondContact O-NZ 2.91Å; I462-F491 HydrophobicContact CD1-CE2 4.18Å; I462-F491 HydrophobicContact CD1-CZ 3.61Å; I462-F491 HydrophobicContact CG1-CZ 4.43Å; I462-V500 HydrophobicContact CB-CG1 4.29Å; I462-V500 HydrophobicContact CG1-CG1 4.02Å; I462-V500 HydrophobicContact CG2-CG1 3.6Å; I462-V500 HydrophobicContact CG2-CG2 4.1Å
463	A	75.8	Confident	75.4	Confident	75 Å²	75	74.2 Å²	74.2	62%	0.62	41%	0.406	S	S	*	.	H	α-helix	trans	-79.6	-21.4	-179.2	0	0	0	0	0	113.3	E459 G460 T465	E459-A463 WeakPolarHBondContact O-CB 3.4Å; E459-A463 PolarHBondContact O-N 3.2Å; G460-A463 PolarHBondContact O-N 3.33Å; A463-T465 PolarHBondContact O-N 3.1Å
464	D	76.1	Confident	75.5	Confident	55 Å²	55	77.9 Å²	77.9	29%	0.294	41%	0.414	S	S	.	.			trans	-61.9	118.2	-179.2	-171.3	-23	0	0	0	111.8	G460 E466 L467 K472	G460-D464 VanDerWaalsContact O-CB 3.31Å; G460-D464 WeakPolarHBondContact O-CB 3.37Å; G460-D464 PolarHBondContact O-N 3.31Å; D464-E466 PolarHBondContact OD1-N 3.01Å; D464-L467 HydrophobicContact CB-CD1 4.05Å; D464-L467 PolarHBondContact OD1-N 2.95Å; D464-L467 WeakPolarHBondContact OD2-CD1 3.46Å; D464-L467 WeakPolarHBondContact OD2-CG 3.37Å; D464-K472 PolarHBondContact O-NZ 3.36Å
465	T	69.8	Low	75.9	Confident	137 Å²	137	81.1 Å²	81.1	84%	0.84	42%	0.424	S	S	*	.	S	Bend	trans	-94.1	-11.8	-179.9	50.2	0	0	0	0	113.7	A463	A463-T465 PolarHBondContact O-N 3.1Å
466	E	72.1	Confident	76.2	Confident	184 Å²	184	77.6 Å²	77.6	86%	0.86	41%	0.407	S	S	*	.	S	Bend	trans	-85.7	-19.4	-179.8	-60	-148.2	147.4	0	0	112.4	D464	D464-E466 PolarHBondContact OD1-N 3.01Å
467	L	70.9	Confident	76.3	Confident	33 Å²	33	77.9 Å²	77.9	17%	0.173	41%	0.407	C	S	.	.	S	Bend	trans	-78.3	125.9	177.7	-71	170.2	0	0	0	112.9	L461 D464 K472	L461-L467 HydrophobicContact CD2-CD1 4.34Å; D464-L467 HydrophobicContact CB-CD1 4.05Å; D464-L467 PolarHBondContact OD1-N 2.95Å; D464-L467 WeakPolarHBondContact OD2-CD1 3.46Å; D464-L467 WeakPolarHBondContact OD2-CG 3.37Å; L467-K472 HydrophobicContact CB-CB 4.45Å
468	S	74.9	Confident	76.3	Confident	71 Å²	71	79.7 Å²	79.7	50%	0.497	41%	0.412	S	S	.	.			trans	-53.7	140.6	169.1	178.4	0	0	0	0	111.7	K470 D471 K472	S468-K470 PolarHBondContact O-N 3.44Å; S468-D471 PolarHBondContact O-N 3.03Å; S468-K472 PolarHBondContact O-N 3.48Å
469	A	71.3	Confident	76.4	Confident	50 Å²	50	80.2 Å²	80.2	41%	0.413	42%	0.415	S	S	.	.	H	α-helix	trans	-54.7	-26.6	179.4	0	0	0	0	0	113.7	R473	A469-R473 WeakPolarHBondContact O-CD 3.35Å; A469-R473 VanDerWaalsContact O-CG 3.24Å; A469-R473 WeakPolarHBondContact O-CG 3.35Å; A469-R473 PolarHBondContact O-N 3.44Å
470	K	70.2	Confident	76.5	Confident	168 Å²	168	80.9 Å²	80.9	73%	0.73	42%	0.418	S	S	*	.	H	α-helix	trans	-72.6	-42.1	175.6	-171.6	-178	176.3	-172	0	112.1	S468 K474	S468-K470 PolarHBondContact O-N 3.44Å; K470-K474 PolarHBondContact O-N 3.15Å
471	D	73.6	Confident	76.5	Confident	74 Å²	74	87.8 Å²	87.8	40%	0.396	44%	0.437	S	S	.	.	H	α-helix	trans	-78.9	-36.5	-178.2	-67.8	-35.9	0	0	0	111.9	S468 R473 K474 R475	S468-D471 PolarHBondContact O-N 3.03Å; D471-R473 VanDerWaalsContact C-N 3.3Å; D471-R473 PolarHBondContact O-N 3.35Å; D471-K474 WeakPolarHBondContact O-CB 3.2Å; D471-K474 PolarHBondContact O-N 3.41Å; D471-R475 WeakPolarHBondContact O-CG 3.44Å; D471-R475 PolarHBondContact O-N 3.49Å
472	K	77.9	Confident	76.5	Confident	38 Å²	38	89.6 Å²	89.6	17%	0.165	45%	0.452	C	S	.	.	H	α-helix	trans	-55.7	-45.5	170.1	-165.4	163.8	-179.4	160.1	0	111.2	L461 I462 D464 L467 S468 K474 R475 L476	L461-K472 WeakPolarHBondContact O-CE 3.45Å; I462-K472 VanDerWaalsContact O-CE 3.26Å; I462-K472 WeakPolarHBondContact O-CE 3.47Å; I462-K472 PolarHBondContact O-NZ 2.91Å; D464-K472 PolarHBondContact O-NZ 3.36Å; L467-K472 HydrophobicContact CB-CB 4.45Å; S468-K472 PolarHBondContact O-N 3.48Å; K472-K474 PolarHBondContact O-N 3.4Å; K472-R475 PolarHBondContact O-N 3.13Å; K472-L476 WeakPolarHBondContact O-CB 3.36Å; K472-L476 PolarHBondContact O-N 2.91Å
473	R	75.7	Confident	76.6	Confident	72 Å²	72	93 Å²	93	27%	0.272	46%	0.464	S	S	.	.	H	α-helix	trans	-62.3	-38.3	172.9	-77.1	170.3	176.9	175.4	-2.4	113.5	A469 D471 K477 L501 P502	A469-R473 WeakPolarHBondContact O-CD 3.35Å; A469-R473 VanDerWaalsContact O-CG 3.24Å; A469-R473 WeakPolarHBondContact O-CG 3.35Å; A469-R473 PolarHBondContact O-N 3.44Å; D471-R473 VanDerWaalsContact C-N 3.3Å; D471-R473 PolarHBondContact O-N 3.35Å; R473-K477 WeakPolarHBondContact O-CB 3.37Å; R473-K477 WeakPolarHBondContact O-CG 3.21Å; R473-K477 PolarHBondContact O-N 3.39Å; R473-L501 HydrophobicContact CG-CD2 3.42Å; R473-L501 VanDerWaalsContact CG-CD2 3.42Å; R473-P502 PolarHBondContact NH2-O 3.43Å
474	K	77.6	Confident	76.7	Confident	147 Å²	147	92.9 Å²	92.9	64%	0.639	46%	0.456	S	S	*	.	H	α-helix	trans	-69.1	-46.3	-179.9	-170.5	-178.3	177.4	-173	0	110.8	K470 D471 K472 K477 Q478	K470-K474 PolarHBondContact O-N 3.15Å; D471-K474 WeakPolarHBondContact O-CB 3.2Å; D471-K474 PolarHBondContact O-N 3.41Å; K472-K474 PolarHBondContact O-N 3.4Å; K474-K477 PolarHBondContact O-N 2.94Å; K474-Q478 WeakPolarHBondContact O-CB 3.23Å; K474-Q478 PolarHBondContact O-N 3Å
475	R	79.3	Confident	76.7	Confident	121 Å²	121	95.2 Å²	95.2	46%	0.457	47%	0.465	S	S	.	.	H	α-helix	trans	-64.3	-41.1	176.2	-69.2	-173.6	179.5	-171.4	1.2	111.5	L461 D471 K472 K477 Q478 F479	L461-R475 HydrophobicContact CD2-CB 4.02Å; D471-R475 WeakPolarHBondContact O-CG 3.44Å; D471-R475 PolarHBondContact O-N 3.49Å; K472-R475 PolarHBondContact O-N 3.13Å; R475-K477 PolarHBondContact O-N 3.44Å; R475-Q478 WeakPolarHBondContact O-CB 3.29Å; R475-Q478 PolarHBondContact O-N 2.96Å; R475-Q478 VanDerWaalsContact O-N 3.16Å; R475-F479 WeakPolarHBondContact O-CB 3.45Å; R475-F479 PolarHBondContact O-N 3.26Å
476	L	81.1	Confident	77.1	Confident	10 Å²	10	89 Å²	89	5%	0.052	43%	0.427	C	S	.	.	H	α-helix	trans	-65.1	-38.8	176.8	-164.2	68.9	0	0	0	112.4	L458 K472 F479 Q480 Y487 F491 L501	L458-L476 HydrophobicContact CD1-CD1 3.49Å; L458-L476 VanDerWaalsContact CD1-CD1 3.49Å; K472-L476 WeakPolarHBondContact O-CB 3.36Å; K472-L476 PolarHBondContact O-N 2.91Å; L476-F479 PolarHBondContact O-N 3.3Å; L476-Q480 WeakPolarHBondContact O-CB 3.46Å; L476-Q480 PolarHBondContact O-N 2.94Å; L476-Y487 HydrophobicContact CD1-CD2 4.42Å; L476-Y487 HydrophobicContact CD1-CE2 3.8Å; L476-Y487 HydrophobicContact CD2-CE2 4.17Å; L476-Y487 HydrophobicContact CG-CE2 3.68Å; L476-F491 HydrophobicContact CD1-CE2 4.38Å; L476-L501 HydrophobicContact CD2-CD1 4.2Å; L476-L501 HydrophobicContact CD2-CD2 4.4Å; L476-L501 HydrophobicContact CD2-CG 4.46Å
477	K	79.4	Confident	77.4	Confident	150 Å²	150	80.9 Å²	80.9	65%	0.652	39%	0.388	S	S	*	.	H	α-helix	trans	-65.3	-38.3	171.1	-79.5	-176.6	177.2	-170.7	0	112.9	R473 K474 R475 Q480 K481	R473-K477 WeakPolarHBondContact O-CB 3.37Å; R473-K477 WeakPolarHBondContact O-CG 3.21Å; R473-K477 PolarHBondContact O-N 3.39Å; K474-K477 PolarHBondContact O-N 2.94Å; R475-K477 PolarHBondContact O-N 3.44Å; K477-Q480 PolarHBondContact O-N 3.2Å; K477-K481 PolarHBondContact O-N 2.94Å
478	Q	81.1	Confident	77.8	Confident	125 Å²	125	87 Å²	87	58%	0.584	41%	0.409	S	S	*	.	H	α-helix	trans	-67.4	-39.3	176.7	-175.7	172.1	-3.8	0	0	111.3	K474 R475 K481 S482	K474-Q478 WeakPolarHBondContact O-CB 3.23Å; K474-Q478 PolarHBondContact O-N 3Å; R475-Q478 WeakPolarHBondContact O-CB 3.29Å; R475-Q478 PolarHBondContact O-N 2.96Å; R475-Q478 VanDerWaalsContact O-N 3.16Å; Q478-K481 PolarHBondContact O-N 3.24Å; Q478-S482 WeakPolarHBondContact O-CB 3.44Å; Q478-S482 PolarHBondContact O-N 3Å; Q478-S482 VanDerWaalsContact O-N 3.1Å; Q478-S482 PolarHBondContact O-OG 3.4Å
479	F	83.2	Confident	77.8	Confident	12 Å²	12	91.4 Å²	91.4	5%	0.053	42%	0.415	C	S	.	.	H	α-helix	trans	-63.4	-47.3	173.1	-167.8	-81.3	0	0	0	111	M454 L457 L458 L461 R475 L476 K481 S482 Y483 I486 Y487	M454-F479 HydrophobicContact CB-CZ 4.5Å; M454-F479 VanDerWaalsContact O-CZ 3.3Å; M454-F479 WeakPolarHBondContact O-CZ 3.42Å; L457-F479 HydrophobicContact CD2-CD2 3.76Å; L457-F479 HydrophobicContact CD2-CE2 3.56Å; L458-F479 HydrophobicContact CB-CE1 4.04Å; L458-F479 HydrophobicContact CB-CE2 4.37Å; L458-F479 HydrophobicContact CB-CZ 3.9Å; L458-F479 HydrophobicContact CD1-CD1 3.79Å; L458-F479 HydrophobicContact CD1-CE1 3.97Å; L458-F479 HydrophobicContact CD1-CG 4.19Å; L458-F479 HydrophobicContact CD2-CD1 4.48Å; L458-F479 HydrophobicContact CD2-CE1 3.98Å; L458-F479 HydrophobicContact CG-CE1 4.22Å; L461-F479 HydrophobicContact CD1-CD2 4.24Å; R475-F479 WeakPolarHBondContact O-CB 3.45Å; R475-F479 PolarHBondContact O-N 3.26Å; L476-F479 PolarHBondContact O-N 3.3Å; F479-K481 VanDerWaalsContact C-N 3.27Å; F479-K481 PolarHBondContact O-N 2.91Å; F479-S482 PolarHBondContact O-N 3.17Å; F479-Y483 HydrophobicContact CD2-CD2 4.22Å; F479-Y483 HydrophobicContact CE1-CD2 4.42Å; F479-Y483 AromaticContact CE2-CD2 3.96Å; F479-Y483 HydrophobicContact CE2-CD2 3.96Å; F479-Y483 HydrophobicContact CZ-CD2 4.07Å; F479-Y483 HydrophobicContact CZ-CG 4.46Å; F479-Y483 PolarHBondContact O-N 3.09Å; F479-I486 HydrophobicContact CE1-CB 4.48Å; F479-I486 HydrophobicContact CE1-CG2 4.21Å; F479-I486 HydrophobicContact CZ-CG2 4.36Å; F479-Y487 HydrophobicContact CD1-CD2 4.43Å
480	Q	82.1	Confident	78	Confident	77 Å²	77	95.1 Å²	95.1	36%	0.36	42%	0.418	S	S	.	.	H	α-helix	trans	-56	-40.4	175.5	-177.6	-177.4	9.6	0	0	112.4	L476 K477 S482 P484 Y487	L476-Q480 WeakPolarHBondContact O-CB 3.46Å; L476-Q480 PolarHBondContact O-N 2.94Å; K477-Q480 PolarHBondContact O-N 3.2Å; Q480-S482 VanDerWaalsContact C-N 3.34Å; Q480-P484 WeakPolarHBondContact O-CA 3.31Å; Q480-Y487 HydrophobicContact CB-CD1 4.06Å; Q480-Y487 HydrophobicContact CB-CD2 3.92Å; Q480-Y487 HydrophobicContact CB-CE1 4.31Å; Q480-Y487 HydrophobicContact CB-CE2 4.18Å; Q480-Y487 HydrophobicContact CB-CG 3.85Å; Q480-Y487 HydrophobicContact CG-CD1 3.6Å; Q480-Y487 HydrophobicContact CG-CD2 4.4Å; Q480-Y487 HydrophobicContact CG-CE1 3.92Å; Q480-Y487 HydrophobicContact CG-CG 3.87Å
481	K	80.1	Confident	78.3	Confident	185 Å²	185	88 Å²	88	80%	0.804	39%	0.388	S	S	*	.	H	α-helix	trans	-68.8	-33.8	178.3	-171.8	177.7	179	-176.8	0	112.5	K477 Q478 F479	K477-K481 PolarHBondContact O-N 2.94Å; Q478-K481 PolarHBondContact O-N 3.24Å; F479-K481 VanDerWaalsContact C-N 3.27Å; F479-K481 PolarHBondContact O-N 2.91Å
482	S	77.4	Confident	78.1	Confident	68 Å²	68	89.1 Å²	89.1	48%	0.476	40%	0.398	S	S	.	.	H	α-helix	trans	-87.4	-32.5	-175.1	-48.9	0	0	0	0	112.2	Q478 F479 Q480	Q478-S482 WeakPolarHBondContact O-CB 3.44Å; Q478-S482 PolarHBondContact O-N 3Å; Q478-S482 VanDerWaalsContact O-N 3.1Å; Q478-S482 PolarHBondContact O-OG 3.4Å; F479-S482 PolarHBondContact O-N 3.17Å; Q480-S482 VanDerWaalsContact C-N 3.34Å
483	Y	79.4	Confident	77.7	Confident	102 Å²	102	91.2 Å²	91.2	40%	0.4	42%	0.415	S	S	.	.			trans	-138.8	68.9	-174.7	-55.5	-70.6	0	0	0	111.9	M454 F479 E485 I486 Y487	M454-Y483 HydrophobicContact SD-CE1 4.49Å; M454-Y483 HydrophobicContact SD-CE2 4.01Å; F479-Y483 HydrophobicContact CD2-CD2 4.22Å; F479-Y483 HydrophobicContact CE1-CD2 4.42Å; F479-Y483 AromaticContact CE2-CD2 3.96Å; F479-Y483 HydrophobicContact CE2-CD2 3.96Å; F479-Y483 HydrophobicContact CZ-CD2 4.07Å; F479-Y483 HydrophobicContact CZ-CG 4.46Å; F479-Y483 PolarHBondContact O-N 3.09Å; Y483-E485 PolarHBondContact O-N 3.47Å; Y483-I486 PolarHBondContact O-N 3.31Å; Y483-Y487 WeakPolarHBondContact O-CB 3.49Å; Y483-Y487 PolarHBondContact O-N 3.38Å
484	P	78.4	Confident	76.9	Confident	71 Å²	71	91.9 Å²	91.9	46%	0.461	44%	0.436	S	S	.	.	H	α-helix	trans	-64.8	-36.5	-172.3	23.1	-32.8	0	0	0	113.8	Q480 Y487 R488	Q480-P484 WeakPolarHBondContact O-CA 3.31Å; P484-Y487 PolarHBondContact O-N 2.96Å; P484-R488 VanDerWaalsContact O-CB 3.29Å; P484-R488 WeakPolarHBondContact O-CB 3.39Å; P484-R488 PolarHBondContact O-N 3.25Å
485	E	75.9	Confident	76	Confident	104 Å²	104	92.5 Å²	92.5	49%	0.486	44%	0.441	S	S	.	.	H	α-helix	trans	-70.7	-38.3	-178.1	-66.7	-53.1	139.1	0	0	113.1	Y483 R488 R489	Y483-E485 PolarHBondContact O-N 3.47Å; E485-R488 PolarHBondContact O-N 3.47Å; E485-R488 IonicContact OE2-CZ 3.57Å; E485-R488 IonicContact OE2-NE 2.72Å; E485-R488 PolarHBondContact OE2-NE 3.18Å; E485-R488 IonicContact OE2-NH2 3.66Å; E485-R488 PolarHBondContact OE2-NH2 2.88Å; E485-R489 WeakPolarHBondContact O-CG 3.34Å; E485-R489 PolarHBondContact O-N 2.91Å
486	I	77.8	Confident	75.1	Confident	6 Å²	6	88.4 Å²	88.4	3%	0.031	43%	0.43	C	S	.	.	H	α-helix	trans	-68.2	-43.3	176.5	-62.8	171.3	0	0	0	109.7	Q451 M454 Q455 L458 F479 Y483 R488 R489 R490	Q451-I486 VanDerWaalsContact OE1-CG1 3.3Å; M454-I486 HydrophobicContact CB-CD1 3.6Å; M454-I486 HydrophobicContact CG-CD1 4.38Å; Q455-I486 HydrophobicContact CG-CG2 3.77Å; L458-I486 HydrophobicContact CD2-CG2 4.41Å; F479-I486 HydrophobicContact CE1-CB 4.48Å; F479-I486 HydrophobicContact CE1-CG2 4.21Å; F479-I486 HydrophobicContact CZ-CG2 4.36Å; Y483-I486 PolarHBondContact O-N 3.31Å; I486-R488 PolarHBondContact O-N 3.45Å; I486-R489 PolarHBondContact O-N 3.3Å; I486-R490 PolarHBondContact O-N 3.37Å; I486-R490 VanDerWaalsContact O-N 3.13Å
487	Y	79.1	Confident	74.1	Confident	14 Å²	14	92 Å²	92	6%	0.055	45%	0.446	C	S	.	.	H	α-helix	trans	-61.7	-42.7	176.1	-172.8	-88.7	0	0	0	112.2	L458 L476 F479 Q480 Y483 P484 R490 F491	L458-Y487 HydrophobicContact CD1-CD2 4.46Å; L476-Y487 HydrophobicContact CD1-CD2 4.42Å; L476-Y487 HydrophobicContact CD1-CE2 3.8Å; L476-Y487 HydrophobicContact CD2-CE2 4.17Å; L476-Y487 HydrophobicContact CG-CE2 3.68Å; F479-Y487 HydrophobicContact CD1-CD2 4.43Å; Q480-Y487 HydrophobicContact CB-CD1 4.06Å; Q480-Y487 HydrophobicContact CB-CD2 3.92Å; Q480-Y487 HydrophobicContact CB-CE1 4.31Å; Q480-Y487 HydrophobicContact CB-CE2 4.18Å; Q480-Y487 HydrophobicContact CB-CG 3.85Å; Q480-Y487 HydrophobicContact CG-CD1 3.6Å; Q480-Y487 HydrophobicContact CG-CD2 4.4Å; Q480-Y487 HydrophobicContact CG-CE1 3.92Å; Q480-Y487 HydrophobicContact CG-CG 3.87Å; Y483-Y487 WeakPolarHBondContact O-CB 3.49Å; Y483-Y487 PolarHBondContact O-N 3.38Å; P484-Y487 PolarHBondContact O-N 2.96Å; Y487-R490 PolarHBondContact O-N 3.26Å; Y487-F491 HydrophobicContact CD1-CD2 4.29Å; Y487-F491 AromaticContact CD2-CD2 3.87Å; Y487-F491 HydrophobicContact CD2-CD2 3.87Å; Y487-F491 HydrophobicContact CD2-CE2 4.06Å; Y487-F491 HydrophobicContact CE1-CB 4.32Å; Y487-F491 AromaticContact CE1-CD2 3.95Å; Y487-F491 HydrophobicContact CE1-CD2 3.95Å; Y487-F491 HydrophobicContact CE1-CG 4.47Å; Y487-F491 AromaticContact CE2-CD2 3.5Å; Y487-F491 HydrophobicContact CE2-CD2 3.5Å; Y487-F491 VanDerWaalsContact CE2-CD2 3.5Å; Y487-F491 AromaticContact CE2-CE2 3.58Å; Y487-F491 HydrophobicContact CE2-CE2 3.58Å; Y487-F491 HydrophobicContact CG-CD2 4.25Å; Y487-F491 AromaticContact CZ-CD2 3.55Å; Y487-F491 PolarHBondContact O-N 2.91Å
488	R	77.6	Confident	73.2	Confident	162 Å²	162	87.6 Å²	87.6	61%	0.611	44%	0.437	S	S	*	.	H	α-helix	trans	-67.5	-34.5	178.4	-168	177.7	72.9	100.1	-1.5	112.6	P484 E485 I486 F491	P484-R488 VanDerWaalsContact O-CB 3.29Å; P484-R488 WeakPolarHBondContact O-CB 3.39Å; P484-R488 PolarHBondContact O-N 3.25Å; E485-R488 PolarHBondContact O-N 3.47Å; E485-R488 IonicContact OE2-CZ 3.57Å; E485-R488 IonicContact OE2-NE 2.72Å; E485-R488 PolarHBondContact OE2-NE 3.18Å; E485-R488 IonicContact OE2-NH2 3.66Å; E485-R488 PolarHBondContact OE2-NH2 2.88Å; I486-R488 PolarHBondContact O-N 3.45Å; R488-F491 CarbonylContact O-C 3.57Å
489	R	75.6	Confident	72.2	Confident	163 Å²	163	86 Å²	86	62%	0.615	45%	0.445	S	S	*	.	H	α-helix	trans	-66	-37.4	173	-77.8	178.7	179.2	179.3	-2	112.5	E485 I486 P492	E485-R489 WeakPolarHBondContact O-CG 3.34Å; E485-R489 PolarHBondContact O-N 2.91Å; I486-R489 PolarHBondContact O-N 3.3Å; R489-P492 WeakPolarHBondContact O-CG 3.28Å
490	R	75.6	Confident	71.2	Confident	128 Å²	128	87.4 Å²	87.4	48%	0.483	46%	0.455	S	S	.	.	H	α-helix	trans	-81.9	-30.5	179	-174.5	52.9	169.6	170.1	-8.3	113.8	L458 E459 I486 Y487 P492	L458-R490 HydrophobicContact CD2-CB 3.77Å; L458-R490 HydrophobicContact CD2-CG 3.98Å; E459-R490 VanDerWaalsContact CD-NH2 3.26Å; E459-R490 WeakPolarHBondContact OE1-CD 3.44Å; E459-R490 IonicContact OE1-CZ 3.3Å; E459-R490 IonicContact OE1-NE 3.07Å; E459-R490 PolarHBondContact OE1-NE 3.28Å; E459-R490 IonicContact OE1-NH2 2.71Å; E459-R490 PolarHBondContact OE1-NH2 3.06Å; E459-R490 IonicContact OE2-CZ 3.42Å; E459-R490 IonicContact OE2-NE 3.55Å; E459-R490 IonicContact OE2-NH2 3.3Å; E459-R490 PolarHBondContact OE2-NH2 3.35Å; I486-R490 PolarHBondContact O-N 3.37Å; I486-R490 VanDerWaalsContact O-N 3.13Å; Y487-R490 PolarHBondContact O-N 3.26Å; R490-P492 VanDerWaalsContact C-CD 3.44Å; R490-P492 WeakPolarHBondContact O-CD 3.44Å
491	F	76.5	Confident	70.1	Confident	20 Å²	20	85.3 Å²	85.3	9%	0.088	45%	0.446	C	S	.	.			trans	-121	71.2	176.2	-58.1	-76	0	0	0	112.4	L458 I462 L476 Y487 R488 S496 K497 V500	L458-F491 HydrophobicContact CD2-CE2 4.43Å; I462-F491 HydrophobicContact CD1-CE2 4.18Å; I462-F491 HydrophobicContact CD1-CZ 3.61Å; I462-F491 HydrophobicContact CG1-CZ 4.43Å; L476-F491 HydrophobicContact CD1-CE2 4.38Å; Y487-F491 HydrophobicContact CD1-CD2 4.29Å; Y487-F491 AromaticContact CD2-CD2 3.87Å; Y487-F491 HydrophobicContact CD2-CD2 3.87Å; Y487-F491 HydrophobicContact CD2-CE2 4.06Å; Y487-F491 HydrophobicContact CE1-CB 4.32Å; Y487-F491 AromaticContact CE1-CD2 3.95Å; Y487-F491 HydrophobicContact CE1-CD2 3.95Å; Y487-F491 HydrophobicContact CE1-CG 4.47Å; Y487-F491 AromaticContact CE2-CD2 3.5Å; Y487-F491 HydrophobicContact CE2-CD2 3.5Å; Y487-F491 VanDerWaalsContact CE2-CD2 3.5Å; Y487-F491 AromaticContact CE2-CE2 3.58Å; Y487-F491 HydrophobicContact CE2-CE2 3.58Å; Y487-F491 HydrophobicContact CG-CD2 4.25Å; Y487-F491 AromaticContact CZ-CD2 3.55Å; Y487-F491 PolarHBondContact O-N 2.91Å; R488-F491 CarbonylContact O-C 3.57Å; F491-S496 WeakPolarHBondContact CA-OG 3.23Å; F491-S496 WeakPolarHBondContact CD1-O 3.35Å; F491-S496 WeakPolarHBondContact CE1-O 3.21Å; F491-K497 HydrophobicContact CD1-CB 4.18Å; F491-V500 HydrophobicContact CE1-CB 4.41Å; F491-V500 HydrophobicContact CE1-CG2 4.14Å
492	P	69.4	Low	68.8	Low	96 Å²	96	80.5 Å²	80.5	62%	0.623	43%	0.434	S	S	*	.			trans	-70.7	-29.9	-178.8	-17.2	32.1	0	0	0	113.2	R489 R490	R489-P492 WeakPolarHBondContact O-CG 3.28Å; R490-P492 VanDerWaalsContact C-CD 3.44Å; R490-P492 WeakPolarHBondContact O-CD 3.44Å
493	T	69.4	Low	67.4	Low	83 Å²	83	86 Å²	86	51%	0.509	45%	0.452	S	S	.	.	S	Bend	trans	-122.2	153.2	-175.7	49.3	0	0	0	0	112.2	E495 S496	T493-E495 PolarHBondContact O-N 3.36Å; T493-S496 PolarHBondContact O-N 3.34Å; T493-S496 PolarHBondContact O-OG 2.72Å
494	A	59.5	Low	65.9	Low	86 Å²	86	89.6 Å²	89.6	71%	0.711	47%	0.47	S	S	*	.	H	α-helix	trans	-62	-27.9	-179.8	0	0	0	0	0	113.3	K497 A498	A494-K497 PolarHBondContact O-N 3.12Å; A494-A498 PolarHBondContact O-N 2.94Å
495	E	58	Low	64	Low	160 Å²	160	90.3 Å²	90.3	75%	0.748	48%	0.482	S	S	*	.	H	α-helix	trans	-68.7	-42.8	177.4	-65.4	174.1	177.6	0	0	112.4	T493 K497 A498 A499	T493-E495 PolarHBondContact O-N 3.36Å; E495-K497 PolarHBondContact O-N 2.89Å; E495-A498 PolarHBondContact O-N 3.07Å; E495-A498 VanDerWaalsContact O-N 3.08Å; E495-A499 PolarHBondContact O-N 2.6Å; E495-A499 VanDerWaalsContact O-N 3.1Å
496	S	60.2	Low	62.2	Low	34 Å²	34	91.3 Å²	91.3	24%	0.238	50%	0.497	C	S	.	.	H	α-helix	trans	-60.8	-28.6	176.2	69	0	0	0	0	113	F491 T493	F491-S496 WeakPolarHBondContact CA-OG 3.23Å; F491-S496 WeakPolarHBondContact CD1-O 3.35Å; F491-S496 WeakPolarHBondContact CE1-O 3.21Å; T493-S496 PolarHBondContact O-N 3.34Å; T493-S496 PolarHBondContact O-OG 2.72Å
497	K	60.8	Low	60.3	Low	85 Å²	85	102.5 Å²	102.5	37%	0.37	54%	0.539	S	S	.	.	H	α-helix	trans	-80	-32	177.2	-174.2	179.7	-179.5	178.5	0	112.5	F491 A494 E495 L501	F491-K497 HydrophobicContact CD1-CB 4.18Å; A494-K497 PolarHBondContact O-N 3.12Å; E495-K497 PolarHBondContact O-N 2.89Å; K497-L501 HydrophobicContact CG-CD1 4.25Å; K497-L501 PolarHBondContact O-N 2.95Å
498	A	59.4	Low	58.5	Low	58 Å²	58	109.8 Å²	109.8	48%	0.479	58%	0.578	S	S	.	*	H	α-helix	trans	-75.7	-31.4	178.9	0	0	0	0	0	112.3	A494 E495 V500 L501	A494-A498 PolarHBondContact O-N 2.94Å; E495-A498 PolarHBondContact O-N 3.07Å; E495-A498 VanDerWaalsContact O-N 3.08Å; A498-V500 PolarHBondContact O-N 2.85Å; A498-L501 PolarHBondContact O-N 3.35Å
499	A	61.6	Low	56.4	Low	91 Å²	91	111.8 Å²	111.8	75%	0.752	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.7	-24.4	176.3	0	0	0	0	0	114.1	E495	E495-A499 PolarHBondContact O-N 2.6Å; E495-A499 VanDerWaalsContact O-N 3.1Å
500	V	61.5	Low	54.7	Low	43 Å²	43	109.4 Å²	109.4	26%	0.261	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-105.1	-17.5	-175.6	176.8	0	0	0	0	112.8	I462 F491 A498	I462-V500 HydrophobicContact CB-CG1 4.29Å; I462-V500 HydrophobicContact CG1-CG1 4.02Å; I462-V500 HydrophobicContact CG2-CG1 3.6Å; I462-V500 HydrophobicContact CG2-CG2 4.1Å; F491-V500 HydrophobicContact CE1-CB 4.41Å; F491-V500 HydrophobicContact CE1-CG2 4.14Å; A498-V500 PolarHBondContact O-N 2.85Å
501	L	58.9	Low	53	Low	32 Å²	32	112.2 Å²	112.2	17%	0.168	62%	0.616	C	S	.	*	S	Bend	trans	-119.3	110.8	-178.8	-69.7	174.4	0	0	0	108.9	R473 L476 K497 A498 E503	R473-L501 HydrophobicContact CG-CD2 3.42Å; R473-L501 VanDerWaalsContact CG-CD2 3.42Å; L476-L501 HydrophobicContact CD2-CD1 4.2Å; L476-L501 HydrophobicContact CD2-CD2 4.4Å; L476-L501 HydrophobicContact CD2-CG 4.46Å; K497-L501 HydrophobicContact CG-CD1 4.25Å; K497-L501 PolarHBondContact O-N 2.95Å; A498-L501 PolarHBondContact O-N 3.35Å; L501-E503 PolarHBondContact O-N 3.32Å
502	P	51.8	Low	51.3	Low	85 Å²	85	119.1 Å²	119.1	55%	0.552	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-57.3	140.8	176.8	21.3	-30.6	0	0	0	110	R473	R473-P502 PolarHBondContact NH2-O 3.43Å
503	E	48.6	Very low	49.8	Very low	183 Å²	183	123.4 Å²	123.4	86%	0.855	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-57.4	151.4	-174	-80.8	-164.6	137.4	0	0	113.4	L501 A505	L501-E503 PolarHBondContact O-N 3.32Å; E503-A505 PolarHBondContact O-N 3.3Å
504	K	47.7	Very low	48.2	Very low	177 Å²	177	126.4 Å²	126.4	77%	0.77	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-74.3	119.6	166.1	-86.2	-179.3	172.8	-179.9	0	108
505	A	38.8	Very low	47.2	Very low	86 Å²	86	130.7 Å²	130.7	71%	0.711	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-54.3	136.2	161.6	0	0	0	0	0	109.9	E503 R507	E503-A505 PolarHBondContact O-N 3.3Å; A505-R507 PolarHBondContact O-N 3.42Å
506	P	37.4	Very low	46.2	Very low	126 Å²	126	128.3 Å²	128.3	82%	0.818	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-65.7	120.7	-175.6	24.9	-31.4	0	0	0	110	L508	P506-L508 PolarHBondContact O-N 3.18Å
507	R	39.7	Very low	45.1	Very low	241 Å²	241	135.1 Å²	135.1	91%	0.909	72%	0.718	S	S	*	*			trans	-77.9	106.9	171.1	-71.7	-174.2	177.5	-174.5	-4.6	108.7	A505 K509	A505-R507 PolarHBondContact O-N 3.42Å; R507-K509 PolarHBondContact O-N 3.33Å
508	L	40.2	Very low	44	Very low	167 Å²	167	140.1 Å²	140.1	87%	0.874	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-51.1	125.8	160.4	-81.3	143.3	0	0	0	109	P506 P510	P506-L508 PolarHBondContact O-N 3.18Å; L508-P510 WeakPolarHBondContact O-CD 3.41Å
509	K	34.1	Very low	42.9	Very low	203 Å²	203	146.9 Å²	146.9	88%	0.883	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-80.4	125.3	177.1	-70.8	178.9	178.5	176.9	0	109.7	R507	R507-K509 PolarHBondContact O-N 3.33Å
510	P	39.8	Very low	42.1	Very low	114 Å²	114	148.1 Å²	148.1	74%	0.74	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-82	132.9	154	-0.6	19.8	0	0	0	108.9	L508	L508-P510 WeakPolarHBondContact O-CD 3.41Å
511	Q	39.6	Very low	41	Very low	187 Å²	187	156.1 Å²	156.1	87%	0.874	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.8	130.6	172.7	-65.6	174.7	-5.3	0	0	109.7
512	L	41.4	Very low	40.2	Very low	165 Å²	165	163.3 Å²	163.3	86%	0.864	82%	0.823	S	S	*	*			trans	-119.6	116.6	167.6	-75.9	171.3	0	0	0	108.7
513	M	36.9	Very low	39.7	Very low	185 Å²	185	164.9 Å²	164.9	91%	0.911	83%	0.834	S	S	*	*			trans	-65.1	135.6	172.5	-75.5	-72.2	-165.9	0	0	110.7
514	L	36.8	Very low	39.1	Very low	146 Å²	146	166.2 Å²	166.2	76%	0.764	84%	0.837	S	S	*	*			trans	-76.3	129.2	169.5	-85.4	124.4	0	0	0	110.4	T516	L514-T516 HydrophobicContact CD2-CG2 4.2Å
515	L	38.4	Very low	38.8	Very low	177 Å²	177	166.4 Å²	166.4	93%	0.927	84%	0.84	S	S	*	*			trans	-133.4	101.7	147.2	-87	166.9	0	0	0	109
516	T	36.1	Very low	38.8	Very low	110 Å²	110	173.2 Å²	173.2	68%	0.675	85%	0.848	S	S	*	*			trans	-83.8	130.9	166.6	44.9	0	0	0	0	109.8	L514	L514-T516 HydrophobicContact CD2-CG2 4.2Å
517	L	38.8	Very low	38.8	Very low	177 Å²	177	172.8 Å²	172.8	93%	0.927	85%	0.848	S	S	*	*			trans	-147.6	138.3	150.6	-108.4	143.2	0	0	0	111
518	K	36.7	Very low	38.6	Very low	189 Å²	189	171.2 Å²	171.2	82%	0.822	84%	0.842	S	S	*	*			trans	-91.3	158.1	-157.4	-65.4	170.8	169.2	174.3	0	113.1
519	K	37.1	Very low	38.8	Very low	200 Å²	200	168.7 Å²	168.7	87%	0.87	84%	0.838	S	S	*	*			trans	117.6	155.8	144.3	-69	-175.8	173.5	180	0	115.1
520	P	44.3	Very low	39	Very low	117 Å²	117	167.1 Å²	167.1	76%	0.76	83%	0.832	S	S	*	*				-122.6	167.2	-69.9	26	-4.9	0	0	0	112	Q522	P520-Q522 PolarHBondContact O-N 3.03Å
521	F	38.5	Very low	39.1	Very low	211 Å²	211	173 Å²	173	93%	0.925	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-55.9	129.1	174.6	-84	-97.7	0	0	0	112.8
522	Q	41.8	Very low	39.2	Very low	183 Å²	183	174.1 Å²	174.1	86%	0.855	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-91.7	138.2	157.5	-80.1	-166.7	-22	0	0	110	P520	P520-Q522 PolarHBondContact O-N 3.03Å
523	P	40.6	Very low	39.1	Very low	119 Å²	119	174.6 Å²	174.6	77%	0.773	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-77.7	127.1	179.5	29.6	-30.3	0	0	0	111.1	Q525	P523-Q525 PolarHBondContact O-N 3.39Å
524	F	37.3	Very low	39.3	Very low	210 Å²	210	174 Å²	174	92%	0.921	86%	0.856	S	S	*	*			trans	-71.1	110.1	173.1	-132.4	-94	0	0	0	109.3
525	Q	40	Very low	39.4	Very low	181 Å²	181	175.6 Å²	175.6	85%	0.846	86%	0.861	S	S	*	*			trans	-72.3	133.1	172.5	-76.3	-170.3	-41.4	0	0	110.6	P523	P523-Q525 PolarHBondContact O-N 3.39Å
526	R	38.7	Very low	39.5	Very low	230 Å²	230	175.5 Å²	175.5	87%	0.868	86%	0.857	S	S	*	*			trans	-74	118.3	173	-70.7	-179.5	173.6	-177.3	-2.7	109.5
527	S	38.3	Very low	39.7	Very low	116 Å²	116	179.6 Å²	179.6	81%	0.811	87%	0.869	S	S	*	*			trans	-84.2	111.8	164.7	47.1	0	0	0	0	109.8
528	W	35.9	Very low	39.7	Very low	208 Å²	208	179.7 Å²	179.7	79%	0.788	87%	0.865	S	S	*	*			trans	-77.3	125.8	159.2	-86.6	40.5	0	0	0	107.8	F530	W528-F530 HydrophobicContact CE3-CD2 4.21Å; W528-F530 AromaticContact CE3-CE2 3.56Å; W528-F530 HydrophobicContact CE3-CE2 3.56Å; W528-F530 HydrophobicContact CE3-CZ 4.3Å; W528-F530 AromaticContact CZ3-CE2 3.75Å; W528-F530 HydrophobicContact CZ3-CE2 3.75Å; W528-F530 HydrophobicContact CZ3-CZ 4.08Å
529	S	43.5	Very low	39.9	Very low	114 Å²	114	179.1 Å²	179.1	80%	0.797	87%	0.868	S	S	*	*			trans	-111.1	106	165.8	53.8	0	0	0	0	108.5
530	F	39.7	Very low	40.2	Very low	170 Å²	170	177.5 Å²	177.5	75%	0.746	87%	0.868	S	S	*	*			trans	-77	135	155.9	-86.6	-85.9	0	0	0	107.7	W528	W528-F530 HydrophobicContact CE3-CD2 4.21Å; W528-F530 AromaticContact CE3-CE2 3.56Å; W528-F530 HydrophobicContact CE3-CE2 3.56Å; W528-F530 HydrophobicContact CE3-CZ 4.3Å; W528-F530 AromaticContact CZ3-CE2 3.75Å; W528-F530 HydrophobicContact CZ3-CE2 3.75Å; W528-F530 HydrophobicContact CZ3-CZ 4.08Å
531	R	40.9	Very low	39.8	Very low	237 Å²	237	182.5 Å²	182.5	89%	0.894	88%	0.877	S	S	*	*			trans	-129.8	114.8	151.5	-77	-168.2	-176.2	-129.5	1.6	108.3
532	T	42.7	Very low	39.9	Very low	211 Å²	211	179.9 Å²	179.9	100%	1.294	87%	0.872	S	S	*	*			trans	-4	0	146.8	43.1	0	0	0	0	117.4

Retrieved 532 of 532 residues in 1048 ms (Link to these results)

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