A0A087Y776_POEFO Loading...

Plastin 1 (I isoform)

AlphaFold DB , UniProt , Accession A0A087Y776, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 632 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	31.8	Very low	43	Very low	243 Å²	243	135.9 Å²	135.9	100%	1.197	65%	0.646	S	S	*	*				0	114.6	0	-71.2	177.6	-166.1	0	0	106.5	K3	M1-K3 PolarHBondContact O-N 3.32Å
2	E	30.1	Very low	43.5	Very low	189 Å²	189	128.8 Å²	128.8	88%	0.883	61%	0.614	S	S	*	*			trans	-65.9	124.3	-178	-71.4	168.5	143.4	0	0	109.5	H4	E2-H4 PolarHBondContact O-N 3.46Å
3	K	35	Very low	44.4	Very low	140 Å²	140	123.1 Å²	123.1	61%	0.609	59%	0.589	S	S	*	*			trans	-77.5	109.5	178.6	-71.5	-167.4	171.6	-160.3	0	109.2	M1 Y5 D73	M1-K3 PolarHBondContact O-N 3.32Å; K3-Y5 HydrophobicContact CB-CD2 3.9Å; K3-Y5 HydrophobicContact CB-CE2 3.55Å; K3-Y5 HydrophobicContact CD-CE2 3.65Å; K3-Y5 WeakPolarHBondContact CD-OH 3.46Å; K3-Y5 HydrophobicContact CG-CE2 4.26Å; K3-Y5 PolarHBondContact NZ-OH 3.29Å; K3-Y5 PolarHBondContact O-N 2.78Å; K3-D73 IonicContact NZ-OD2 3.01Å; K3-D73 PolarHBondContact NZ-OD2 2.88Å
4	H	32.5	Very low	45.3	Very low	166 Å²	166	122.6 Å²	122.6	77%	0.769	59%	0.586	S	S	*	*			trans	-69.9	86.6	172.8	-92.2	-78.3	0	0	0	110.7	E2	E2-H4 PolarHBondContact O-N 3.46Å
5	Y	38.2	Very low	45.7	Very low	119 Å²	119	117.4 Å²	117.4	47%	0.467	56%	0.563	S	S	.	*			trans	-93.4	85.1	162	-63.4	-76.9	0	0	0	108.6	K3 H7 D73	K3-Y5 HydrophobicContact CB-CD2 3.9Å; K3-Y5 HydrophobicContact CB-CE2 3.55Å; K3-Y5 HydrophobicContact CD-CE2 3.65Å; K3-Y5 WeakPolarHBondContact CD-OH 3.46Å; K3-Y5 HydrophobicContact CG-CE2 4.26Å; K3-Y5 PolarHBondContact NZ-OH 3.29Å; K3-Y5 PolarHBondContact O-N 2.78Å; Y5-H7 PolarHBondContact O-N 3.25Å; Y5-D73 PolarHBondContact OH-OD1 2.96Å
6	T	46.3	Very low	46.2	Very low	81 Å²	81	110.8 Å²	110.8	50%	0.497	53%	0.532	S	S	.	.			trans	-80.1	111.5	174.4	40.4	0	0	0	0	110.6	Q80	T6-Q80 PolarHBondContact O-NE2 3.37Å
7	H	50.9	Low	47.3	Very low	185 Å²	185	111.4 Å²	111.4	86%	0.856	53%	0.527	S	S	*	.	S	Bend	trans	56.4	61.3	162.9	-63.5	-69.7	0	0	0	118.1	Y5	Y5-H7 PolarHBondContact O-N 3.25Å
8	I	51.2	Low	47.8	Very low	32 Å²	32	108.2 Å²	108.2	16%	0.164	51%	0.512	C	S	.	.			trans	-114.4	131.1	157.8	-57.5	-178.7	0	0	0	108.3	D12 L13 L16 V76 Q80	I8-D12 HydrophobicContact CG2-CB 3.39Å; I8-L13 HydrophobicContact CB-CD2 4.36Å; I8-L13 HydrophobicContact CB-CG 4.08Å; I8-L13 HydrophobicContact CD1-CD2 4.27Å; I8-L13 HydrophobicContact CG2-CB 4.47Å; I8-L13 HydrophobicContact CG2-CD2 4.05Å; I8-L13 HydrophobicContact CG2-CG 3.64Å; I8-L16 HydrophobicContact CD1-CD1 4.32Å; I8-V76 HydrophobicContact CD1-CG1 3.36Å; I8-Q80 HydrophobicContact CD1-CG 3.79Å; I8-Q80 HydrophobicContact CG1-CG 4.19Å
9	S	55.5	Low	48.1	Very low	55 Å²	55	104.2 Å²	104.2	39%	0.385	50%	0.499	S	S	.	.			trans	-66.9	154.5	175.9	75.1	0	0	0	0	110.1	E11 D12 L13	S9-E11 PolarHBondContact O-N 2.74Å; S9-D12 PolarHBondContact O-N 3.17Å; S9-D12 VanDerWaalsContact O-N 3.15Å; S9-D12 WeakPolarHBondContact OG-CB 3.34Å; S9-D12 PolarHBondContact OG-N 3.22Å; S9-D12 VanDerWaalsContact OG-N 3.12Å; S9-D12 PolarHBondContact OG-OD2 2.99Å; S9-L13 PolarHBondContact O-N 2.95Å
10	K	54.3	Low	48.8	Very low	160 Å²	160	99.1 Å²	99.1	70%	0.696	47%	0.474	S	S	*	.	H	α-helix	trans	-59.2	-34.5	178.4	-169.4	-179.4	175.1	-173.6	0	111.8	L13 E14	K10-L13 PolarHBondContact O-N 2.81Å; K10-E14 WeakPolarHBondContact O-CG 3.19Å; K10-E14 PolarHBondContact O-N 3.39Å; K10-E14 VanDerWaalsContact O-N 3.14Å
11	E	47.6	Very low	49.6	Very low	125 Å²	125	97.7 Å²	97.7	58%	0.584	47%	0.469	S	S	*	.	H	α-helix	trans	-65.9	-44.7	175.4	-64.8	-177	-173.8	0	0	111.8	S9 L13 E14 D15	S9-E11 PolarHBondContact O-N 2.74Å; E11-L13 VanDerWaalsContact C-N 3.31Å; E11-L13 PolarHBondContact O-N 3.01Å; E11-E14 PolarHBondContact O-N 2.85Å; E11-D15 PolarHBondContact O-N 3.07Å
12	D	49.1	Very low	50.9	Low	50 Å²	50	91.2 Å²	91.2	27%	0.267	43%	0.434	S	S	.	.	H	α-helix	trans	-64.9	-34.6	177.7	-67.4	-42.7	0	0	0	112.1	I8 S9 L16	I8-D12 HydrophobicContact CG2-CB 3.39Å; S9-D12 PolarHBondContact O-N 3.17Å; S9-D12 VanDerWaalsContact O-N 3.15Å; S9-D12 WeakPolarHBondContact OG-CB 3.34Å; S9-D12 PolarHBondContact OG-N 3.22Å; S9-D12 VanDerWaalsContact OG-N 3.12Å; S9-D12 PolarHBondContact OG-OD2 2.99Å; D12-L16 WeakPolarHBondContact O-CB 3.43Å; D12-L16 WeakPolarHBondContact O-CD1 3.36Å; D12-L16 WeakPolarHBondContact O-CG 3.47Å; D12-L16 PolarHBondContact O-N 3.22Å
13	L	55.1	Low	52.5	Low	55 Å²	55	83 Å²	83	29%	0.288	40%	0.397	S	S	.	.	H	α-helix	trans	-68.3	-38.1	174.7	-80.6	170.7	0	0	0	112.2	I8 S9 K10 E11 R17 V76	I8-L13 HydrophobicContact CB-CD2 4.36Å; I8-L13 HydrophobicContact CB-CG 4.08Å; I8-L13 HydrophobicContact CD1-CD2 4.27Å; I8-L13 HydrophobicContact CG2-CB 4.47Å; I8-L13 HydrophobicContact CG2-CD2 4.05Å; I8-L13 HydrophobicContact CG2-CG 3.64Å; S9-L13 PolarHBondContact O-N 2.95Å; K10-L13 PolarHBondContact O-N 2.81Å; E11-L13 VanDerWaalsContact C-N 3.31Å; E11-L13 PolarHBondContact O-N 3.01Å; L13-R17 WeakPolarHBondContact O-CB 3.3Å; L13-R17 PolarHBondContact O-N 3.09Å; L13-V76 HydrophobicContact CD2-CG1 4.39Å; L13-V76 HydrophobicContact CD2-CG2 4.29Å
14	E	56.6	Low	54.2	Low	117 Å²	117	76.6 Å²	76.6	55%	0.547	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-42.3	175.4	-74.3	175.9	-171.5	0	0	111	K10 E11 R17 E18	K10-E14 WeakPolarHBondContact O-CG 3.19Å; K10-E14 PolarHBondContact O-N 3.39Å; K10-E14 VanDerWaalsContact O-N 3.14Å; E11-E14 PolarHBondContact O-N 2.85Å; E14-R17 PolarHBondContact O-N 3.41Å; E14-E18 PolarHBondContact O-N 2.67Å
15	D	51.3	Low	55.9	Low	44 Å²	44	74 Å²	74	24%	0.235	36%	0.359	C	S	.	.	H	α-helix	trans	-63.2	-40.8	174.4	-86.6	-3.8	0	0	0	112	E11 R17 A19 T188	E11-D15 PolarHBondContact O-N 3.07Å; D15-R17 VanDerWaalsContact C-N 3.31Å; D15-R17 PolarHBondContact O-N 3.06Å; D15-A19 WeakPolarHBondContact O-CB 3.29Å; D15-A19 PolarHBondContact O-N 3.04Å; D15-T188 PolarHBondContact OD2-OG1 2.57Å
16	L	53.1	Low	57.5	Low	12 Å²	12	73.3 Å²	73.3	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-66.1	-34.3	174.7	-74.8	169.2	0	0	0	111.9	I8 D12 F20 F72 F75 V76 Y79	I8-L16 HydrophobicContact CD1-CD1 4.32Å; D12-L16 WeakPolarHBondContact O-CB 3.43Å; D12-L16 WeakPolarHBondContact O-CD1 3.36Å; D12-L16 WeakPolarHBondContact O-CG 3.47Å; D12-L16 PolarHBondContact O-N 3.22Å; L16-F20 VanDerWaalsContact O-CB 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.38Å; L16-F20 PolarHBondContact O-N 3.01Å; L16-F72 HydrophobicContact CB-CE2 4.33Å; L16-F72 HydrophobicContact CB-CZ 4.5Å; L16-F75 HydrophobicContact CD2-CD1 4.43Å; L16-F75 HydrophobicContact CD2-CE1 3.88Å; L16-V76 HydrophobicContact CD1-CG2 4.28Å; L16-Y79 HydrophobicContact CD1-CD1 3.83Å; L16-Y79 HydrophobicContact CD1-CE1 4.17Å; L16-Y79 HydrophobicContact CD1-CG 4.2Å; L16-Y79 HydrophobicContact CD2-CD1 4.1Å; L16-Y79 HydrophobicContact CD2-CD2 3.68Å; L16-Y79 HydrophobicContact CD2-CE1 4.4Å; L16-Y79 HydrophobicContact CD2-CE2 3.99Å; L16-Y79 HydrophobicContact CD2-CG 3.73Å
17	R	64.9	Low	58.9	Low	120 Å²	120	76.5 Å²	76.5	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-69.8	-44.4	177.6	-171.2	62.3	178.5	-132.8	2.5	111.9	L13 E14 D15 A19 F20 D21 F72	L13-R17 WeakPolarHBondContact O-CB 3.3Å; L13-R17 PolarHBondContact O-N 3.09Å; E14-R17 PolarHBondContact O-N 3.41Å; D15-R17 VanDerWaalsContact C-N 3.31Å; D15-R17 PolarHBondContact O-N 3.06Å; R17-A19 VanDerWaalsContact C-N 3.32Å; R17-A19 PolarHBondContact O-N 2.89Å; R17-F20 WeakPolarHBondContact O-CB 3.46Å; R17-F20 PolarHBondContact O-N 2.95Å; R17-D21 IonicContact NE-OD1 3.48Å; R17-D21 PolarHBondContact NE-OD1 3.15Å; R17-D21 WeakPolarHBondContact O-CB 3.33Å; R17-D21 PolarHBondContact O-N 3.27Å; R17-F72 VanDerWaalsContact CA-CE2 3.49Å; R17-F72 HydrophobicContact CB-CE2 3.9Å; R17-F72 HydrophobicContact CB-CZ 3.89Å; R17-F72 HydrophobicContact CG-CE2 4.38Å; R17-F72 HydrophobicContact CG-CZ 4.44Å
18	E	57.3	Low	60.1	Low	55 Å²	55	70.4 Å²	70.4	26%	0.257	35%	0.351	S	S	.	.	H	α-helix	trans	-66.2	-35.5	176	-162.1	-166.3	146.6	0	0	111.8	E14 K22 F189	E14-E18 PolarHBondContact O-N 2.67Å; E18-K22 WeakPolarHBondContact O-CG 3.4Å; E18-K22 PolarHBondContact O-N 2.97Å; E18-K22 WeakPolarHBondContact OE1-CE 3.38Å; E18-K22 IonicContact OE1-NZ 2.66Å; E18-K22 PolarHBondContact OE1-NZ 3.41Å; E18-F189 WeakPolarHBondContact OE1-CD2 3.32Å
19	A	52.8	Low	61.3	Low	31 Å²	31	70.5 Å²	70.5	26%	0.256	36%	0.36	S	S	.	.	H	α-helix	trans	-64.8	-43.4	172.7	0	0	0	0	0	111.6	D15 R17 K22 I23	D15-A19 WeakPolarHBondContact O-CB 3.29Å; D15-A19 PolarHBondContact O-N 3.04Å; R17-A19 VanDerWaalsContact C-N 3.32Å; R17-A19 PolarHBondContact O-N 2.89Å; A19-K22 PolarHBondContact O-N 3.02Å; A19-I23 WeakPolarHBondContact O-CD1 3.21Å; A19-I23 VanDerWaalsContact O-CG1 3.25Å; A19-I23 WeakPolarHBondContact O-CG1 3.5Å; A19-I23 PolarHBondContact O-N 3.29Å
20	F	62.1	Low	62.4	Low	2 Å²	2	72.9 Å²	72.9	1%	0.009	36%	0.361	C	S	.	.	H	α-helix	trans	-61.2	-47.8	175.7	-173.6	-88.1	0	0	0	111.6	L16 R17 K22 I23 D24 G29 V31 F72 F75	L16-F20 VanDerWaalsContact O-CB 3.3Å; L16-F20 WeakPolarHBondContact O-CB 3.38Å; L16-F20 PolarHBondContact O-N 3.01Å; R17-F20 WeakPolarHBondContact O-CB 3.46Å; R17-F20 PolarHBondContact O-N 2.95Å; F20-K22 PolarHBondContact O-N 3.06Å; F20-I23 PolarHBondContact O-N 3.37Å; F20-D24 HydrophobicContact CE1-CB 4.42Å; F20-D24 WeakPolarHBondContact O-CB 3.46Å; F20-D24 PolarHBondContact O-N 3.47Å; F20-G29 WeakPolarHBondContact CZ-O 3.38Å; F20-V31 HydrophobicContact CD2-CG2 3.92Å; F20-V31 HydrophobicContact CE2-CB 4.43Å; F20-V31 HydrophobicContact CE2-CG2 3.62Å; F20-V31 HydrophobicContact CZ-CG2 3.98Å; F20-F72 HydrophobicContact CB-CD2 3.88Å; F20-F72 HydrophobicContact CB-CE2 4.2Å; F20-F72 HydrophobicContact CD1-CD2 4.23Å; F20-F72 HydrophobicContact CD2-CB 4.43Å; F20-F72 AromaticContact CD2-CD2 3.96Å; F20-F72 HydrophobicContact CD2-CD2 3.96Å; F20-F72 HydrophobicContact CE1-CB 4.38Å; F20-F72 HydrophobicContact CE2-CB 4.21Å; F20-F72 AromaticContact CG-CD2 3.76Å; F20-F72 HydrophobicContact CG-CD2 3.76Å; F20-F72 HydrophobicContact CZ-CB 4.18Å; F20-F75 HydrophobicContact CB-CD1 4.48Å; F20-F75 HydrophobicContact CD2-CB 3.97Å; F20-F75 HydrophobicContact CD2-CD1 4.09Å; F20-F75 HydrophobicContact CD2-CD2 4.37Å; F20-F75 AromaticContact CD2-CG 3.9Å; F20-F75 HydrophobicContact CD2-CG 3.9Å; F20-F75 HydrophobicContact CE2-CB 4.18Å
21	D	66.9	Low	63.2	Low	70 Å²	70	65.2 Å²	65.2	37%	0.374	33%	0.328	S	S	.	.	H	α-helix	trans	-65.7	-19.7	-179.6	-64	-14.6	0	0	0	113.1	R17	R17-D21 IonicContact NE-OD1 3.48Å; R17-D21 PolarHBondContact NE-OD1 3.15Å; R17-D21 WeakPolarHBondContact O-CB 3.33Å; R17-D21 PolarHBondContact O-N 3.27Å
22	K	58.8	Low	64.2	Low	107 Å²	107	60.8 Å²	60.8	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-83.9	-25.4	172.5	-80	177.4	-173.8	160.9	0	113.6	E18 A19 F20 F189	E18-K22 WeakPolarHBondContact O-CG 3.4Å; E18-K22 PolarHBondContact O-N 2.97Å; E18-K22 WeakPolarHBondContact OE1-CE 3.38Å; E18-K22 IonicContact OE1-NZ 2.66Å; E18-K22 PolarHBondContact OE1-NZ 3.41Å; A19-K22 PolarHBondContact O-N 3.02Å; F20-K22 PolarHBondContact O-N 3.06Å; K22-F189 HydrophobicContact CD-CE2 4.44Å; K22-F189 HydrophobicContact CD-CZ 4.12Å; K22-F189 VanDerWaalsContact NZ-CZ 3.28Å
23	I	62.2	Low	64.8	Low	18 Å²	18	61.9 Å²	61.9	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-87.3	-34.7	178.6	-60.1	163.7	0	0	0	110	A19 F20 I25 V31 L39 F75	A19-I23 WeakPolarHBondContact O-CD1 3.21Å; A19-I23 VanDerWaalsContact O-CG1 3.25Å; A19-I23 WeakPolarHBondContact O-CG1 3.5Å; A19-I23 PolarHBondContact O-N 3.29Å; F20-I23 PolarHBondContact O-N 3.37Å; I23-I25 PolarHBondContact O-N 3.48Å; I23-V31 HydrophobicContact CB-CG2 4.14Å; I23-V31 HydrophobicContact CG2-CB 4.38Å; I23-V31 HydrophobicContact CG2-CG1 3.6Å; I23-V31 HydrophobicContact CG2-CG2 3.81Å; I23-L39 HydrophobicContact CD1-CD2 3.71Å; I23-L39 HydrophobicContact CG1-CD1 4.04Å; I23-L39 HydrophobicContact CG1-CD2 3.79Å; I23-L39 HydrophobicContact CG1-CG 4.47Å; I23-L39 HydrophobicContact CG2-CD2 4.08Å; I23-F75 HydrophobicContact CD1-CE2 4.23Å; I23-F75 HydrophobicContact CD1-CZ 4.18Å
24	D	70.4	Confident	65.2	Low	4 Å²	4	65.6 Å²	65.6	2%	0.021	33%	0.331	C	S	.	.			trans	-72.6	76.2	171	-177.7	12	0	0	0	109.9	F20 D26 H27 S28 G29	F20-D24 HydrophobicContact CE1-CB 4.42Å; F20-D24 WeakPolarHBondContact O-CB 3.46Å; F20-D24 PolarHBondContact O-N 3.47Å; D24-D26 PolarHBondContact O-N 2.77Å; D24-H27 VanDerWaalsContact CG-CA 3.48Å; D24-H27 PolarHBondContact O-N 2.77Å; D24-H27 PolarHBondContact O-ND1 3.44Å; D24-H27 WeakPolarHBondContact OD1-CA 3.28Å; D24-H27 PolarHBondContact OD1-N 3.41Å; D24-H27 WeakPolarHBondContact OD2-CA 2.98Å; D24-S28 PolarHBondContact OD1-N 3.14Å; D24-S28 PolarHBondContact OD1-OG 2.85Å; D24-S28 PolarHBondContact OD2-N 3.36Å; D24-G29 VanDerWaalsContact OD2-CA 3.28Å; D24-G29 WeakPolarHBondContact OD2-CA 3.44Å; D24-G29 PolarHBondContact OD2-N 3.04Å
25	I	68.5	Low	65.6	Low	111 Å²	111	60.4 Å²	60.4	57%	0.569	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-33.7	-174.8	-65.4	165.4	0	0	0	110.2	I23 E35	I23-I25 PolarHBondContact O-N 3.48Å; I25-E35 HydrophobicContact CB-CG 4.49Å; I25-E35 HydrophobicContact CD1-CG 4.49Å; I25-E35 PolarHBondContact N-OE1 2.87Å
26	D	73.1	Confident	66	Low	106 Å²	106	59.1 Å²	59.1	57%	0.567	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-3.6	179.2	78.9	0.7	0	0	0	114.3	D24 S28 E35	D24-D26 PolarHBondContact O-N 2.77Å; D26-S28 PolarHBondContact O-N 2.96Å; D26-S28 WeakPolarHBondContact OD1-CB 3.4Å; D26-S28 PolarHBondContact OD1-N 3.32Å; D26-S28 PolarHBondContact OD1-OG 3.06Å; D26-E35 PolarHBondContact N-OE1 2.96Å
27	H	75.1	Confident	66	Low	147 Å²	147	63.6 Å²	63.6	68%	0.681	32%	0.32	S	S	*	.			trans	57.4	32.6	-178.9	-57.3	-43.1	0	0	0	113.4	D24 G29	D24-H27 VanDerWaalsContact CG-CA 3.48Å; D24-H27 PolarHBondContact O-N 2.77Å; D24-H27 PolarHBondContact O-ND1 3.44Å; D24-H27 WeakPolarHBondContact OD1-CA 3.28Å; D24-H27 PolarHBondContact OD1-N 3.41Å; D24-H27 WeakPolarHBondContact OD2-CA 2.98Å; H27-G29 PolarHBondContact O-N 3.41Å
28	S	76.7	Confident	65.5	Low	57 Å²	57	60 Å²	60	40%	0.399	31%	0.309	S	S	.	.	S	Bend	trans	-74.7	-12.1	179.6	63.9	0	0	0	0	113.5	D24 D26 Y30	D24-S28 PolarHBondContact OD1-N 3.14Å; D24-S28 PolarHBondContact OD1-OG 2.85Å; D24-S28 PolarHBondContact OD2-N 3.36Å; D26-S28 PolarHBondContact O-N 2.96Å; D26-S28 WeakPolarHBondContact OD1-CB 3.4Å; D26-S28 PolarHBondContact OD1-N 3.32Å; D26-S28 PolarHBondContact OD1-OG 3.06Å; S28-Y30 VanDerWaalsContact C-N 3.31Å; S28-Y30 WeakPolarHBondContact O-CD2 3.33Å; S28-Y30 PolarHBondContact OG-O 3.2Å; S28-Y30 VanDerWaalsContact OG-O 3.14Å
29	G	76.2	Confident	65.3	Low	34 Å²	34	60.4 Å²	60.4	35%	0.351	31%	0.312	S	S	.	.	S	Bend	trans	82.7	7.8	-174	0	0	0	0	0	113.7	F20 D24 H27	F20-G29 WeakPolarHBondContact CZ-O 3.38Å; D24-G29 VanDerWaalsContact OD2-CA 3.28Å; D24-G29 WeakPolarHBondContact OD2-CA 3.44Å; D24-G29 PolarHBondContact OD2-N 3.04Å; H27-G29 PolarHBondContact O-N 3.41Å
30	Y	78.7	Confident	65	Low	105 Å²	105	61.3 Å²	61.3	41%	0.412	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	143.5	180	-62.5	-90.3	0	0	0	109	S28 K69	S28-Y30 VanDerWaalsContact C-N 3.31Å; S28-Y30 WeakPolarHBondContact O-CD2 3.33Å; S28-Y30 PolarHBondContact OG-O 3.2Å; S28-Y30 VanDerWaalsContact OG-O 3.14Å; Y30-K69 HydrophobicContact CD1-CB 4.49Å
31	V	70.4	Confident	64.2	Low	0 Å²	0	68 Å²	68	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.5	171.6	173.4	0	0	0	0	108.8	F20 I23 E35 L36 I70	F20-V31 HydrophobicContact CD2-CG2 3.92Å; F20-V31 HydrophobicContact CE2-CB 4.43Å; F20-V31 HydrophobicContact CE2-CG2 3.62Å; F20-V31 HydrophobicContact CZ-CG2 3.98Å; I23-V31 HydrophobicContact CB-CG2 4.14Å; I23-V31 HydrophobicContact CG2-CB 4.38Å; I23-V31 HydrophobicContact CG2-CG1 3.6Å; I23-V31 HydrophobicContact CG2-CG2 3.81Å; V31-E35 HydrophobicContact CG1-CB 4.46Å; V31-L36 HydrophobicContact CG1-CB 4.04Å; V31-L36 HydrophobicContact CG1-CD1 3.74Å; V31-I70 HydrophobicContact CB-CB 4.41Å; V31-I70 PolarHBondContact N-O 3.47Å; V31-I70 PolarHBondContact O-N 3.32Å
32	S	68.8	Low	62.9	Low	31 Å²	31	70.4 Å²	70.4	22%	0.217	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	159.2	176.6	63.9	0	0	0	0	112.7	F34 E35 L36	S32-F34 PolarHBondContact O-N 3.36Å; S32-E35 WeakPolarHBondContact CB-OE2 3.44Å; S32-E35 PolarHBondContact N-OE2 3.18Å; S32-E35 PolarHBondContact O-N 2.89Å; S32-E35 WeakPolarHBondContact OG-CG 3.4Å; S32-E35 PolarHBondContact OG-N 2.91Å; S32-E35 PolarHBondContact OG-OE2 3.2Å; S32-L36 WeakPolarHBondContact O-CB 3.45Å; S32-L36 PolarHBondContact O-N 2.91Å
33	D	61.2	Low	61.7	Low	73 Å²	73	67.2 Å²	67.2	39%	0.39	34%	0.338	S	S	.	.	H	α-helix	trans	-54.6	-33.7	171.4	179.9	49.5	0	0	0	111.8	Q37 F59	D33-Q37 WeakPolarHBondContact O-CB 3.34Å; D33-Q37 WeakPolarHBondContact O-CG 3.43Å; D33-Q37 PolarHBondContact O-N 2.76Å; D33-Q37 PolarHBondContact OD1-NE2 2.9Å; D33-Q37 PolarHBondContact OD2-NE2 2.98Å; D33-F59 HydrophobicContact CB-CE1 4.47Å
34	F	64.3	Low	60.4	Low	133 Å²	133	68.9 Å²	68.9	58%	0.583	35%	0.351	S	S	*	.	H	α-helix	trans	-67	-49.1	175.5	179.7	-98.9	0	0	0	112.7	S32 L36 Q37 E38	S32-F34 PolarHBondContact O-N 3.36Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 3.23Å; F34-Q37 CarbonylContact O-C 3.55Å; F34-Q37 PolarHBondContact O-N 3.48Å; F34-E38 HydrophobicContact CD1-CG 4.23Å; F34-E38 HydrophobicContact CE1-CG 3.82Å; F34-E38 HydrophobicContact CE2-CG 4.44Å; F34-E38 HydrophobicContact CZ-CG 3.94Å; F34-E38 WeakPolarHBondContact O-CG 3.25Å; F34-E38 PolarHBondContact O-N 3.28Å
35	E	65.7	Low	58.8	Low	8 Å²	8	76.2 Å²	76.2	4%	0.037	38%	0.383	C	S	.	.	H	α-helix	trans	-66.8	-35.3	179.7	-71	164.3	129.9	0	0	112.4	I25 D26 V31 S32 E38 L39	I25-E35 HydrophobicContact CB-CG 4.49Å; I25-E35 HydrophobicContact CD1-CG 4.49Å; I25-E35 PolarHBondContact N-OE1 2.87Å; D26-E35 PolarHBondContact N-OE1 2.96Å; V31-E35 HydrophobicContact CG1-CB 4.46Å; S32-E35 WeakPolarHBondContact CB-OE2 3.44Å; S32-E35 PolarHBondContact N-OE2 3.18Å; S32-E35 PolarHBondContact O-N 2.89Å; S32-E35 WeakPolarHBondContact OG-CG 3.4Å; S32-E35 PolarHBondContact OG-N 2.91Å; S32-E35 PolarHBondContact OG-OE2 3.2Å; E35-E38 PolarHBondContact O-N 3.03Å; E35-L39 WeakPolarHBondContact O-CB 3.35Å; E35-L39 PolarHBondContact O-N 3.44Å
36	L	59.2	Low	57.2	Low	18 Å²	18	78.5 Å²	78.5	9%	0.094	39%	0.391	C	S	.	.	H	α-helix	trans	-69.3	-39.5	173.7	-158.8	100	0	0	0	111.4	V31 S32 F34 L39 F40 F59	V31-L36 HydrophobicContact CG1-CB 4.04Å; V31-L36 HydrophobicContact CG1-CD1 3.74Å; S32-L36 WeakPolarHBondContact O-CB 3.45Å; S32-L36 PolarHBondContact O-N 2.91Å; F34-L36 VanDerWaalsContact C-N 3.32Å; F34-L36 PolarHBondContact O-N 3.23Å; L36-L39 PolarHBondContact O-N 2.88Å; L36-F40 HydrophobicContact CD1-CE2 4.16Å; L36-F40 HydrophobicContact CD2-CD2 3.77Å; L36-F40 HydrophobicContact CD2-CE2 3.47Å; L36-F40 VanDerWaalsContact CD2-CE2 3.47Å; L36-F40 HydrophobicContact CG-CD2 3.78Å; L36-F40 HydrophobicContact CG-CE2 3.53Å; L36-F40 WeakPolarHBondContact O-CB 3.45Å; L36-F40 WeakPolarHBondContact O-CD2 3.34Å; L36-F40 PolarHBondContact O-N 2.67Å; L36-F59 HydrophobicContact CB-CE2 4.23Å; L36-F59 HydrophobicContact CD1-CD2 4.07Å; L36-F59 HydrophobicContact CD1-CE2 3.92Å; L36-F59 HydrophobicContact CD2-CB 4.41Å; L36-F59 HydrophobicContact CD2-CD2 3.17Å; L36-F59 HydrophobicContact CD2-CE2 3.44Å; L36-F59 VanDerWaalsContact CD2-CE2 3.44Å; L36-F59 HydrophobicContact CD2-CG 3.9Å; L36-F59 HydrophobicContact CD2-CZ 4.36Å; L36-F59 HydrophobicContact CG-CD2 4.14Å; L36-F59 HydrophobicContact CG-CE2 4.04Å
37	Q	51.8	Low	55.5	Low	105 Å²	105	76.4 Å²	76.4	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-67.7	-33.4	172.5	-78.4	176.8	24.3	0	0	112.5	D33 F34 R41	D33-Q37 WeakPolarHBondContact O-CB 3.34Å; D33-Q37 WeakPolarHBondContact O-CG 3.43Å; D33-Q37 PolarHBondContact O-N 2.76Å; D33-Q37 PolarHBondContact OD1-NE2 2.9Å; D33-Q37 PolarHBondContact OD2-NE2 2.98Å; F34-Q37 CarbonylContact O-C 3.55Å; F34-Q37 PolarHBondContact O-N 3.48Å; Q37-R41 WeakPolarHBondContact O-CB 3.15Å; Q37-R41 PolarHBondContact O-N 2.88Å
38	E	55.1	Low	53.8	Low	46 Å²	46	72.5 Å²	72.5	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-51.1	170.4	-74.3	-68	131.4	0	0	110.5	F34 E35 F40 R41 E42	F34-E38 HydrophobicContact CD1-CG 4.23Å; F34-E38 HydrophobicContact CE1-CG 3.82Å; F34-E38 HydrophobicContact CE2-CG 4.44Å; F34-E38 HydrophobicContact CZ-CG 3.94Å; F34-E38 WeakPolarHBondContact O-CG 3.25Å; F34-E38 PolarHBondContact O-N 3.28Å; E35-E38 PolarHBondContact O-N 3.03Å; E38-F40 VanDerWaalsContact C-N 3.3Å; E38-F40 PolarHBondContact O-N 2.96Å; E38-R41 PolarHBondContact O-N 2.93Å; E38-R41 VanDerWaalsContact O-N 3.13Å; E38-R41 IonicContact OE1-CZ 3.48Å; E38-R41 IonicContact OE1-NH1 3.95Å; E38-R41 PolarHBondContact OE1-NH1 3.15Å; E38-R41 IonicContact OE1-NH2 3.5Å; E38-R41 PolarHBondContact OE1-NH2 2.72Å; E38-R41 IonicContact OE2-CZ 2.94Å; E38-R41 IonicContact OE2-NH1 3.68Å; E38-R41 IonicContact OE2-NH2 3.44Å; E38-R41 PolarHBondContact OE2-NH2 3.02Å; E38-E42 WeakPolarHBondContact O-CB 3.2Å; E38-E42 PolarHBondContact O-N 3.08Å
39	L	52.7	Low	52.1	Low	62 Å²	62	72.3 Å²	72.3	33%	0.325	38%	0.375	S	S	.	.	H	α-helix	trans	-56.2	-44	174.9	-178.4	76.3	0	0	0	111.7	I23 E35 L36 E42 A43	I23-L39 HydrophobicContact CD1-CD2 3.71Å; I23-L39 HydrophobicContact CG1-CD1 4.04Å; I23-L39 HydrophobicContact CG1-CD2 3.79Å; I23-L39 HydrophobicContact CG1-CG 4.47Å; I23-L39 HydrophobicContact CG2-CD2 4.08Å; E35-L39 WeakPolarHBondContact O-CB 3.35Å; E35-L39 PolarHBondContact O-N 3.44Å; L36-L39 PolarHBondContact O-N 2.88Å; L39-E42 WeakPolarHBondContact O-CB 3.4Å; L39-E42 PolarHBondContact O-N 3.23Å; L39-A43 WeakPolarHBondContact O-CB 3.48Å; L39-A43 PolarHBondContact O-N 3.07Å
40	F	48	Very low	50.9	Low	50 Å²	50	77.3 Å²	77.3	22%	0.219	38%	0.384	C	S	.	.	H	α-helix	trans	-75.3	-30.4	178.1	-77.1	-57.4	0	0	0	112.6	L36 E38 E42 A43 S44 I55	L36-F40 HydrophobicContact CD1-CE2 4.16Å; L36-F40 HydrophobicContact CD2-CD2 3.77Å; L36-F40 HydrophobicContact CD2-CE2 3.47Å; L36-F40 VanDerWaalsContact CD2-CE2 3.47Å; L36-F40 HydrophobicContact CG-CD2 3.78Å; L36-F40 HydrophobicContact CG-CE2 3.53Å; L36-F40 WeakPolarHBondContact O-CB 3.45Å; L36-F40 WeakPolarHBondContact O-CD2 3.34Å; L36-F40 PolarHBondContact O-N 2.67Å; E38-F40 VanDerWaalsContact C-N 3.3Å; E38-F40 PolarHBondContact O-N 2.96Å; F40-E42 VanDerWaalsContact C-N 3.3Å; F40-A43 HydrophobicContact CD1-CB 4.38Å; F40-A43 CarbonylContact O-C 3.57Å; F40-A43 PolarHBondContact O-N 3.45Å; F40-S44 VanDerWaalsContact O-CA 3.29Å; F40-S44 WeakPolarHBondContact O-CA 3.16Å; F40-S44 WeakPolarHBondContact O-CB 3.3Å; F40-S44 PolarHBondContact O-N 2.84Å; F40-S44 PolarHBondContact O-OG 2.98Å; F40-I55 HydrophobicContact CD1-CG2 4.5Å; F40-I55 HydrophobicContact CD2-CG2 4.29Å; F40-I55 HydrophobicContact CE1-CD1 4.03Å; F40-I55 HydrophobicContact CE1-CG2 3.78Å; F40-I55 HydrophobicContact CE2-CG2 3.5Å; F40-I55 HydrophobicContact CZ-CG2 3.25Å
41	R	45	Very low	49.4	Very low	142 Å²	142	76.2 Å²	76.2	54%	0.536	38%	0.381	S	S	.	.	H	α-helix	trans	-67.1	-35.9	172.2	-169.2	175.7	73	-143.8	2.1	110.8	Q37 E38 S44	Q37-R41 WeakPolarHBondContact O-CB 3.15Å; Q37-R41 PolarHBondContact O-N 2.88Å; E38-R41 PolarHBondContact O-N 2.93Å; E38-R41 VanDerWaalsContact O-N 3.13Å; E38-R41 IonicContact OE1-CZ 3.48Å; E38-R41 IonicContact OE1-NH1 3.95Å; E38-R41 PolarHBondContact OE1-NH1 3.15Å; E38-R41 IonicContact OE1-NH2 3.5Å; E38-R41 PolarHBondContact OE1-NH2 2.72Å; E38-R41 IonicContact OE2-CZ 2.94Å; E38-R41 IonicContact OE2-NH1 3.68Å; E38-R41 IonicContact OE2-NH2 3.44Å; E38-R41 PolarHBondContact OE2-NH2 3.02Å; R41-S44 PolarHBondContact O-N 2.99Å
42	E	38.8	Very low	48.2	Very low	122 Å²	122	78.3 Å²	78.3	57%	0.57	39%	0.394	S	S	*	.	H	α-helix	trans	-64.7	-43.3	169.4	-155	170.9	173.5	0	0	110.6	E38 L39 F40	E38-E42 WeakPolarHBondContact O-CB 3.2Å; E38-E42 PolarHBondContact O-N 3.08Å; L39-E42 WeakPolarHBondContact O-CB 3.4Å; L39-E42 PolarHBondContact O-N 3.23Å; F40-E42 VanDerWaalsContact C-N 3.3Å
43	A	33.5	Very low	47.3	Very low	39 Å²	39	86 Å²	86	32%	0.322	42%	0.418	S	S	.	.	H	α-helix	trans	-76.7	-19.3	175.5	0	0	0	0	0	115.4	L39 F40 F45 H46	L39-A43 WeakPolarHBondContact O-CB 3.48Å; L39-A43 PolarHBondContact O-N 3.07Å; F40-A43 HydrophobicContact CD1-CB 4.38Å; F40-A43 CarbonylContact O-C 3.57Å; F40-A43 PolarHBondContact O-N 3.45Å; A43-F45 PolarHBondContact O-N 3.25Å; A43-F45 VanDerWaalsContact O-N 3.17Å; A43-H46 PolarHBondContact O-N 3.05Å
44	S	34.3	Very low	47	Very low	54 Å²	54	87.7 Å²	87.7	38%	0.378	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-68.8	-14.5	-170.8	-76.8	0	0	0	0	113.1	F40 R41 H46	F40-S44 VanDerWaalsContact O-CA 3.29Å; F40-S44 WeakPolarHBondContact O-CA 3.16Å; F40-S44 WeakPolarHBondContact O-CB 3.3Å; F40-S44 PolarHBondContact O-N 2.84Å; F40-S44 PolarHBondContact O-OG 2.98Å; R41-S44 PolarHBondContact O-N 2.99Å; S44-H46 PolarHBondContact O-N 3.48Å
45	F	37.4	Very low	46.4	Very low	157 Å²	157	83.8 Å²	83.8	69%	0.689	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-69.4	-6.7	171.6	-69.9	-77.6	0	0	0	113.1	A43	A43-F45 PolarHBondContact O-N 3.25Å; A43-F45 VanDerWaalsContact O-N 3.17Å
46	H	36.1	Very low	45.9	Very low	159 Å²	159	87.2 Å²	87.2	74%	0.736	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-131.5	6	-175.4	-68.5	62.4	0	0	0	115.5	A43 S44	A43-H46 PolarHBondContact O-N 3.05Å; S44-H46 PolarHBondContact O-N 3.48Å
47	L	35.8	Very low	46	Very low	63 Å²	63	92.8 Å²	92.8	33%	0.33	46%	0.455	S	S	.	.	S	Bend	trans	-126.1	131.5	-178.3	-70.8	169.2	0	0	0	112.9	K51 I55	L47-K51 HydrophobicContact CD2-CD 3.84Å; L47-I55 HydrophobicContact CD1-CD1 4.48Å
48	P	41.1	Very low	46.5	Very low	64 Å²	64	89.4 Å²	89.4	42%	0.416	44%	0.442	S	S	.	.			trans	-64.3	143.8	173	-19	30.7	0	0	0	112.1	Y50 K51	P48-Y50 HydrophobicContact CB-CD1 3.63Å; P48-Y50 HydrophobicContact CB-CE1 3.41Å; P48-Y50 VanDerWaalsContact CB-CE1 3.41Å; P48-Y50 HydrophobicContact CG-CE1 3.87Å; P48-Y50 PolarHBondContact O-N 3.5Å; P48-K51 PolarHBondContact O-N 2.88Å
49	G	40.8	Very low	46.7	Very low	54 Å²	54	88.3 Å²	88.3	56%	0.557	44%	0.437	S	S	*	.	H	α-helix	trans	-57.9	-17	-172	0	0	0	0	0	117.1	R53	G49-R53 PolarHBondContact O-N 3.46Å
50	Y	50.8	Low	47.1	Very low	139 Å²	139	90.4 Å²	90.4	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-73.9	-32.3	172.7	74	-91.9	0	0	0	112.7	P48 V52 R53 E54	P48-Y50 HydrophobicContact CB-CD1 3.63Å; P48-Y50 HydrophobicContact CB-CE1 3.41Å; P48-Y50 VanDerWaalsContact CB-CE1 3.41Å; P48-Y50 HydrophobicContact CG-CE1 3.87Å; P48-Y50 PolarHBondContact O-N 3.5Å; Y50-V52 VanDerWaalsContact C-N 3.35Å; Y50-R53 PolarHBondContact O-N 2.93Å; Y50-E54 PolarHBondContact O-N 3.18Å; Y50-E54 VanDerWaalsContact O-N 3.17Å
51	K	47.1	Very low	47.7	Very low	81 Å²	81	92.3 Å²	92.3	35%	0.352	47%	0.468	S	S	.	.	H	α-helix	trans	-71.4	-32.4	175.9	-69.3	-167.9	176.2	178.4	0	112.1	L47 P48 R53 E54 I55	L47-K51 HydrophobicContact CD2-CD 3.84Å; P48-K51 PolarHBondContact O-N 2.88Å; K51-R53 VanDerWaalsContact C-N 3.28Å; K51-R53 PolarHBondContact O-N 3.24Å; K51-E54 PolarHBondContact O-N 3.01Å; K51-I55 WeakPolarHBondContact O-CB 3.47Å; K51-I55 WeakPolarHBondContact O-CD1 3.38Å; K51-I55 WeakPolarHBondContact O-CG1 3.47Å; K51-I55 PolarHBondContact O-N 2.89Å
52	V	45.2	Very low	48.5	Very low	44 Å²	44	85.8 Å²	85.8	27%	0.267	44%	0.444	S	S	.	.	H	α-helix	trans	-62.6	-39.7	173.8	-178.1	0	0	0	0	110.1	Y50 I55 V56	Y50-V52 VanDerWaalsContact C-N 3.35Å; V52-I55 PolarHBondContact O-N 3.07Å; V52-V56 VanDerWaalsContact O-CG2 3.29Å; V52-V56 WeakPolarHBondContact O-CG2 3.21Å; V52-V56 PolarHBondContact O-N 3.47Å
53	R	50.2	Low	49.9	Very low	193 Å²	193	81 Å²	81	73%	0.728	42%	0.423	S	S	*	.	H	α-helix	trans	-66.9	-42.9	175.3	-67.6	-178.7	-169.4	-177.6	1.8	113	G49 Y50 K51 I55 V56 E57	G49-R53 PolarHBondContact O-N 3.46Å; Y50-R53 PolarHBondContact O-N 2.93Å; K51-R53 VanDerWaalsContact C-N 3.28Å; K51-R53 PolarHBondContact O-N 3.24Å; R53-I55 VanDerWaalsContact C-N 3.25Å; R53-I55 PolarHBondContact O-N 3.22Å; R53-V56 PolarHBondContact O-N 2.95Å; R53-E57 PolarHBondContact O-N 3.25Å
54	E	55	Low	51.4	Low	108 Å²	108	84.4 Å²	84.4	51%	0.505	44%	0.44	S	S	.	.	H	α-helix	trans	-60.5	-35.9	175.3	-75.7	179.1	163.4	0	0	112.3	Y50 K51 T58	Y50-E54 PolarHBondContact O-N 3.18Å; Y50-E54 VanDerWaalsContact O-N 3.17Å; K51-E54 PolarHBondContact O-N 3.01Å; E54-T58 PolarHBondContact O-N 3.06Å; E54-T58 PolarHBondContact O-OG1 3Å
55	I	51.9	Low	53.2	Low	52 Å²	52	86 Å²	86	27%	0.267	44%	0.444	S	S	.	.	H	α-helix	trans	-75.1	-40.2	179.5	-69.7	167.4	0	0	0	111.4	F40 L47 K51 V52 R53 E57 T58 F59	F40-I55 HydrophobicContact CD1-CG2 4.5Å; F40-I55 HydrophobicContact CD2-CG2 4.29Å; F40-I55 HydrophobicContact CE1-CD1 4.03Å; F40-I55 HydrophobicContact CE1-CG2 3.78Å; F40-I55 HydrophobicContact CE2-CG2 3.5Å; F40-I55 HydrophobicContact CZ-CG2 3.25Å; L47-I55 HydrophobicContact CD1-CD1 4.48Å; K51-I55 WeakPolarHBondContact O-CB 3.47Å; K51-I55 WeakPolarHBondContact O-CD1 3.38Å; K51-I55 WeakPolarHBondContact O-CG1 3.47Å; K51-I55 PolarHBondContact O-N 2.89Å; V52-I55 PolarHBondContact O-N 3.07Å; R53-I55 VanDerWaalsContact C-N 3.25Å; R53-I55 PolarHBondContact O-N 3.22Å; I55-E57 VanDerWaalsContact C-N 3.3Å; I55-E57 PolarHBondContact O-N 3.42Å; I55-T58 CarbonylContact O-C 3.52Å; I55-T58 WeakPolarHBondContact O-CA 3.4Å; I55-T58 WeakPolarHBondContact O-CB 3.45Å; I55-T58 PolarHBondContact O-N 2.93Å; I55-T58 VanDerWaalsContact O-N 3.07Å; I55-F59 PolarHBondContact O-N 3.33Å
56	V	54.9	Low	54.8	Low	80 Å²	80	87.1 Å²	87.1	49%	0.485	45%	0.448	S	S	.	.	H	α-helix	trans	-62.3	-39.3	172	171.8	0	0	0	0	110.7	V52 R53 T58 F59 V60	V52-V56 VanDerWaalsContact O-CG2 3.29Å; V52-V56 WeakPolarHBondContact O-CG2 3.21Å; V52-V56 PolarHBondContact O-N 3.47Å; R53-V56 PolarHBondContact O-N 2.95Å; V56-T58 VanDerWaalsContact C-N 3.3Å; V56-T58 PolarHBondContact O-N 3.17Å; V56-F59 WeakPolarHBondContact O-CB 3.49Å; V56-F59 PolarHBondContact O-N 2.94Å; V56-V60 WeakPolarHBondContact O-CG2 3.37Å; V56-V60 PolarHBondContact O-N 3.5Å
57	E	61.4	Low	56.6	Low	134 Å²	134	82.6 Å²	82.6	63%	0.626	43%	0.43	S	S	*	.	H	α-helix	trans	-63.5	-35.6	171.1	-78	178.4	171.8	0	0	112.4	R53 I55 F59 T61	R53-E57 PolarHBondContact O-N 3.25Å; I55-E57 VanDerWaalsContact C-N 3.3Å; I55-E57 PolarHBondContact O-N 3.42Å; E57-F59 VanDerWaalsContact C-N 3.34Å; E57-T61 WeakPolarHBondContact O-CB 3.4Å; E57-T61 WeakPolarHBondContact O-CG2 3.49Å; E57-T61 PolarHBondContact O-N 3.22Å; E57-T61 PolarHBondContact O-OG1 3.46Å
58	T	60.5	Low	58.1	Low	35 Å²	35	87.1 Å²	87.1	22%	0.215	45%	0.449	C	S	.	.	H	α-helix	trans	-67.8	-33.4	174.7	-53.3	0	0	0	0	111.9	E54 I55 V56 T61 G62 I78 L82	E54-T58 PolarHBondContact O-N 3.06Å; E54-T58 PolarHBondContact O-OG1 3Å; I55-T58 CarbonylContact O-C 3.52Å; I55-T58 WeakPolarHBondContact O-CA 3.4Å; I55-T58 WeakPolarHBondContact O-CB 3.45Å; I55-T58 PolarHBondContact O-N 2.93Å; I55-T58 VanDerWaalsContact O-N 3.07Å; V56-T58 VanDerWaalsContact C-N 3.3Å; V56-T58 PolarHBondContact O-N 3.17Å; T58-T61 VanDerWaalsContact CA-OG1 3.25Å; T58-T61 WeakPolarHBondContact CA-OG1 3.41Å; T58-T61 PolarHBondContact O-OG1 2.94Å; T58-T61 VanDerWaalsContact O-OG1 3.08Å; T58-G62 PolarHBondContact O-N 2.97Å; T58-I78 HydrophobicContact CG2-CG2 3.75Å; T58-L82 HydrophobicContact CG2-CD1 4.35Å; T58-L82 HydrophobicContact CG2-CD2 4.27Å; T58-L82 HydrophobicContact CG2-CG 4.33Å
59	F	59.3	Low	59.6	Low	23 Å²	23	88.8 Å²	88.8	10%	0.101	45%	0.45	C	S	.	.	H	α-helix	trans	-69.1	-47.3	175.1	-172.2	-92.4	0	0	0	111.6	D33 L36 I55 V56 E57 T61 G62 D63 I70	D33-F59 HydrophobicContact CB-CE1 4.47Å; L36-F59 HydrophobicContact CB-CE2 4.23Å; L36-F59 HydrophobicContact CD1-CD2 4.07Å; L36-F59 HydrophobicContact CD1-CE2 3.92Å; L36-F59 HydrophobicContact CD2-CB 4.41Å; L36-F59 HydrophobicContact CD2-CD2 3.17Å; L36-F59 HydrophobicContact CD2-CE2 3.44Å; L36-F59 VanDerWaalsContact CD2-CE2 3.44Å; L36-F59 HydrophobicContact CD2-CG 3.9Å; L36-F59 HydrophobicContact CD2-CZ 4.36Å; L36-F59 HydrophobicContact CG-CD2 4.14Å; L36-F59 HydrophobicContact CG-CE2 4.04Å; I55-F59 PolarHBondContact O-N 3.33Å; V56-F59 WeakPolarHBondContact O-CB 3.49Å; V56-F59 PolarHBondContact O-N 2.94Å; E57-F59 VanDerWaalsContact C-N 3.34Å; F59-T61 PolarHBondContact O-N 3.04Å; F59-G62 PolarHBondContact O-N 3.46Å; F59-G62 VanDerWaalsContact O-N 3.15Å; F59-D63 PolarHBondContact O-N 2.92Å; F59-I70 HydrophobicContact CD2-CD1 3.1Å; F59-I70 HydrophobicContact CD2-CG1 3.91Å; F59-I70 HydrophobicContact CE2-CB 4.36Å; F59-I70 HydrophobicContact CE2-CD1 3.09Å; F59-I70 HydrophobicContact CE2-CG1 3.4Å; F59-I70 HydrophobicContact CG-CD1 4.03Å; F59-I70 HydrophobicContact CZ-CD1 3.99Å; F59-I70 HydrophobicContact CZ-CG1 3.84Å
60	V	61.1	Low	61.2	Low	105 Å²	105	86.4 Å²	86.4	64%	0.636	42%	0.424	S	S	*	.	H	α-helix	trans	-63.1	-29.9	176.8	174	0	0	0	0	112.3	V56	V56-V60 WeakPolarHBondContact O-CG2 3.37Å; V56-V60 PolarHBondContact O-N 3.5Å
61	T	61.6	Low	62.4	Low	91 Å²	91	81 Å²	81	56%	0.558	41%	0.407	S	S	*	.	H	α-helix	trans	-84.8	-23.4	176.7	45.8	0	0	0	0	113.5	E57 T58 F59	E57-T61 WeakPolarHBondContact O-CB 3.4Å; E57-T61 WeakPolarHBondContact O-CG2 3.49Å; E57-T61 PolarHBondContact O-N 3.22Å; E57-T61 PolarHBondContact O-OG1 3.46Å; T58-T61 VanDerWaalsContact CA-OG1 3.25Å; T58-T61 WeakPolarHBondContact CA-OG1 3.41Å; T58-T61 PolarHBondContact O-OG1 2.94Å; T58-T61 VanDerWaalsContact O-OG1 3.08Å; F59-T61 PolarHBondContact O-N 3.04Å
62	G	61.1	Low	63.7	Low	5 Å²	5	78.8 Å²	78.8	5%	0.052	40%	0.397	C	S	.	.	H	α-helix	trans	-88.8	-20.3	-179.5	0	0	0	0	0	115.6	T58 F59 T64	T58-G62 PolarHBondContact O-N 2.97Å; F59-G62 PolarHBondContact O-N 3.46Å; F59-G62 VanDerWaalsContact O-N 3.15Å; G62-T64 VanDerWaalsContact C-N 3.32Å; G62-T64 PolarHBondContact O-N 2.81Å
63	D	69	Low	65	Low	21 Å²	21	79.7 Å²	79.7	11%	0.112	40%	0.401	C	S	.	.			trans	-73.1	84.7	167.6	-179.7	2.3	0	0	0	109.6	F59 N65 K66 D67 E68	F59-D63 PolarHBondContact O-N 2.92Å; D63-N65 VanDerWaalsContact C-N 3.32Å; D63-N65 PolarHBondContact OD1-OD1 2.73Å; D63-K66 WeakPolarHBondContact OD1-CA 3.48Å; D63-K66 PolarHBondContact OD1-N 2.82Å; D63-K66 WeakPolarHBondContact OD2-CA 3.07Å; D63-D67 PolarHBondContact OD1-N 3.36Å; D63-D67 PolarHBondContact OD2-N 3.06Å; D63-E68 WeakPolarHBondContact OD2-CA 3.4Å; D63-E68 PolarHBondContact OD2-N 3.41Å
64	T	64.5	Low	66	Low	111 Å²	111	71 Å²	71	68%	0.681	37%	0.368	S	S	*	.	S	Bend	trans	-74.6	-25.2	-175	53.7	0	0	0	0	112.9	G62 E74	G62-T64 VanDerWaalsContact C-N 3.32Å; G62-T64 PolarHBondContact O-N 2.81Å; T64-E74 PolarHBondContact N-OE1 3.2Å; T64-E74 VanDerWaalsContact N-OE1 3.07Å; T64-E74 WeakPolarHBondContact OG1-CG 3.36Å; T64-E74 PolarHBondContact OG1-OE1 3.23Å
65	N	73	Confident	66.4	Low	87 Å²	87	67.7 Å²	67.7	47%	0.465	35%	0.352	S	S	.	.	S	Bend	trans	-97.2	-8.3	-178.2	75.9	11.3	0	0	0	113.3	D63 D67 E74	D63-N65 VanDerWaalsContact C-N 3.32Å; D63-N65 PolarHBondContact OD1-OD1 2.73Å; N65-D67 VanDerWaalsContact C-N 3.34Å; N65-D67 PolarHBondContact ND2-OD2 3.34Å; N65-D67 VanDerWaalsContact OD1-CB 3.29Å; N65-D67 WeakPolarHBondContact OD1-CB 3.2Å; N65-D67 PolarHBondContact OD1-N 3.39Å; N65-D67 PolarHBondContact OD1-OD1 3.48Å; N65-D67 PolarHBondContact OD1-OD2 3Å; N65-E74 PolarHBondContact N-OE1 2.98Å
66	K	70.4	Confident	67.1	Low	180 Å²	180	65.4 Å²	65.4	78%	0.783	34%	0.341	S	S	*	.			trans	60.4	35.6	179.9	-58.3	-175.2	178.3	-176.4	0	113.8	D63 E68	D63-K66 WeakPolarHBondContact OD1-CA 3.48Å; D63-K66 PolarHBondContact OD1-N 2.82Å; D63-K66 WeakPolarHBondContact OD2-CA 3.07Å; K66-E68 VanDerWaalsContact C-N 3.31Å
67	D	74.9	Confident	67.5	Low	64 Å²	64	64.6 Å²	64.6	34%	0.342	34%	0.338	S	S	.	.	S	Bend	trans	-91.3	6.8	178.4	74.7	11.4	0	0	0	113.7	D63 N65 K69	D63-D67 PolarHBondContact OD1-N 3.36Å; D63-D67 PolarHBondContact OD2-N 3.06Å; N65-D67 VanDerWaalsContact C-N 3.34Å; N65-D67 PolarHBondContact ND2-OD2 3.34Å; N65-D67 VanDerWaalsContact OD1-CB 3.29Å; N65-D67 WeakPolarHBondContact OD1-CB 3.2Å; N65-D67 PolarHBondContact OD1-N 3.39Å; N65-D67 PolarHBondContact OD1-OD1 3.48Å; N65-D67 PolarHBondContact OD1-OD2 3Å; D67-K69 PolarHBondContact O-N 3.39Å; D67-K69 WeakPolarHBondContact OD1-CA 3.39Å; D67-K69 VanDerWaalsContact OD1-CB 3.3Å; D67-K69 WeakPolarHBondContact OD1-CB 3.29Å; D67-K69 PolarHBondContact OD1-N 3.17Å
68	E	65.6	Low	67.6	Low	158 Å²	158	59.1 Å²	59.1	74%	0.738	31%	0.313	S	S	*	.	S	Bend	trans	60.6	18	-177.2	-58.2	-179	167.6	0	0	113.1	D63 K66	D63-E68 WeakPolarHBondContact OD2-CA 3.4Å; D63-E68 PolarHBondContact OD2-N 3.41Å; K66-E68 VanDerWaalsContact C-N 3.31Å
69	K	73.2	Confident	67.3	Low	99 Å²	99	61.7 Å²	61.7	43%	0.43	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	158.6	175.6	-56	-179.5	-179.4	-171.7	0	109.6	Y30 D67	Y30-K69 HydrophobicContact CD1-CB 4.49Å; D67-K69 PolarHBondContact O-N 3.39Å; D67-K69 WeakPolarHBondContact OD1-CA 3.39Å; D67-K69 VanDerWaalsContact OD1-CB 3.3Å; D67-K69 WeakPolarHBondContact OD1-CB 3.29Å; D67-K69 PolarHBondContact OD1-N 3.17Å
70	I	73.8	Confident	67.2	Low	4 Å²	4	62.9 Å²	62.9	2%	0.021	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.4	174.4	-69.7	-169.9	0	0	0	109.4	V31 F59 E74 F75 I78	V31-I70 HydrophobicContact CB-CB 4.41Å; V31-I70 PolarHBondContact N-O 3.47Å; V31-I70 PolarHBondContact O-N 3.32Å; F59-I70 HydrophobicContact CD2-CD1 3.1Å; F59-I70 HydrophobicContact CD2-CG1 3.91Å; F59-I70 HydrophobicContact CE2-CB 4.36Å; F59-I70 HydrophobicContact CE2-CD1 3.09Å; F59-I70 HydrophobicContact CE2-CG1 3.4Å; F59-I70 HydrophobicContact CG-CD1 4.03Å; F59-I70 HydrophobicContact CZ-CD1 3.99Å; F59-I70 HydrophobicContact CZ-CG1 3.84Å; I70-E74 HydrophobicContact CG2-CB 4.14Å; I70-F75 HydrophobicContact CG2-CB 3.73Å; I70-F75 HydrophobicContact CG2-CD2 4.35Å; I70-I78 HydrophobicContact CD1-CD1 3.5Å
71	S	77.4	Confident	66.9	Low	25 Å²	25	61.6 Å²	61.6	18%	0.175	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	160.9	167.7	69.2	0	0	0	0	111.4	D73 E74 F75	S71-D73 VanDerWaalsContact C-N 3.26Å; S71-D73 PolarHBondContact O-N 2.92Å; S71-E74 WeakPolarHBondContact CB-OE2 3.38Å; S71-E74 PolarHBondContact N-OE2 2.93Å; S71-E74 PolarHBondContact O-N 3.23Å; S71-E74 VanDerWaalsContact O-N 3.09Å; S71-E74 WeakPolarHBondContact OG-CG 3.44Å; S71-E74 PolarHBondContact OG-N 3.48Å; S71-E74 PolarHBondContact OG-OE2 3.01Å; S71-F75 PolarHBondContact O-N 3.19Å
72	F	73.3	Confident	66.4	Low	36 Å²	36	61.6 Å²	61.6	16%	0.158	31%	0.309	C	S	.	.	H	α-helix	trans	-57.5	-37.9	176.9	-178.1	-108.1	0	0	0	113.1	L16 R17 F20 E74 F75 V76	L16-F72 HydrophobicContact CB-CE2 4.33Å; L16-F72 HydrophobicContact CB-CZ 4.5Å; R17-F72 VanDerWaalsContact CA-CE2 3.49Å; R17-F72 HydrophobicContact CB-CE2 3.9Å; R17-F72 HydrophobicContact CB-CZ 3.89Å; R17-F72 HydrophobicContact CG-CE2 4.38Å; R17-F72 HydrophobicContact CG-CZ 4.44Å; F20-F72 HydrophobicContact CB-CD2 3.88Å; F20-F72 HydrophobicContact CB-CE2 4.2Å; F20-F72 HydrophobicContact CD1-CD2 4.23Å; F20-F72 HydrophobicContact CD2-CB 4.43Å; F20-F72 AromaticContact CD2-CD2 3.96Å; F20-F72 HydrophobicContact CD2-CD2 3.96Å; F20-F72 HydrophobicContact CE1-CB 4.38Å; F20-F72 HydrophobicContact CE2-CB 4.21Å; F20-F72 AromaticContact CG-CD2 3.76Å; F20-F72 HydrophobicContact CG-CD2 3.76Å; F20-F72 HydrophobicContact CZ-CB 4.18Å; F72-E74 VanDerWaalsContact C-N 3.33Å; F72-E74 PolarHBondContact O-N 2.7Å; F72-F75 PolarHBondContact O-N 3.12Å; F72-V76 HydrophobicContact CD1-CG2 4.34Å; F72-V76 HydrophobicContact CE1-CG2 3.96Å; F72-V76 HydrophobicContact CE2-CG2 4.13Å; F72-V76 HydrophobicContact CZ-CG2 3.85Å; F72-V76 WeakPolarHBondContact O-CB 3.45Å; F72-V76 WeakPolarHBondContact O-CG2 3.42Å; F72-V76 PolarHBondContact O-N 3.4Å
73	D	72.1	Confident	65.7	Low	63 Å²	63	67 Å²	67	34%	0.337	33%	0.331	S	S	.	.	H	α-helix	trans	-67	-34.4	178.2	-81	-25.8	0	0	0	111.3	K3 Y5 S71 S77	K3-D73 IonicContact NZ-OD2 3.01Å; K3-D73 PolarHBondContact NZ-OD2 2.88Å; Y5-D73 PolarHBondContact OH-OD1 2.96Å; S71-D73 VanDerWaalsContact C-N 3.26Å; S71-D73 PolarHBondContact O-N 2.92Å; D73-S77 PolarHBondContact O-N 3.22Å; D73-S77 PolarHBondContact O-OG 3.13Å
74	E	71.1	Confident	64.8	Low	9 Å²	9	69.8 Å²	69.8	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-73.7	-40.6	174.4	-75.1	163.4	143.8	0	0	112.1	T64 N65 I70 S71 F72 V76 S77 I78	T64-E74 PolarHBondContact N-OE1 3.2Å; T64-E74 VanDerWaalsContact N-OE1 3.07Å; T64-E74 WeakPolarHBondContact OG1-CG 3.36Å; T64-E74 PolarHBondContact OG1-OE1 3.23Å; N65-E74 PolarHBondContact N-OE1 2.98Å; I70-E74 HydrophobicContact CG2-CB 4.14Å; S71-E74 WeakPolarHBondContact CB-OE2 3.38Å; S71-E74 PolarHBondContact N-OE2 2.93Å; S71-E74 PolarHBondContact O-N 3.23Å; S71-E74 VanDerWaalsContact O-N 3.09Å; S71-E74 WeakPolarHBondContact OG-CG 3.44Å; S71-E74 PolarHBondContact OG-N 3.48Å; S71-E74 PolarHBondContact OG-OE2 3.01Å; F72-E74 VanDerWaalsContact C-N 3.33Å; F72-E74 PolarHBondContact O-N 2.7Å; E74-V76 VanDerWaalsContact C-N 3.28Å; E74-V76 PolarHBondContact O-N 3.28Å; E74-S77 WeakPolarHBondContact O-CB 3.25Å; E74-S77 PolarHBondContact O-N 3.3Å; E74-I78 WeakPolarHBondContact O-CG1 3.43Å; E74-I78 PolarHBondContact O-N 3.14Å
75	F	64.2	Low	63.9	Low	40 Å²	40	71.8 Å²	71.8	18%	0.175	35%	0.351	C	S	.	.	H	α-helix	trans	-57.4	-42.6	173.9	-173.4	-104.3	0	0	0	112	L16 F20 I23 I70 S71 F72 S77 Y79	L16-F75 HydrophobicContact CD2-CD1 4.43Å; L16-F75 HydrophobicContact CD2-CE1 3.88Å; F20-F75 HydrophobicContact CB-CD1 4.48Å; F20-F75 HydrophobicContact CD2-CB 3.97Å; F20-F75 HydrophobicContact CD2-CD1 4.09Å; F20-F75 HydrophobicContact CD2-CD2 4.37Å; F20-F75 AromaticContact CD2-CG 3.9Å; F20-F75 HydrophobicContact CD2-CG 3.9Å; F20-F75 HydrophobicContact CE2-CB 4.18Å; I23-F75 HydrophobicContact CD1-CE2 4.23Å; I23-F75 HydrophobicContact CD1-CZ 4.18Å; I70-F75 HydrophobicContact CG2-CB 3.73Å; I70-F75 HydrophobicContact CG2-CD2 4.35Å; S71-F75 PolarHBondContact O-N 3.19Å; F72-F75 PolarHBondContact O-N 3.12Å; F75-S77 VanDerWaalsContact C-N 3.34Å; F75-Y79 WeakPolarHBondContact O-CB 3.41Å; F75-Y79 PolarHBondContact O-N 3.33Å
76	V	65.8	Low	62.7	Low	3 Å²	3	75.9 Å²	75.9	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-64.5	-39	175.3	170.4	0	0	0	0	111.5	I8 L13 L16 F72 E74 Y79 Q80	I8-V76 HydrophobicContact CD1-CG1 3.36Å; L13-V76 HydrophobicContact CD2-CG1 4.39Å; L13-V76 HydrophobicContact CD2-CG2 4.29Å; L16-V76 HydrophobicContact CD1-CG2 4.28Å; F72-V76 HydrophobicContact CD1-CG2 4.34Å; F72-V76 HydrophobicContact CE1-CG2 3.96Å; F72-V76 HydrophobicContact CE2-CG2 4.13Å; F72-V76 HydrophobicContact CZ-CG2 3.85Å; F72-V76 WeakPolarHBondContact O-CB 3.45Å; F72-V76 WeakPolarHBondContact O-CG2 3.42Å; F72-V76 PolarHBondContact O-N 3.4Å; E74-V76 VanDerWaalsContact C-N 3.28Å; E74-V76 PolarHBondContact O-N 3.28Å; V76-Y79 PolarHBondContact O-N 3.44Å; V76-Q80 WeakPolarHBondContact O-CG 3.1Å; V76-Q80 PolarHBondContact O-N 2.66Å
77	S	65.1	Low	61.2	Low	63 Å²	63	74.7 Å²	74.7	44%	0.441	36%	0.36	S	S	.	.	H	α-helix	trans	-68.4	-42.8	179.4	-58.8	0	0	0	0	112.1	D73 E74 F75 Y79 Q80 E81	D73-S77 PolarHBondContact O-N 3.22Å; D73-S77 PolarHBondContact O-OG 3.13Å; E74-S77 WeakPolarHBondContact O-CB 3.25Å; E74-S77 PolarHBondContact O-N 3.3Å; F75-S77 VanDerWaalsContact C-N 3.34Å; S77-Y79 VanDerWaalsContact C-N 3.32Å; S77-Y79 PolarHBondContact O-N 3.42Å; S77-Q80 PolarHBondContact O-N 2.73Å; S77-E81 PolarHBondContact O-N 3.23Å
78	I	62.7	Low	59.4	Low	20 Å²	20	75.6 Å²	75.6	10%	0.103	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-44	173.3	-67.5	165.3	0	0	0	110.9	T58 I70 E74 Q80 E81 L82	T58-I78 HydrophobicContact CG2-CG2 3.75Å; I70-I78 HydrophobicContact CD1-CD1 3.5Å; E74-I78 WeakPolarHBondContact O-CG1 3.43Å; E74-I78 PolarHBondContact O-N 3.14Å; I78-Q80 VanDerWaalsContact C-N 3.35Å; I78-Q80 PolarHBondContact O-N 2.65Å; I78-E81 PolarHBondContact O-N 2.53Å; I78-L82 HydrophobicContact CG2-CD1 3.96Å; I78-L82 HydrophobicContact CG2-CG 4.49Å; I78-L82 WeakPolarHBondContact O-CB 3.45Å; I78-L82 WeakPolarHBondContact O-CG 3.43Å; I78-L82 PolarHBondContact O-N 2.88Å
79	Y	54.9	Low	58.3	Low	89 Å²	89	76.1 Å²	76.1	35%	0.349	37%	0.374	S	S	.	.	H	α-helix	trans	-62	-41.4	177.9	-179.1	-94.1	0	0	0	112.1	L16 F75 V76 S77 K83	L16-Y79 HydrophobicContact CD1-CD1 3.83Å; L16-Y79 HydrophobicContact CD1-CE1 4.17Å; L16-Y79 HydrophobicContact CD1-CG 4.2Å; L16-Y79 HydrophobicContact CD2-CD1 4.1Å; L16-Y79 HydrophobicContact CD2-CD2 3.68Å; L16-Y79 HydrophobicContact CD2-CE1 4.4Å; L16-Y79 HydrophobicContact CD2-CE2 3.99Å; L16-Y79 HydrophobicContact CD2-CG 3.73Å; F75-Y79 WeakPolarHBondContact O-CB 3.41Å; F75-Y79 PolarHBondContact O-N 3.33Å; V76-Y79 PolarHBondContact O-N 3.44Å; S77-Y79 VanDerWaalsContact C-N 3.32Å; S77-Y79 PolarHBondContact O-N 3.42Å; Y79-K83 HydrophobicContact CE1-CD 4.2Å; Y79-K83 WeakPolarHBondContact O-CB 3.41Å; Y79-K83 PolarHBondContact O-N 2.88Å
80	Q	57.5	Low	56.4	Low	48 Å²	48	76.4 Å²	76.4	22%	0.224	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-42.4	175.1	-72.8	-179.4	2.8	0	0	112.2	T6 I8 V76 S77 I78 K83 S84	T6-Q80 PolarHBondContact O-NE2 3.37Å; I8-Q80 HydrophobicContact CD1-CG 3.79Å; I8-Q80 HydrophobicContact CG1-CG 4.19Å; V76-Q80 WeakPolarHBondContact O-CG 3.1Å; V76-Q80 PolarHBondContact O-N 2.66Å; S77-Q80 PolarHBondContact O-N 2.73Å; I78-Q80 VanDerWaalsContact C-N 3.35Å; I78-Q80 PolarHBondContact O-N 2.65Å; Q80-K83 WeakPolarHBondContact O-CB 3.42Å; Q80-K83 PolarHBondContact O-N 2.63Å; Q80-S84 PolarHBondContact O-N 2.99Å; Q80-S84 PolarHBondContact O-OG 3.49Å
81	E	54.3	Low	54.5	Low	78 Å²	78	82 Å²	82	36%	0.364	41%	0.408	S	S	.	.	H	α-helix	trans	-68.2	-38	-179.3	-162.6	-178.8	164.5	0	0	112.2	S77 I78 K83 S84 K85	S77-E81 PolarHBondContact O-N 3.23Å; I78-E81 PolarHBondContact O-N 2.53Å; E81-K83 VanDerWaalsContact C-N 3.32Å; E81-K83 PolarHBondContact O-N 2.69Å; E81-S84 PolarHBondContact O-N 3.38Å; E81-S84 PolarHBondContact O-OG 2.91Å; E81-K85 HydrophobicContact CG-CD 4.31Å; E81-K85 WeakPolarHBondContact O-CB 3.29Å; E81-K85 PolarHBondContact O-N 3.35Å; E81-K85 WeakPolarHBondContact OE1-CE 3.13Å; E81-K85 IonicContact OE1-NZ 2.67Å; E81-K85 PolarHBondContact OE1-NZ 2.94Å
82	L	50.5	Low	52.5	Low	90 Å²	90	90.3 Å²	90.3	47%	0.471	44%	0.436	S	S	.	.	H	α-helix	trans	-66.3	-34	172.7	-75	172.3	0	0	0	112.3	T58 I78 K86	T58-L82 HydrophobicContact CG2-CD1 4.35Å; T58-L82 HydrophobicContact CG2-CD2 4.27Å; T58-L82 HydrophobicContact CG2-CG 4.33Å; I78-L82 HydrophobicContact CG2-CD1 3.96Å; I78-L82 HydrophobicContact CG2-CG 4.49Å; I78-L82 WeakPolarHBondContact O-CB 3.45Å; I78-L82 WeakPolarHBondContact O-CG 3.43Å; I78-L82 PolarHBondContact O-N 2.88Å; L82-K86 PolarHBondContact O-N 3.47Å
83	K	45.8	Very low	50.8	Low	118 Å²	118	96.9 Å²	96.9	51%	0.513	46%	0.464	S	S	.	.	H	α-helix	trans	-71.8	-33.3	175.3	-158	176.5	-175.2	175.7	0	111.8	Y79 Q80 E81	Y79-K83 HydrophobicContact CE1-CD 4.2Å; Y79-K83 WeakPolarHBondContact O-CB 3.41Å; Y79-K83 PolarHBondContact O-N 2.88Å; Q80-K83 WeakPolarHBondContact O-CB 3.42Å; Q80-K83 PolarHBondContact O-N 2.63Å; E81-K83 VanDerWaalsContact C-N 3.32Å; E81-K83 PolarHBondContact O-N 2.69Å
84	S	50.2	Low	49	Very low	81 Å²	81	98.8 Å²	98.8	57%	0.566	48%	0.478	S	S	*	.	H	α-helix	trans	-79.8	-31.5	176.4	66.4	0	0	0	0	113.7	Q80 E81 K86	Q80-S84 PolarHBondContact O-N 2.99Å; Q80-S84 PolarHBondContact O-OG 3.49Å; E81-S84 PolarHBondContact O-N 3.38Å; E81-S84 PolarHBondContact O-OG 2.91Å; S84-K86 VanDerWaalsContact C-N 3.34Å
85	K	46.3	Very low	47	Very low	153 Å²	153	104.5 Å²	104.5	67%	0.665	51%	0.509	S	S	*	.	H	α-helix	trans	-78	-12.9	179.1	-81.7	175.5	172.4	164.7	0	114.2	E81	E81-K85 HydrophobicContact CG-CD 4.31Å; E81-K85 WeakPolarHBondContact O-CB 3.29Å; E81-K85 PolarHBondContact O-N 3.35Å; E81-K85 WeakPolarHBondContact OE1-CE 3.13Å; E81-K85 IonicContact OE1-NZ 2.67Å; E81-K85 PolarHBondContact OE1-NZ 2.94Å
86	K	48.2	Very low	45.5	Very low	172 Å²	172	108.1 Å²	108.1	75%	0.748	53%	0.534	S	S	*	.	S	Bend	trans	-109.7	88.4	165.9	-83.2	179.7	176.9	170.1	0	109.9	L82 S84	L82-K86 PolarHBondContact O-N 3.47Å; S84-K86 VanDerWaalsContact C-N 3.34Å
87	F	37.6	Very low	43.9	Very low	155 Å²	155	119 Å²	119	68%	0.68	58%	0.575	S	S	*	*	S	Bend	trans	170.7	1.4	146.7	-113.3	-93.9	0	0	0	115.4	F91	F87-F91 HydrophobicContact CD1-CD2 4.28Å; F87-F91 HydrophobicContact CE1-CD2 4.44Å; F87-F91 WeakPolarHBondContact O-CB 3.19Å
88	S	37.5	Very low	42.3	Very low	83 Å²	83	125.5 Å²	125.5	58%	0.58	60%	0.595	S	S	*	*	H	α-helix	trans	-80.8	-32.6	-172.1	-178.8	0	0	0	0	115.5
89	E	41.8	Very low	40.7	Very low	170 Å²	170	133.6 Å²	133.6	79%	0.794	63%	0.632	S	S	*	*	H	α-helix	trans	-86.9	-31.5	-172.3	-66.5	-171.1	159.4	0	0	114.2
90	T	35.2	Very low	39.6	Very low	104 Å²	104	132.6 Å²	132.6	64%	0.638	65%	0.65	S	S	*	*	H	α-helix	trans	-76.1	-34.4	177.6	-45	0	0	0	0	111.5	K93 V94	T90-K93 PolarHBondContact O-N 2.76Å; T90-V94 WeakPolarHBondContact O-CG2 3.46Å; T90-V94 PolarHBondContact O-N 3.39Å
91	F	33.4	Very low	38.2	Very low	121 Å²	121	138.2 Å²	138.2	53%	0.531	68%	0.679	S	S	.	*	H	α-helix	trans	-72.8	-34.2	-177	-148.5	-102	0	0	0	112.6	F87 K93 V94 L95	F87-F91 HydrophobicContact CD1-CD2 4.28Å; F87-F91 HydrophobicContact CE1-CD2 4.44Å; F87-F91 WeakPolarHBondContact O-CB 3.19Å; F91-K93 VanDerWaalsContact C-N 3.32Å; F91-K93 PolarHBondContact O-N 3.35Å; F91-V94 PolarHBondContact O-N 3.36Å; F91-L95 HydrophobicContact CD1-CD1 3.56Å; F91-L95 HydrophobicContact CE1-CD1 3.66Å; F91-L95 PolarHBondContact O-N 2.73Å
92	R	35.7	Very low	37	Very low	200 Å²	200	141.8 Å²	141.8	76%	0.755	70%	0.701	S	S	*	*	H	α-helix	trans	-65.7	-30	173.8	-90.3	178.5	73.2	109.6	-4.7	113.7	T96	R92-T96 PolarHBondContact O-OG1 3.17Å
93	K	36.4	Very low	35.8	Very low	174 Å²	174	141.7 Å²	141.7	76%	0.757	71%	0.708	S	S	*	*	H	α-helix	trans	-78.8	-26.5	175.8	-82.9	179.5	176.9	172.1	0	113.2	T90 F91	T90-K93 PolarHBondContact O-N 2.76Å; F91-K93 VanDerWaalsContact C-N 3.32Å; F91-K93 PolarHBondContact O-N 3.35Å
94	V	34.5	Very low	34.9	Very low	104 Å²	104	146.9 Å²	146.9	63%	0.63	73%	0.731	S	S	*	*	H	α-helix	trans	-80	-30.3	178.6	173	0	0	0	0	112	T90 F91 T96	T90-V94 WeakPolarHBondContact O-CG2 3.46Å; T90-V94 PolarHBondContact O-N 3.39Å; F91-V94 PolarHBondContact O-N 3.36Å; V94-T96 VanDerWaalsContact C-N 3.33Å; V94-T96 PolarHBondContact O-N 3.07Å
95	L	30.4	Very low	33.8	Very low	129 Å²	129	147 Å²	147	68%	0.675	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-9	179.8	-86.7	155.7	0	0	0	115.3	F91	F91-L95 HydrophobicContact CD1-CD1 3.56Å; F91-L95 HydrophobicContact CE1-CD1 3.66Å; F91-L95 PolarHBondContact O-N 2.73Å
96	T	31.2	Very low	32.8	Very low	116 Å²	116	143.1 Å²	143.1	71%	0.712	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	5.7	-175.4	21.9	0	0	0	0	115.6	R92 V94	R92-T96 PolarHBondContact O-OG1 3.17Å; V94-T96 VanDerWaalsContact C-N 3.33Å; V94-T96 PolarHBondContact O-N 3.07Å
97	R	31.9	Very low	31.8	Very low	231 Å²	231	141.6 Å²	141.6	87%	0.872	75%	0.753	S	S	*	*			trans	-117.3	85.5	168.5	-79.3	-175.7	176.9	-179.9	-1.5	110.5
98	K	32.5	Very low	31.4	Very low	200 Å²	200	139.1 Å²	139.1	87%	0.87	76%	0.755	S	S	*	*			trans	-65	139.3	157	-93.2	-177.8	170.3	-177.8	0	108.8
99	E	28.4	Very low	31	Very low	189 Å²	189	139.3 Å²	139.3	88%	0.883	77%	0.77	S	S	*	*	S	Bend	trans	84.1	98.6	168.8	-61.2	-178.9	178.8	0	0	117.7
100	G	33.3	Very low	30.5	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	78%	0.776	S	S	*	*	S	Bend	trans	86.7	123.7	146.3	0	0	0	0	0	117.6
101	I	28.1	Very low	30.3	Very low	165 Å²	165	137.4 Å²	137.4	85%	0.846	77%	0.773	S	S	*	*			trans	89.7	109.5	158.7	-49.4	165.7	0	0	0	115.8
102	N	27.5	Very low	30.1	Very low	154 Å²	154	137 Å²	137	82%	0.824	78%	0.784	S	S	*	*			trans	-95.4	119.9	172.6	-77.7	-23.4	0	0	0	111.4
103	S	26.2	Very low	29.7	Very low	88 Å²	88	137 Å²	137	62%	0.615	79%	0.793	S	S	*	*			trans	-154.2	125.1	160.4	61.5	0	0	0	0	110.3
104	F	27.9	Very low	29.2	Very low	227 Å²	227	132.5 Å²	132.5	100%	0.996	80%	0.795	S	S	*	*			trans	-144.9	132.5	163	-102.1	-85.2	0	0	0	109.6
105	G	25.8	Very low	29	Very low	82 Å²	82	132.4 Å²	132.4	85%	0.845	80%	0.795	S	S	*	*			trans	-139.8	170.7	-174.9	0	0	0	0	0	114
106	G	24.9	Very low	29.1	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	80%	0.795	S	S	*	*			trans	131.1	141.1	169	0	0	0	0	0	112.6
107	T	27.2	Very low	29.7	Very low	140 Å²	140	133.8 Å²	133.8	86%	0.859	79%	0.79	S	S	*	*			cis	-164	120	-10.8	36	0	0	0	0	107.3
108	S	30.5	Very low	30.8	Very low	104 Å²	104	128 Å²	128	73%	0.727	79%	0.785	S	S	*	*			trans	-164.6	125.4	160	33.3	0	0	0	0	112	V110 S111	S108-V110 PolarHBondContact O-N 3.48Å; S108-S111 PolarHBondContact O-OG 3.31Å
109	G	29.1	Very low	32.7	Very low	86 Å²	86	121.1 Å²	121.1	89%	0.887	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	47.8	-159.2	0	0	0	0	0	118.2
110	V	30.4	Very low	35.5	Very low	152 Å²	152	113.4 Å²	113.4	92%	0.921	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	7.3	165.2	-168.3	0	0	0	0	111.9	S108	S108-V110 PolarHBondContact O-N 3.48Å
111	S	30.5	Very low	38	Very low	82 Å²	82	113.9 Å²	113.9	57%	0.573	70%	0.704	S	S	*	*	S	Bend	trans	-105.4	128	167.9	46.3	0	0	0	0	107.9	S108 E113	S108-S111 PolarHBondContact O-OG 3.31Å; S111-E113 PolarHBondContact O-N 3.18Å; S111-E113 VanDerWaalsContact O-N 3.08Å
112	C	30.4	Very low	41	Very low	114 Å²	114	109 Å²	109	77%	0.77	68%	0.678	S	S	*	*			trans	-50.5	119.9	166.1	-68.6	0	0	0	0	108.1	G114	C112-G114 PolarHBondContact O-N 3.19Å
113	E	27.2	Very low	44	Very low	200 Å²	200	103 Å²	103	94%	0.935	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	121.6	-178.2	-70	176.1	140.2	0	0	110.5	S111	S111-E113 PolarHBondContact O-N 3.18Å; S111-E113 VanDerWaalsContact O-N 3.08Å
114	G	25.1	Very low	47.2	Very low	78 Å²	78	99.1 Å²	99.1	80%	0.804	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	116.2	-0.2	162.8	0	0	0	0	0	118.2	C112 Q116	C112-G114 PolarHBondContact O-N 3.19Å; G114-Q116 PolarHBondContact O-N 3.11Å
115	T	30.8	Very low	50.2	Low	103 Å²	103	89.4 Å²	89.4	63%	0.632	58%	0.576	S	S	*	*			trans	-83.9	100.3	178.1	-25.2	0	0	0	0	110.5	H117	T115-H117 PolarHBondContact O-N 3.25Å
116	Q	32.8	Very low	53.4	Low	144 Å²	144	85.7 Å²	85.7	67%	0.673	54%	0.538	S	S	*	.			trans	-50.6	124.4	157.8	-70.7	174.8	-31.9	0	0	107.5	G114 S118	G114-Q116 PolarHBondContact O-N 3.11Å; Q116-S118 PolarHBondContact O-N 3.03Å
117	H	43.8	Very low	56.7	Low	130 Å²	130	82.3 Å²	82.3	60%	0.602	50%	0.502	S	S	*	.			trans	-73.7	72.6	176.1	-66.3	-65.4	0	0	0	109.8	T115	T115-H117 PolarHBondContact O-N 3.25Å
118	S	54.2	Low	60	Low	109 Å²	109	75.7 Å²	75.7	76%	0.762	46%	0.462	S	S	*	.			trans	-61.6	134.2	159.1	48.7	0	0	0	0	108	Q116	Q116-S118 PolarHBondContact O-N 3.03Å
119	Y	73.7	Confident	62.9	Low	55 Å²	55	75.5 Å²	75.5	22%	0.216	45%	0.445	C	S	.	.			trans	-107.7	152.7	170.6	66.4	-94.3	0	0	0	108.4	E121 K124 E152 F155 P222 L226	Y119-E121 WeakPolarHBondContact CE2-OE1 3.31Å; Y119-E121 VanDerWaalsContact CZ-OE1 3.28Å; Y119-E121 PolarHBondContact O-N 2.98Å; Y119-E121 PolarHBondContact OH-OE1 3.41Å; Y119-K124 HydrophobicContact CE2-CD 4.3Å; Y119-E152 PolarHBondContact OH-OE1 3.41Å; Y119-F155 HydrophobicContact CD2-CZ 4.08Å; Y119-F155 AromaticContact CE2-CE2 3.93Å; Y119-F155 HydrophobicContact CE2-CE2 3.93Å; Y119-F155 AromaticContact CE2-CZ 3.76Å; Y119-F155 HydrophobicContact CE2-CZ 3.76Å; Y119-F155 AromaticContact CZ-CE2 3.92Å; Y119-P222 HydrophobicContact CD1-CB 3.4Å; Y119-P222 VanDerWaalsContact CD1-CB 3.4Å; Y119-P222 HydrophobicContact CD1-CG 4Å; Y119-P222 HydrophobicContact CD2-CB 4.26Å; Y119-P222 HydrophobicContact CE1-CB 3.72Å; Y119-P222 HydrophobicContact CE1-CG 3.87Å; Y119-P222 HydrophobicContact CG-CB 3.69Å; Y119-L226 HydrophobicContact CD2-CD1 3.86Å; Y119-L226 HydrophobicContact CG-CD1 4.3Å
120	S	85.5	Confident	65.9	Low	27 Å²	27	72.5 Å²	72.5	19%	0.189	41%	0.407	C	S	.	.			trans	-80.1	118.9	-179.1	168.9	0	0	0	0	109.8	E122 E123 K124	S120-E122 PolarHBondContact O-N 3.18Å; S120-E122 WeakPolarHBondContact OG-CB 3.32Å; S120-E122 PolarHBondContact OG-N 3.17Å; S120-E122 PolarHBondContact OG-OE2 3.23Å; S120-E123 PolarHBondContact O-N 3.31Å; S120-E123 WeakPolarHBondContact OG-CG 3.38Å; S120-E123 PolarHBondContact OG-N 3.31Å; S120-E123 VanDerWaalsContact OG-N 3.09Å; S120-K124 PolarHBondContact O-N 3.06Å; S120-K124 VanDerWaalsContact O-N 3.12Å
121	E	87.5	Confident	69	Low	79 Å²	79	65.3 Å²	65.3	37%	0.369	36%	0.363	S	S	.	.	H	α-helix	trans	-63	-36.1	172.2	-72.4	-58.1	136.8	0	0	110.9	Y119 K124 V125	Y119-E121 WeakPolarHBondContact CE2-OE1 3.31Å; Y119-E121 VanDerWaalsContact CZ-OE1 3.28Å; Y119-E121 PolarHBondContact O-N 2.98Å; Y119-E121 PolarHBondContact OH-OE1 3.41Å; E121-K124 WeakPolarHBondContact O-CB 3.47Å; E121-K124 PolarHBondContact O-N 2.93Å; E121-K124 VanDerWaalsContact OE2-CE 3.23Å; E121-K124 WeakPolarHBondContact OE2-CE 3.44Å; E121-K124 IonicContact OE2-NZ 3.31Å; E121-K124 PolarHBondContact OE2-NZ 3.11Å; E121-V125 VanDerWaalsContact O-CG2 3.26Å; E121-V125 WeakPolarHBondContact O-CG2 3.43Å; E121-V125 PolarHBondContact O-N 3.48Å
122	E	89.1	Confident	72.1	Confident	63 Å²	63	63 Å²	63	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-60.3	-47.7	177.1	-57.9	76.1	-164.7	0	0	111	S120 K124 V125 A126 D355 L363	S120-E122 PolarHBondContact O-N 3.18Å; S120-E122 WeakPolarHBondContact OG-CB 3.32Å; S120-E122 PolarHBondContact OG-N 3.17Å; S120-E122 PolarHBondContact OG-OE2 3.23Å; E122-K124 PolarHBondContact O-N 3.17Å; E122-V125 PolarHBondContact O-N 3.41Å; E122-A126 VanDerWaalsContact O-CB 3.29Å; E122-A126 WeakPolarHBondContact O-CB 3.3Å; E122-A126 PolarHBondContact O-N 3.33Å; E122-D355 WeakPolarHBondContact CB-OD1 3.47Å; E122-D355 WeakPolarHBondContact CG-OD1 3.03Å; E122-L363 HydrophobicContact CB-CD1 3.89Å
123	E	90.7	Very high	75	Confident	29 Å²	29	62 Å²	62	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-61.9	-42.8	175.4	-71.3	177.2	-171.5	0	0	111.9	S120 V125 A126 F127 K362 L363	S120-E123 PolarHBondContact O-N 3.31Å; S120-E123 WeakPolarHBondContact OG-CG 3.38Å; S120-E123 PolarHBondContact OG-N 3.31Å; S120-E123 VanDerWaalsContact OG-N 3.09Å; E123-V125 PolarHBondContact O-N 3.31Å; E123-A126 PolarHBondContact O-N 3.42Å; E123-F127 HydrophobicContact CB-CD2 4.41Å; E123-F127 HydrophobicContact CB-CE2 3.89Å; E123-F127 HydrophobicContact CB-CZ 4.06Å; E123-F127 HydrophobicContact CG-CE2 4.46Å; E123-F127 HydrophobicContact CG-CZ 4.24Å; E123-F127 WeakPolarHBondContact O-CB 3.32Å; E123-F127 WeakPolarHBondContact O-CD2 3.46Å; E123-F127 WeakPolarHBondContact O-CG 3.47Å; E123-F127 PolarHBondContact O-N 3.15Å; E123-K362 HydrophobicContact CG-CD 4.34Å; E123-K362 VanDerWaalsContact OE1-CD 3.31Å; E123-K362 WeakPolarHBondContact OE1-CD 3.4Å; E123-K362 WeakPolarHBondContact OE1-CE 3.43Å; E123-K362 IonicContact OE1-NZ 3.6Å; E123-K362 PolarHBondContact OE1-NZ 3.15Å; E123-K362 IonicContact OE2-NZ 2.74Å; E123-K362 PolarHBondContact OE2-NZ 3.44Å; E123-K362 VanDerWaalsContact OE2-NZ 3.13Å; E123-L363 HydrophobicContact CG-CD2 4.27Å
124	K	94	Very high	78.1	Confident	5 Å²	5	54.7 Å²	54.7	2%	0.022	30%	0.299	C	S	.	.	H	α-helix	trans	-57.8	-50.1	177.1	-174.8	-160.4	73.9	-177.2	0	111.1	Y119 S120 E121 E122 T128 P149 D151 L154 F155 L226	Y119-K124 HydrophobicContact CE2-CD 4.3Å; S120-K124 PolarHBondContact O-N 3.06Å; S120-K124 VanDerWaalsContact O-N 3.12Å; E121-K124 WeakPolarHBondContact O-CB 3.47Å; E121-K124 PolarHBondContact O-N 2.93Å; E121-K124 VanDerWaalsContact OE2-CE 3.23Å; E121-K124 WeakPolarHBondContact OE2-CE 3.44Å; E121-K124 IonicContact OE2-NZ 3.31Å; E121-K124 PolarHBondContact OE2-NZ 3.11Å; E122-K124 PolarHBondContact O-N 3.17Å; K124-T128 VanDerWaalsContact O-CB 3.27Å; K124-T128 WeakPolarHBondContact O-CB 3.35Å; K124-T128 PolarHBondContact O-N 2.95Å; K124-T128 PolarHBondContact O-OG1 3.12Å; K124-P149 WeakPolarHBondContact CE-O 3.33Å; K124-D151 WeakPolarHBondContact CD-O 3.29Å; K124-D151 VanDerWaalsContact CE-O 3.25Å; K124-D151 WeakPolarHBondContact CE-O 3.45Å; K124-D151 PolarHBondContact NZ-O 3.06Å; K124-L154 HydrophobicContact CB-CD2 4.5Å; K124-L154 HydrophobicContact CG-CB 4.45Å; K124-L154 HydrophobicContact CG-CD2 3.74Å; K124-F155 HydrophobicContact CD-CE2 4.17Å; K124-F155 HydrophobicContact CD-CZ 4.18Å; K124-F155 HydrophobicContact CG-CZ 4.16Å; K124-L226 HydrophobicContact CB-CD1 4.48Å; K124-L226 HydrophobicContact CB-CD2 4.24Å
125	V	92.1	Very high	81.4	Confident	24 Å²	24	51.2 Å²	51.2	15%	0.145	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-48.2	179.3	170.8	0	0	0	0	110.6	E121 E122 E123 T128 R129 P149	E121-V125 VanDerWaalsContact O-CG2 3.26Å; E121-V125 WeakPolarHBondContact O-CG2 3.43Å; E121-V125 PolarHBondContact O-N 3.48Å; E122-V125 PolarHBondContact O-N 3.41Å; E123-V125 PolarHBondContact O-N 3.31Å; V125-T128 PolarHBondContact O-N 3.46Å; V125-R129 WeakPolarHBondContact O-CG 3.49Å; V125-R129 PolarHBondContact O-N 3.3Å; V125-P149 HydrophobicContact CB-CB 4.5Å; V125-P149 HydrophobicContact CG1-CB 4.17Å; V125-P149 WeakPolarHBondContact CG2-O 3.31Å
126	A	91.6	Very high	84.3	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-50.6	-179.2	0	0	0	0	0	112.4	E122 E123 T128 R129 W130 F350 L363	E122-A126 VanDerWaalsContact O-CB 3.29Å; E122-A126 WeakPolarHBondContact O-CB 3.3Å; E122-A126 PolarHBondContact O-N 3.33Å; E123-A126 PolarHBondContact O-N 3.42Å; A126-T128 PolarHBondContact O-N 3.32Å; A126-R129 PolarHBondContact O-N 3.19Å; A126-W130 PolarHBondContact O-N 3.49Å; A126-F350 WeakPolarHBondContact CB-O 3.38Å; A126-L363 HydrophobicContact CB-CD1 4.26Å; A126-L363 HydrophobicContact CB-CD2 3.74Å
127	F	94.9	Very high	87.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-67.5	-37.6	-179.1	-59.1	-18.1	0	0	0	111.5	E123 W130 I131 L226 L229 W230 I233 L363	E123-F127 HydrophobicContact CB-CD2 4.41Å; E123-F127 HydrophobicContact CB-CE2 3.89Å; E123-F127 HydrophobicContact CB-CZ 4.06Å; E123-F127 HydrophobicContact CG-CE2 4.46Å; E123-F127 HydrophobicContact CG-CZ 4.24Å; E123-F127 WeakPolarHBondContact O-CB 3.32Å; E123-F127 WeakPolarHBondContact O-CD2 3.46Å; E123-F127 WeakPolarHBondContact O-CG 3.47Å; E123-F127 PolarHBondContact O-N 3.15Å; F127-W130 PolarHBondContact O-N 3.15Å; F127-I131 WeakPolarHBondContact O-CB 2.98Å; F127-I131 WeakPolarHBondContact O-CG1 3.36Å; F127-I131 PolarHBondContact O-N 3.4Å; F127-L226 HydrophobicContact CD2-CD2 3.91Å; F127-L226 HydrophobicContact CE2-CD2 4.4Å; F127-L229 HydrophobicContact CB-CD1 4.31Å; F127-L229 HydrophobicContact CD2-CB 3.97Å; F127-L229 HydrophobicContact CD2-CD1 4.25Å; F127-L229 HydrophobicContact CE2-CB 4.44Å; F127-W230 AromaticContact CE1-CE3 3.87Å; F127-W230 HydrophobicContact CE1-CE3 3.87Å; F127-W230 HydrophobicContact CE2-CB 3.99Å; F127-W230 HydrophobicContact CZ-CB 3.8Å; F127-W230 HydrophobicContact CZ-CD2 4.33Å; F127-W230 AromaticContact CZ-CE3 3.75Å; F127-W230 HydrophobicContact CZ-CE3 3.75Å; F127-W230 HydrophobicContact CZ-CG 4.38Å; F127-I233 HydrophobicContact CB-CD1 4.15Å; F127-I233 HydrophobicContact CD1-CD1 3.46Å; F127-I233 VanDerWaalsContact CD1-CD1 3.46Å; F127-I233 HydrophobicContact CD2-CD1 4.47Å; F127-I233 HydrophobicContact CE1-CD1 3.98Å; F127-I233 HydrophobicContact CG-CD1 3.77Å; F127-L363 HydrophobicContact CE1-CD2 4.19Å
128	T	95.3	Very high	89.5	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-46.5	176	-59.3	0	0	0	0	111.8	K124 V125 A126 W130 I131 N132 I147 P149	K124-T128 VanDerWaalsContact O-CB 3.27Å; K124-T128 WeakPolarHBondContact O-CB 3.35Å; K124-T128 PolarHBondContact O-N 2.95Å; K124-T128 PolarHBondContact O-OG1 3.12Å; V125-T128 PolarHBondContact O-N 3.46Å; A126-T128 PolarHBondContact O-N 3.32Å; T128-W130 VanDerWaalsContact C-N 3.33Å; T128-W130 PolarHBondContact O-N 3.13Å; T128-I131 PolarHBondContact O-N 2.95Å; T128-N132 PolarHBondContact O-N 2.84Å; T128-N132 PolarHBondContact O-ND2 2.91Å; T128-I147 HydrophobicContact CG2-CB 3.7Å; T128-I147 HydrophobicContact CG2-CG2 3.46Å; T128-I147 VanDerWaalsContact CG2-CG2 3.46Å; T128-I147 WeakPolarHBondContact CG2-O 3.45Å; T128-P149 HydrophobicContact CG2-CB 3.93Å
129	R	92.4	Very high	91.4	Very high	101 Å²	101	45.7 Å²	45.7	38%	0.381	23%	0.233	S	C	.	.	H	α-helix	trans	-61.8	-42.1	176.8	-72.1	176.4	-176.1	163.1	5.7	111.7	V125 A126 N132 K133 P149 E150	V125-R129 WeakPolarHBondContact O-CG 3.49Å; V125-R129 PolarHBondContact O-N 3.3Å; A126-R129 PolarHBondContact O-N 3.19Å; R129-N132 PolarHBondContact O-N 2.83Å; R129-K133 PolarHBondContact O-N 2.82Å; R129-P149 HydrophobicContact CG-CB 4.34Å; R129-E150 IonicContact NH2-OE1 3.53Å
130	W	92.3	Very high	92.3	Very high	23 Å²	23	45.2 Å²	45.2	9%	0.087	23%	0.234	C	C	.	.	H	α-helix	trans	-64.1	-42.8	176.4	-179.9	78.6	0	0	0	112.4	A126 F127 T128 K133 S134 L167 I170 I233 F350	A126-W130 PolarHBondContact O-N 3.49Å; F127-W130 PolarHBondContact O-N 3.15Å; T128-W130 VanDerWaalsContact C-N 3.33Å; T128-W130 PolarHBondContact O-N 3.13Å; W130-K133 PolarHBondContact O-N 2.83Å; W130-S134 PolarHBondContact NE1-OG 3.32Å; W130-S134 WeakPolarHBondContact O-CB 3.02Å; W130-S134 PolarHBondContact O-N 3.26Å; W130-S134 PolarHBondContact O-OG 3.06Å; W130-L167 HydrophobicContact CE3-CD2 4.19Å; W130-L167 HydrophobicContact CH2-CD2 3.7Å; W130-L167 HydrophobicContact CZ3-CD1 4.18Å; W130-L167 HydrophobicContact CZ3-CD2 3.3Å; W130-L167 HydrophobicContact CZ3-CG 4.23Å; W130-I170 HydrophobicContact CH2-CG2 4.25Å; W130-I170 HydrophobicContact CZ2-CG2 4.05Å; W130-I233 HydrophobicContact CD2-CD1 4.32Å; W130-I233 HydrophobicContact CD2-CG1 4.23Å; W130-I233 HydrophobicContact CE3-CD1 3.66Å; W130-I233 HydrophobicContact CE3-CG1 3.62Å; W130-I233 HydrophobicContact CH2-CG1 3.75Å; W130-I233 HydrophobicContact CZ2-CG1 4.35Å; W130-I233 HydrophobicContact CZ3-CD1 3.85Å; W130-I233 HydrophobicContact CZ3-CG1 3.33Å; W130-F350 HydrophobicContact CB-CE1 4.1Å; W130-F350 HydrophobicContact CB-CZ 4.48Å; W130-F350 AromaticContact CD1-CE1 3.74Å; W130-F350 AromaticContact CD1-CZ 3.28Å; W130-F350 HydrophobicContact CD2-CE1 4.38Å; W130-F350 HydrophobicContact CD2-CZ 4.41Å; W130-F350 AromaticContact CG-CE1 3.8Å; W130-F350 HydrophobicContact CG-CE1 3.8Å; W130-F350 AromaticContact CG-CZ 3.83Å; W130-F350 HydrophobicContact CG-CZ 3.83Å; W130-F350 AromaticContact NE1-CZ 3.58Å
131	I	95.4	Very high	92.6	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-48.4	175	-70.9	165.9	0	0	0	110.6	F127 T128 K133 S134 L135 L145 I147 L154 V163 L167 L229	F127-I131 WeakPolarHBondContact O-CB 2.98Å; F127-I131 WeakPolarHBondContact O-CG1 3.36Å; F127-I131 PolarHBondContact O-N 3.4Å; T128-I131 PolarHBondContact O-N 2.95Å; I131-K133 VanDerWaalsContact C-N 3.31Å; I131-K133 PolarHBondContact O-N 2.74Å; I131-S134 PolarHBondContact O-N 2.93Å; I131-L135 HydrophobicContact CG2-CD1 4.45Å; I131-L135 PolarHBondContact O-N 3.22Å; I131-L145 HydrophobicContact CG2-CD2 3.82Å; I131-I147 HydrophobicContact CG2-CD1 4.09Å; I131-L154 HydrophobicContact CD1-CD1 3.71Å; I131-V163 HydrophobicContact CG2-CG1 4.01Å; I131-L167 HydrophobicContact CD1-CD1 4.07Å; I131-L167 HydrophobicContact CG1-CD1 3.89Å; I131-L167 HydrophobicContact CG1-CD2 4.24Å; I131-L229 HydrophobicContact CD1-CD1 4.34Å; I131-L229 HydrophobicContact CD1-CD2 4.15Å
132	N	94.9	Very high	92.7	Very high	35 Å²	35	45.2 Å²	45.2	19%	0.187	24%	0.235	C	C	.	.	H	α-helix	trans	-60.4	-40	179	-73.1	-20.6	0	0	0	112.2	T128 R129 G136 L145 P146 I147	T128-N132 PolarHBondContact O-N 2.84Å; T128-N132 PolarHBondContact O-ND2 2.91Å; R129-N132 PolarHBondContact O-N 2.83Å; N132-G136 VanDerWaalsContact O-CA 3.24Å; N132-G136 WeakPolarHBondContact O-CA 3.46Å; N132-G136 PolarHBondContact O-N 2.87Å; N132-L145 WeakPolarHBondContact OD1-CD2 3.45Å; N132-P146 WeakPolarHBondContact OD1-CA 3.36Å; N132-I147 PolarHBondContact ND2-O 3.47Å; N132-I147 PolarHBondContact OD1-N 2.91Å
133	K	91.8	Very high	92.6	Very high	91 Å²	91	47.5 Å²	47.5	40%	0.396	25%	0.245	S	C	.	.	H	α-helix	trans	-68	-45.4	176.1	-179.6	171	173.6	176.7	0	111.6	R129 W130 I131 D346 Q349	R129-K133 PolarHBondContact O-N 2.82Å; W130-K133 PolarHBondContact O-N 2.83Å; I131-K133 VanDerWaalsContact C-N 3.31Å; I131-K133 PolarHBondContact O-N 2.74Å; K133-D346 PolarHBondContact NZ-O 3.35Å; K133-D346 VanDerWaalsContact NZ-O 3.12Å; K133-D346 IonicContact NZ-OD1 2.75Å; K133-D346 PolarHBondContact NZ-OD1 3.23Å; K133-D346 IonicContact NZ-OD2 2.78Å; K133-D346 PolarHBondContact NZ-OD2 3.48Å; K133-Q349 HydrophobicContact CD-CG 3.89Å; K133-Q349 VanDerWaalsContact CD-NE2 3.3Å
134	S	92.4	Very high	92.5	Very high	48 Å²	48	47.7 Å²	47.7	34%	0.336	25%	0.247	S	C	.	.	H	α-helix	trans	-77.8	-35.4	-171.8	-58.7	0	0	0	0	113.5	W130 I131	W130-S134 PolarHBondContact NE1-OG 3.32Å; W130-S134 WeakPolarHBondContact O-CB 3.02Å; W130-S134 PolarHBondContact O-N 3.26Å; W130-S134 PolarHBondContact O-OG 3.06Å; I131-S134 PolarHBondContact O-N 2.93Å
135	L	94.9	Very high	92.4	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-112.7	-1.3	-175.8	-69.9	175.6	0	0	0	114.3	I131 K137 D138 L145 V163 K166 L167 I170	I131-L135 HydrophobicContact CG2-CD1 4.45Å; I131-L135 PolarHBondContact O-N 3.22Å; L135-K137 PolarHBondContact O-N 3.22Å; L135-D138 HydrophobicContact CD2-CB 4.14Å; L135-D138 WeakPolarHBondContact O-CB 3.33Å; L135-D138 PolarHBondContact O-N 3.2Å; L135-L145 HydrophobicContact CB-CD1 3.53Å; L135-L145 WeakPolarHBondContact O-CD1 3.38Å; L135-V163 HydrophobicContact CD1-CG1 3.95Å; L135-K166 HydrophobicContact CD1-CB 3.99Å; L135-K166 HydrophobicContact CD2-CB 3.7Å; L135-L167 HydrophobicContact CD1-CD2 3.66Å; L135-L167 HydrophobicContact CD1-CG 3.95Å; L135-L167 HydrophobicContact CG-CD2 4.19Å; L135-I170 HydrophobicContact CD1-CD1 4.4Å; L135-I170 HydrophobicContact CD2-CD1 3.39Å; L135-I170 HydrophobicContact CD2-CG1 4.46Å; L135-I170 HydrophobicContact CG-CD1 3.65Å
136	G	91.4	Very high	92.4	Very high	40 Å²	40	52.9 Å²	52.9	41%	0.412	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-11.5	-174.7	0	0	0	0	0	115.7	N132	N132-G136 VanDerWaalsContact O-CA 3.24Å; N132-G136 WeakPolarHBondContact O-CA 3.46Å; N132-G136 PolarHBondContact O-N 2.87Å
137	K	91.9	Very high	92.6	Very high	208 Å²	208	53 Å²	53	90%	0.904	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-0.2	174.7	-61.7	-179.4	-178	175.3	0	113.5	L135	L135-K137 PolarHBondContact O-N 3.22Å
138	D	93.9	Very high	92.5	Very high	29 Å²	29	56.3 Å²	56.3	16%	0.155	30%	0.298	C	S	.	.			trans	-77.9	123.6	-178.4	-173.9	-70.1	0	0	0	110.4	L135 D140 C141 N142 K166	L135-D138 HydrophobicContact CD2-CB 4.14Å; L135-D138 WeakPolarHBondContact O-CB 3.33Å; L135-D138 PolarHBondContact O-N 3.2Å; D138-D140 VanDerWaalsContact C-N 3.28Å; D138-D140 PolarHBondContact O-N 2.94Å; D138-D140 WeakPolarHBondContact OD1-CA 3.39Å; D138-D140 WeakPolarHBondContact OD1-CB 3.12Å; D138-D140 PolarHBondContact OD1-N 3.11Å; D138-C141 HydrophobicContact CB-CB 4.34Å; D138-C141 PolarHBondContact O-N 3.2Å; D138-C141 PolarHBondContact OD1-N 3.24Å; D138-N142 PolarHBondContact O-OD1 3.4Å; D138-K166 IonicContact OD1-NZ 2.89Å; D138-K166 PolarHBondContact OD1-NZ 2.93Å; D138-K166 IonicContact OD2-NZ 2.82Å; D138-K166 PolarHBondContact OD2-NZ 3.31Å
139	P	93.1	Very high	92.3	Very high	92 Å²	92	57.3 Å²	57.3	60%	0.597	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-66.1	-28	-174.2	27.1	-35.2	0	0	0	113.8	C141 N142	P139-C141 VanDerWaalsContact C-N 3.3Å; P139-N142 PolarHBondContact O-ND2 3.14Å
140	D	92.5	Very high	92.1	Very high	46 Å²	46	58.5 Å²	58.5	25%	0.246	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-79.7	-14.7	-178.8	-61.1	-47.5	0	0	0	112.2	D138 H143 I162 K166 T183	D138-D140 VanDerWaalsContact C-N 3.28Å; D138-D140 PolarHBondContact O-N 2.94Å; D138-D140 WeakPolarHBondContact OD1-CA 3.39Å; D138-D140 WeakPolarHBondContact OD1-CB 3.12Å; D138-D140 PolarHBondContact OD1-N 3.11Å; D140-H143 PolarHBondContact O-CE1 3.3Å; D140-H143 PolarHBondContact O-ND1 3.47Å; D140-I162 HydrophobicContact CB-CG2 4.28Å; D140-K166 WeakPolarHBondContact OD2-CE 3.5Å; D140-K166 IonicContact OD2-NZ 3.9Å; D140-K166 PolarHBondContact OD2-NZ 3.45Å; D140-T183 HydrophobicContact CB-CG2 4Å
141	C	92.2	Very high	92.1	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-102.2	-0.1	179	-65.3	0	0	0	0	113.6	D138 P139 H143 L144 L145	D138-C141 HydrophobicContact CB-CB 4.34Å; D138-C141 PolarHBondContact O-N 3.2Å; D138-C141 PolarHBondContact OD1-N 3.24Å; P139-C141 VanDerWaalsContact C-N 3.3Å; C141-H143 PolarHBondContact O-N 2.61Å; C141-H143 VanDerWaalsContact O-N 3.15Å; C141-L144 PolarHBondContact O-N 3.16Å; C141-L145 HydrophobicContact CB-CD1 3.48Å; C141-L145 VanDerWaalsContact CB-CD1 3.48Å; C141-L145 HydrophobicContact CB-CG 4Å; C141-L145 PolarHBondContact O-N 2.81Å
142	N	89.3	Confident	91.8	Very high	105 Å²	105	66.3 Å²	66.3	56%	0.561	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-27.8	-175.3	-81.1	-21.9	0	0	0	114.2	D138 P139 L144	D138-N142 PolarHBondContact O-OD1 3.4Å; P139-N142 PolarHBondContact O-ND2 3.14Å; N142-L144 PolarHBondContact O-N 2.95Å
143	H	87.6	Confident	91.7	Very high	112 Å²	112	66.2 Å²	66.2	52%	0.519	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-9.6	177.1	63.9	-69.6	0	0	0	113.5	D140 C141 D160	D140-H143 PolarHBondContact O-CE1 3.3Å; D140-H143 PolarHBondContact O-ND1 3.47Å; C141-H143 PolarHBondContact O-N 2.61Å; C141-H143 VanDerWaalsContact O-N 3.15Å; H143-D160 IonicContact CE1-OD2 2.92Å; H143-D160 IonicContact NE2-OD2 3.94Å; H143-D160 PolarHBondContact NE2-OD2 3.18Å
144	L	88.9	Confident	91.9	Very high	33 Å²	33	61.9 Å²	61.9	17%	0.173	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-26.8	-176.3	-57.6	170	0	0	0	112.9	C141 N142 I147 D160 V163	C141-L144 PolarHBondContact O-N 3.16Å; N142-L144 PolarHBondContact O-N 2.95Å; L144-I147 WeakPolarHBondContact O-CG1 3.45Å; L144-D160 WeakPolarHBondContact CD1-OD2 3.04Å; L144-V163 HydrophobicContact CD1-CG2 3.62Å
145	L	90.8	Very high	91.9	Very high	24 Å²	24	59.9 Å²	59.9	13%	0.126	32%	0.322	C	S	.	.			trans	-104.1	146.5	-173.1	-61.1	176.4	0	0	0	112	I131 N132 L135 C141 I147	I131-L145 HydrophobicContact CG2-CD2 3.82Å; N132-L145 WeakPolarHBondContact OD1-CD2 3.45Å; L135-L145 HydrophobicContact CB-CD1 3.53Å; L135-L145 WeakPolarHBondContact O-CD1 3.38Å; C141-L145 HydrophobicContact CB-CD1 3.48Å; C141-L145 VanDerWaalsContact CB-CD1 3.48Å; C141-L145 HydrophobicContact CB-CG 4Å; C141-L145 PolarHBondContact O-N 2.81Å; L145-I147 HydrophobicContact CD2-CD1 3.83Å; L145-I147 HydrophobicContact CD2-CG1 3.91Å
146	P	93.8	Very high	91.8	Very high	114 Å²	114	62 Å²	62	74%	0.74	34%	0.341	S	S	*	.	S	Bend	cis	-78.5	141.2	-2.8	32	-34.3	0	0	0	112.7	N132	N132-P146 WeakPolarHBondContact OD1-CA 3.36Å
147	I	94.6	Very high	91.9	Very high	5 Å²	5	60.9 Å²	60.9	3%	0.026	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-79.3	139.1	173	-64.1	161.6	0	0	0	108.9	T128 I131 N132 L144 L145 P149 S153 L154	T128-I147 HydrophobicContact CG2-CB 3.7Å; T128-I147 HydrophobicContact CG2-CG2 3.46Å; T128-I147 VanDerWaalsContact CG2-CG2 3.46Å; T128-I147 WeakPolarHBondContact CG2-O 3.45Å; I131-I147 HydrophobicContact CG2-CD1 4.09Å; N132-I147 PolarHBondContact ND2-O 3.47Å; N132-I147 PolarHBondContact OD1-N 2.91Å; L144-I147 WeakPolarHBondContact O-CG1 3.45Å; L145-I147 HydrophobicContact CD2-CD1 3.83Å; L145-I147 HydrophobicContact CD2-CG1 3.91Å; I147-P149 WeakPolarHBondContact O-CD 3.37Å; I147-S153 VanDerWaalsContact CG2-OG 3.28Å; I147-S153 WeakPolarHBondContact CG2-OG 3.48Å; I147-L154 HydrophobicContact CD1-CD1 4.34Å; I147-L154 HydrophobicContact CG2-CB 4.16Å
148	N	93.4	Very high	92	Very high	70 Å²	70	51.1 Å²	51.1	37%	0.374	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-77.7	118.7	176.4	-178.7	7.6	0	0	0	110.4	E150 D151 S153	N148-E150 PolarHBondContact O-N 3.02Å; N148-E150 PolarHBondContact OD1-N 2.88Å; N148-E150 VanDerWaalsContact OD1-N 3.09Å; N148-D151 WeakPolarHBondContact CB-OD2 3.23Å; N148-D151 PolarHBondContact ND2-OD2 3.46Å; N148-S153 PolarHBondContact N-OG 2.71Å; N148-S153 PolarHBondContact O-OG 2.76Å
149	P	90.9	Very high	91.9	Very high	23 Å²	23	55 Å²	55	15%	0.149	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-18.7	-180	28	-34.5	0	0	0	113.9	K124 V125 T128 R129 I147	K124-P149 WeakPolarHBondContact CE-O 3.33Å; V125-P149 HydrophobicContact CB-CB 4.5Å; V125-P149 HydrophobicContact CG1-CB 4.17Å; V125-P149 WeakPolarHBondContact CG2-O 3.31Å; T128-P149 HydrophobicContact CG2-CB 3.93Å; R129-P149 HydrophobicContact CG-CB 4.34Å; I147-P149 WeakPolarHBondContact O-CD 3.37Å
150	E	88.9	Confident	91.8	Very high	125 Å²	125	51.2 Å²	51.2	58%	0.584	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.4	-172.1	-54.6	-56.4	139.2	0	0	113.4	R129 N148	R129-E150 IonicContact NH2-OE1 3.53Å; N148-E150 PolarHBondContact O-N 3.02Å; N148-E150 PolarHBondContact OD1-N 2.88Å; N148-E150 VanDerWaalsContact OD1-N 3.09Å
151	D	90.7	Very high	91.9	Very high	65 Å²	65	49 Å²	49	35%	0.348	26%	0.26	S	S	.	.	S	Bend	trans	-121.3	-168.5	-179.4	66.4	27.1	0	0	0	112.5	K124 N148 S153	K124-D151 WeakPolarHBondContact CD-O 3.29Å; K124-D151 VanDerWaalsContact CE-O 3.25Å; K124-D151 WeakPolarHBondContact CE-O 3.45Å; K124-D151 PolarHBondContact NZ-O 3.06Å; N148-D151 WeakPolarHBondContact CB-OD2 3.23Å; N148-D151 PolarHBondContact ND2-OD2 3.46Å; D151-S153 VanDerWaalsContact C-N 3.33Å; D151-S153 WeakPolarHBondContact OD1-CA 3.32Å; D151-S153 WeakPolarHBondContact OD1-CB 3.29Å; D151-S153 PolarHBondContact OD1-N 2.87Å; D151-S153 PolarHBondContact OD1-OG 2.68Å
152	E	90.3	Very high	92.1	Very high	123 Å²	123	49 Å²	49	58%	0.575	26%	0.26	S	S	*	.	S	Bend	trans	-89.8	9.3	179.8	-66.9	-168.5	161.9	0	0	113.4	Y119 L154 F155	Y119-E152 PolarHBondContact OH-OE1 3.41Å; E152-L154 PolarHBondContact O-N 2.69Å; E152-L154 VanDerWaalsContact O-N 3.14Å; E152-F155 HydrophobicContact CB-CD2 3.98Å; E152-F155 HydrophobicContact CB-CE2 4.4Å; E152-F155 HydrophobicContact CG-CD2 4.33Å; E152-F155 HydrophobicContact CG-CE2 4.32Å; E152-F155 PolarHBondContact O-N 2.96Å
153	S	92.9	Very high	92.5	Very high	32 Å²	32	44 Å²	44	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-25.2	-176.6	62.2	0	0	0	0	113.4	I147 N148 D151 F155 A156 S157	I147-S153 VanDerWaalsContact CG2-OG 3.28Å; I147-S153 WeakPolarHBondContact CG2-OG 3.48Å; N148-S153 PolarHBondContact N-OG 2.71Å; N148-S153 PolarHBondContact O-OG 2.76Å; D151-S153 VanDerWaalsContact C-N 3.33Å; D151-S153 WeakPolarHBondContact OD1-CA 3.32Å; D151-S153 WeakPolarHBondContact OD1-CB 3.29Å; D151-S153 PolarHBondContact OD1-N 2.87Å; D151-S153 PolarHBondContact OD1-OG 2.68Å; S153-F155 VanDerWaalsContact C-N 3.29Å; S153-F155 PolarHBondContact O-N 3.26Å; S153-A156 PolarHBondContact O-N 3.02Å; S153-S157 WeakPolarHBondContact O-CB 3.48Å; S153-S157 PolarHBondContact O-N 3.46Å; S153-S157 PolarHBondContact O-OG 3.47Å
154	L	94.9	Very high	92.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-52.2	-47.8	171.8	178.2	66.2	0	0	0	111.6	K124 I131 I147 E152 A156 S157 L158 L226 L229	K124-L154 HydrophobicContact CB-CD2 4.5Å; K124-L154 HydrophobicContact CG-CB 4.45Å; K124-L154 HydrophobicContact CG-CD2 3.74Å; I131-L154 HydrophobicContact CD1-CD1 3.71Å; I147-L154 HydrophobicContact CD1-CD1 4.34Å; I147-L154 HydrophobicContact CG2-CB 4.16Å; E152-L154 PolarHBondContact O-N 2.69Å; E152-L154 VanDerWaalsContact O-N 3.14Å; L154-A156 VanDerWaalsContact C-N 3.32Å; L154-A156 PolarHBondContact O-N 3.36Å; L154-S157 PolarHBondContact O-N 3.47Å; L154-L158 HydrophobicContact CD1-CD1 3.96Å; L154-L158 HydrophobicContact CG-CD1 4.18Å; L154-L158 WeakPolarHBondContact O-CG 3.35Å; L154-L158 PolarHBondContact O-N 2.97Å; L154-L226 HydrophobicContact CD2-CD2 3.79Å; L154-L229 HydrophobicContact CD1-CD1 4.28Å; L154-L229 HydrophobicContact CD2-CD1 4.12Å
155	F	94	Very high	93.3	Very high	6 Å²	6	37.3 Å²	37.3	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-71.7	-29.9	-174.7	-52.8	-56.8	0	0	0	112.5	Y119 K124 E152 S153 R159 P222 V225 L226	Y119-F155 HydrophobicContact CD2-CZ 4.08Å; Y119-F155 AromaticContact CE2-CE2 3.93Å; Y119-F155 HydrophobicContact CE2-CE2 3.93Å; Y119-F155 AromaticContact CE2-CZ 3.76Å; Y119-F155 HydrophobicContact CE2-CZ 3.76Å; Y119-F155 AromaticContact CZ-CE2 3.92Å; K124-F155 HydrophobicContact CD-CE2 4.17Å; K124-F155 HydrophobicContact CD-CZ 4.18Å; K124-F155 HydrophobicContact CG-CZ 4.16Å; E152-F155 HydrophobicContact CB-CD2 3.98Å; E152-F155 HydrophobicContact CB-CE2 4.4Å; E152-F155 HydrophobicContact CG-CD2 4.33Å; E152-F155 HydrophobicContact CG-CE2 4.32Å; E152-F155 PolarHBondContact O-N 2.96Å; S153-F155 VanDerWaalsContact C-N 3.29Å; S153-F155 PolarHBondContact O-N 3.26Å; F155-R159 WeakPolarHBondContact O-CG 3.21Å; F155-P222 HydrophobicContact CD1-CB 4.26Å; F155-P222 HydrophobicContact CD1-CG 4.45Å; F155-P222 HydrophobicContact CD2-CG 4.13Å; F155-P222 HydrophobicContact CE1-CB 3.73Å; F155-P222 HydrophobicContact CE1-CG 4.31Å; F155-P222 HydrophobicContact CE2-CB 3.98Å; F155-P222 HydrophobicContact CE2-CG 3.97Å; F155-P222 HydrophobicContact CG-CG 4.38Å; F155-P222 HydrophobicContact CZ-CB 3.57Å; F155-P222 HydrophobicContact CZ-CG 4.07Å; F155-V225 HydrophobicContact CD1-CB 4.03Å; F155-V225 HydrophobicContact CD1-CG1 3.88Å; F155-V225 HydrophobicContact CD1-CG2 4.45Å; F155-V225 HydrophobicContact CE1-CB 4.39Å; F155-V225 HydrophobicContact CE1-CG1 4.3Å; F155-L226 HydrophobicContact CE1-CD2 4.13Å; F155-L226 HydrophobicContact CE1-CG 4.02Å; F155-L226 HydrophobicContact CZ-CG 4.45Å
156	A	91.6	Very high	93.7	Very high	51 Å²	51	36.4 Å²	36.4	42%	0.421	20%	0.196	S	C	.	.	H	α-helix	trans	-73.3	-40.4	174	0	0	0	0	0	111.7	S153 L154 L158 R159	S153-A156 PolarHBondContact O-N 3.02Å; L154-A156 VanDerWaalsContact C-N 3.32Å; L154-A156 PolarHBondContact O-N 3.36Å; A156-L158 PolarHBondContact O-N 3.01Å; A156-R159 WeakPolarHBondContact O-CB 3.44Å; A156-R159 WeakPolarHBondContact O-CG 3.35Å; A156-R159 PolarHBondContact O-N 3.47Å
157	S	93	Very high	93.8	Very high	15 Å²	15	31 Å²	31	11%	0.105	16%	0.161	C	C	.	.	H	α-helix	trans	-70.4	-14.5	-175	-56.1	0	0	0	0	113.8	S153 L154	S153-S157 WeakPolarHBondContact O-CB 3.48Å; S153-S157 PolarHBondContact O-N 3.46Å; S153-S157 PolarHBondContact O-OG 3.47Å; L154-S157 PolarHBondContact O-N 3.47Å
158	L	93.8	Very high	93.9	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.016	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-4.4	178.7	-62.9	172	0	0	0	113.3	L154 A156 D160 G161 V163 L164 V225 L229	L154-L158 HydrophobicContact CD1-CD1 3.96Å; L154-L158 HydrophobicContact CG-CD1 4.18Å; L154-L158 WeakPolarHBondContact O-CG 3.35Å; L154-L158 PolarHBondContact O-N 2.97Å; A156-L158 PolarHBondContact O-N 3.01Å; L158-D160 VanDerWaalsContact C-N 3.28Å; L158-D160 PolarHBondContact O-N 3.23Å; L158-G161 PolarHBondContact O-N 3.5Å; L158-V163 HydrophobicContact CD2-CB 3.61Å; L158-V163 HydrophobicContact CD2-CG1 3.37Å; L158-L164 HydrophobicContact CD2-CD2 4.12Å; L158-L164 HydrophobicContact CD2-CG 4.17Å; L158-V225 HydrophobicContact CD1-CG1 3.3Å; L158-L229 HydrophobicContact CD1-CD1 3.81Å; L158-L229 HydrophobicContact CD1-CD2 4.19Å; L158-L229 HydrophobicContact CD1-CG 4.22Å
159	R	92.3	Very high	94.1	Very high	112 Å²	112	28.4 Å²	28.4	42%	0.423	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.5	-173.4	-64.8	-179.7	175.5	-179.4	-4.2	114.5	F155 A156 I195 M218 A219	F155-R159 WeakPolarHBondContact O-CG 3.21Å; A156-R159 WeakPolarHBondContact O-CB 3.44Å; A156-R159 WeakPolarHBondContact O-CG 3.35Å; A156-R159 PolarHBondContact O-N 3.47Å; R159-I195 VanDerWaalsContact O-CD1 3.32Å; R159-I195 WeakPolarHBondContact O-CD1 3.32Å; R159-M218 VanDerWaalsContact CD-O 3.23Å; R159-M218 WeakPolarHBondContact CD-O 3.43Å; R159-M218 VanDerWaalsContact CG-O 3.31Å; R159-M218 WeakPolarHBondContact CG-O 3.41Å; R159-M218 PolarHBondContact NE-O 2.86Å; R159-A219 PolarHBondContact NH2-O 3Å
160	D	91.1	Very high	94.3	Very high	12 Å²	12	30.6 Å²	30.6	6%	0.064	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.9	175.1	69.1	12.3	0	0	0	114.1	H143 L144 L158 I162 L186 R191 N194	H143-D160 IonicContact CE1-OD2 2.92Å; H143-D160 IonicContact NE2-OD2 3.94Å; H143-D160 PolarHBondContact NE2-OD2 3.18Å; L144-D160 WeakPolarHBondContact CD1-OD2 3.04Å; L158-D160 VanDerWaalsContact C-N 3.28Å; L158-D160 PolarHBondContact O-N 3.23Å; D160-I162 PolarHBondContact O-N 3.03Å; D160-I162 PolarHBondContact OD1-N 3.47Å; D160-L186 HydrophobicContact CB-CD1 3.62Å; D160-R191 HydrophobicContact CB-CG 4.07Å; D160-N194 WeakPolarHBondContact O-CB 3.34Å; D160-N194 PolarHBondContact O-ND2 3.38Å
161	G	95.1	Very high	94.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	S	Bend	trans	72	-2.4	179.4	0	0	0	0	0	115.9	L158 L164 C165	L158-G161 PolarHBondContact O-N 3.5Å; G161-L164 PolarHBondContact O-N 2.92Å; G161-C165 PolarHBondContact O-N 3.12Å; G161-C165 PolarHBondContact O-SG 2.82Å
162	I	96.6	Very high	94.7	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.3	-52.8	-176.7	-64.5	176.9	0	0	0	110.1	D140 D160 L164 C165 K166 I181 T183 L186	D140-I162 HydrophobicContact CB-CG2 4.28Å; D160-I162 PolarHBondContact O-N 3.03Å; D160-I162 PolarHBondContact OD1-N 3.47Å; I162-L164 VanDerWaalsContact C-N 3.29Å; I162-L164 PolarHBondContact O-N 3.38Å; I162-C165 WeakPolarHBondContact O-CB 3.32Å; I162-C165 PolarHBondContact O-N 2.99Å; I162-C165 VanDerWaalsContact O-N 3.16Å; I162-K166 HydrophobicContact CG2-CG 4.38Å; I162-K166 WeakPolarHBondContact O-CG 3.27Å; I162-K166 PolarHBondContact O-N 3.44Å; I162-I181 HydrophobicContact CG1-CG2 4.17Å; I162-T183 HydrophobicContact CD1-CG2 4.47Å; I162-L186 HydrophobicContact CD1-CD1 3.96Å
163	V	96.7	Very high	94.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58	-43.1	178.8	172.1	0	0	0	0	110.5	I131 L135 L144 L158 C165 K166 L167	I131-V163 HydrophobicContact CG2-CG1 4.01Å; L135-V163 HydrophobicContact CD1-CG1 3.95Å; L144-V163 HydrophobicContact CD1-CG2 3.62Å; L158-V163 HydrophobicContact CD2-CB 3.61Å; L158-V163 HydrophobicContact CD2-CG1 3.37Å; V163-C165 PolarHBondContact O-N 2.99Å; V163-K166 PolarHBondContact O-N 3.19Å; V163-L167 HydrophobicContact CG1-CD1 3.92Å; V163-L167 HydrophobicContact CG1-CG 4.11Å; V163-L167 WeakPolarHBondContact O-CB 3.23Å; V163-L167 WeakPolarHBondContact O-CG 3.41Å; V163-L167 PolarHBondContact O-N 3.16Å
164	L	96.9	Very high	94.7	Very high	4 Å²	4	25.9 Å²	25.9	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-60	-45.4	177.5	-67.7	175.4	0	0	0	112.3	L158 G161 I162 L167 I168 A198 L217 L228 L229 I232	L158-L164 HydrophobicContact CD2-CD2 4.12Å; L158-L164 HydrophobicContact CD2-CG 4.17Å; G161-L164 PolarHBondContact O-N 2.92Å; I162-L164 VanDerWaalsContact C-N 3.29Å; I162-L164 PolarHBondContact O-N 3.38Å; L164-L167 PolarHBondContact O-N 2.65Å; L164-I168 WeakPolarHBondContact O-CD1 3.4Å; L164-I168 VanDerWaalsContact O-CG1 3.31Å; L164-I168 WeakPolarHBondContact O-CG1 3.4Å; L164-I168 PolarHBondContact O-N 3.5Å; L164-I168 VanDerWaalsContact O-N 3.11Å; L164-A198 HydrophobicContact CB-CB 3.77Å; L164-L217 HydrophobicContact CD1-CD1 4.14Å; L164-L228 HydrophobicContact CD1-CD2 4.36Å; L164-L228 HydrophobicContact CD2-CD2 4.34Å; L164-L229 HydrophobicContact CD2-CD2 4.02Å; L164-I232 HydrophobicContact CD2-CD1 4.49Å
165	C	97.9	Very high	94.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.7	-45	176.5	-72.8	0	0	0	0	111.9	G161 I162 V163 I168 N169 I176 I181 N194	G161-C165 PolarHBondContact O-N 3.12Å; G161-C165 PolarHBondContact O-SG 2.82Å; I162-C165 WeakPolarHBondContact O-CB 3.32Å; I162-C165 PolarHBondContact O-N 2.99Å; I162-C165 VanDerWaalsContact O-N 3.16Å; V163-C165 PolarHBondContact O-N 2.99Å; C165-I168 PolarHBondContact O-N 3.38Å; C165-N169 PolarHBondContact O-N 3.17Å; C165-I176 HydrophobicContact CB-CD1 3.85Å; C165-I181 HydrophobicContact CB-CD1 3.63Å; C165-I181 HydrophobicContact CB-CG1 4.12Å; C165-N194 PolarHBondContact SG-O 3.21Å
166	K	97.3	Very high	94.9	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.017	15%	0.145	C	C	.	.	H	α-helix	trans	-67.6	-39.3	-179.6	-65.5	-73.9	-172.3	148.8	0	112.2	L135 D138 D140 I162 V163 I168 N169 I170 E178	L135-K166 HydrophobicContact CD1-CB 3.99Å; L135-K166 HydrophobicContact CD2-CB 3.7Å; D138-K166 IonicContact OD1-NZ 2.89Å; D138-K166 PolarHBondContact OD1-NZ 2.93Å; D138-K166 IonicContact OD2-NZ 2.82Å; D138-K166 PolarHBondContact OD2-NZ 3.31Å; D140-K166 WeakPolarHBondContact OD2-CE 3.5Å; D140-K166 IonicContact OD2-NZ 3.9Å; D140-K166 PolarHBondContact OD2-NZ 3.45Å; I162-K166 HydrophobicContact CG2-CG 4.38Å; I162-K166 WeakPolarHBondContact O-CG 3.27Å; I162-K166 PolarHBondContact O-N 3.44Å; V163-K166 PolarHBondContact O-N 3.19Å; K166-I168 VanDerWaalsContact C-N 3.31Å; K166-I168 PolarHBondContact O-N 3.44Å; K166-N169 PolarHBondContact O-N 3.02Å; K166-N169 VanDerWaalsContact O-N 3.16Å; K166-I170 PolarHBondContact O-N 2.86Å; K166-E178 WeakPolarHBondContact CD-OE1 3.33Å; K166-E178 IonicContact NZ-OE1 2.85Å; K166-E178 IonicContact NZ-OE2 3.25Å; K166-E178 PolarHBondContact NZ-OE2 3.3Å
167	L	96.9	Very high	95.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-37.3	174.4	-71.9	-178.6	0	0	0	112.6	W130 I131 L135 V163 L164 N169 I170 S171 L229 I232	W130-L167 HydrophobicContact CE3-CD2 4.19Å; W130-L167 HydrophobicContact CH2-CD2 3.7Å; W130-L167 HydrophobicContact CZ3-CD1 4.18Å; W130-L167 HydrophobicContact CZ3-CD2 3.3Å; W130-L167 HydrophobicContact CZ3-CG 4.23Å; I131-L167 HydrophobicContact CD1-CD1 4.07Å; I131-L167 HydrophobicContact CG1-CD1 3.89Å; I131-L167 HydrophobicContact CG1-CD2 4.24Å; L135-L167 HydrophobicContact CD1-CD2 3.66Å; L135-L167 HydrophobicContact CD1-CG 3.95Å; L135-L167 HydrophobicContact CG-CD2 4.19Å; V163-L167 HydrophobicContact CG1-CD1 3.92Å; V163-L167 HydrophobicContact CG1-CG 4.11Å; V163-L167 WeakPolarHBondContact O-CB 3.23Å; V163-L167 WeakPolarHBondContact O-CG 3.41Å; V163-L167 PolarHBondContact O-N 3.16Å; L164-L167 PolarHBondContact O-N 2.65Å; L167-N169 VanDerWaalsContact C-N 3.31Å; L167-N169 PolarHBondContact O-N 3.05Å; L167-I170 HydrophobicContact CD2-CD1 3.97Å; L167-I170 PolarHBondContact O-N 3.25Å; L167-S171 PolarHBondContact O-N 3.31Å; L167-S171 PolarHBondContact O-OG 3.44Å; L167-L229 HydrophobicContact CD1-CD2 3.56Å; L167-I232 HydrophobicContact CB-CG2 4.13Å
168	I	97.4	Very high	95.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.4	-41.2	174.6	-71.5	162.9	0	0	0	110.9	L164 C165 K166 S171 Q172 T175 I176 A198 A202 I205 I232	L164-I168 WeakPolarHBondContact O-CD1 3.4Å; L164-I168 VanDerWaalsContact O-CG1 3.31Å; L164-I168 WeakPolarHBondContact O-CG1 3.4Å; L164-I168 PolarHBondContact O-N 3.5Å; L164-I168 VanDerWaalsContact O-N 3.11Å; C165-I168 PolarHBondContact O-N 3.38Å; K166-I168 VanDerWaalsContact C-N 3.31Å; K166-I168 PolarHBondContact O-N 3.44Å; I168-S171 PolarHBondContact O-N 3.18Å; I168-Q172 PolarHBondContact O-N 2.98Å; I168-T175 HydrophobicContact CG2-CG2 3.59Å; I168-I176 HydrophobicContact CB-CD1 4.06Å; I168-I176 HydrophobicContact CD1-CD1 4.06Å; I168-I176 HydrophobicContact CG2-CD1 3.96Å; I168-I176 HydrophobicContact CG2-CG1 4.28Å; I168-A198 HydrophobicContact CD1-CB 4.08Å; I168-A198 WeakPolarHBondContact CD1-O 3.5Å; I168-A202 HydrophobicContact CD1-CB 4.05Å; I168-I205 HydrophobicContact CG2-CD1 4.31Å; I168-I232 HydrophobicContact CD1-CD1 4.34Å; I168-I232 HydrophobicContact CG1-CD1 3.9Å; I168-I232 HydrophobicContact CG1-CG1 4.19Å; I168-I232 HydrophobicContact CG1-CG2 4.24Å
169	N	96.5	Very high	95.3	Very high	21 Å²	21	31.2 Å²	31.2	11%	0.112	16%	0.155	C	C	.	.	H	α-helix	trans	-68.9	-31.8	175.2	-83.2	-9.3	0	0	0	113.1	C165 K166 L167 Q172 P173 T175 I176 E178	C165-N169 PolarHBondContact O-N 3.17Å; K166-N169 PolarHBondContact O-N 3.02Å; K166-N169 VanDerWaalsContact O-N 3.16Å; L167-N169 VanDerWaalsContact C-N 3.31Å; L167-N169 PolarHBondContact O-N 3.05Å; N169-Q172 CarbonylContact O-C 3.56Å; N169-Q172 VanDerWaalsContact O-C 3.31Å; N169-P173 VanDerWaalsContact O-CA 3.23Å; N169-P173 WeakPolarHBondContact O-CA 3.42Å; N169-P173 VanDerWaalsContact O-N 3.15Å; N169-T175 PolarHBondContact OD1-N 3.39Å; N169-I176 PolarHBondContact ND2-O 3.11Å; N169-I176 PolarHBondContact OD1-N 3.39Å; N169-I176 PolarHBondContact OD1-O 2.95Å; N169-E178 WeakPolarHBondContact ND2-CG 3.37Å; N169-E178 PolarHBondContact ND2-OE1 2.85Å
170	I	94.7	Very high	95.5	Very high	68 Å²	68	26 Å²	26	35%	0.349	14%	0.135	S	C	.	.	H	α-helix	trans	-64.4	-47.2	171.2	-71.5	162.3	0	0	0	110.4	W130 L135 K166 L167	W130-I170 HydrophobicContact CH2-CG2 4.25Å; W130-I170 HydrophobicContact CZ2-CG2 4.05Å; L135-I170 HydrophobicContact CD1-CD1 4.4Å; L135-I170 HydrophobicContact CD2-CD1 3.39Å; L135-I170 HydrophobicContact CD2-CG1 4.46Å; L135-I170 HydrophobicContact CG-CD1 3.65Å; K166-I170 PolarHBondContact O-N 2.86Å; L167-I170 HydrophobicContact CD2-CD1 3.97Å; L167-I170 PolarHBondContact O-N 3.25Å
171	S	94.6	Very high	95.7	Very high	6 Å²	6	25.7 Å²	25.7	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-71.6	-36.2	-178	-67.2	0	0	0	0	113.3	L167 I168 I232 G236	L167-S171 PolarHBondContact O-N 3.31Å; L167-S171 PolarHBondContact O-OG 3.44Å; I168-S171 PolarHBondContact O-N 3.18Å; S171-I232 VanDerWaalsContact CB-O 3.25Å; S171-I232 WeakPolarHBondContact CB-O 3.49Å; S171-I232 WeakPolarHBondContact OG-CG2 3.27Å; S171-I232 PolarHBondContact OG-O 3.26Å; S171-G236 WeakPolarHBondContact O-CA 3.42Å
172	Q	93.3	Very high	95.7	Very high	35 Å²	35	26.7 Å²	26.7	16%	0.164	14%	0.139	C	C	.	.	S	Bend	trans	-142.4	101.1	173.8	-172.1	176.4	-52.7	0	0	109	I168 N169 T175 I205	I168-Q172 PolarHBondContact O-N 2.98Å; N169-Q172 CarbonylContact O-C 3.56Å; N169-Q172 VanDerWaalsContact O-C 3.31Å; Q172-T175 WeakPolarHBondContact CB-OG1 3.36Å; Q172-T175 WeakPolarHBondContact CG-OG1 3.46Å; Q172-T175 WeakPolarHBondContact O-CB 3.17Å; Q172-T175 PolarHBondContact O-N 3.45Å; Q172-T175 PolarHBondContact O-OG1 2.93Å; Q172-I205 HydrophobicContact CB-CG2 4.05Å; Q172-I205 HydrophobicContact CG-CG2 4.33Å
173	P	93.1	Very high	95.5	Very high	96 Å²	96	28.6 Å²	28.6	62%	0.623	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	149.6	-180	-29.5	36.1	0	0	0	113.1	N169 T175	N169-P173 VanDerWaalsContact O-CA 3.23Å; N169-P173 WeakPolarHBondContact O-CA 3.42Å; N169-P173 VanDerWaalsContact O-N 3.15Å; P173-T175 PolarHBondContact O-N 3.44Å; P173-T175 VanDerWaalsContact O-N 3.17Å
174	D	91.7	Very high	95	Very high	109 Å²	109	37.1 Å²	37.1	58%	0.583	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	17.1	177.7	-70.8	-43.6	0	0	0	115.9	K587	D174-K587 IonicContact OD1-NZ 3.62Å; D174-K587 PolarHBondContact OD1-NZ 3.4Å; D174-K587 IonicContact OD2-NZ 2.8Å; D174-K587 PolarHBondContact OD2-NZ 3.13Å
175	T	95.6	Very high	94.2	Very high	11 Å²	11	46.6 Å²	46.6	7%	0.067	23%	0.228	C	C	.	.	S	Bend	trans	-73.8	-39.2	177.4	-62.2	0	0	0	0	112.3	I168 N169 Q172 P173 I205 R594	I168-T175 HydrophobicContact CG2-CG2 3.59Å; N169-T175 PolarHBondContact OD1-N 3.39Å; Q172-T175 WeakPolarHBondContact CB-OG1 3.36Å; Q172-T175 WeakPolarHBondContact CG-OG1 3.46Å; Q172-T175 WeakPolarHBondContact O-CB 3.17Å; Q172-T175 PolarHBondContact O-N 3.45Å; Q172-T175 PolarHBondContact O-OG1 2.93Å; P173-T175 PolarHBondContact O-N 3.44Å; P173-T175 VanDerWaalsContact O-N 3.17Å; T175-I205 HydrophobicContact CG2-CG2 3.67Å; T175-R594 PolarHBondContact O-NH1 2.8Å
176	I	97.7	Very high	93.6	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.026	24%	0.237	C	C	.	.	S	Bend	trans	-119.8	126.7	178.2	-63.1	171.7	0	0	0	109	C165 I168 N169 E178 I181 L197 S201	C165-I176 HydrophobicContact CB-CD1 3.85Å; I168-I176 HydrophobicContact CB-CD1 4.06Å; I168-I176 HydrophobicContact CD1-CD1 4.06Å; I168-I176 HydrophobicContact CG2-CD1 3.96Å; I168-I176 HydrophobicContact CG2-CG1 4.28Å; N169-I176 PolarHBondContact ND2-O 3.11Å; N169-I176 PolarHBondContact OD1-N 3.39Å; N169-I176 PolarHBondContact OD1-O 2.95Å; I176-E178 PolarHBondContact O-N 3.22Å; I176-I181 HydrophobicContact CG2-CD1 4.19Å; I176-I181 HydrophobicContact CG2-CG1 4.11Å; I176-L197 HydrophobicContact CD1-CG 4.38Å; I176-L197 HydrophobicContact CG2-CD1 4.32Å; I176-L197 HydrophobicContact CG2-CD2 3.87Å; I176-L197 HydrophobicContact CG2-CG 4.23Å; I176-S201 VanDerWaalsContact CG1-OG 3.31Å; I176-S201 WeakPolarHBondContact CG1-OG 3.43Å
177	D	96.9	Very high	93.2	Very high	19 Å²	19	49.7 Å²	49.7	10%	0.102	25%	0.247	C	C	.	.			trans	-72.4	108.9	166.1	-169.2	-36	0	0	0	109.6	R179 V180 K587 Y588 S591	D177-R179 PolarHBondContact O-N 3.44Å; D177-R179 VanDerWaalsContact OD1-CB 3.29Å; D177-R179 WeakPolarHBondContact OD1-CB 3.29Å; D177-R179 WeakPolarHBondContact OD1-CG 3.44Å; D177-R179 IonicContact OD1-CZ 3.91Å; D177-R179 PolarHBondContact OD1-N 2.8Å; D177-R179 VanDerWaalsContact OD1-N 3.17Å; D177-R179 IonicContact OD1-NE 2.65Å; D177-R179 PolarHBondContact OD1-NE 3.06Å; D177-R179 IonicContact OD1-NH2 3.51Å; D177-R179 IonicContact OD2-CZ 3.82Å; D177-R179 IonicContact OD2-NE 3.44Å; D177-R179 PolarHBondContact OD2-NE 3.17Å; D177-R179 IonicContact OD2-NH2 2.61Å; D177-R179 PolarHBondContact OD2-NH2 3.09Å; D177-V180 HydrophobicContact CB-CG2 4.25Å; D177-V180 VanDerWaalsContact O-CB 3.32Å; D177-V180 WeakPolarHBondContact O-CB 3.37Å; D177-V180 PolarHBondContact O-N 2.85Å; D177-K587 HydrophobicContact CB-CB 4.47Å; D177-Y588 WeakPolarHBondContact OD2-CA 3.38Å; D177-Y588 PolarHBondContact OD2-N 3.45Å; D177-S591 WeakPolarHBondContact CB-OG 3.32Å; D177-S591 PolarHBondContact N-OG 3.02Å
178	E	95.4	Very high	92.7	Very high	80 Å²	80	52.4 Å²	52.4	37%	0.374	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-61.6	-21.8	-172.3	-58.6	-166.6	168.3	0	0	113.6	K166 N169 I176 V180 I181	K166-E178 WeakPolarHBondContact CD-OE1 3.33Å; K166-E178 IonicContact NZ-OE1 2.85Å; K166-E178 IonicContact NZ-OE2 3.25Å; K166-E178 PolarHBondContact NZ-OE2 3.3Å; N169-E178 WeakPolarHBondContact ND2-CG 3.37Å; N169-E178 PolarHBondContact ND2-OE1 2.85Å; I176-E178 PolarHBondContact O-N 3.22Å; E178-V180 PolarHBondContact O-N 3.33Å; E178-V180 VanDerWaalsContact O-N 3.16Å; E178-I181 HydrophobicContact CB-CD1 4.12Å; E178-I181 HydrophobicContact CG-CD1 4.22Å; E178-I181 WeakPolarHBondContact O-CB 3.46Å; E178-I181 PolarHBondContact O-N 3.16Å
179	R	94.5	Very high	92.2	Very high	73 Å²	73	55.9 Å²	55.9	28%	0.275	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-63	-21.8	175.8	-57.9	176.7	-70.2	176.5	-3.2	113	D177 M568 N584	D177-R179 PolarHBondContact O-N 3.44Å; D177-R179 VanDerWaalsContact OD1-CB 3.29Å; D177-R179 WeakPolarHBondContact OD1-CB 3.29Å; D177-R179 WeakPolarHBondContact OD1-CG 3.44Å; D177-R179 IonicContact OD1-CZ 3.91Å; D177-R179 PolarHBondContact OD1-N 2.8Å; D177-R179 VanDerWaalsContact OD1-N 3.17Å; D177-R179 IonicContact OD1-NE 2.65Å; D177-R179 PolarHBondContact OD1-NE 3.06Å; D177-R179 IonicContact OD1-NH2 3.51Å; D177-R179 IonicContact OD2-CZ 3.82Å; D177-R179 IonicContact OD2-NE 3.44Å; D177-R179 PolarHBondContact OD2-NE 3.17Å; D177-R179 IonicContact OD2-NH2 2.61Å; D177-R179 PolarHBondContact OD2-NH2 3.09Å; R179-M568 HydrophobicContact CB-CE 4.11Å; R179-M568 HydrophobicContact CB-SD 3.72Å; R179-N584 PolarHBondContact NH1-OD1 2.89Å; R179-N584 VanDerWaalsContact NH2-CG 3.33Å; R179-N584 PolarHBondContact NH2-ND2 3.31Å; R179-N584 PolarHBondContact NH2-O 3.23Å; R179-N584 PolarHBondContact NH2-OD1 2.78Å
180	V	95.6	Very high	91.8	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.012	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-81.9	-20.5	179.2	177.2	0	0	0	0	111.7	D177 E178 L197 Y588 L592 K595	D177-V180 HydrophobicContact CB-CG2 4.25Å; D177-V180 VanDerWaalsContact O-CB 3.32Å; D177-V180 WeakPolarHBondContact O-CB 3.37Å; D177-V180 PolarHBondContact O-N 2.85Å; E178-V180 PolarHBondContact O-N 3.33Å; E178-V180 VanDerWaalsContact O-N 3.16Å; V180-L197 HydrophobicContact CG1-CD2 4.09Å; V180-Y588 HydrophobicContact CG2-CD2 3.5Å; V180-Y588 HydrophobicContact CG2-CE2 3.52Å; V180-L592 HydrophobicContact CG1-CD2 3.99Å; V180-L592 HydrophobicContact CG1-CG 4.47Å; V180-L592 HydrophobicContact CG2-CD2 4.2Å; V180-L592 HydrophobicContact CG2-CG 4.09Å; V180-K595 HydrophobicContact CG1-CB 3.92Å; V180-K595 HydrophobicContact CG1-CD 3.44Å; V180-K595 VanDerWaalsContact CG1-CD 3.44Å; V180-K595 HydrophobicContact CG1-CG 4.28Å; V180-K595 PolarHBondContact O-NZ 2.98Å
181	I	95.9	Very high	91.7	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.026	28%	0.279	C	S	.	.	S	Bend	trans	-70	132.3	179.5	-53.8	171.2	0	0	0	109.2	I162 C165 I176 E178 T183 L197	I162-I181 HydrophobicContact CG1-CG2 4.17Å; C165-I181 HydrophobicContact CB-CD1 3.63Å; C165-I181 HydrophobicContact CB-CG1 4.12Å; I176-I181 HydrophobicContact CG2-CD1 4.19Å; I176-I181 HydrophobicContact CG2-CG1 4.11Å; E178-I181 HydrophobicContact CB-CD1 4.12Å; E178-I181 HydrophobicContact CG-CD1 4.22Å; E178-I181 WeakPolarHBondContact O-CB 3.46Å; E178-I181 PolarHBondContact O-N 3.16Å; I181-T183 HydrophobicContact CB-CG2 4.25Å; I181-T183 HydrophobicContact CG2-CG2 3.87Å; I181-T183 PolarHBondContact O-N 2.99Å; I181-L197 HydrophobicContact CG1-CD2 4.11Å
182	N	94.4	Very high	91.6	Very high	21 Å²	21	63 Å²	63	11%	0.112	30%	0.302	C	S	.	.			trans	-78.4	113.2	169.8	-59.9	-43.8	0	0	0	107.9	L186 T190 E193 N194 K595	N182-L186 HydrophobicContact CB-CD2 4.15Å; N182-L186 VanDerWaalsContact O-CD2 3.31Å; N182-L186 WeakPolarHBondContact O-CD2 3.38Å; N182-T190 WeakPolarHBondContact ND2-CB 3.34Å; N182-T190 PolarHBondContact ND2-O 3.14Å; N182-E193 PolarHBondContact ND2-OE2 3.42Å; N182-N194 WeakPolarHBondContact CB-OD1 3.42Å; N182-N194 PolarHBondContact N-OD1 3.06Å; N182-N194 PolarHBondContact O-ND2 2.82Å; N182-K595 VanDerWaalsContact CG-NZ 3.28Å; N182-K595 WeakPolarHBondContact ND2-CE 3.34Å; N182-K595 PolarHBondContact ND2-NZ 3.19Å; N182-K595 VanDerWaalsContact ND2-NZ 3.16Å; N182-K595 PolarHBondContact OD1-NZ 3.16Å
183	T	91.7	Very high	91.7	Very high	41 Å²	41	63.3 Å²	63.3	25%	0.252	30%	0.303	S	S	.	.			trans	-114.2	-5.8	-177.2	59.1	0	0	0	0	114	D140 I162 I181	D140-T183 HydrophobicContact CB-CG2 4Å; I162-T183 HydrophobicContact CD1-CG2 4.47Å; I181-T183 HydrophobicContact CB-CG2 4.25Å; I181-T183 HydrophobicContact CG2-CG2 3.87Å; I181-T183 PolarHBondContact O-N 2.99Å
184	K	86.8	Confident	91.8	Very high	179 Å²	179	58.8 Å²	58.8	78%	0.778	27%	0.273	S	S	*	.	S	Bend	trans	-132	143.1	-175.9	-61.3	-178.3	-177.4	178.3	0	110.7
185	K	80.1	Confident	92	Very high	202 Å²	202	53.6 Å²	53.6	88%	0.878	25%	0.246	S	C	*	.	S	Bend	trans	49	63.5	176.8	-62.4	-175.6	177.6	-175.3	0	112.4	T187	K185-T187 PolarHBondContact O-N 2.62Å
186	L	85.9	Confident	92	Very high	33 Å²	33	54.4 Å²	54.4	17%	0.173	25%	0.251	C	S	.	.			trans	-76.8	99.8	-172.1	-68.3	168	0	0	0	112.6	D160 I162 N182 T190 R191	D160-L186 HydrophobicContact CB-CD1 3.62Å; I162-L186 HydrophobicContact CD1-CD1 3.96Å; N182-L186 HydrophobicContact CB-CD2 4.15Å; N182-L186 VanDerWaalsContact O-CD2 3.31Å; N182-L186 WeakPolarHBondContact O-CD2 3.38Å; L186-T190 WeakPolarHBondContact CA-OG1 3.42Å; L186-R191 HydrophobicContact CB-CG 4.01Å; L186-R191 PolarHBondContact O-NE 2.91Å; L186-R191 PolarHBondContact O-NH2 3.33Å; L186-R191 VanDerWaalsContact O-NH2 3.11Å
187	T	88.3	Confident	92	Very high	37 Å²	37	54.1 Å²	54.1	23%	0.227	25%	0.249	C	C	.	.			trans	-77	165	166.4	70.6	0	0	0	0	111.8	K185 F189 T190 R191	K185-T187 PolarHBondContact O-N 2.62Å; T187-F189 PolarHBondContact O-N 3.3Å; T187-F189 VanDerWaalsContact O-N 3.17Å; T187-T190 PolarHBondContact N-OG1 2.87Å; T187-T190 PolarHBondContact O-N 3.4Å; T187-T190 PolarHBondContact O-OG1 3.35Å; T187-T190 PolarHBondContact OG1-N 2.82Å; T187-T190 PolarHBondContact OG1-OG1 3.23Å; T187-R191 WeakPolarHBondContact O-CG 3.37Å; T187-R191 PolarHBondContact O-N 3.32Å
188	T	86.7	Confident	92	Very high	57 Å²	57	53.3 Å²	53.3	35%	0.35	25%	0.245	S	C	.	.	H	α-helix	trans	-54	-35.9	175.6	-68.3	0	0	0	0	112.7	D15 R192 M218	D15-T188 PolarHBondContact OD2-OG1 2.57Å; T188-R192 PolarHBondContact O-N 3.32Å; T188-M218 HydrophobicContact CG2-CE 3.73Å; T188-M218 WeakPolarHBondContact O-CE 3.23Å
189	F	85.9	Confident	92.1	Very high	74 Å²	74	50.1 Å²	50.1	33%	0.325	23%	0.23	S	C	.	.	H	α-helix	trans	-69.2	-48.1	176.8	-66.5	-78.6	0	0	0	112.9	E18 K22 T187 R191 R192 E193	E18-F189 WeakPolarHBondContact OE1-CD2 3.32Å; K22-F189 HydrophobicContact CD-CE2 4.44Å; K22-F189 HydrophobicContact CD-CZ 4.12Å; K22-F189 VanDerWaalsContact NZ-CZ 3.28Å; T187-F189 PolarHBondContact O-N 3.3Å; T187-F189 VanDerWaalsContact O-N 3.17Å; F189-R191 VanDerWaalsContact C-N 3.32Å; F189-R191 PolarHBondContact O-N 3.06Å; F189-R192 WeakPolarHBondContact O-CB 3.5Å; F189-R192 PolarHBondContact O-N 3.16Å; F189-R192 VanDerWaalsContact O-N 3.12Å; F189-E193 WeakPolarHBondContact O-CG 3.38Å; F189-E193 PolarHBondContact O-N 3.44Å
190	T	89.7	Confident	92.1	Very high	28 Å²	28	47.4 Å²	47.4	17%	0.172	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-31.6	-178.7	56.7	0	0	0	0	112.9	N182 L186 T187 E193 N194	N182-T190 WeakPolarHBondContact ND2-CB 3.34Å; N182-T190 PolarHBondContact ND2-O 3.14Å; L186-T190 WeakPolarHBondContact CA-OG1 3.42Å; T187-T190 PolarHBondContact N-OG1 2.87Å; T187-T190 PolarHBondContact O-N 3.4Å; T187-T190 PolarHBondContact O-OG1 3.35Å; T187-T190 PolarHBondContact OG1-N 2.82Å; T187-T190 PolarHBondContact OG1-OG1 3.23Å; T190-E193 PolarHBondContact O-N 3.48Å; T190-N194 PolarHBondContact O-N 3.31Å; T190-N194 VanDerWaalsContact O-N 3.11Å
191	R	92.1	Very high	92.2	Very high	78 Å²	78	47.3 Å²	47.3	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-63.1	-45.2	169.5	-66.6	178.1	-166	173	4.5	111.2	D160 L186 T187 F189 E193 N194 I195 M218	D160-R191 HydrophobicContact CB-CG 4.07Å; L186-R191 HydrophobicContact CB-CG 4.01Å; L186-R191 PolarHBondContact O-NE 2.91Å; L186-R191 PolarHBondContact O-NH2 3.33Å; L186-R191 VanDerWaalsContact O-NH2 3.11Å; T187-R191 WeakPolarHBondContact O-CG 3.37Å; T187-R191 PolarHBondContact O-N 3.32Å; F189-R191 VanDerWaalsContact C-N 3.32Å; F189-R191 PolarHBondContact O-N 3.06Å; R191-E193 VanDerWaalsContact C-N 3.34Å; R191-E193 PolarHBondContact O-N 3.48Å; R191-N194 PolarHBondContact O-N 2.89Å; R191-I195 WeakPolarHBondContact O-CG1 3.03Å; R191-I195 PolarHBondContact O-N 3.36Å; R191-M218 HydrophobicContact CB-CE 4.34Å
192	R	92.9	Very high	92.2	Very high	138 Å²	138	47 Å²	47	52%	0.521	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-43.8	175.9	-176.8	-178.3	175.3	-176.9	-0.2	111.6	T188 F189 I195 V196 A214 M218	T188-R192 PolarHBondContact O-N 3.32Å; F189-R192 WeakPolarHBondContact O-CB 3.5Å; F189-R192 PolarHBondContact O-N 3.16Å; F189-R192 VanDerWaalsContact O-N 3.12Å; R192-I195 PolarHBondContact O-N 2.98Å; R192-V196 HydrophobicContact CG-CG2 4.39Å; R192-V196 VanDerWaalsContact O-CG2 3.29Å; R192-V196 WeakPolarHBondContact O-CG2 3.37Å; R192-V196 PolarHBondContact O-N 3.1Å; R192-A214 HydrophobicContact CG-CB 4.3Å; R192-M218 HydrophobicContact CB-CE 4.39Å; R192-M218 HydrophobicContact CB-SD 3.78Å; R192-M218 HydrophobicContact CG-SD 4.21Å
193	E	94.1	Very high	92.2	Very high	42 Å²	42	46.4 Å²	46.4	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-43.7	176.9	-70.9	172.3	-179	0	0	112.6	N182 F189 T190 R191 I195 V196 L197 M563 K595	N182-E193 PolarHBondContact ND2-OE2 3.42Å; F189-E193 WeakPolarHBondContact O-CG 3.38Å; F189-E193 PolarHBondContact O-N 3.44Å; T190-E193 PolarHBondContact O-N 3.48Å; R191-E193 VanDerWaalsContact C-N 3.34Å; R191-E193 PolarHBondContact O-N 3.48Å; E193-I195 VanDerWaalsContact C-N 3.34Å; E193-I195 PolarHBondContact O-N 3.08Å; E193-V196 PolarHBondContact O-N 2.67Å; E193-L197 WeakPolarHBondContact O-CB 3.27Å; E193-L197 PolarHBondContact O-N 3.49Å; E193-M563 WeakPolarHBondContact OE1-CE 3.28Å; E193-K595 HydrophobicContact CB-CD 4.45Å; E193-K595 HydrophobicContact CB-CG 4.05Å; E193-K595 WeakPolarHBondContact OE2-CE 3.46Å; E193-K595 IonicContact OE2-NZ 2.69Å
194	N	96.5	Very high	92.3	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-43	175.2	-75.5	-10.1	0	0	0	111.5	D160 C165 N182 T190 R191 L197 A198	D160-N194 WeakPolarHBondContact O-CB 3.34Å; D160-N194 PolarHBondContact O-ND2 3.38Å; C165-N194 PolarHBondContact SG-O 3.21Å; N182-N194 WeakPolarHBondContact CB-OD1 3.42Å; N182-N194 PolarHBondContact N-OD1 3.06Å; N182-N194 PolarHBondContact O-ND2 2.82Å; T190-N194 PolarHBondContact O-N 3.31Å; T190-N194 VanDerWaalsContact O-N 3.11Å; R191-N194 PolarHBondContact O-N 2.89Å; N194-L197 WeakPolarHBondContact O-CB 3.46Å; N194-L197 PolarHBondContact O-N 2.93Å; N194-A198 WeakPolarHBondContact O-CB 3.41Å; N194-A198 PolarHBondContact O-N 3.38Å
195	I	96.3	Very high	92.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66.6	-40.5	177.9	-71.9	169.8	0	0	0	111.4	R159 R191 R192 E193 L197 A198 L199 A214 L217 M218	R159-I195 VanDerWaalsContact O-CD1 3.32Å; R159-I195 WeakPolarHBondContact O-CD1 3.32Å; R191-I195 WeakPolarHBondContact O-CG1 3.03Å; R191-I195 PolarHBondContact O-N 3.36Å; R192-I195 PolarHBondContact O-N 2.98Å; E193-I195 VanDerWaalsContact C-N 3.34Å; E193-I195 PolarHBondContact O-N 3.08Å; I195-L197 VanDerWaalsContact C-N 3.34Å; I195-A198 PolarHBondContact O-N 3.3Å; I195-L199 HydrophobicContact CG2-CD1 3.99Å; I195-L199 HydrophobicContact CG2-CG 4.3Å; I195-L199 WeakPolarHBondContact O-CB 3.37Å; I195-L199 WeakPolarHBondContact O-CG 3.48Å; I195-L199 PolarHBondContact O-N 2.98Å; I195-A214 HydrophobicContact CB-CB 4.47Å; I195-A214 HydrophobicContact CG2-CB 3.74Å; I195-L217 HydrophobicContact CD1-CB 4.22Å; I195-L217 HydrophobicContact CG2-CB 3.94Å; I195-L217 HydrophobicContact CG2-CD1 3.77Å; I195-L217 HydrophobicContact CG2-CG 4.43Å; I195-M218 HydrophobicContact CD1-CB 4.31Å; I195-M218 HydrophobicContact CD1-CG 3.3Å
196	V	95.6	Very high	93.3	Very high	28 Å²	28	26.9 Å²	26.9	17%	0.17	13%	0.13	C	C	.	.	H	α-helix	trans	-62.8	-42.9	175.1	169.8	0	0	0	0	110.8	R192 E193 L199 N200 A214 K595	R192-V196 HydrophobicContact CG-CG2 4.39Å; R192-V196 VanDerWaalsContact O-CG2 3.29Å; R192-V196 WeakPolarHBondContact O-CG2 3.37Å; R192-V196 PolarHBondContact O-N 3.1Å; E193-V196 PolarHBondContact O-N 2.67Å; V196-L199 PolarHBondContact O-N 3.27Å; V196-N200 WeakPolarHBondContact O-CB 3.42Å; V196-N200 PolarHBondContact O-N 3.34Å; V196-N200 PolarHBondContact O-ND2 2.84Å; V196-A214 HydrophobicContact CG2-CB 3.95Å; V196-K595 WeakPolarHBondContact CG1-O 3.37Å
197	L	97.3	Very high	93.6	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-57.3	-48.9	172.3	174.6	60.4	0	0	0	111.3	I176 V180 I181 E193 N194 I195 S201 S591 R594 K595	I176-L197 HydrophobicContact CD1-CG 4.38Å; I176-L197 HydrophobicContact CG2-CD1 4.32Å; I176-L197 HydrophobicContact CG2-CD2 3.87Å; I176-L197 HydrophobicContact CG2-CG 4.23Å; V180-L197 HydrophobicContact CG1-CD2 4.09Å; I181-L197 HydrophobicContact CG1-CD2 4.11Å; E193-L197 WeakPolarHBondContact O-CB 3.27Å; E193-L197 PolarHBondContact O-N 3.49Å; N194-L197 WeakPolarHBondContact O-CB 3.46Å; N194-L197 PolarHBondContact O-N 2.93Å; I195-L197 VanDerWaalsContact C-N 3.34Å; L197-S201 WeakPolarHBondContact O-CB 3.25Å; L197-S201 PolarHBondContact O-N 3.44Å; L197-S201 PolarHBondContact O-OG 2.84Å; L197-S591 WeakPolarHBondContact CD1-O 3.33Å; L197-R594 HydrophobicContact CD1-CB 3.92Å; L197-K595 HydrophobicContact CB-CB 4.16Å; L197-K595 HydrophobicContact CB-CG 4.42Å; L197-K595 HydrophobicContact CD1-CB 4.25Å
198	A	97.6	Very high	93.8	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-60.9	-48.6	178.3	0	0	0	0	0	111.9	L164 I168 N194 I195 N200 S201 A202	L164-A198 HydrophobicContact CB-CB 3.77Å; I168-A198 HydrophobicContact CD1-CB 4.08Å; I168-A198 WeakPolarHBondContact CD1-O 3.5Å; N194-A198 WeakPolarHBondContact O-CB 3.41Å; N194-A198 PolarHBondContact O-N 3.38Å; I195-A198 PolarHBondContact O-N 3.3Å; A198-N200 PolarHBondContact O-N 2.87Å; A198-S201 PolarHBondContact O-N 2.99Å; A198-A202 VanDerWaalsContact O-CB 3.29Å; A198-A202 WeakPolarHBondContact O-CB 3.39Å; A198-A202 PolarHBondContact O-N 3.36Å
199	L	96.1	Very high	93.6	Very high	13 Å²	13	23.5 Å²	23.5	7%	0.068	11%	0.111	C	C	.	.	H	α-helix	trans	-61.2	-47.3	-179.9	-75.3	173.6	0	0	0	112.3	I195 V196 S201 A202 S203 V209 I212 A214 L217 L228	I195-L199 HydrophobicContact CG2-CD1 3.99Å; I195-L199 HydrophobicContact CG2-CG 4.3Å; I195-L199 WeakPolarHBondContact O-CB 3.37Å; I195-L199 WeakPolarHBondContact O-CG 3.48Å; I195-L199 PolarHBondContact O-N 2.98Å; V196-L199 PolarHBondContact O-N 3.27Å; L199-S201 VanDerWaalsContact C-N 3.29Å; L199-S201 PolarHBondContact O-N 3.16Å; L199-A202 PolarHBondContact O-N 2.88Å; L199-S203 WeakPolarHBondContact O-CB 3.19Å; L199-S203 PolarHBondContact O-N 3.33Å; L199-V209 HydrophobicContact CD2-CB 4.19Å; L199-V209 HydrophobicContact CD2-CG1 4.14Å; L199-I212 HydrophobicContact CD2-CB 4.13Å; L199-I212 HydrophobicContact CD2-CG2 3.86Å; L199-A214 HydrophobicContact CD1-CB 4.34Å; L199-L217 HydrophobicContact CD1-CD1 4.18Å; L199-L217 HydrophobicContact CD2-CD1 3.66Å; L199-L217 HydrophobicContact CG-CD1 3.94Å; L199-L228 HydrophobicContact CD2-CD2 4.07Å
200	N	95.4	Very high	93	Very high	16 Å²	16	24.2 Å²	24.2	9%	0.086	12%	0.121	C	C	.	.	H	α-helix	trans	-67.8	-32	179	-75.2	-32.9	0	0	0	112.1	V196 A198 S203 A204 R594 G597	V196-N200 WeakPolarHBondContact O-CB 3.42Å; V196-N200 PolarHBondContact O-N 3.34Å; V196-N200 PolarHBondContact O-ND2 2.84Å; A198-N200 PolarHBondContact O-N 2.87Å; N200-S203 WeakPolarHBondContact O-CB 3.49Å; N200-A204 PolarHBondContact O-N 3.05Å; N200-A204 VanDerWaalsContact O-N 3.08Å; N200-R594 HydrophobicContact CB-CB 3.85Å; N200-R594 HydrophobicContact CB-CG 4.04Å; N200-R594 PolarHBondContact ND2-O 3.45Å; N200-G597 WeakPolarHBondContact ND2-CA 3.39Å
201	S	97.1	Very high	92.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-76	-39.4	176.9	-57.1	0	0	0	0	112	I176 L197 A198 L199 S203 A204 I205 R594	I176-S201 VanDerWaalsContact CG1-OG 3.31Å; I176-S201 WeakPolarHBondContact CG1-OG 3.43Å; L197-S201 WeakPolarHBondContact O-CB 3.25Å; L197-S201 PolarHBondContact O-N 3.44Å; L197-S201 PolarHBondContact O-OG 2.84Å; A198-S201 PolarHBondContact O-N 2.99Å; L199-S201 VanDerWaalsContact C-N 3.29Å; L199-S201 PolarHBondContact O-N 3.16Å; S201-S203 VanDerWaalsContact C-N 3.3Å; S201-S203 PolarHBondContact O-N 3.32Å; S201-A204 WeakPolarHBondContact O-CB 3.44Å; S201-A204 PolarHBondContact O-N 3.19Å; S201-A204 VanDerWaalsContact O-N 3.1Å; S201-I205 PolarHBondContact O-N 3.38Å; S201-R594 WeakPolarHBondContact OG-CD 3.44Å
202	A	96.6	Very high	91.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.4	-42.2	170.4	0	0	0	0	0	111	I168 A198 L199 A204 I205 G206 C207 V209 L228 I232	I168-A202 HydrophobicContact CD1-CB 4.05Å; A198-A202 VanDerWaalsContact O-CB 3.29Å; A198-A202 WeakPolarHBondContact O-CB 3.39Å; A198-A202 PolarHBondContact O-N 3.36Å; L199-A202 PolarHBondContact O-N 2.88Å; A202-A204 VanDerWaalsContact C-N 3.32Å; A202-A204 PolarHBondContact O-N 3.45Å; A202-I205 WeakPolarHBondContact O-CG1 3.41Å; A202-I205 PolarHBondContact O-N 3.38Å; A202-G206 PolarHBondContact O-N 3.14Å; A202-C207 HydrophobicContact CB-CB 4.01Å; A202-C207 WeakPolarHBondContact O-CB 3.35Å; A202-C207 PolarHBondContact O-N 3.44Å; A202-C207 PolarHBondContact O-SG 3.23Å; A202-V209 HydrophobicContact CB-CG1 4.11Å; A202-L228 HydrophobicContact CB-CD1 4.07Å; A202-I232 HydrophobicContact CB-CG1 4.47Å
203	S	94.3	Very high	91.3	Very high	7 Å²	7	22.9 Å²	22.9	5%	0.049	14%	0.136	C	C	.	.	H	α-helix	trans	-58.8	-42.7	172.7	-166.4	0	0	0	0	111.9	L199 N200 S201 I205 G206 S406 Y601	L199-S203 WeakPolarHBondContact O-CB 3.19Å; L199-S203 PolarHBondContact O-N 3.33Å; N200-S203 WeakPolarHBondContact O-CB 3.49Å; S201-S203 VanDerWaalsContact C-N 3.3Å; S201-S203 PolarHBondContact O-N 3.32Å; S203-I205 PolarHBondContact O-N 3.3Å; S203-G206 PolarHBondContact O-N 3.42Å; S203-S406 WeakPolarHBondContact O-CB 3.46Å; S203-S406 WeakPolarHBondContact OG-CB 3.48Å; S203-Y601 WeakPolarHBondContact O-CE1 3.43Å; S203-Y601 PolarHBondContact OG-OH 3.01Å
204	A	93.6	Very high	91	Very high	10 Å²	10	21.6 Å²	21.6	8%	0.083	13%	0.132	C	C	.	.	H	α-helix	trans	-67.8	-21.7	-178.6	0	0	0	0	0	113.9	N200 S201 A202 N402 R594	N200-A204 PolarHBondContact O-N 3.05Å; N200-A204 VanDerWaalsContact O-N 3.08Å; S201-A204 WeakPolarHBondContact O-CB 3.44Å; S201-A204 PolarHBondContact O-N 3.19Å; S201-A204 VanDerWaalsContact O-N 3.1Å; A202-A204 VanDerWaalsContact C-N 3.32Å; A202-A204 PolarHBondContact O-N 3.45Å; A204-N402 WeakPolarHBondContact O-CB 3.46Å; A204-N402 PolarHBondContact O-ND2 3.28Å; A204-R594 VanDerWaalsContact CB-NH2 3.28Å
205	I	94.2	Very high	90.5	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	9.2	172.8	68.4	170.3	0	0	0	112.9	I168 Q172 T175 S201 A202 S203 V235	I168-I205 HydrophobicContact CG2-CD1 4.31Å; Q172-I205 HydrophobicContact CB-CG2 4.05Å; Q172-I205 HydrophobicContact CG-CG2 4.33Å; T175-I205 HydrophobicContact CG2-CG2 3.67Å; S201-I205 PolarHBondContact O-N 3.38Å; A202-I205 WeakPolarHBondContact O-CG1 3.41Å; A202-I205 PolarHBondContact O-N 3.38Å; S203-I205 PolarHBondContact O-N 3.3Å; I205-V235 HydrophobicContact CB-CG1 4.44Å; I205-V235 HydrophobicContact CD1-CB 4.36Å; I205-V235 HydrophobicContact CD1-CG1 4.06Å; I205-V235 HydrophobicContact CD1-CG2 4.48Å
206	G	92.4	Very high	90.2	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	21.8	175.1	0	0	0	0	0	115.4	A202 S203 N402 R412	A202-G206 PolarHBondContact O-N 3.14Å; S203-G206 PolarHBondContact O-N 3.42Å; G206-N402 WeakPolarHBondContact CA-O 3.13Å; G206-R412 PolarHBondContact O-NH1 3.16Å; G206-R412 PolarHBondContact O-NH2 3Å
207	C	93.8	Very high	89.9	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.007	16%	0.161	C	C	.	.			trans	-79.1	140.8	166.2	-58.2	0	0	0	0	110.3	A202 V209 Q231 S406	A202-C207 HydrophobicContact CB-CB 4.01Å; A202-C207 WeakPolarHBondContact O-CB 3.35Å; A202-C207 PolarHBondContact O-N 3.44Å; A202-C207 PolarHBondContact O-SG 3.23Å; C207-V209 HydrophobicContact CB-CG1 4.3Å; C207-V209 PolarHBondContact O-N 3.25Å; C207-Q231 HydrophobicContact CB-CB 4.17Å; C207-S406 WeakPolarHBondContact O-CA 3.45Å
208	T	91.1	Very high	89.4	Confident	39 Å²	39	29.9 Å²	29.9	24%	0.239	17%	0.17	C	C	.	.			trans	-83.8	103.5	174.9	-51.2	0	0	0	0	109.4	Q231 N405	T208-Q231 PolarHBondContact O-NE2 3.46Å; T208-N405 PolarHBondContact OG1-O 3.17Å
209	V	83.4	Confident	89	Confident	17 Å²	17	32 Å²	32	10%	0.103	19%	0.188	C	C	.	.			trans	-113.2	7.9	-178.3	-60.6	0	0	0	0	113.6	L199 A202 C207 S211 I212 L228	L199-V209 HydrophobicContact CD2-CB 4.19Å; L199-V209 HydrophobicContact CD2-CG1 4.14Å; A202-V209 HydrophobicContact CB-CG1 4.11Å; C207-V209 HydrophobicContact CB-CG1 4.3Å; C207-V209 PolarHBondContact O-N 3.25Å; V209-S211 PolarHBondContact O-N 3.01Å; V209-S211 VanDerWaalsContact O-N 3.11Å; V209-I212 PolarHBondContact O-N 3.3Å; V209-L228 HydrophobicContact CG1-CD1 4Å
210	V	72.3	Confident	88.7	Confident	88 Å²	88	31.6 Å²	31.6	53%	0.533	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.7	-172.6	-177.8	0	0	0	0	113	S406	V210-S406 WeakPolarHBondContact CG2-O 3.24Å
211	S	72.7	Confident	88.4	Confident	91 Å²	91	35 Å²	35	64%	0.636	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	9.8	-179.8	58	0	0	0	0	114.1	V209	V209-S211 PolarHBondContact O-N 3.01Å; V209-S211 VanDerWaalsContact O-N 3.11Å
212	I	83.3	Confident	88.1	Confident	13 Å²	13	36.6 Å²	36.6	7%	0.067	21%	0.211	C	C	.	.			trans	-119.6	112.8	-174.8	-50.3	179.5	0	0	0	109.6	L199 V209 L217 L224 L228	L199-I212 HydrophobicContact CD2-CB 4.13Å; L199-I212 HydrophobicContact CD2-CG2 3.86Å; V209-I212 PolarHBondContact O-N 3.3Å; I212-L217 HydrophobicContact CG2-CD1 3.89Å; I212-L217 HydrophobicContact CG2-CD2 3.93Å; I212-L217 HydrophobicContact CG2-CG 3.69Å; I212-L224 HydrophobicContact CG1-CD2 4.33Å; I212-L228 HydrophobicContact CD1-CB 4.08Å
213	D	84.1	Confident	87.7	Confident	113 Å²	113	39.9 Å²	39.9	60%	0.604	23%	0.226	S	C	*	.			trans	-91.9	153.3	172.5	-77.9	-42.2	0	0	0	111.8	H215 D216 L217	D213-H215 PolarHBondContact O-N 2.9Å; D213-D216 PolarHBondContact N-OD2 3.27Å; D213-D216 WeakPolarHBondContact O-CB 3.24Å; D213-D216 PolarHBondContact O-N 3.5Å; D213-L217 PolarHBondContact O-N 2.9Å
214	A	87.4	Confident	87.5	Confident	14 Å²	14	40.7 Å²	40.7	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-57.8	-34.2	178.3	0	0	0	0	0	112.2	R192 I195 V196 L199 D216 L217 M218	R192-A214 HydrophobicContact CG-CB 4.3Å; I195-A214 HydrophobicContact CB-CB 4.47Å; I195-A214 HydrophobicContact CG2-CB 3.74Å; V196-A214 HydrophobicContact CG2-CB 3.95Å; L199-A214 HydrophobicContact CD1-CB 4.34Å; A214-D216 VanDerWaalsContact C-N 3.31Å; A214-D216 PolarHBondContact O-N 3.23Å; A214-L217 PolarHBondContact O-N 3.49Å; A214-M218 VanDerWaalsContact O-CG 3.29Å; A214-M218 WeakPolarHBondContact O-CG 3.45Å; A214-M218 PolarHBondContact O-N 3.03Å
215	H	87.1	Confident	87.5	Confident	141 Å²	141	40.4 Å²	40.4	65%	0.653	23%	0.227	S	C	*	.	H	α-helix	trans	-64.2	-35.4	176.7	-174.5	63.7	0	0	0	112.6	D213 L217 M218 A219	D213-H215 PolarHBondContact O-N 2.9Å; H215-L217 VanDerWaalsContact C-N 3.35Å; H215-L217 PolarHBondContact O-N 2.9Å; H215-M218 PolarHBondContact O-N 3.31Å; H215-A219 WeakPolarHBondContact O-CB 3.37Å; H215-A219 PolarHBondContact O-N 2.91Å
216	D	88.1	Confident	87.5	Confident	21 Å²	21	40.5 Å²	40.5	11%	0.112	23%	0.228	C	C	.	.	H	α-helix	trans	-66.4	-38.6	179.2	-67.2	-39	0	0	0	112.3	D213 A214 A219 G220 K221 L224	D213-D216 PolarHBondContact N-OD2 3.27Å; D213-D216 WeakPolarHBondContact O-CB 3.24Å; D213-D216 PolarHBondContact O-N 3.5Å; A214-D216 VanDerWaalsContact C-N 3.31Å; A214-D216 PolarHBondContact O-N 3.23Å; D216-A219 PolarHBondContact O-N 2.9Å; D216-G220 PolarHBondContact O-N 3.35Å; D216-K221 HydrophobicContact CB-CD 3.98Å; D216-K221 PolarHBondContact O-N 2.89Å; D216-K221 VanDerWaalsContact O-N 3.12Å; D216-K221 VanDerWaalsContact OD1-CE 3.27Å; D216-K221 WeakPolarHBondContact OD1-CE 3.34Å; D216-K221 IonicContact OD1-NZ 2.76Å; D216-K221 PolarHBondContact OD1-NZ 2.95Å; D216-L224 HydrophobicContact CB-CD1 3.53Å
217	L	89.5	Confident	87.5	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-74.3	-37.2	176	-65.7	-178.8	0	0	0	111.9	L164 I195 L199 I212 D213 A214 H215 A219 G220 V225 L228	L164-L217 HydrophobicContact CD1-CD1 4.14Å; I195-L217 HydrophobicContact CD1-CB 4.22Å; I195-L217 HydrophobicContact CG2-CB 3.94Å; I195-L217 HydrophobicContact CG2-CD1 3.77Å; I195-L217 HydrophobicContact CG2-CG 4.43Å; L199-L217 HydrophobicContact CD1-CD1 4.18Å; L199-L217 HydrophobicContact CD2-CD1 3.66Å; L199-L217 HydrophobicContact CG-CD1 3.94Å; I212-L217 HydrophobicContact CG2-CD1 3.89Å; I212-L217 HydrophobicContact CG2-CD2 3.93Å; I212-L217 HydrophobicContact CG2-CG 3.69Å; D213-L217 PolarHBondContact O-N 2.9Å; A214-L217 PolarHBondContact O-N 3.49Å; H215-L217 VanDerWaalsContact C-N 3.35Å; H215-L217 PolarHBondContact O-N 2.9Å; L217-A219 VanDerWaalsContact C-N 3.27Å; L217-A219 PolarHBondContact O-N 3.24Å; L217-G220 WeakPolarHBondContact O-CA 3.24Å; L217-G220 PolarHBondContact O-N 2.88Å; L217-V225 HydrophobicContact CD2-CG2 3.8Å; L217-L228 HydrophobicContact CD1-CD2 3.74Å; L217-L228 HydrophobicContact CD2-CD2 4.34Å
218	M	88.4	Confident	87.5	Confident	38 Å²	38	41.9 Å²	41.9	19%	0.187	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-34.9	171.8	-71.4	178.6	76.7	0	0	112.2	R159 T188 R191 R192 I195 A214 H215 G220	R159-M218 VanDerWaalsContact CD-O 3.23Å; R159-M218 WeakPolarHBondContact CD-O 3.43Å; R159-M218 VanDerWaalsContact CG-O 3.31Å; R159-M218 WeakPolarHBondContact CG-O 3.41Å; R159-M218 PolarHBondContact NE-O 2.86Å; T188-M218 HydrophobicContact CG2-CE 3.73Å; T188-M218 WeakPolarHBondContact O-CE 3.23Å; R191-M218 HydrophobicContact CB-CE 4.34Å; R192-M218 HydrophobicContact CB-CE 4.39Å; R192-M218 HydrophobicContact CB-SD 3.78Å; R192-M218 HydrophobicContact CG-SD 4.21Å; I195-M218 HydrophobicContact CD1-CB 4.31Å; I195-M218 HydrophobicContact CD1-CG 3.3Å; A214-M218 VanDerWaalsContact O-CG 3.29Å; A214-M218 WeakPolarHBondContact O-CG 3.45Å; A214-M218 PolarHBondContact O-N 3.03Å; H215-M218 PolarHBondContact O-N 3.31Å; M218-G220 PolarHBondContact O-N 3.13Å
219	A	88.1	Confident	87.7	Confident	45 Å²	45	40 Å²	40	37%	0.372	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-18.3	172.5	0	0	0	0	0	112.6	R159 H215 D216 L217 K221	R159-A219 PolarHBondContact NH2-O 3Å; H215-A219 WeakPolarHBondContact O-CB 3.37Å; H215-A219 PolarHBondContact O-N 2.91Å; D216-A219 PolarHBondContact O-N 2.9Å; L217-A219 VanDerWaalsContact C-N 3.27Å; L217-A219 PolarHBondContact O-N 3.24Å; A219-K221 HydrophobicContact CB-CG 4.44Å
220	G	89.1	Confident	88.3	Confident	5 Å²	5	40.8 Å²	40.8	5%	0.052	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	40.1	-177.6	0	0	0	0	0	113	D216 L217 M218 P222	D216-G220 PolarHBondContact O-N 3.35Å; L217-G220 WeakPolarHBondContact O-CA 3.24Å; L217-G220 PolarHBondContact O-N 2.88Å; M218-G220 PolarHBondContact O-N 3.13Å; G220-P222 VanDerWaalsContact O-CD 3.23Å; G220-P222 WeakPolarHBondContact O-CD 3.44Å
221	K	90.3	Very high	89.3	Confident	87 Å²	87	38.7 Å²	38.7	38%	0.378	22%	0.216	S	C	.	.			trans	-61.4	114.8	179.4	-73.4	-175.8	179.1	174.2	0	110.9	D216 A219 H223 L224 V225	D216-K221 HydrophobicContact CB-CD 3.98Å; D216-K221 PolarHBondContact O-N 2.89Å; D216-K221 VanDerWaalsContact O-N 3.12Å; D216-K221 VanDerWaalsContact OD1-CE 3.27Å; D216-K221 WeakPolarHBondContact OD1-CE 3.34Å; D216-K221 IonicContact OD1-NZ 2.76Å; D216-K221 PolarHBondContact OD1-NZ 2.95Å; A219-K221 HydrophobicContact CB-CG 4.44Å; K221-H223 PolarHBondContact O-N 3.05Å; K221-L224 HydrophobicContact CB-CB 4.43Å; K221-L224 HydrophobicContact CB-CD1 4.09Å; K221-L224 HydrophobicContact CB-CG 4.37Å; K221-L224 HydrophobicContact CD-CD1 3.91Å; K221-L224 PolarHBondContact O-N 2.87Å; K221-V225 WeakPolarHBondContact O-CG2 3.34Å; K221-V225 PolarHBondContact O-N 2.86Å
222	P	90.8	Very high	90.4	Very high	34 Å²	34	34.4 Å²	34.4	22%	0.221	19%	0.186	C	C	.	.	H	α-helix	trans	-55.1	-50.2	-166.9	-32.9	38.2	0	0	0	115.5	Y119 F155 G220 L224 V225 L226	Y119-P222 HydrophobicContact CD1-CB 3.4Å; Y119-P222 VanDerWaalsContact CD1-CB 3.4Å; Y119-P222 HydrophobicContact CD1-CG 4Å; Y119-P222 HydrophobicContact CD2-CB 4.26Å; Y119-P222 HydrophobicContact CE1-CB 3.72Å; Y119-P222 HydrophobicContact CE1-CG 3.87Å; Y119-P222 HydrophobicContact CG-CB 3.69Å; F155-P222 HydrophobicContact CD1-CB 4.26Å; F155-P222 HydrophobicContact CD1-CG 4.45Å; F155-P222 HydrophobicContact CD2-CG 4.13Å; F155-P222 HydrophobicContact CE1-CB 3.73Å; F155-P222 HydrophobicContact CE1-CG 4.31Å; F155-P222 HydrophobicContact CE2-CB 3.98Å; F155-P222 HydrophobicContact CE2-CG 3.97Å; F155-P222 HydrophobicContact CG-CG 4.38Å; F155-P222 HydrophobicContact CZ-CB 3.57Å; F155-P222 HydrophobicContact CZ-CG 4.07Å; G220-P222 VanDerWaalsContact O-CD 3.23Å; G220-P222 WeakPolarHBondContact O-CD 3.44Å; P222-L224 VanDerWaalsContact C-N 3.34Å; P222-L224 PolarHBondContact O-N 2.72Å; P222-V225 PolarHBondContact O-N 3.2Å; P222-L226 WeakPolarHBondContact O-CG 3.38Å; P222-L226 PolarHBondContact O-N 3.27Å
223	H	88.2	Confident	91	Very high	68 Å²	68	33.8 Å²	33.8	32%	0.315	18%	0.183	S	C	.	.	H	α-helix	trans	-64.4	-34.6	-176.9	62.3	-82.6	0	0	0	113.3	K221 G227	K221-H223 PolarHBondContact O-N 3.05Å; H223-G227 PolarHBondContact O-N 2.65Å
224	L	90.9	Very high	91.4	Very high	25 Å²	25	30.9 Å²	30.9	13%	0.131	16%	0.164	C	C	.	.	H	α-helix	trans	-74.9	-40.6	177.4	-60.4	176.3	0	0	0	111.1	I212 D216 K221 P222 G227 L228	I212-L224 HydrophobicContact CG1-CD2 4.33Å; D216-L224 HydrophobicContact CB-CD1 3.53Å; K221-L224 HydrophobicContact CB-CB 4.43Å; K221-L224 HydrophobicContact CB-CD1 4.09Å; K221-L224 HydrophobicContact CB-CG 4.37Å; K221-L224 HydrophobicContact CD-CD1 3.91Å; K221-L224 PolarHBondContact O-N 2.87Å; P222-L224 VanDerWaalsContact C-N 3.34Å; P222-L224 PolarHBondContact O-N 2.72Å; L224-G227 PolarHBondContact O-N 2.96Å; L224-L228 WeakPolarHBondContact O-CB 3.45Å; L224-L228 PolarHBondContact O-N 3.25Å
225	V	93.5	Very high	91.7	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.024	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-53.1	176.6	171.2	0	0	0	0	110.8	F155 L158 L217 K221 P222 G227 L228 L229	F155-V225 HydrophobicContact CD1-CB 4.03Å; F155-V225 HydrophobicContact CD1-CG1 3.88Å; F155-V225 HydrophobicContact CD1-CG2 4.45Å; F155-V225 HydrophobicContact CE1-CB 4.39Å; F155-V225 HydrophobicContact CE1-CG1 4.3Å; L158-V225 HydrophobicContact CD1-CG1 3.3Å; L217-V225 HydrophobicContact CD2-CG2 3.8Å; K221-V225 WeakPolarHBondContact O-CG2 3.34Å; K221-V225 PolarHBondContact O-N 2.86Å; P222-V225 PolarHBondContact O-N 3.2Å; V225-G227 VanDerWaalsContact C-N 3.33Å; V225-G227 PolarHBondContact O-N 2.88Å; V225-L228 PolarHBondContact O-N 2.86Å; V225-L229 HydrophobicContact CG1-CD1 4.09Å; V225-L229 HydrophobicContact CG1-CG 4.45Å; V225-L229 WeakPolarHBondContact O-CB 3.43Å; V225-L229 WeakPolarHBondContact O-CG 3.32Å; V225-L229 PolarHBondContact O-N 3.28Å
226	L	92.9	Very high	92	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-39.3	178.5	-65.4	-178.7	0	0	0	111.9	Y119 K124 F127 L154 F155 P222 L228 L229 W230	Y119-L226 HydrophobicContact CD2-CD1 3.86Å; Y119-L226 HydrophobicContact CG-CD1 4.3Å; K124-L226 HydrophobicContact CB-CD1 4.48Å; K124-L226 HydrophobicContact CB-CD2 4.24Å; F127-L226 HydrophobicContact CD2-CD2 3.91Å; F127-L226 HydrophobicContact CE2-CD2 4.4Å; L154-L226 HydrophobicContact CD2-CD2 3.79Å; F155-L226 HydrophobicContact CE1-CD2 4.13Å; F155-L226 HydrophobicContact CE1-CG 4.02Å; F155-L226 HydrophobicContact CZ-CG 4.45Å; P222-L226 WeakPolarHBondContact O-CG 3.38Å; P222-L226 PolarHBondContact O-N 3.27Å; L226-L228 VanDerWaalsContact C-N 3.34Å; L226-L228 PolarHBondContact O-N 2.93Å; L226-L229 HydrophobicContact CD2-CD1 4.4Å; L226-L229 PolarHBondContact O-N 3.18Å; L226-W230 WeakPolarHBondContact O-CB 3.43Å; L226-W230 PolarHBondContact O-N 3.36Å
227	G	92.3	Very high	92.2	Very high	28 Å²	28	25.1 Å²	25.1	29%	0.289	14%	0.142	S	C	.	.	H	α-helix	trans	-61.5	-40	175.9	0	0	0	0	0	112.9	H223 L224 V225 Q231	H223-G227 PolarHBondContact O-N 2.65Å; L224-G227 PolarHBondContact O-N 2.96Å; V225-G227 VanDerWaalsContact C-N 3.33Å; V225-G227 PolarHBondContact O-N 2.88Å; G227-Q231 VanDerWaalsContact O-CG 3.32Å; G227-Q231 WeakPolarHBondContact O-CG 3.28Å; G227-Q231 PolarHBondContact O-N 3.4Å; G227-Q231 PolarHBondContact O-NE2 3.35Å
228	L	94.8	Very high	92.4	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-71.2	-46	175.5	-179.9	59.3	0	0	0	111.9	L164 L199 A202 V209 I212 L217 L224 V225 L226 W230 Q231 I232	L164-L228 HydrophobicContact CD1-CD2 4.36Å; L164-L228 HydrophobicContact CD2-CD2 4.34Å; L199-L228 HydrophobicContact CD2-CD2 4.07Å; A202-L228 HydrophobicContact CB-CD1 4.07Å; V209-L228 HydrophobicContact CG1-CD1 4Å; I212-L228 HydrophobicContact CD1-CB 4.08Å; L217-L228 HydrophobicContact CD1-CD2 3.74Å; L217-L228 HydrophobicContact CD2-CD2 4.34Å; L224-L228 WeakPolarHBondContact O-CB 3.45Å; L224-L228 PolarHBondContact O-N 3.25Å; V225-L228 PolarHBondContact O-N 2.86Å; L226-L228 VanDerWaalsContact C-N 3.34Å; L226-L228 PolarHBondContact O-N 2.93Å; L228-W230 VanDerWaalsContact C-N 3.33Å; L228-W230 PolarHBondContact O-N 3.5Å; L228-Q231 PolarHBondContact O-N 3.3Å; L228-I232 HydrophobicContact CD1-CD1 3.96Å; L228-I232 HydrophobicContact CD1-CG1 4.25Å; L228-I232 HydrophobicContact CG-CD1 3.84Å; L228-I232 WeakPolarHBondContact O-CG1 3.31Å; L228-I232 PolarHBondContact O-N 2.86Å
229	L	95.9	Very high	92.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-56.3	-47.8	176.9	-75.1	175.8	0	0	0	111.3	F127 I131 L154 L158 L164 L167 V225 L226 Q231 I232 I233	F127-L229 HydrophobicContact CB-CD1 4.31Å; F127-L229 HydrophobicContact CD2-CB 3.97Å; F127-L229 HydrophobicContact CD2-CD1 4.25Å; F127-L229 HydrophobicContact CE2-CB 4.44Å; I131-L229 HydrophobicContact CD1-CD1 4.34Å; I131-L229 HydrophobicContact CD1-CD2 4.15Å; L154-L229 HydrophobicContact CD1-CD1 4.28Å; L154-L229 HydrophobicContact CD2-CD1 4.12Å; L158-L229 HydrophobicContact CD1-CD1 3.81Å; L158-L229 HydrophobicContact CD1-CD2 4.19Å; L158-L229 HydrophobicContact CD1-CG 4.22Å; L164-L229 HydrophobicContact CD2-CD2 4.02Å; L167-L229 HydrophobicContact CD1-CD2 3.56Å; V225-L229 HydrophobicContact CG1-CD1 4.09Å; V225-L229 HydrophobicContact CG1-CG 4.45Å; V225-L229 WeakPolarHBondContact O-CB 3.43Å; V225-L229 WeakPolarHBondContact O-CG 3.32Å; V225-L229 PolarHBondContact O-N 3.28Å; L226-L229 HydrophobicContact CD2-CD1 4.4Å; L226-L229 PolarHBondContact O-N 3.18Å; L229-Q231 VanDerWaalsContact C-N 3.32Å; L229-Q231 PolarHBondContact O-N 3.45Å; L229-I232 PolarHBondContact O-N 2.78Å; L229-I233 WeakPolarHBondContact O-CB 3.49Å; L229-I233 VanDerWaalsContact O-CG1 3.24Å; L229-I233 WeakPolarHBondContact O-CG1 3.39Å; L229-I233 PolarHBondContact O-N 3.06Å
230	W	94.4	Very high	92.2	Very high	34 Å²	34	27 Å²	27	13%	0.129	15%	0.149	C	C	.	.	H	α-helix	trans	-57.1	-46.3	177.8	171.6	-119	0	0	0	111.8	F127 L226 L228 I232 I233 K234 K362 A366	F127-W230 AromaticContact CE1-CE3 3.87Å; F127-W230 HydrophobicContact CE1-CE3 3.87Å; F127-W230 HydrophobicContact CE2-CB 3.99Å; F127-W230 HydrophobicContact CZ-CB 3.8Å; F127-W230 HydrophobicContact CZ-CD2 4.33Å; F127-W230 AromaticContact CZ-CE3 3.75Å; F127-W230 HydrophobicContact CZ-CE3 3.75Å; F127-W230 HydrophobicContact CZ-CG 4.38Å; L226-W230 WeakPolarHBondContact O-CB 3.43Å; L226-W230 PolarHBondContact O-N 3.36Å; L228-W230 VanDerWaalsContact C-N 3.33Å; L228-W230 PolarHBondContact O-N 3.5Å; W230-I232 PolarHBondContact O-N 2.88Å; W230-I233 PolarHBondContact O-N 2.96Å; W230-K234 HydrophobicContact CD2-CB 4.47Å; W230-K234 HydrophobicContact CH2-CB 4.46Å; W230-K234 HydrophobicContact CZ2-CB 4.18Å; W230-K234 HydrophobicContact CZ2-CD 3.84Å; W230-K234 HydrophobicContact CZ2-CG 4.14Å; W230-K234 WeakPolarHBondContact O-CB 3.49Å; W230-K234 PolarHBondContact O-N 2.87Å; W230-K362 HydrophobicContact CD2-CD 3.5Å; W230-K362 HydrophobicContact CD2-CG 3.74Å; W230-K362 VanDerWaalsContact CE2-CG 3.47Å; W230-K362 HydrophobicContact CE3-CD 3.83Å; W230-K362 HydrophobicContact CE3-CG 3.87Å; W230-K362 HydrophobicContact CG-CD 3.86Å; W230-K362 HydrophobicContact CH2-CD 4.36Å; W230-K362 HydrophobicContact CH2-CG 3.5Å; W230-K362 VanDerWaalsContact CH2-CG 3.5Å; W230-K362 HydrophobicContact CZ2-CD 4.08Å; W230-K362 HydrophobicContact CZ2-CG 3.36Å; W230-K362 HydrophobicContact CZ3-CD 4.24Å; W230-K362 HydrophobicContact CZ3-CG 3.75Å; W230-A366 HydrophobicContact CH2-CB 4.19Å; W230-A366 HydrophobicContact CZ3-CB 3.93Å
231	Q	94.4	Very high	92.3	Very high	44 Å²	44	26.8 Å²	26.8	21%	0.206	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-43.6	179.6	-72.6	179.8	80.2	0	0	111.9	C207 T208 G227 L228 L229 K234 V235	C207-Q231 HydrophobicContact CB-CB 4.17Å; T208-Q231 PolarHBondContact O-NE2 3.46Å; G227-Q231 VanDerWaalsContact O-CG 3.32Å; G227-Q231 WeakPolarHBondContact O-CG 3.28Å; G227-Q231 PolarHBondContact O-N 3.4Å; G227-Q231 PolarHBondContact O-NE2 3.35Å; L228-Q231 PolarHBondContact O-N 3.3Å; L229-Q231 VanDerWaalsContact C-N 3.32Å; L229-Q231 PolarHBondContact O-N 3.45Å; Q231-K234 PolarHBondContact O-N 3.35Å; Q231-V235 WeakPolarHBondContact O-CG2 3.34Å; Q231-V235 PolarHBondContact O-N 2.88Å; Q231-V235 VanDerWaalsContact O-N 3.07Å
232	I	96.2	Very high	92	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-48.5	177.4	-66.6	165.8	0	0	0	110.4	L164 L167 I168 S171 A202 L228 L229 W230 K234 V235 G236	L164-I232 HydrophobicContact CD2-CD1 4.49Å; L167-I232 HydrophobicContact CB-CG2 4.13Å; I168-I232 HydrophobicContact CD1-CD1 4.34Å; I168-I232 HydrophobicContact CG1-CD1 3.9Å; I168-I232 HydrophobicContact CG1-CG1 4.19Å; I168-I232 HydrophobicContact CG1-CG2 4.24Å; S171-I232 VanDerWaalsContact CB-O 3.25Å; S171-I232 WeakPolarHBondContact CB-O 3.49Å; S171-I232 WeakPolarHBondContact OG-CG2 3.27Å; S171-I232 PolarHBondContact OG-O 3.26Å; A202-I232 HydrophobicContact CB-CG1 4.47Å; L228-I232 HydrophobicContact CD1-CD1 3.96Å; L228-I232 HydrophobicContact CD1-CG1 4.25Å; L228-I232 HydrophobicContact CG-CD1 3.84Å; L228-I232 WeakPolarHBondContact O-CG1 3.31Å; L228-I232 PolarHBondContact O-N 2.86Å; L229-I232 PolarHBondContact O-N 2.78Å; W230-I232 PolarHBondContact O-N 2.88Å; I232-K234 VanDerWaalsContact C-N 3.35Å; I232-K234 PolarHBondContact O-N 3.3Å; I232-V235 PolarHBondContact O-N 3.32Å; I232-G236 PolarHBondContact O-N 3.16Å
233	I	94.9	Very high	91.6	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-58.4	-47.6	177.8	-71.1	166.2	0	0	0	110.6	F127 W130 L229 W230 V235 G236 L237 F350	F127-I233 HydrophobicContact CB-CD1 4.15Å; F127-I233 HydrophobicContact CD1-CD1 3.46Å; F127-I233 VanDerWaalsContact CD1-CD1 3.46Å; F127-I233 HydrophobicContact CD2-CD1 4.47Å; F127-I233 HydrophobicContact CE1-CD1 3.98Å; F127-I233 HydrophobicContact CG-CD1 3.77Å; W130-I233 HydrophobicContact CD2-CD1 4.32Å; W130-I233 HydrophobicContact CD2-CG1 4.23Å; W130-I233 HydrophobicContact CE3-CD1 3.66Å; W130-I233 HydrophobicContact CE3-CG1 3.62Å; W130-I233 HydrophobicContact CH2-CG1 3.75Å; W130-I233 HydrophobicContact CZ2-CG1 4.35Å; W130-I233 HydrophobicContact CZ3-CD1 3.85Å; W130-I233 HydrophobicContact CZ3-CG1 3.33Å; L229-I233 WeakPolarHBondContact O-CB 3.49Å; L229-I233 VanDerWaalsContact O-CG1 3.24Å; L229-I233 WeakPolarHBondContact O-CG1 3.39Å; L229-I233 PolarHBondContact O-N 3.06Å; W230-I233 PolarHBondContact O-N 2.96Å; I233-V235 VanDerWaalsContact C-N 3.32Å; I233-V235 PolarHBondContact O-N 3.25Å; I233-G236 PolarHBondContact O-N 2.87Å; I233-G236 VanDerWaalsContact O-N 3.11Å; I233-L237 HydrophobicContact CG2-CD1 3.62Å; I233-L237 HydrophobicContact CG2-CG 4.05Å; I233-L237 WeakPolarHBondContact O-CG 3.24Å; I233-L237 PolarHBondContact O-N 3.34Å; I233-F350 HydrophobicContact CG2-CE1 3.72Å; I233-F350 HydrophobicContact CG2-CZ 4.12Å
234	K	93.3	Very high	91.2	Very high	51 Å²	51	22.6 Å²	22.6	22%	0.222	13%	0.13	C	C	.	.	H	α-helix	trans	-59.9	-40.9	-179	-173.4	179.1	-176.5	179.1	0	112	W230 Q231 I232 G236 L237 F238 E268	W230-K234 HydrophobicContact CD2-CB 4.47Å; W230-K234 HydrophobicContact CH2-CB 4.46Å; W230-K234 HydrophobicContact CZ2-CB 4.18Å; W230-K234 HydrophobicContact CZ2-CD 3.84Å; W230-K234 HydrophobicContact CZ2-CG 4.14Å; W230-K234 WeakPolarHBondContact O-CB 3.49Å; W230-K234 PolarHBondContact O-N 2.87Å; Q231-K234 PolarHBondContact O-N 3.35Å; I232-K234 VanDerWaalsContact C-N 3.35Å; I232-K234 PolarHBondContact O-N 3.3Å; K234-G236 VanDerWaalsContact C-N 3.31Å; K234-G236 PolarHBondContact O-N 3.27Å; K234-L237 PolarHBondContact O-N 3.28Å; K234-F238 HydrophobicContact CD-CE2 4.23Å; K234-F238 HydrophobicContact CG-CD2 3.95Å; K234-F238 HydrophobicContact CG-CE2 3.9Å; K234-F238 HydrophobicContact CG-CG 4.46Å; K234-F238 HydrophobicContact CG-CZ 4.33Å; K234-F238 WeakPolarHBondContact O-CB 3.47Å; K234-F238 PolarHBondContact O-N 2.84Å; K234-F238 VanDerWaalsContact O-N 3.11Å; K234-E268 WeakPolarHBondContact CE-OE1 3.21Å; K234-E268 IonicContact NZ-OE1 3.25Å; K234-E268 PolarHBondContact NZ-OE1 3.17Å
235	V	93.6	Very high	90.7	Very high	25 Å²	25	28.2 Å²	28.2	15%	0.152	15%	0.149	C	C	.	.	H	α-helix	trans	-58.7	-44.8	175.4	169.9	0	0	0	0	111	I205 Q231 I232 I233 A239	I205-V235 HydrophobicContact CB-CG1 4.44Å; I205-V235 HydrophobicContact CD1-CB 4.36Å; I205-V235 HydrophobicContact CD1-CG1 4.06Å; I205-V235 HydrophobicContact CD1-CG2 4.48Å; Q231-V235 WeakPolarHBondContact O-CG2 3.34Å; Q231-V235 PolarHBondContact O-N 2.88Å; Q231-V235 VanDerWaalsContact O-N 3.07Å; I232-V235 PolarHBondContact O-N 3.32Å; I233-V235 VanDerWaalsContact C-N 3.32Å; I233-V235 PolarHBondContact O-N 3.25Å; V235-A239 PolarHBondContact O-N 3.36Å
236	G	92.7	Very high	90.2	Very high	19 Å²	19	29.8 Å²	29.8	20%	0.196	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-46.7	179.4	0	0	0	0	0	113	S171 I232 I233 K234 F238 A239	S171-G236 WeakPolarHBondContact O-CA 3.42Å; I232-G236 PolarHBondContact O-N 3.16Å; I233-G236 PolarHBondContact O-N 2.87Å; I233-G236 VanDerWaalsContact O-N 3.11Å; K234-G236 VanDerWaalsContact C-N 3.31Å; K234-G236 PolarHBondContact O-N 3.27Å; G236-F238 PolarHBondContact O-N 3.38Å; G236-A239 WeakPolarHBondContact O-CB 3.49Å; G236-A239 PolarHBondContact O-N 2.97Å
237	L	93	Very high	89.7	Confident	11 Å²	11	35.9 Å²	35.9	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-33.5	-179.7	-72.8	178.1	0	0	0	112.8	I233 K234 I241 F350 A366 A369 N370 N373	I233-L237 HydrophobicContact CG2-CD1 3.62Å; I233-L237 HydrophobicContact CG2-CG 4.05Å; I233-L237 WeakPolarHBondContact O-CG 3.24Å; I233-L237 PolarHBondContact O-N 3.34Å; K234-L237 PolarHBondContact O-N 3.28Å; L237-I241 WeakPolarHBondContact O-CD1 3.41Å; L237-F350 HydrophobicContact CD1-CE1 4.25Å; L237-F350 HydrophobicContact CD1-CE2 4.18Å; L237-F350 HydrophobicContact CD1-CZ 3.85Å; L237-F350 HydrophobicContact CD2-CE2 3.95Å; L237-F350 HydrophobicContact CD2-CZ 3.94Å; L237-F350 HydrophobicContact CG-CZ 4.31Å; L237-A366 HydrophobicContact CD1-CB 3.7Å; L237-A369 HydrophobicContact CB-CB 4Å; L237-A369 HydrophobicContact CD1-CB 4.42Å; L237-A369 HydrophobicContact CD2-CB 4.49Å; L237-N370 HydrophobicContact CD2-CB 4.48Å; L237-N373 PolarHBondContact O-ND2 2.93Å
238	F	92.7	Very high	89.3	Confident	22 Å²	22	34.9 Å²	34.9	10%	0.096	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-1.4	-176.1	-67.7	1.4	0	0	0	113.5	K234 G236 D240 I241 P267 E268 L271 T365 A369	K234-F238 HydrophobicContact CD-CE2 4.23Å; K234-F238 HydrophobicContact CG-CD2 3.95Å; K234-F238 HydrophobicContact CG-CE2 3.9Å; K234-F238 HydrophobicContact CG-CG 4.46Å; K234-F238 HydrophobicContact CG-CZ 4.33Å; K234-F238 WeakPolarHBondContact O-CB 3.47Å; K234-F238 PolarHBondContact O-N 2.84Å; K234-F238 VanDerWaalsContact O-N 3.11Å; G236-F238 PolarHBondContact O-N 3.38Å; F238-D240 PolarHBondContact O-N 3.48Å; F238-I241 HydrophobicContact CD1-CD1 3.69Å; F238-I241 HydrophobicContact CE1-CD1 4.3Å; F238-I241 HydrophobicContact CG-CD1 4.4Å; F238-I241 PolarHBondContact O-N 3.18Å; F238-P267 HydrophobicContact CB-CB 3.85Å; F238-P267 HydrophobicContact CB-CG 4.12Å; F238-P267 HydrophobicContact CD1-CB 4.38Å; F238-P267 HydrophobicContact CD2-CB 3.46Å; F238-P267 VanDerWaalsContact CD2-CB 3.46Å; F238-P267 HydrophobicContact CD2-CG 3.97Å; F238-P267 HydrophobicContact CE2-CB 3.99Å; F238-P267 HydrophobicContact CG-CB 3.67Å; F238-P267 HydrophobicContact CG-CG 4.33Å; F238-E268 VanDerWaalsContact CE2-CD 3.43Å; F238-E268 HydrophobicContact CE2-CG 3.77Å; F238-E268 WeakPolarHBondContact CE2-OE1 3.48Å; F238-E268 HydrophobicContact CZ-CG 3.85Å; F238-L271 HydrophobicContact CE1-CD1 3.9Å; F238-L271 HydrophobicContact CZ-CD1 4.46Å; F238-T365 HydrophobicContact CE1-CG2 4.18Å; F238-T365 HydrophobicContact CZ-CG2 3.76Å; F238-A369 HydrophobicContact CD1-CB 4.13Å; F238-A369 HydrophobicContact CE1-CB 3.86Å
239	A	87.9	Confident	89	Confident	31 Å²	31	34.8 Å²	34.8	26%	0.256	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-34.5	-175.3	0	0	0	0	0	112.8	V235 G236 R245	V235-A239 PolarHBondContact O-N 3.36Å; G236-A239 WeakPolarHBondContact O-CB 3.49Å; G236-A239 PolarHBondContact O-N 2.97Å; A239-R245 WeakPolarHBondContact O-CD 3.42Å; A239-R245 PolarHBondContact O-NE 3.21Å
240	D	85.6	Confident	88.6	Confident	72 Å²	72	35.3 Å²	35.3	39%	0.385	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	5.5	-176.4	-60	-37	0	0	0	113.4	F238 E242 R245	F238-D240 PolarHBondContact O-N 3.48Å; D240-E242 PolarHBondContact O-N 3.05Å; D240-E242 VanDerWaalsContact O-N 3.13Å; D240-R245 IonicContact OD1-CZ 2.88Å; D240-R245 IonicContact OD1-NH1 2.95Å; D240-R245 PolarHBondContact OD1-NH1 2.69Å
241	I	90.2	Very high	88.2	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	18%	0.181	C	C	.	.			trans	-91.3	59.1	176	-45.8	-179.5	0	0	0	108.7	L237 F238 P267 L270 L271 A369 F372	L237-I241 WeakPolarHBondContact O-CD1 3.41Å; F238-I241 HydrophobicContact CD1-CD1 3.69Å; F238-I241 HydrophobicContact CE1-CD1 4.3Å; F238-I241 HydrophobicContact CG-CD1 4.4Å; F238-I241 PolarHBondContact O-N 3.18Å; I241-P267 HydrophobicContact CB-CB 4.26Å; I241-P267 HydrophobicContact CG2-CB 4.29Å; I241-L270 HydrophobicContact CG2-CB 4.03Å; I241-L271 HydrophobicContact CD1-CD1 3.68Å; I241-L271 HydrophobicContact CD1-CD2 3.7Å; I241-L271 HydrophobicContact CD1-CG 3.71Å; I241-L271 HydrophobicContact CG2-CD2 4.29Å; I241-L271 HydrophobicContact CG2-CG 4.15Å; I241-A369 HydrophobicContact CD1-CB 4.03Å; I241-F372 HydrophobicContact CB-CE1 4.34Å; I241-F372 HydrophobicContact CD1-CD1 4.3Å; I241-F372 HydrophobicContact CG1-CD1 3.74Å; I241-F372 HydrophobicContact CG1-CE1 3.9Å; I241-F372 HydrophobicContact CG2-CE1 4.41Å
242	E	84.6	Confident	88	Confident	47 Å²	47	33 Å²	33	22%	0.22	17%	0.173	C	C	.	.	S	Bend	trans	-148.3	139.4	-179.4	-167.2	-171	154.3	0	0	109	D240 T244 R245 N246	D240-E242 PolarHBondContact O-N 3.05Å; D240-E242 VanDerWaalsContact O-N 3.13Å; E242-T244 WeakPolarHBondContact CG-OG1 3.34Å; E242-T244 PolarHBondContact O-N 2.94Å; E242-T244 PolarHBondContact OE1-OG1 2.87Å; E242-R245 PolarHBondContact O-N 2.62Å; E242-N246 PolarHBondContact O-N 2.99Å
243	I	82.8	Confident	87.6	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-35.9	-174.3	-55.8	-177.7	0	0	0	112	R245 N246 E247 L249 I250 L259 L262 M263 I390	I243-R245 PolarHBondContact O-N 3.03Å; I243-N246 CarbonylContact O-C 3.28Å; I243-N246 VanDerWaalsContact O-C 3.28Å; I243-N246 PolarHBondContact O-N 3.4Å; I243-E247 PolarHBondContact O-N 3.11Å; I243-L249 HydrophobicContact CG1-CB 3.98Å; I243-L249 HydrophobicContact CG1-CD1 4.41Å; I243-I250 HydrophobicContact CG2-CD1 4.14Å; I243-I250 HydrophobicContact CG2-CG1 3.61Å; I243-L259 HydrophobicContact CD1-CD1 4.35Å; I243-L262 HydrophobicContact CD1-CB 4.27Å; I243-L262 HydrophobicContact CD1-CD2 3.78Å; I243-L262 HydrophobicContact CD1-CG 3.7Å; I243-M263 HydrophobicContact CD1-CB 4.44Å; I243-M263 HydrophobicContact CD1-CG 3.7Å; I243-I390 HydrophobicContact CG2-CD1 3.7Å
244	T	79.6	Confident	87.2	Confident	48 Å²	48	40.9 Å²	40.9	29%	0.294	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-25.6	179	58.2	0	0	0	0	113.2	E242 I390 A392	E242-T244 WeakPolarHBondContact CG-OG1 3.34Å; E242-T244 PolarHBondContact O-N 2.94Å; E242-T244 PolarHBondContact OE1-OG1 2.87Å; T244-I390 HydrophobicContact CG2-CG2 3.86Å; T244-A392 HydrophobicContact CG2-CB 4.46Å
245	R	80.3	Confident	86.7	Confident	143 Å²	143	48.2 Å²	48.2	54%	0.54	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-32.5	179.1	-71.8	175.6	167.3	-110.5	-8.1	112.6	A239 D240 E242 I243	A239-R245 WeakPolarHBondContact O-CD 3.42Å; A239-R245 PolarHBondContact O-NE 3.21Å; D240-R245 IonicContact OD1-CZ 2.88Å; D240-R245 IonicContact OD1-NH1 2.95Å; D240-R245 PolarHBondContact OD1-NH1 2.69Å; E242-R245 PolarHBondContact O-N 2.62Å; I243-R245 PolarHBondContact O-N 3.03Å
246	N	83.2	Confident	86.1	Confident	38 Å²	38	51 Å²	51	20%	0.203	28%	0.281	C	S	.	.			trans	-129.7	86.9	179.6	-168.2	-19.5	0	0	0	110.2	E242 I243 G248 L249 F372	E242-N246 PolarHBondContact O-N 2.99Å; I243-N246 CarbonylContact O-C 3.28Å; I243-N246 VanDerWaalsContact O-C 3.28Å; I243-N246 PolarHBondContact O-N 3.4Å; N246-G248 PolarHBondContact O-N 3.03Å; N246-G248 PolarHBondContact OD1-N 3.42Å; N246-L249 HydrophobicContact CB-CD1 4.17Å; N246-L249 HydrophobicContact CB-CG 4.33Å; N246-L249 VanDerWaalsContact O-CB 3.3Å; N246-L249 WeakPolarHBondContact O-CB 3.42Å; N246-L249 WeakPolarHBondContact O-CG 3.38Å; N246-L249 PolarHBondContact O-N 3.5Å; N246-F372 VanDerWaalsContact ND2-CZ 3.34Å; N246-F372 WeakPolarHBondContact ND2-CZ 3.23Å
247	E	82.2	Confident	85.9	Confident	131 Å²	131	51.3 Å²	51.3	61%	0.612	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-57.8	-20	177.6	-64.8	176.5	171.6	0	0	112.8	I243 L249 I250	I243-E247 PolarHBondContact O-N 3.11Å; E247-L249 PolarHBondContact O-N 3.05Å; E247-I250 HydrophobicContact CB-CD1 4.43Å; E247-I250 WeakPolarHBondContact O-CB 3.38Å; E247-I250 VanDerWaalsContact O-CG1 3.23Å; E247-I250 WeakPolarHBondContact O-CG1 3.48Å; E247-I250 PolarHBondContact O-N 3.11Å; E247-I250 VanDerWaalsContact O-N 3.08Å
248	G	83.5	Confident	85.5	Confident	7 Å²	7	57.9 Å²	57.9	7%	0.072	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-57.4	-28.3	173.5	0	0	0	0	0	112.8	N246 I250 A251 L378	N246-G248 PolarHBondContact O-N 3.03Å; N246-G248 PolarHBondContact OD1-N 3.42Å; G248-I250 PolarHBondContact O-N 3.44Å; G248-I250 VanDerWaalsContact O-N 3.13Å; G248-A251 VanDerWaalsContact O-CB 3.27Å; G248-A251 WeakPolarHBondContact O-CB 3.32Å; G248-A251 PolarHBondContact O-N 2.68Å; G248-L378 VanDerWaalsContact C-CD1 3.46Å; G248-L378 VanDerWaalsContact O-CD1 3.32Å; G248-L378 WeakPolarHBondContact O-CD1 3.41Å
249	L	87.9	Confident	85.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-60.3	-20.9	176.7	-71.9	170.3	0	0	0	113.4	I243 N246 E247 A251 L252 F372 L378	I243-L249 HydrophobicContact CG1-CB 3.98Å; I243-L249 HydrophobicContact CG1-CD1 4.41Å; N246-L249 HydrophobicContact CB-CD1 4.17Å; N246-L249 HydrophobicContact CB-CG 4.33Å; N246-L249 VanDerWaalsContact O-CB 3.3Å; N246-L249 WeakPolarHBondContact O-CB 3.42Å; N246-L249 WeakPolarHBondContact O-CG 3.38Å; N246-L249 PolarHBondContact O-N 3.5Å; E247-L249 PolarHBondContact O-N 3.05Å; L249-A251 PolarHBondContact O-N 2.96Å; L249-L252 HydrophobicContact CD2-CD1 3.53Å; L249-L252 HydrophobicContact CD2-CG 4.45Å; L249-L252 WeakPolarHBondContact O-CB 3.32Å; L249-L252 WeakPolarHBondContact O-CG 3.47Å; L249-L252 PolarHBondContact O-N 2.95Å; L249-F372 HydrophobicContact CD1-CZ 4.17Å; L249-F372 HydrophobicContact CD2-CE2 3.6Å; L249-F372 HydrophobicContact CD2-CZ 3.58Å; L249-F372 HydrophobicContact CG-CE2 4.39Å; L249-F372 HydrophobicContact CG-CZ 3.95Å; L249-L378 HydrophobicContact CD2-CD1 4.06Å; L249-L378 HydrophobicContact CG-CD1 4.47Å
250	I	86.9	Confident	84.8	Confident	11 Å²	11	60.7 Å²	60.7	6%	0.056	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-59.7	-28.6	174.9	-60.7	173.5	0	0	0	111	I243 E247 G248 L252 L253 L259 F383 L385 I390	I243-I250 HydrophobicContact CG2-CD1 4.14Å; I243-I250 HydrophobicContact CG2-CG1 3.61Å; E247-I250 HydrophobicContact CB-CD1 4.43Å; E247-I250 WeakPolarHBondContact O-CB 3.38Å; E247-I250 VanDerWaalsContact O-CG1 3.23Å; E247-I250 WeakPolarHBondContact O-CG1 3.48Å; E247-I250 PolarHBondContact O-N 3.11Å; E247-I250 VanDerWaalsContact O-N 3.08Å; G248-I250 PolarHBondContact O-N 3.44Å; G248-I250 VanDerWaalsContact O-N 3.13Å; I250-L252 PolarHBondContact O-N 3.4Å; I250-L252 VanDerWaalsContact O-N 3.08Å; I250-L253 WeakPolarHBondContact O-CB 3.48Å; I250-L253 PolarHBondContact O-N 3.26Å; I250-L253 VanDerWaalsContact O-N 3.08Å; I250-L259 HydrophobicContact CG1-CD1 4.46Å; I250-F383 HydrophobicContact CG2-CD2 4.17Å; I250-L385 HydrophobicContact CD1-CD1 3.69Å; I250-I390 HydrophobicContact CD1-CD1 3.86Å
251	A	86.9	Confident	84.7	Confident	22 Å²	22	61.6 Å²	61.6	18%	0.182	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-62.3	-15.1	175	0	0	0	0	0	113.6	G248 L249 L253 A381	G248-A251 VanDerWaalsContact O-CB 3.27Å; G248-A251 WeakPolarHBondContact O-CB 3.32Å; G248-A251 PolarHBondContact O-N 2.68Å; L249-A251 PolarHBondContact O-N 2.96Å; A251-L253 VanDerWaalsContact C-N 3.29Å; A251-A381 HydrophobicContact CB-CB 4.43Å
252	L	89.6	Confident	84.5	Confident	8 Å²	8	61.5 Å²	61.5	4%	0.042	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-79.8	-9.1	177.1	-56.6	-178.3	0	0	0	113.2	L249 I250 M254 L262 R273 W274 Y277 L378	L249-L252 HydrophobicContact CD2-CD1 3.53Å; L249-L252 HydrophobicContact CD2-CG 4.45Å; L249-L252 WeakPolarHBondContact O-CB 3.32Å; L249-L252 WeakPolarHBondContact O-CG 3.47Å; L249-L252 PolarHBondContact O-N 2.95Å; I250-L252 PolarHBondContact O-N 3.4Å; I250-L252 VanDerWaalsContact O-N 3.08Å; L252-M254 PolarHBondContact O-N 3.48Å; L252-L262 HydrophobicContact CB-CD1 4.17Å; L252-R273 HydrophobicContact CB-CG 4.24Å; L252-R273 PolarHBondContact O-NE 3.26Å; L252-R273 PolarHBondContact O-NH2 2.9Å; L252-W274 HydrophobicContact CD1-CB 3.98Å; L252-W274 HydrophobicContact CD2-CB 4.38Å; L252-Y277 HydrophobicContact CD2-CD1 4.29Å; L252-Y277 HydrophobicContact CD2-CD2 4.14Å; L252-Y277 HydrophobicContact CD2-CG 3.75Å; L252-L378 HydrophobicContact CD2-CD2 4.01Å
253	L	88.6	Confident	84.5	Confident	49 Å²	49	61.8 Å²	61.8	26%	0.257	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-58	130.8	179.5	-165	73.3	0	0	0	111	I250 A251 E257 L262	I250-L253 WeakPolarHBondContact O-CB 3.48Å; I250-L253 PolarHBondContact O-N 3.26Å; I250-L253 VanDerWaalsContact O-N 3.08Å; A251-L253 VanDerWaalsContact C-N 3.29Å; L253-E257 HydrophobicContact CD1-CB 4.28Å; L253-E257 HydrophobicContact CD1-CG 4.19Å; L253-E257 WeakPolarHBondContact CD1-OE2 3.4Å; L253-L262 HydrophobicContact CB-CD2 4.19Å; L253-L262 HydrophobicContact CD1-CB 3.95Å; L253-L262 HydrophobicContact CD1-CD2 4.09Å
254	M	86.8	Confident	84.5	Confident	116 Å²	116	62.9 Å²	62.9	57%	0.571	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-87.8	158.7	-179.3	-85.7	176.7	-43.4	0	0	110.5	L252 G256 E257 R273	L252-M254 PolarHBondContact O-N 3.48Å; M254-G256 PolarHBondContact O-N 2.79Å; M254-E257 HydrophobicContact CB-CB 4.22Å; M254-E257 PolarHBondContact N-OE2 3.43Å; M254-E257 WeakPolarHBondContact O-CB 3.39Å; M254-E257 PolarHBondContact O-N 3.26Å; M254-E257 VanDerWaalsContact O-N 3.13Å; M254-R273 VanDerWaalsContact CB-NH2 3.33Å
255	E	82.4	Confident	84.9	Confident	206 Å²	206	61.5 Å²	61.5	96%	0.963	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	125	175.9	-168.6	177.6	-178.9	0	0	110.9	E257	E255-E257 VanDerWaalsContact C-N 3.33Å
256	G	81.7	Confident	85.4	Confident	84 Å²	84	55.5 Å²	55.5	87%	0.866	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	8	-179	0	0	0	0	0	115.3	M254	M254-G256 PolarHBondContact O-N 2.79Å
257	E	86.8	Confident	85.8	Confident	25 Å²	25	54.6 Å²	54.6	12%	0.117	30%	0.297	C	S	.	.			trans	-97.7	137.1	175.4	-173.5	-168.9	-140.1	0	0	111.7	L253 M254 E255 H261 R273	L253-E257 HydrophobicContact CD1-CB 4.28Å; L253-E257 HydrophobicContact CD1-CG 4.19Å; L253-E257 WeakPolarHBondContact CD1-OE2 3.4Å; M254-E257 HydrophobicContact CB-CB 4.22Å; M254-E257 PolarHBondContact N-OE2 3.43Å; M254-E257 WeakPolarHBondContact O-CB 3.39Å; M254-E257 PolarHBondContact O-N 3.26Å; M254-E257 VanDerWaalsContact O-N 3.13Å; E255-E257 VanDerWaalsContact C-N 3.33Å; E257-H261 HydrophobicContact CG-CB 3.99Å; E257-H261 IonicContact OE1-CE1 3.51Å; E257-H261 PolarHBondContact OE1-CE1 3.3Å; E257-H261 IonicContact OE1-CG 3.25Å; E257-H261 IonicContact OE1-ND1 3.57Å; E257-H261 PolarHBondContact OE1-ND1 3.26Å; E257-R273 IonicContact OE1-CZ 2.76Å; E257-R273 IonicContact OE1-NH1 3.62Å; E257-R273 PolarHBondContact OE1-NH1 3.4Å; E257-R273 IonicContact OE1-NH2 2.76Å; E257-R273 IonicContact OE2-CZ 3.73Å; E257-R273 VanDerWaalsContact OE2-CZ 3.25Å; E257-R273 IonicContact OE2-NH1 2.79Å; E257-R273 PolarHBondContact OE2-NH1 2.78Å; E257-R273 IonicContact OE2-NH2 2.7Å; E257-R273 PolarHBondContact OE2-NH2 3.06Å
258	E	85.4	Confident	86.3	Confident	148 Å²	148	51.2 Å²	51.2	69%	0.692	28%	0.281	S	S	*	.			trans	-75.9	140.5	173.3	-62.5	-63.9	148.8	0	0	111.4	D260 H261	E258-D260 HydrophobicContact CB-CB 4.37Å; E258-D260 PolarHBondContact O-N 3.44Å; E258-D260 VanDerWaalsContact O-N 3.09Å; E258-H261 WeakPolarHBondContact O-CB 3.41Å; E258-H261 PolarHBondContact O-N 3.49Å
259	L	84.1	Confident	86.8	Confident	21 Å²	21	55.6 Å²	55.6	11%	0.11	30%	0.3	C	S	.	.	H	α-helix	trans	-53.2	-35.7	177.6	178.5	60.9	0	0	0	112.2	I243 I250 H261 L262 M263 I390	I243-L259 HydrophobicContact CD1-CD1 4.35Å; I250-L259 HydrophobicContact CG1-CD1 4.46Å; L259-H261 VanDerWaalsContact C-N 3.27Å; L259-H261 PolarHBondContact O-N 2.96Å; L259-L262 HydrophobicContact CD1-CD2 4.36Å; L259-L262 WeakPolarHBondContact O-CB 3.42Å; L259-L262 PolarHBondContact O-N 3.47Å; L259-L262 VanDerWaalsContact O-N 3.11Å; L259-M263 HydrophobicContact CG-CE 4.23Å; L259-M263 HydrophobicContact CG-CG 4.4Å; L259-M263 HydrophobicContact CG-SD 4.49Å; L259-M263 PolarHBondContact O-N 2.82Å; L259-I390 HydrophobicContact CD2-CD1 4.23Å; L259-I390 HydrophobicContact CD2-CG1 4.41Å
260	D	81.4	Confident	87.1	Confident	92 Å²	92	55.9 Å²	55.9	49%	0.492	30%	0.302	S	S	.	.	H	α-helix	trans	-52.1	-41.4	174.4	-111.6	28.7	0	0	0	113.1	E258 M263 S264 R418	E258-D260 HydrophobicContact CB-CB 4.37Å; E258-D260 PolarHBondContact O-N 3.44Å; E258-D260 VanDerWaalsContact O-N 3.09Å; D260-M263 WeakPolarHBondContact OD1-CE 3.18Å; D260-S264 PolarHBondContact O-N 2.89Å; D260-R418 VanDerWaalsContact C-NH2 3.29Å; D260-R418 PolarHBondContact O-NH1 2.87Å; D260-R418 PolarHBondContact O-NH2 3Å; D260-R418 IonicContact OD1-NH2 3.65Å; D260-R418 IonicContact OD2-NH2 2.69Å; D260-R418 PolarHBondContact OD2-NH2 2.75Å
261	H	84.3	Confident	87.5	Confident	91 Å²	91	55.4 Å²	55.4	42%	0.421	30%	0.299	S	S	.	.	H	α-helix	trans	-68.4	-43.8	177.1	-177.4	-125.4	0	0	0	111.6	E257 E258 L259 M263 S264	E257-H261 HydrophobicContact CG-CB 3.99Å; E257-H261 IonicContact OE1-CE1 3.51Å; E257-H261 PolarHBondContact OE1-CE1 3.3Å; E257-H261 IonicContact OE1-CG 3.25Å; E257-H261 IonicContact OE1-ND1 3.57Å; E257-H261 PolarHBondContact OE1-ND1 3.26Å; E258-H261 WeakPolarHBondContact O-CB 3.41Å; E258-H261 PolarHBondContact O-N 3.49Å; L259-H261 VanDerWaalsContact C-N 3.27Å; L259-H261 PolarHBondContact O-N 2.96Å; H261-M263 VanDerWaalsContact C-N 3.32Å; H261-M263 PolarHBondContact O-N 3.08Å; H261-S264 WeakPolarHBondContact O-CB 3.38Å; H261-S264 PolarHBondContact O-N 3.29Å; H261-S264 PolarHBondContact O-OG 3.36Å
262	L	86.4	Confident	88	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-41.9	176.5	-174.1	69	0	0	0	111.6	I243 L252 L253 L259 S264 L265 L270	I243-L262 HydrophobicContact CD1-CB 4.27Å; I243-L262 HydrophobicContact CD1-CD2 3.78Å; I243-L262 HydrophobicContact CD1-CG 3.7Å; L252-L262 HydrophobicContact CB-CD1 4.17Å; L253-L262 HydrophobicContact CB-CD2 4.19Å; L253-L262 HydrophobicContact CD1-CB 3.95Å; L253-L262 HydrophobicContact CD1-CD2 4.09Å; L259-L262 HydrophobicContact CD1-CD2 4.36Å; L259-L262 WeakPolarHBondContact O-CB 3.42Å; L259-L262 PolarHBondContact O-N 3.47Å; L259-L262 VanDerWaalsContact O-N 3.11Å; L262-S264 PolarHBondContact O-N 3.03Å; L262-L265 HydrophobicContact CD1-CD1 4.07Å; L262-L265 PolarHBondContact O-N 3.28Å; L262-L270 HydrophobicContact CD1-CD2 3.84Å; L262-L270 HydrophobicContact CG-CD2 4.33Å
263	M	83.1	Confident	88.3	Confident	53 Å²	53	57.4 Å²	57.4	26%	0.261	30%	0.304	S	S	.	.	H	α-helix	trans	-61.5	-22.4	174.9	-76	-168.8	-62.7	0	0	113.2	I243 L259 D260 H261 I390 H415	I243-M263 HydrophobicContact CD1-CB 4.44Å; I243-M263 HydrophobicContact CD1-CG 3.7Å; L259-M263 HydrophobicContact CG-CE 4.23Å; L259-M263 HydrophobicContact CG-CG 4.4Å; L259-M263 HydrophobicContact CG-SD 4.49Å; L259-M263 PolarHBondContact O-N 2.82Å; D260-M263 WeakPolarHBondContact OD1-CE 3.18Å; H261-M263 VanDerWaalsContact C-N 3.32Å; H261-M263 PolarHBondContact O-N 3.08Å; M263-I390 HydrophobicContact SD-CG2 3.89Å; M263-H415 PolarHBondContact O-CD2 3.44Å; M263-H415 PolarHBondContact O-CE1 3.31Å; M263-H415 PolarHBondContact O-NE2 2.93Å
264	S	83.1	Confident	88.6	Confident	27 Å²	27	55 Å²	55	19%	0.189	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-8.5	-178.8	69.2	0	0	0	0	115.6	D260 H261 L262 H415 R418	D260-S264 PolarHBondContact O-N 2.89Å; H261-S264 WeakPolarHBondContact O-CB 3.38Å; H261-S264 PolarHBondContact O-N 3.29Å; H261-S264 PolarHBondContact O-OG 3.36Å; L262-S264 PolarHBondContact O-N 3.03Å; S264-H415 PolarHBondContact O-CD2 3.22Å; S264-R418 PolarHBondContact OG-NH1 2.92Å
265	L	89.3	Confident	89.1	Confident	20 Å²	20	49.6 Å²	49.6	11%	0.105	27%	0.265	C	S	.	.	S	Bend	trans	-66.3	143.6	177.7	-63.9	-174	0	0	0	110.3	L262 E269 L270 H415	L262-L265 HydrophobicContact CD1-CD1 4.07Å; L262-L265 PolarHBondContact O-N 3.28Å; L265-E269 HydrophobicContact CB-CB 3.97Å; L265-E269 HydrophobicContact CD1-CB 4.41Å; L265-E269 HydrophobicContact CD2-CB 4.23Å; L265-E269 HydrophobicContact CG-CB 4.43Å; L265-L270 HydrophobicContact CB-CD2 4.03Å; L265-L270 HydrophobicContact CB-CG 3.87Å; L265-L270 HydrophobicContact CD1-CD2 4.15Å; L265-H415 PolarHBondContact O-NE2 2.94Å
266	S	90.3	Very high	89.8	Confident	16 Å²	16	41 Å²	41	11%	0.112	23%	0.226	C	C	.	.			trans	-65.9	158.1	167.5	61.1	0	0	0	0	110.6	E268 E269 L270	S266-E268 PolarHBondContact O-N 3.26Å; S266-E269 WeakPolarHBondContact CB-OE2 3.27Å; S266-E269 PolarHBondContact N-OE2 2.85Å; S266-E269 PolarHBondContact O-N 3.5Å; S266-E269 VanDerWaalsContact O-N 3.07Å; S266-E269 VanDerWaalsContact OG-CD 3.22Å; S266-E269 VanDerWaalsContact OG-CG 3.28Å; S266-E269 WeakPolarHBondContact OG-CG 3.4Å; S266-E269 PolarHBondContact OG-N 2.9Å; S266-E269 PolarHBondContact OG-OE2 2.9Å; S266-L270 PolarHBondContact O-N 3.49Å
267	P	92.1	Very high	90.5	Very high	19 Å²	19	40.3 Å²	40.3	12%	0.123	20%	0.197	C	C	.	.	H	α-helix	trans	-54.3	-36.8	173.9	-28.5	36.8	0	0	0	113.3	F238 I241 L270 L271	F238-P267 HydrophobicContact CB-CB 3.85Å; F238-P267 HydrophobicContact CB-CG 4.12Å; F238-P267 HydrophobicContact CD1-CB 4.38Å; F238-P267 HydrophobicContact CD2-CB 3.46Å; F238-P267 VanDerWaalsContact CD2-CB 3.46Å; F238-P267 HydrophobicContact CD2-CG 3.97Å; F238-P267 HydrophobicContact CE2-CB 3.99Å; F238-P267 HydrophobicContact CG-CB 3.67Å; F238-P267 HydrophobicContact CG-CG 4.33Å; I241-P267 HydrophobicContact CB-CB 4.26Å; I241-P267 HydrophobicContact CG2-CB 4.29Å; P267-L270 PolarHBondContact O-N 3.02Å; P267-L271 WeakPolarHBondContact O-CB 3.31Å; P267-L271 WeakPolarHBondContact O-CG 3.15Å; P267-L271 PolarHBondContact O-N 3.32Å
268	E	92.6	Very high	90.9	Very high	60 Å²	60	39.3 Å²	39.3	28%	0.28	19%	0.193	S	C	.	.	H	α-helix	trans	-63.7	-42.5	175.7	-66.3	97.5	154.4	0	0	112.9	K234 F238 S266 L271 L272 T365	K234-E268 WeakPolarHBondContact CE-OE1 3.21Å; K234-E268 IonicContact NZ-OE1 3.25Å; K234-E268 PolarHBondContact NZ-OE1 3.17Å; F238-E268 VanDerWaalsContact CE2-CD 3.43Å; F238-E268 HydrophobicContact CE2-CG 3.77Å; F238-E268 WeakPolarHBondContact CE2-OE1 3.48Å; F238-E268 HydrophobicContact CZ-CG 3.85Å; S266-E268 PolarHBondContact O-N 3.26Å; E268-L271 PolarHBondContact O-N 3.38Å; E268-L272 PolarHBondContact O-N 2.89Å; E268-T365 HydrophobicContact CG-CG2 4.37Å
269	E	93.1	Very high	91.5	Very high	99 Å²	99	32.2 Å²	32.2	46%	0.463	16%	0.16	S	C	.	.	H	α-helix	trans	-68.5	-39.9	177.8	-72.3	162.4	145.2	0	0	111.4	L265 S266 L271 L272 R273	L265-E269 HydrophobicContact CB-CB 3.97Å; L265-E269 HydrophobicContact CD1-CB 4.41Å; L265-E269 HydrophobicContact CD2-CB 4.23Å; L265-E269 HydrophobicContact CG-CB 4.43Å; S266-E269 WeakPolarHBondContact CB-OE2 3.27Å; S266-E269 PolarHBondContact N-OE2 2.85Å; S266-E269 PolarHBondContact O-N 3.5Å; S266-E269 VanDerWaalsContact O-N 3.07Å; S266-E269 VanDerWaalsContact OG-CD 3.22Å; S266-E269 VanDerWaalsContact OG-CG 3.28Å; S266-E269 WeakPolarHBondContact OG-CG 3.4Å; S266-E269 PolarHBondContact OG-N 2.9Å; S266-E269 PolarHBondContact OG-OE2 2.9Å; E269-L271 VanDerWaalsContact C-N 3.34Å; E269-L272 PolarHBondContact O-N 2.87Å; E269-R273 VanDerWaalsContact O-CB 3.28Å; E269-R273 WeakPolarHBondContact O-CB 3.22Å; E269-R273 PolarHBondContact O-N 3.47Å
270	L	94.4	Very high	92	Very high	7 Å²	7	36.2 Å²	36.2	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-42.1	173.2	-74.2	172.9	0	0	0	111.7	I241 L262 L265 S266 P267 R273 W274	I241-L270 HydrophobicContact CG2-CB 4.03Å; L262-L270 HydrophobicContact CD1-CD2 3.84Å; L262-L270 HydrophobicContact CG-CD2 4.33Å; L265-L270 HydrophobicContact CB-CD2 4.03Å; L265-L270 HydrophobicContact CB-CG 3.87Å; L265-L270 HydrophobicContact CD1-CD2 4.15Å; S266-L270 PolarHBondContact O-N 3.49Å; P267-L270 PolarHBondContact O-N 3.02Å; L270-R273 PolarHBondContact O-N 3.04Å; L270-W274 VanDerWaalsContact O-CB 3.28Å; L270-W274 WeakPolarHBondContact O-CB 3.31Å; L270-W274 PolarHBondContact O-N 3.11Å
271	L	96	Very high	92.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63	-45.4	175	-79.7	178.9	0	0	0	112.4	F238 I241 P267 E268 E269 R273 W274 V275 F290 T365 V368 A369 F372	F238-L271 HydrophobicContact CE1-CD1 3.9Å; F238-L271 HydrophobicContact CZ-CD1 4.46Å; I241-L271 HydrophobicContact CD1-CD1 3.68Å; I241-L271 HydrophobicContact CD1-CD2 3.7Å; I241-L271 HydrophobicContact CD1-CG 3.71Å; I241-L271 HydrophobicContact CG2-CD2 4.29Å; I241-L271 HydrophobicContact CG2-CG 4.15Å; P267-L271 WeakPolarHBondContact O-CB 3.31Å; P267-L271 WeakPolarHBondContact O-CG 3.15Å; P267-L271 PolarHBondContact O-N 3.32Å; E268-L271 PolarHBondContact O-N 3.38Å; E269-L271 VanDerWaalsContact C-N 3.34Å; L271-R273 VanDerWaalsContact C-N 3.25Å; L271-R273 PolarHBondContact O-N 3.43Å; L271-W274 HydrophobicContact CD2-CE3 4.32Å; L271-W274 WeakPolarHBondContact O-CB 3.48Å; L271-W274 PolarHBondContact O-N 3.37Å; L271-V275 WeakPolarHBondContact O-CG2 3.42Å; L271-V275 PolarHBondContact O-N 3.48Å; L271-F290 HydrophobicContact CB-CE2 4.19Å; L271-F290 HydrophobicContact CB-CZ 4.05Å; L271-T365 HydrophobicContact CD1-CG2 4.4Å; L271-V368 HydrophobicContact CB-CG1 4.29Å; L271-V368 HydrophobicContact CD1-CG1 4.45Å; L271-V368 HydrophobicContact CD2-CG1 4.17Å; L271-A369 HydrophobicContact CD1-CB 3.73Å; L271-F372 HydrophobicContact CD2-CB 3.67Å; L271-F372 HydrophobicContact CD2-CD2 4.4Å; L271-F372 HydrophobicContact CD2-CG 3.96Å
272	L	96.6	Very high	93	Very high	40 Å²	40	33.1 Å²	33.1	21%	0.209	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-42.7	178.5	-177	64.2	0	0	0	110.7	E268 E269 V275 N276 I287 N288 F290	E268-L272 PolarHBondContact O-N 2.89Å; E269-L272 PolarHBondContact O-N 2.87Å; L272-V275 PolarHBondContact O-N 2.89Å; L272-N276 WeakPolarHBondContact O-CB 3.2Å; L272-N276 PolarHBondContact O-N 3.21Å; L272-N276 PolarHBondContact O-ND2 3.15Å; L272-I287 HydrophobicContact CD1-CD1 3.95Å; L272-I287 HydrophobicContact CD1-CG1 3.78Å; L272-N288 WeakPolarHBondContact CD2-O 3.37Å; L272-F290 HydrophobicContact CB-CE2 4.38Å; L272-F290 HydrophobicContact CB-CZ 4.1Å; L272-F290 HydrophobicContact CD1-CE1 4.18Å; L272-F290 HydrophobicContact CD1-CZ 4.15Å
273	R	95.5	Very high	93.4	Very high	32 Å²	32	36.6 Å²	36.6	12%	0.121	21%	0.207	C	C	.	.	H	α-helix	trans	-65.5	-40.4	177	-168	171.9	-177.4	150.5	2.8	112.6	L252 M254 E257 E269 L270 L271 N276 Y277	L252-R273 HydrophobicContact CB-CG 4.24Å; L252-R273 PolarHBondContact O-NE 3.26Å; L252-R273 PolarHBondContact O-NH2 2.9Å; M254-R273 VanDerWaalsContact CB-NH2 3.33Å; E257-R273 IonicContact OE1-CZ 2.76Å; E257-R273 IonicContact OE1-NH1 3.62Å; E257-R273 PolarHBondContact OE1-NH1 3.4Å; E257-R273 IonicContact OE1-NH2 2.76Å; E257-R273 IonicContact OE2-CZ 3.73Å; E257-R273 VanDerWaalsContact OE2-CZ 3.25Å; E257-R273 IonicContact OE2-NH1 2.79Å; E257-R273 PolarHBondContact OE2-NH1 2.78Å; E257-R273 IonicContact OE2-NH2 2.7Å; E257-R273 PolarHBondContact OE2-NH2 3.06Å; E269-R273 VanDerWaalsContact O-CB 3.28Å; E269-R273 WeakPolarHBondContact O-CB 3.22Å; E269-R273 PolarHBondContact O-N 3.47Å; L270-R273 PolarHBondContact O-N 3.04Å; L271-R273 VanDerWaalsContact C-N 3.25Å; L271-R273 PolarHBondContact O-N 3.43Å; R273-N276 PolarHBondContact O-N 2.76Å; R273-Y277 WeakPolarHBondContact O-CB 3.23Å; R273-Y277 PolarHBondContact O-N 3.07Å
274	W	96.3	Very high	94	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-45.6	173.9	170	77.4	0	0	0	112.5	L252 L270 L271 N276 Y277 H278 L303 I307 V368 L371 F372 P376	L252-W274 HydrophobicContact CD1-CB 3.98Å; L252-W274 HydrophobicContact CD2-CB 4.38Å; L270-W274 VanDerWaalsContact O-CB 3.28Å; L270-W274 WeakPolarHBondContact O-CB 3.31Å; L270-W274 PolarHBondContact O-N 3.11Å; L271-W274 HydrophobicContact CD2-CE3 4.32Å; L271-W274 WeakPolarHBondContact O-CB 3.48Å; L271-W274 PolarHBondContact O-N 3.37Å; W274-N276 VanDerWaalsContact C-N 3.34Å; W274-N276 PolarHBondContact O-N 3.31Å; W274-Y277 WeakPolarHBondContact O-CB 3.42Å; W274-Y277 PolarHBondContact O-N 3.18Å; W274-H278 AromaticContact CD1-CD2 3.92Å; W274-H278 AromaticContact CD1-NE2 3.87Å; W274-H278 AromaticContact CE2-CD2 3.59Å; W274-H278 AromaticContact CE2-NE2 3.76Å; W274-H278 AromaticContact NE1-CD2 3.42Å; W274-H278 PolarHBondContact NE1-CD2 3.39Å; W274-H278 AromaticContact NE1-NE2 3.21Å; W274-H278 PolarHBondContact NE1-NE2 2.88Å; W274-H278 PolarHBondContact O-CD2 3.08Å; W274-H278 PolarHBondContact O-N 3.25Å; W274-L303 HydrophobicContact CH2-CD1 3.9Å; W274-L303 HydrophobicContact CH2-CD2 4.14Å; W274-L303 HydrophobicContact CH2-CG 4.32Å; W274-L303 HydrophobicContact CZ2-CD1 4.29Å; W274-L303 HydrophobicContact CZ3-CD1 4.06Å; W274-L303 HydrophobicContact CZ3-CD2 3.92Å; W274-L303 HydrophobicContact CZ3-CG 4.49Å; W274-I307 HydrophobicContact CH2-CD1 4.28Å; W274-I307 HydrophobicContact CH2-CG2 4.23Å; W274-I307 HydrophobicContact CZ2-CG2 3.71Å; W274-V368 HydrophobicContact CE3-CG1 4.19Å; W274-V368 HydrophobicContact CZ3-CG1 3.91Å; W274-L371 HydrophobicContact CH2-CB 4.03Å; W274-F372 AromaticContact CD1-CD2 3.69Å; W274-F372 AromaticContact CD1-CE2 3.85Å; W274-F372 HydrophobicContact CD2-CB 4.38Å; W274-F372 AromaticContact CD2-CD2 3.68Å; W274-F372 HydrophobicContact CD2-CD2 3.68Å; W274-F372 AromaticContact CE2-CD2 3.63Å; W274-F372 HydrophobicContact CE3-CB 4.24Å; W274-F372 HydrophobicContact CE3-CD2 4.32Å; W274-F372 AromaticContact CG-CD2 3.72Å; W274-F372 HydrophobicContact CG-CD2 3.72Å; W274-F372 HydrophobicContact CG-CE2 4.16Å; W274-F372 HydrophobicContact CH2-CB 4.13Å; W274-F372 HydrophobicContact CZ2-CB 4.25Å; W274-F372 HydrophobicContact CZ2-CD2 4.22Å; W274-F372 HydrophobicContact CZ3-CB 4.12Å; W274-F372 AromaticContact NE1-CD2 3.59Å; W274-P376 PolarHBondContact NE1-O 3.04Å
275	V	97.5	Very high	94.5	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-60.2	-48.1	175	173.1	0	0	0	0	110	L271 L272 Y277 H278 L279 I287 F290 L303 V368	L271-V275 WeakPolarHBondContact O-CG2 3.42Å; L271-V275 PolarHBondContact O-N 3.48Å; L272-V275 PolarHBondContact O-N 2.89Å; V275-Y277 VanDerWaalsContact C-N 3.32Å; V275-Y277 PolarHBondContact O-N 3.26Å; V275-H278 PolarHBondContact O-N 3.26Å; V275-H278 VanDerWaalsContact O-N 3.14Å; V275-L279 HydrophobicContact CG1-CD1 3.73Å; V275-L279 HydrophobicContact CG1-CG 4.04Å; V275-L279 WeakPolarHBondContact O-CG 3.35Å; V275-L279 PolarHBondContact O-N 3.03Å; V275-I287 HydrophobicContact CB-CD1 4.39Å; V275-I287 HydrophobicContact CG1-CD1 3.71Å; V275-I287 HydrophobicContact CG1-CG1 4.1Å; V275-F290 HydrophobicContact CG2-CE1 3.99Å; V275-F290 HydrophobicContact CG2-CZ 4.34Å; V275-L303 HydrophobicContact CG1-CD2 4.3Å; V275-L303 HydrophobicContact CG2-CD1 4.5Å; V275-L303 HydrophobicContact CG2-CD2 3.88Å; V275-V368 HydrophobicContact CG2-CG1 3.61Å
276	N	97	Very high	94.9	Very high	26 Å²	26	45.4 Å²	45.4	14%	0.139	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-35.3	-179.2	-76.1	-22.7	0	0	0	113.4	L272 R273 W274 H278 L279 I280 T286 I287	L272-N276 WeakPolarHBondContact O-CB 3.2Å; L272-N276 PolarHBondContact O-N 3.21Å; L272-N276 PolarHBondContact O-ND2 3.15Å; R273-N276 PolarHBondContact O-N 2.76Å; W274-N276 VanDerWaalsContact C-N 3.34Å; W274-N276 PolarHBondContact O-N 3.31Å; N276-H278 VanDerWaalsContact C-N 3.31Å; N276-H278 PolarHBondContact O-N 3.36Å; N276-L279 PolarHBondContact O-N 3.38Å; N276-I280 WeakPolarHBondContact O-CB 3.43Å; N276-I280 WeakPolarHBondContact O-CD1 3.26Å; N276-I280 WeakPolarHBondContact O-CG1 3.41Å; N276-I280 PolarHBondContact O-N 2.95Å; N276-T286 HydrophobicContact CB-CG2 4.02Å; N276-T286 WeakPolarHBondContact OD1-CA 3.24Å; N276-T286 WeakPolarHBondContact OD1-CB 2.94Å; N276-I287 PolarHBondContact ND2-O 2.97Å; N276-I287 WeakPolarHBondContact OD1-CG1 3.41Å; N276-I287 PolarHBondContact OD1-N 2.83Å; N276-I287 PolarHBondContact OD1-O 3.12Å
277	Y	95.5	Very high	95.2	Very high	69 Å²	69	45 Å²	45	27%	0.271	25%	0.249	S	C	.	.	H	α-helix	trans	-55.2	-47.9	172.2	171.9	-93.2	0	0	0	111.4	L252 R273 W274 V275 N281 L378	L252-Y277 HydrophobicContact CD2-CD1 4.29Å; L252-Y277 HydrophobicContact CD2-CD2 4.14Å; L252-Y277 HydrophobicContact CD2-CG 3.75Å; R273-Y277 WeakPolarHBondContact O-CB 3.23Å; R273-Y277 PolarHBondContact O-N 3.07Å; W274-Y277 WeakPolarHBondContact O-CB 3.42Å; W274-Y277 PolarHBondContact O-N 3.18Å; V275-Y277 VanDerWaalsContact C-N 3.32Å; V275-Y277 PolarHBondContact O-N 3.26Å; Y277-N281 WeakPolarHBondContact CE1-ND2 3.5Å; Y277-N281 VanDerWaalsContact O-CG 3.28Å; Y277-N281 PolarHBondContact O-N 3.27Å; Y277-N281 VanDerWaalsContact O-N 3.14Å; Y277-N281 PolarHBondContact O-ND2 2.94Å; Y277-L378 HydrophobicContact CD1-CD2 3.81Å; Y277-L378 HydrophobicContact CE1-CD2 3.71Å
278	H	95.6	Very high	95.4	Very high	4 Å²	4	50 Å²	50	2%	0.019	27%	0.274	C	S	.	.	H	α-helix	trans	-70.8	-38	178.4	-74.4	-56.5	0	0	0	113.1	W274 V275 N276 I280 N281 A282 L303 Q306 P376 G377	W274-H278 AromaticContact CD1-CD2 3.92Å; W274-H278 AromaticContact CD1-NE2 3.87Å; W274-H278 AromaticContact CE2-CD2 3.59Å; W274-H278 AromaticContact CE2-NE2 3.76Å; W274-H278 AromaticContact NE1-CD2 3.42Å; W274-H278 PolarHBondContact NE1-CD2 3.39Å; W274-H278 AromaticContact NE1-NE2 3.21Å; W274-H278 PolarHBondContact NE1-NE2 2.88Å; W274-H278 PolarHBondContact O-CD2 3.08Å; W274-H278 PolarHBondContact O-N 3.25Å; V275-H278 PolarHBondContact O-N 3.26Å; V275-H278 VanDerWaalsContact O-N 3.14Å; N276-H278 VanDerWaalsContact C-N 3.31Å; N276-H278 PolarHBondContact O-N 3.36Å; H278-I280 PolarHBondContact O-N 3.24Å; H278-N281 PolarHBondContact O-N 3.08Å; H278-A282 WeakPolarHBondContact O-CB 3.29Å; H278-A282 PolarHBondContact O-N 2.98Å; H278-L303 HydrophobicContact CB-CD1 3.76Å; H278-Q306 HydrophobicContact CB-CB 4Å; H278-Q306 HydrophobicContact CB-CG 4.33Å; H278-P376 PolarHBondContact NE2-O 2.95Å; H278-G377 PolarHBondContact CE1-O 3.39Å; H278-G377 VanDerWaalsContact CE1-O 3.31Å
279	L	96.8	Very high	95.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-41.3	175.7	-67.3	178.9	0	0	0	112.2	V275 N276 A282 G283 T284 I287 A299 H302	V275-L279 HydrophobicContact CG1-CD1 3.73Å; V275-L279 HydrophobicContact CG1-CG 4.04Å; V275-L279 WeakPolarHBondContact O-CG 3.35Å; V275-L279 PolarHBondContact O-N 3.03Å; N276-L279 PolarHBondContact O-N 3.38Å; L279-A282 CarbonylContact O-C 3.59Å; L279-A282 PolarHBondContact O-N 3.3Å; L279-G283 PolarHBondContact O-N 3.38Å; L279-G283 VanDerWaalsContact O-N 3.17Å; L279-T284 HydrophobicContact CB-CG2 3.84Å; L279-T284 HydrophobicContact CD2-CG2 3.63Å; L279-T284 HydrophobicContact CG-CG2 4.28Å; L279-T284 WeakPolarHBondContact O-CG2 3.38Å; L279-T284 PolarHBondContact O-N 2.76Å; L279-I287 HydrophobicContact CD1-CG1 4.19Å; L279-I287 HydrophobicContact CD1-CG2 4.06Å; L279-A299 HydrophobicContact CD1-CB 4.14Å; L279-A299 HydrophobicContact CD2-CB 4.22Å; L279-A299 WeakPolarHBondContact CD2-O 3.22Å; L279-H302 HydrophobicContact CD2-CB 3.88Å
280	I	95.3	Very high	95.7	Very high	105 Å²	105	45.1 Å²	45.1	54%	0.538	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-45.1	174.5	-69.4	164.3	0	0	0	110.3	N276 H278 A282 G283 T286	N276-I280 WeakPolarHBondContact O-CB 3.43Å; N276-I280 WeakPolarHBondContact O-CD1 3.26Å; N276-I280 WeakPolarHBondContact O-CG1 3.41Å; N276-I280 PolarHBondContact O-N 2.95Å; H278-I280 PolarHBondContact O-N 3.24Å; I280-A282 VanDerWaalsContact C-N 3.25Å; I280-A282 PolarHBondContact O-N 3Å; I280-G283 PolarHBondContact O-N 3.27Å; I280-T286 HydrophobicContact CD1-CG2 3.94Å; I280-T286 HydrophobicContact CG1-CG2 3.67Å
281	N	92.8	Very high	95.7	Very high	85 Å²	85	46.6 Å²	46.6	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-29.5	177.1	-69.7	-17.9	0	0	0	113.1	Y277 H278 G283	Y277-N281 WeakPolarHBondContact CE1-ND2 3.5Å; Y277-N281 VanDerWaalsContact O-CG 3.28Å; Y277-N281 PolarHBondContact O-N 3.27Å; Y277-N281 VanDerWaalsContact O-N 3.14Å; Y277-N281 PolarHBondContact O-ND2 2.94Å; H278-N281 PolarHBondContact O-N 3.08Å; N281-G283 VanDerWaalsContact C-N 3.26Å; N281-G283 PolarHBondContact O-N 2.89Å
282	A	94.3	Very high	95.7	Very high	32 Å²	32	49.5 Å²	49.5	26%	0.264	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-7	172.3	0	0	0	0	0	113.7	H278 L279 I280 T284 H302 Q306	H278-A282 WeakPolarHBondContact O-CB 3.29Å; H278-A282 PolarHBondContact O-N 2.98Å; L279-A282 CarbonylContact O-C 3.59Å; L279-A282 PolarHBondContact O-N 3.3Å; I280-A282 VanDerWaalsContact C-N 3.25Å; I280-A282 PolarHBondContact O-N 3Å; A282-T284 HydrophobicContact CB-CG2 4.27Å; A282-H302 HydrophobicContact CB-CB 4.2Å; A282-Q306 HydrophobicContact CB-CG 3.83Å
283	G	94.9	Very high	95.7	Very high	73 Å²	73	50.3 Å²	50.3	75%	0.753	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	28.6	-178.2	0	0	0	0	0	114.1	L279 I280 N281	L279-G283 PolarHBondContact O-N 3.38Å; L279-G283 VanDerWaalsContact O-N 3.17Å; I280-G283 PolarHBondContact O-N 3.27Å; N281-G283 VanDerWaalsContact C-N 3.26Å; N281-G283 PolarHBondContact O-N 2.89Å
284	T	94.8	Very high	95.7	Very high	48 Å²	48	48.8 Å²	48.8	29%	0.294	29%	0.287	S	S	.	.			trans	-115.2	168.9	178.7	-172.9	0	0	0	0	112.1	L279 A282 H302	L279-T284 HydrophobicContact CB-CG2 3.84Å; L279-T284 HydrophobicContact CD2-CG2 3.63Å; L279-T284 HydrophobicContact CG-CG2 4.28Å; L279-T284 WeakPolarHBondContact O-CG2 3.38Å; L279-T284 PolarHBondContact O-N 2.76Å; A282-T284 HydrophobicContact CB-CG2 4.27Å; T284-H302 HydrophobicContact CG2-CB 4.01Å
285	E	94.3	Very high	95.7	Very high	170 Å²	170	53 Å²	53	79%	0.794	31%	0.305	S	S	*	.			trans	-62.3	145.9	176.7	-63.1	-180	-179	0	0	112.2
286	T	96.6	Very high	95.6	Very high	68 Å²	68	55.4 Å²	55.4	42%	0.417	32%	0.318	S	S	.	.			trans	-82.8	160.8	175.8	53.3	0	0	0	0	111.8	N276 I280	N276-T286 HydrophobicContact CB-CG2 4.02Å; N276-T286 WeakPolarHBondContact OD1-CA 3.24Å; N276-T286 WeakPolarHBondContact OD1-CB 2.94Å; I280-T286 HydrophobicContact CD1-CG2 3.94Å; I280-T286 HydrophobicContact CG1-CG2 3.67Å
287	I	97.4	Very high	95.6	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.036	31%	0.311	C	S	.	.			trans	-110.5	156.7	175.6	62.4	164.9	0	0	0	111.1	L272 V275 N276 L279 F290 D293 I294 A299	L272-I287 HydrophobicContact CD1-CD1 3.95Å; L272-I287 HydrophobicContact CD1-CG1 3.78Å; V275-I287 HydrophobicContact CB-CD1 4.39Å; V275-I287 HydrophobicContact CG1-CD1 3.71Å; V275-I287 HydrophobicContact CG1-CG1 4.1Å; N276-I287 PolarHBondContact ND2-O 2.97Å; N276-I287 WeakPolarHBondContact OD1-CG1 3.41Å; N276-I287 PolarHBondContact OD1-N 2.83Å; N276-I287 PolarHBondContact OD1-O 3.12Å; L279-I287 HydrophobicContact CD1-CG1 4.19Å; L279-I287 HydrophobicContact CD1-CG2 4.06Å; I287-F290 HydrophobicContact CD1-CD1 3.96Å; I287-F290 HydrophobicContact CD1-CE1 3.83Å; I287-D293 HydrophobicContact CB-CB 3.79Å; I287-D293 HydrophobicContact CG2-CB 3.77Å; I287-I294 HydrophobicContact CD1-CG2 3.98Å; I287-A299 HydrophobicContact CG2-CB 3.89Å
288	N	96.6	Very high	95.7	Very high	123 Å²	123	56.9 Å²	56.9	66%	0.658	32%	0.321	S	S	*	.	S	Bend	trans	-115.7	-9.5	178.4	-58.7	-75.4	0	0	0	112.7	L272 D293	L272-N288 WeakPolarHBondContact CD2-O 3.37Å; N288-D293 PolarHBondContact N-OD2 3.1Å
289	N	95.8	Very high	95.8	Very high	45 Å²	45	57.1 Å²	57.1	24%	0.241	32%	0.324	C	S	.	.			trans	-157.7	159.6	-178.6	61.5	79.2	0	0	0	111.6	S291 A292 D293	N289-S291 VanDerWaalsContact C-N 3.28Å; N289-S291 PolarHBondContact O-N 2.89Å; N289-S291 WeakPolarHBondContact OD1-CA 3.43Å; N289-S291 PolarHBondContact OD1-N 3.26Å; N289-S291 PolarHBondContact OD1-OG 2.9Å; N289-A292 PolarHBondContact OD1-N 2.89Å; N289-D293 PolarHBondContact ND2-OD1 3.21Å; N289-D293 PolarHBondContact ND2-OD2 2.85Å; N289-D293 VanDerWaalsContact ND2-OD2 3.13Å; N289-D293 PolarHBondContact OD1-N 3.48Å
290	F	95.9	Very high	95.8	Very high	12 Å²	12	57.2 Å²	57.2	5%	0.053	32%	0.324	C	S	.	.	S	Bend	trans	-92.7	28.3	172.5	-58.2	-54.8	0	0	0	112.9	L271 L272 V275 I287 I294 S361 N364 T365 V368	L271-F290 HydrophobicContact CB-CE2 4.19Å; L271-F290 HydrophobicContact CB-CZ 4.05Å; L272-F290 HydrophobicContact CB-CE2 4.38Å; L272-F290 HydrophobicContact CB-CZ 4.1Å; L272-F290 HydrophobicContact CD1-CE1 4.18Å; L272-F290 HydrophobicContact CD1-CZ 4.15Å; V275-F290 HydrophobicContact CG2-CE1 3.99Å; V275-F290 HydrophobicContact CG2-CZ 4.34Å; I287-F290 HydrophobicContact CD1-CD1 3.96Å; I287-F290 HydrophobicContact CD1-CE1 3.83Å; F290-I294 VanDerWaalsContact C-CG1 3.47Å; F290-I294 WeakPolarHBondContact O-CG1 3.3Å; F290-S361 WeakPolarHBondContact O-CA 3.49Å; F290-N364 HydrophobicContact CB-CB 4.1Å; F290-N364 VanDerWaalsContact O-CB 3.26Å; F290-N364 WeakPolarHBondContact O-CB 3.39Å; F290-T365 HydrophobicContact CD2-CG2 4.27Å; F290-T365 WeakPolarHBondContact CD2-OG1 3.42Å; F290-T365 HydrophobicContact CE2-CG2 4.5Å; F290-V368 HydrophobicContact CD1-CG2 3.99Å; F290-V368 HydrophobicContact CE1-CB 4.32Å; F290-V368 HydrophobicContact CE1-CG1 3.93Å; F290-V368 HydrophobicContact CE1-CG2 3.89Å; F290-V368 HydrophobicContact CZ-CB 4.43Å; F290-V368 HydrophobicContact CZ-CG1 3.84Å; F290-V368 HydrophobicContact CZ-CG2 4.48Å
291	S	94.9	Very high	95.9	Very high	39 Å²	39	52.2 Å²	52.2	27%	0.273	30%	0.298	S	S	.	.	S	Bend	trans	-121.8	-83.9	179.3	54.8	0	0	0	0	112.3	N289 I294 K295 G359	N289-S291 VanDerWaalsContact C-N 3.28Å; N289-S291 PolarHBondContact O-N 2.89Å; N289-S291 WeakPolarHBondContact OD1-CA 3.43Å; N289-S291 PolarHBondContact OD1-N 3.26Å; N289-S291 PolarHBondContact OD1-OG 2.9Å; S291-I294 WeakPolarHBondContact O-CD1 3.32Å; S291-I294 WeakPolarHBondContact O-CG1 3.34Å; S291-K295 WeakPolarHBondContact O-CG 3.37Å; S291-G359 WeakPolarHBondContact CA-O 3.33Å; S291-G359 VanDerWaalsContact CB-O 3.24Å; S291-G359 WeakPolarHBondContact CB-O 3.36Å; S291-G359 VanDerWaalsContact O-CA 3.28Å; S291-G359 WeakPolarHBondContact O-CA 3.4Å
292	A	95.7	Very high	96.1	Very high	61 Å²	61	50.2 Å²	50.2	50%	0.504	29%	0.286	S	S	.	.	S	Bend	trans	-67.8	-39.3	-177.2	0	0	0	0	0	112.8	N289 I294 K295	N289-A292 PolarHBondContact OD1-N 2.89Å; A292-I294 VanDerWaalsContact C-N 3.25Å; A292-I294 PolarHBondContact O-N 2.96Å; A292-K295 WeakPolarHBondContact O-CG 3.22Å
293	D	96.3	Very high	96.2	Very high	56 Å²	56	48.7 Å²	48.7	30%	0.299	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-10.9	-169.1	-58.9	5.3	0	0	0	112.7	I287 N288 N289	I287-D293 HydrophobicContact CB-CB 3.79Å; I287-D293 HydrophobicContact CG2-CB 3.77Å; N288-D293 PolarHBondContact N-OD2 3.1Å; N289-D293 PolarHBondContact ND2-OD1 3.21Å; N289-D293 PolarHBondContact ND2-OD2 2.85Å; N289-D293 VanDerWaalsContact ND2-OD2 3.13Å; N289-D293 PolarHBondContact OD1-N 3.48Å
294	I	95.2	Very high	96.3	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	-5.6	-178.7	59.7	69.8	0	0	0	113.7	I287 F290 S291 A292 D296 S297 Y300 V356 N364	I287-I294 HydrophobicContact CD1-CG2 3.98Å; F290-I294 VanDerWaalsContact C-CG1 3.47Å; F290-I294 WeakPolarHBondContact O-CG1 3.3Å; S291-I294 WeakPolarHBondContact O-CD1 3.32Å; S291-I294 WeakPolarHBondContact O-CG1 3.34Å; A292-I294 VanDerWaalsContact C-N 3.25Å; A292-I294 PolarHBondContact O-N 2.96Å; I294-D296 PolarHBondContact O-N 3.31Å; I294-D296 VanDerWaalsContact O-N 3.08Å; I294-S297 PolarHBondContact O-N 3.43Å; I294-Y300 HydrophobicContact CB-CD2 4.48Å; I294-Y300 HydrophobicContact CB-CE2 3.81Å; I294-Y300 HydrophobicContact CD1-CE2 4.34Å; I294-Y300 HydrophobicContact CG1-CE2 4.28Å; I294-Y300 HydrophobicContact CG2-CE1 4.43Å; I294-Y300 HydrophobicContact CG2-CE2 4.33Å; I294-V356 HydrophobicContact CD1-CG1 4.29Å; I294-V356 WeakPolarHBondContact CD1-O 3.31Å; I294-N364 HydrophobicContact CD1-CB 4.31Å; I294-N364 VanDerWaalsContact CD1-CG 3.48Å; I294-N364 WeakPolarHBondContact CD1-OD1 3.48Å; I294-N364 HydrophobicContact CG1-CB 4.41Å
295	K	96	Very high	96.3	Very high	87 Å²	87	44.9 Å²	44.9	38%	0.378	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.8	-167.7	-64.1	-178.2	72.1	176.7	0	113.7	S291 A292 V356 T357	S291-K295 WeakPolarHBondContact O-CG 3.37Å; A292-K295 WeakPolarHBondContact O-CG 3.22Å; K295-V356 WeakPolarHBondContact CA-O 3.32Å; K295-T357 WeakPolarHBondContact CE-O 3.4Å
296	D	95.8	Very high	96.3	Very high	52 Å²	52	38.9 Å²	38.9	28%	0.278	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	4.2	-177.4	79.2	-8.9	0	0	0	113.4	I294 R298 L331 R334	I294-D296 PolarHBondContact O-N 3.31Å; I294-D296 VanDerWaalsContact O-N 3.08Å; D296-R298 PolarHBondContact O-N 3.05Å; D296-R298 WeakPolarHBondContact OD1-CB 3.07Å; D296-R298 PolarHBondContact OD1-N 3.42Å; D296-R298 WeakPolarHBondContact OD2-CD 3.17Å; D296-R298 WeakPolarHBondContact OD2-CG 3.12Å; D296-R298 IonicContact OD2-NE 2.76Å; D296-L331 HydrophobicContact CB-CD2 4.17Å; D296-R334 WeakPolarHBondContact O-CD 3.17Å; D296-R334 PolarHBondContact O-NH1 3.45Å
297	S	97.5	Very high	96.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	58.8	4.9	-179.4	-54	0	0	0	0	116.3	I294 Y300 F301 A335 V356	I294-S297 PolarHBondContact O-N 3.43Å; S297-Y300 PolarHBondContact O-N 3.16Å; S297-F301 WeakPolarHBondContact O-CD2 3.25Å; S297-F301 PolarHBondContact O-N 2.86Å; S297-F301 VanDerWaalsContact O-N 3.08Å; S297-A335 WeakPolarHBondContact OG-CA 3.35Å; S297-A335 WeakPolarHBondContact OG-CB 3.15Å; S297-V356 WeakPolarHBondContact OG-CG1 3.48Å
298	R	96.7	Very high	95.8	Very high	126 Å²	126	36.1 Å²	36.1	48%	0.475	19%	0.189	S	C	.	.	H	α-helix	trans	-67.5	-47.9	-176	-69	-172.3	172	-147.1	-6.2	111.8	D296 Y300 F301 H302 L326	D296-R298 PolarHBondContact O-N 3.05Å; D296-R298 WeakPolarHBondContact OD1-CB 3.07Å; D296-R298 PolarHBondContact OD1-N 3.42Å; D296-R298 WeakPolarHBondContact OD2-CD 3.17Å; D296-R298 WeakPolarHBondContact OD2-CG 3.12Å; D296-R298 IonicContact OD2-NE 2.76Å; R298-Y300 PolarHBondContact O-N 2.69Å; R298-F301 PolarHBondContact O-N 3.33Å; R298-H302 PolarHBondContact O-CD2 2.98Å; R298-H302 PolarHBondContact O-N 3.17Å; R298-L326 HydrophobicContact CB-CD2 4.26Å; R298-L326 HydrophobicContact CG-CD2 3.97Å
299	A	97.3	Very high	95.1	Very high	10 Å²	10	32.8 Å²	32.8	8%	0.083	18%	0.175	C	C	.	.	H	α-helix	trans	-54.6	-40.7	174.6	0	0	0	0	0	111.3	L279 I287 H302 L303	L279-A299 HydrophobicContact CD1-CB 4.14Å; L279-A299 HydrophobicContact CD2-CB 4.22Å; L279-A299 WeakPolarHBondContact CD2-O 3.22Å; I287-A299 HydrophobicContact CG2-CB 3.89Å; A299-H302 PolarHBondContact O-N 3.28Å; A299-L303 VanDerWaalsContact O-CB 3.29Å; A299-L303 WeakPolarHBondContact O-CB 3.42Å; A299-L303 PolarHBondContact O-N 3.14Å
300	Y	97.7	Very high	94.1	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.008	19%	0.19	C	C	.	.	H	α-helix	trans	-68	-40.2	178.6	-71.3	-40.1	0	0	0	114	I294 S297 R298 H302 L303 L304 M338 V356 N364 F367 V368	I294-Y300 HydrophobicContact CB-CD2 4.48Å; I294-Y300 HydrophobicContact CB-CE2 3.81Å; I294-Y300 HydrophobicContact CD1-CE2 4.34Å; I294-Y300 HydrophobicContact CG1-CE2 4.28Å; I294-Y300 HydrophobicContact CG2-CE1 4.43Å; I294-Y300 HydrophobicContact CG2-CE2 4.33Å; S297-Y300 PolarHBondContact O-N 3.16Å; R298-Y300 PolarHBondContact O-N 2.69Å; Y300-H302 PolarHBondContact O-N 3.23Å; Y300-L303 HydrophobicContact CD1-CD2 4.35Å; Y300-L303 PolarHBondContact O-N 3.43Å; Y300-L304 WeakPolarHBondContact O-CB 3.42Å; Y300-L304 WeakPolarHBondContact O-CG 3.3Å; Y300-L304 PolarHBondContact O-N 3.21Å; Y300-M338 HydrophobicContact CD2-CE 3.64Å; Y300-M338 HydrophobicContact CD2-SD 4.28Å; Y300-M338 HydrophobicContact CE2-CE 4.41Å; Y300-M338 HydrophobicContact CG-CE 4.17Å; Y300-M338 HydrophobicContact CG-SD 4.2Å; Y300-V356 HydrophobicContact CD2-CG1 4.24Å; Y300-V356 HydrophobicContact CE2-CG1 4.14Å; Y300-N364 WeakPolarHBondContact OH-CB 3.42Å; Y300-N364 PolarHBondContact OH-OD1 3.31Å; Y300-N364 VanDerWaalsContact OH-OD1 3.11Å; Y300-F367 HydrophobicContact CD1-CD1 4.42Å; Y300-F367 AromaticContact CD1-CE1 3.96Å; Y300-F367 HydrophobicContact CD1-CE1 3.96Å; Y300-F367 HydrophobicContact CD2-CE1 4.29Å; Y300-F367 AromaticContact CE1-CD1 3.99Å; Y300-F367 HydrophobicContact CE1-CD1 3.99Å; Y300-F367 HydrophobicContact CE1-CE1 4.01Å; Y300-F367 HydrophobicContact CE2-CD1 4.28Å; Y300-F367 HydrophobicContact CE2-CE1 4.28Å; Y300-F367 HydrophobicContact CG-CE1 4.13Å; Y300-F367 AromaticContact CZ-CD1 3.9Å; Y300-V368 HydrophobicContact CE1-CG2 3.56Å
301	F	97.6	Very high	92.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-47.4	174.1	-90.6	-72.4	0	0	0	111.9	S297 R298 L304 D305 M323 L326 R334 L337 M338 E341	S297-F301 WeakPolarHBondContact O-CD2 3.25Å; S297-F301 PolarHBondContact O-N 2.86Å; S297-F301 VanDerWaalsContact O-N 3.08Å; R298-F301 PolarHBondContact O-N 3.33Å; F301-L304 PolarHBondContact O-N 3.46Å; F301-D305 PolarHBondContact O-N 2.69Å; F301-D305 VanDerWaalsContact O-N 3.11Å; F301-M323 HydrophobicContact CB-CE 4.08Å; F301-M323 HydrophobicContact CB-SD 4.17Å; F301-M323 HydrophobicContact CD1-SD 4.17Å; F301-L326 HydrophobicContact CB-CD2 3.79Å; F301-L326 HydrophobicContact CB-CG 4.16Å; F301-L326 HydrophobicContact CD2-CD2 3.71Å; F301-L326 HydrophobicContact CD2-CG 4.23Å; F301-L326 HydrophobicContact CG-CD2 3.93Å; F301-L326 HydrophobicContact CG-CG 4.15Å; F301-R334 HydrophobicContact CE2-CG 3.81Å; F301-L337 HydrophobicContact CZ-CB 4.07Å; F301-M338 HydrophobicContact CD2-CB 4.07Å; F301-M338 HydrophobicContact CD2-CG 4.31Å; F301-M338 HydrophobicContact CE1-CB 4.4Å; F301-M338 HydrophobicContact CE2-CB 3.61Å; F301-M338 HydrophobicContact CE2-CG 4.34Å; F301-M338 HydrophobicContact CZ-CB 3.79Å; F301-E341 HydrophobicContact CE1-CG 4.05Å
302	H	97.1	Very high	91.1	Very high	42 Å²	42	48.6 Å²	48.6	19%	0.194	24%	0.24	C	C	.	.	H	α-helix	trans	-65.6	-40.8	178.5	-71.4	-67.5	0	0	0	112.3	L279 A282 T284 R298 A299 Y300 D305 Q306	L279-H302 HydrophobicContact CD2-CB 3.88Å; A282-H302 HydrophobicContact CB-CB 4.2Å; T284-H302 HydrophobicContact CG2-CB 4.01Å; R298-H302 PolarHBondContact O-CD2 2.98Å; R298-H302 PolarHBondContact O-N 3.17Å; A299-H302 PolarHBondContact O-N 3.28Å; Y300-H302 PolarHBondContact O-N 3.23Å; H302-D305 PolarHBondContact O-N 3.09Å; H302-Q306 WeakPolarHBondContact O-CG 3.36Å; H302-Q306 PolarHBondContact O-N 3Å; H302-Q306 VanDerWaalsContact O-N 3.1Å
303	L	97.1	Very high	89.3	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60	-49.9	175.3	179.5	63.7	0	0	0	111.5	W274 V275 H278 A299 Y300 D305 Q306 I307 L371	W274-L303 HydrophobicContact CH2-CD1 3.9Å; W274-L303 HydrophobicContact CH2-CD2 4.14Å; W274-L303 HydrophobicContact CH2-CG 4.32Å; W274-L303 HydrophobicContact CZ2-CD1 4.29Å; W274-L303 HydrophobicContact CZ3-CD1 4.06Å; W274-L303 HydrophobicContact CZ3-CD2 3.92Å; W274-L303 HydrophobicContact CZ3-CG 4.49Å; V275-L303 HydrophobicContact CG1-CD2 4.3Å; V275-L303 HydrophobicContact CG2-CD1 4.5Å; V275-L303 HydrophobicContact CG2-CD2 3.88Å; H278-L303 HydrophobicContact CB-CD1 3.76Å; A299-L303 VanDerWaalsContact O-CB 3.29Å; A299-L303 WeakPolarHBondContact O-CB 3.42Å; A299-L303 PolarHBondContact O-N 3.14Å; Y300-L303 HydrophobicContact CD1-CD2 4.35Å; Y300-L303 PolarHBondContact O-N 3.43Å; L303-D305 VanDerWaalsContact C-N 3.3Å; L303-D305 PolarHBondContact O-N 3.24Å; L303-Q306 PolarHBondContact O-N 3.18Å; L303-Q306 VanDerWaalsContact O-N 3.16Å; L303-I307 HydrophobicContact CD1-CG2 3.95Å; L303-I307 HydrophobicContact CG-CD1 4.45Å; L303-I307 WeakPolarHBondContact O-CG1 3.44Å; L303-I307 WeakPolarHBondContact O-CG2 3.34Å; L303-I307 PolarHBondContact O-N 2.95Å; L303-L371 HydrophobicContact CD2-CD1 4.05Å
304	L	96.5	Very high	87.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.4	-43	179.3	-71.9	169.2	0	0	0	111.6	Y300 F301 Q306 S308 I321 M338 E341 A342 L345 L371	Y300-L304 WeakPolarHBondContact O-CB 3.42Å; Y300-L304 WeakPolarHBondContact O-CG 3.3Å; Y300-L304 PolarHBondContact O-N 3.21Å; F301-L304 PolarHBondContact O-N 3.46Å; L304-Q306 VanDerWaalsContact C-N 3.35Å; L304-Q306 PolarHBondContact O-N 3.04Å; L304-S308 VanDerWaalsContact O-CB 3.27Å; L304-S308 WeakPolarHBondContact O-CB 3.31Å; L304-S308 PolarHBondContact O-N 3.38Å; L304-I321 HydrophobicContact CB-CD1 4.33Å; L304-I321 HydrophobicContact CB-CG1 4.19Å; L304-I321 HydrophobicContact CB-CG2 4.28Å; L304-M338 HydrophobicContact CD1-CG 3.89Å; L304-M338 HydrophobicContact CD1-SD 3.98Å; L304-E341 HydrophobicContact CD1-CB 4.13Å; L304-A342 HydrophobicContact CD1-CB 4.19Å; L304-A342 HydrophobicContact CD2-CB 3.97Å; L304-L345 HydrophobicContact CD2-CD1 3.79Å; L304-L371 HydrophobicContact CD2-CD1 4.46Å; L304-L371 HydrophobicContact CD2-CD2 3.69Å
305	D	94.7	Very high	85.3	Confident	42 Å²	42	65.5 Å²	65.5	23%	0.225	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-34.8	178.6	-176.5	72.1	0	0	0	113	F301 H302 L303 S308 R310 I321 M323	F301-D305 PolarHBondContact O-N 2.69Å; F301-D305 VanDerWaalsContact O-N 3.11Å; H302-D305 PolarHBondContact O-N 3.09Å; L303-D305 VanDerWaalsContact C-N 3.3Å; L303-D305 PolarHBondContact O-N 3.24Å; D305-S308 PolarHBondContact O-OG 3.34Å; D305-R310 PolarHBondContact O-NH2 2.83Å; D305-R310 VanDerWaalsContact O-NH2 3.16Å; D305-R310 IonicContact OD2-NH2 3.49Å; D305-I321 HydrophobicContact CB-CB 4.27Å; D305-M323 HydrophobicContact CB-CE 4.38Å; D305-M323 HydrophobicContact CB-SD 3.96Å
306	Q	93.4	Very high	83.5	Confident	44 Å²	44	68 Å²	68	21%	0.206	32%	0.321	C	S	.	.	H	α-helix	trans	-73.2	-40.7	177.2	-71	-66.5	-53.8	0	0	113	H278 A282 H302 L303 L304	H278-Q306 HydrophobicContact CB-CB 4Å; H278-Q306 HydrophobicContact CB-CG 4.33Å; A282-Q306 HydrophobicContact CB-CG 3.83Å; H302-Q306 WeakPolarHBondContact O-CG 3.36Å; H302-Q306 PolarHBondContact O-N 3Å; H302-Q306 VanDerWaalsContact O-N 3.1Å; L303-Q306 PolarHBondContact O-N 3.18Å; L303-Q306 VanDerWaalsContact O-N 3.16Å; L304-Q306 VanDerWaalsContact C-N 3.35Å; L304-Q306 PolarHBondContact O-N 3.04Å
307	I	93.1	Very high	82.1	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.041	34%	0.342	C	S	.	.	H	α-helix	trans	-86.2	-13.6	-175.8	71.5	-177.8	0	0	0	113	W274 L303 L345 L371 H375	W274-I307 HydrophobicContact CH2-CD1 4.28Å; W274-I307 HydrophobicContact CH2-CG2 4.23Å; W274-I307 HydrophobicContact CZ2-CG2 3.71Å; L303-I307 HydrophobicContact CD1-CG2 3.95Å; L303-I307 HydrophobicContact CG-CD1 4.45Å; L303-I307 WeakPolarHBondContact O-CG1 3.44Å; L303-I307 WeakPolarHBondContact O-CG2 3.34Å; L303-I307 PolarHBondContact O-N 2.95Å; I307-L345 HydrophobicContact CD1-CD1 4.45Å; I307-L345 HydrophobicContact CG1-CD1 4.24Å; I307-L371 HydrophobicContact CD1-CB 4.11Å; I307-L371 HydrophobicContact CD1-CD2 4.05Å; I307-H375 HydrophobicContact CB-CB 4.19Å; I307-H375 HydrophobicContact CD1-CB 4.22Å; I307-H375 HydrophobicContact CG1-CB 4.22Å
308	S	90.7	Very high	81.1	Confident	8 Å²	8	73.5 Å²	73.5	6%	0.056	35%	0.353	C	S	.	.	S	Bend	trans	-62.9	136.2	178.5	65.5	0	0	0	0	111.7	L304 D305 R310 I319	L304-S308 VanDerWaalsContact O-CB 3.27Å; L304-S308 WeakPolarHBondContact O-CB 3.31Å; L304-S308 PolarHBondContact O-N 3.38Å; D305-S308 PolarHBondContact O-OG 3.34Å; S308-R310 PolarHBondContact O-N 2.9Å; S308-I319 VanDerWaalsContact CB-O 3.3Å; S308-I319 WeakPolarHBondContact CB-O 3.38Å; S308-I319 PolarHBondContact OG-O 3.08Å
309	P	83.1	Confident	80.5	Confident	54 Å²	54	69.8 Å²	69.8	35%	0.351	34%	0.342	S	S	.	.			trans	-65	121.3	177.8	25.3	-32.7	0	0	0	110.1	G318 I319	P309-G318 WeakPolarHBondContact O-CA 3.37Å; P309-I319 HydrophobicContact CG-CB 4.21Å; P309-I319 HydrophobicContact CG-CD1 4.03Å; P309-I319 HydrophobicContact CG-CG1 4.11Å; P309-I319 PolarHBondContact O-N 2.75Å
310	R	74.6	Confident	80.1	Confident	149 Å²	149	78.1 Å²	78.1	56%	0.562	38%	0.376	S	S	*	.			trans	-96.2	-25.2	-175.6	-63.7	-173.9	177.7	177	-0.5	113.9	D305 S308	D305-R310 PolarHBondContact O-NH2 2.83Å; D305-R310 VanDerWaalsContact O-NH2 3.16Å; D305-R310 IonicContact OD2-NH2 3.49Å; S308-R310 PolarHBondContact O-N 2.9Å
311	D	66.6	Low	79.9	Confident	126 Å²	126	78.2 Å²	78.2	67%	0.674	38%	0.377	S	S	*	.			trans	-83.7	127.6	-175.5	-62	-36.6	0	0	0	110.5	D313	D311-D313 PolarHBondContact O-N 2.95Å
312	E	59.8	Low	79.7	Confident	152 Å²	152	82.5 Å²	82.5	71%	0.71	40%	0.4	S	S	*	.			trans	-82.7	95.7	166.4	-72.2	178.9	-173.5	0	0	108	M317	E312-M317 HydrophobicContact CG-SD 4.4Å
313	D	57.8	Low	79.5	Confident	112 Å²	112	83 Å²	83	60%	0.599	40%	0.403	S	S	*	.	B	Isolated β-bridge	trans	-88.3	160.2	168.1	-73.2	-22.6	0	0	0	109.8	D311 F315 H316	D311-D313 PolarHBondContact O-N 2.95Å; D313-F315 PolarHBondContact O-N 3.09Å; D313-H316 PolarHBondContact N-O 3.37Å; D313-H316 PolarHBondContact O-N 3.08Å
314	E	53.5	Low	79.3	Confident	188 Å²	188	86 Å²	86	88%	0.879	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-18.6	-178.6	-95.3	-176.2	161.7	0	0	114.9
315	F	55.2	Low	79.1	Confident	174 Å²	174	86.3 Å²	86.3	76%	0.763	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-9.1	-176.4	-60.2	-82	0	0	0	115	D313	D313-F315 PolarHBondContact O-N 3.09Å
316	H	58.8	Low	79.1	Confident	140 Å²	140	86.1 Å²	86.1	65%	0.648	43%	0.43	S	S	*	.	B	Isolated β-bridge	trans	-139.8	124.7	-173.5	-61.1	90.7	0	0	0	112.2	D313	D313-H316 PolarHBondContact N-O 3.37Å; D313-H316 PolarHBondContact O-N 3.08Å
317	M	65.3	Low	79.1	Confident	145 Å²	145	89.3 Å²	89.3	71%	0.714	46%	0.457	S	S	*	.			trans	-78.4	129.7	173.6	-172.5	66.2	62.7	0	0	109.8	E312 I319	E312-M317 HydrophobicContact CG-SD 4.4Å; M317-I319 PolarHBondContact O-N 2.91Å
318	G	76.4	Confident	79.3	Confident	22 Å²	22	91.3 Å²	91.3	23%	0.227	47%	0.466	C	S	.	.			trans	-56.3	135.4	173.2	0	0	0	0	0	111.4	P309	P309-G318 WeakPolarHBondContact O-CA 3.37Å
319	I	84.7	Confident	79.5	Confident	47 Å²	47	100.9 Å²	100.9	24%	0.241	50%	0.501	C	S	.	.			trans	-97.4	105.3	-177.7	-60.4	172.5	0	0	0	108.2	S308 P309 M317 I321 K344 L345	S308-I319 VanDerWaalsContact CB-O 3.3Å; S308-I319 WeakPolarHBondContact CB-O 3.38Å; S308-I319 PolarHBondContact OG-O 3.08Å; P309-I319 HydrophobicContact CG-CB 4.21Å; P309-I319 HydrophobicContact CG-CD1 4.03Å; P309-I319 HydrophobicContact CG-CG1 4.11Å; P309-I319 PolarHBondContact O-N 2.75Å; M317-I319 PolarHBondContact O-N 2.91Å; I319-I321 HydrophobicContact CG2-CD1 4.45Å; I319-K344 HydrophobicContact CG2-CB 3.85Å; I319-L345 HydrophobicContact CB-CD2 4.1Å; I319-L345 HydrophobicContact CD1-CD2 3.78Å; I319-L345 HydrophobicContact CG2-CD2 3.85Å
320	K	88.7	Confident	80.2	Confident	185 Å²	185	101.2 Å²	101.2	80%	0.804	50%	0.5	S	S	*	.			trans	-85.7	125.3	177.4	-169.5	174.7	-176.7	175.6	0	111.9
321	I	92.8	Very high	81.3	Confident	5 Å²	5	97.7 Å²	97.7	3%	0.026	49%	0.492	C	S	.	.			trans	-80.9	132.4	173.9	-56.7	-55.2	0	0	0	110.4	L304 D305 I319 M323 E341 L345	L304-I321 HydrophobicContact CB-CD1 4.33Å; L304-I321 HydrophobicContact CB-CG1 4.19Å; L304-I321 HydrophobicContact CB-CG2 4.28Å; D305-I321 HydrophobicContact CB-CB 4.27Å; I319-I321 HydrophobicContact CG2-CD1 4.45Å; I321-M323 HydrophobicContact CG2-SD 4.01Å; I321-M323 PolarHBondContact O-N 3.49Å; I321-E341 WeakPolarHBondContact CA-OE2 3.5Å; I321-E341 HydrophobicContact CD1-CB 4.3Å; I321-E341 HydrophobicContact CG2-CB 4.06Å; I321-E341 HydrophobicContact CG2-CG 4.08Å; I321-L345 HydrophobicContact CD1-CD1 4.43Å
322	N	93.3	Very high	82.7	Confident	89 Å²	89	96.6 Å²	96.6	48%	0.476	48%	0.483	S	S	.	.			trans	-86.2	102.1	176.6	-176.2	6	0	0	0	111.3	A324 E341	N322-A324 VanDerWaalsContact C-N 3.25Å; N322-A324 PolarHBondContact O-N 3.12Å; N322-A324 WeakPolarHBondContact OD1-CB 3.32Å; N322-A324 PolarHBondContact OD1-N 3.09Å; N322-E341 PolarHBondContact N-OE2 3.22Å
323	M	94.6	Very high	84.5	Confident	52 Å²	52	95.4 Å²	95.4	26%	0.256	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-76.3	-4.8	-179.5	-59.7	-60.1	-83.3	0	0	114.4	F301 D305 I321 G325 L326	F301-M323 HydrophobicContact CB-CE 4.08Å; F301-M323 HydrophobicContact CB-SD 4.17Å; F301-M323 HydrophobicContact CD1-SD 4.17Å; D305-M323 HydrophobicContact CB-CE 4.38Å; D305-M323 HydrophobicContact CB-SD 3.96Å; I321-M323 HydrophobicContact CG2-SD 4.01Å; I321-M323 PolarHBondContact O-N 3.49Å; M323-G325 PolarHBondContact O-N 3.4Å; M323-G325 VanDerWaalsContact O-N 3.11Å; M323-L326 HydrophobicContact CE-CD1 3.73Å; M323-L326 WeakPolarHBondContact O-CB 3.23Å; M323-L326 PolarHBondContact O-N 3.48Å; M323-L326 VanDerWaalsContact O-N 3.08Å
324	A	92.8	Very high	86.4	Confident	65 Å²	65	90.9 Å²	90.9	54%	0.537	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-60.5	-23.1	179.3	0	0	0	0	0	113.1	N322 L326 S327	N322-A324 VanDerWaalsContact C-N 3.25Å; N322-A324 PolarHBondContact O-N 3.12Å; N322-A324 WeakPolarHBondContact OD1-CB 3.32Å; N322-A324 PolarHBondContact OD1-N 3.09Å; A324-L326 PolarHBondContact O-N 3.38Å; A324-S327 PolarHBondContact O-N 3.32Å
325	G	91.9	Very high	88.5	Confident	5 Å²	5	82 Å²	82	5%	0.052	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-59.8	-24.1	175	0	0	0	0	0	113.9	M323 S327 E328 R334	M323-G325 PolarHBondContact O-N 3.4Å; M323-G325 VanDerWaalsContact O-N 3.11Å; G325-S327 PolarHBondContact O-N 3.39Å; G325-E328 WeakPolarHBondContact O-CB 3.37Å; G325-E328 PolarHBondContact O-N 3.2Å; G325-R334 WeakPolarHBondContact O-CG 3.36Å
326	L	94.1	Very high	90.5	Very high	38 Å²	38	75.5 Å²	75.5	20%	0.199	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-62.2	-24.7	177	-72.3	176.9	0	0	0	113.7	R298 F301 M323 A324 E328	R298-L326 HydrophobicContact CB-CD2 4.26Å; R298-L326 HydrophobicContact CG-CD2 3.97Å; F301-L326 HydrophobicContact CB-CD2 3.79Å; F301-L326 HydrophobicContact CB-CG 4.16Å; F301-L326 HydrophobicContact CD2-CD2 3.71Å; F301-L326 HydrophobicContact CD2-CG 4.23Å; F301-L326 HydrophobicContact CG-CD2 3.93Å; F301-L326 HydrophobicContact CG-CG 4.15Å; M323-L326 HydrophobicContact CE-CD1 3.73Å; M323-L326 WeakPolarHBondContact O-CB 3.23Å; M323-L326 PolarHBondContact O-N 3.48Å; M323-L326 VanDerWaalsContact O-N 3.08Å; A324-L326 PolarHBondContact O-N 3.38Å; L326-E328 VanDerWaalsContact C-N 3.32Å
327	S	94.5	Very high	92.4	Very high	112 Å²	112	70.7 Å²	70.7	78%	0.783	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-81.6	-9.1	177.2	-56.7	0	0	0	0	113.6	A324 G325 W329	A324-S327 PolarHBondContact O-N 3.32Å; G325-S327 PolarHBondContact O-N 3.39Å; S327-W329 PolarHBondContact O-N 2.9Å
328	E	96.9	Very high	93.9	Very high	49 Å²	49	63.8 Å²	63.8	23%	0.229	32%	0.321	C	S	.	.			trans	-66	130.7	176.1	-177.5	55	-103.2	0	0	110.1	G325 L326 D330 R333 R334 L337	G325-E328 WeakPolarHBondContact O-CB 3.37Å; G325-E328 PolarHBondContact O-N 3.2Å; L326-E328 VanDerWaalsContact C-N 3.32Å; E328-D330 PolarHBondContact OE1-N 3.42Å; E328-R333 HydrophobicContact CG-CB 3.87Å; E328-R333 HydrophobicContact CG-CG 3.81Å; E328-R334 HydrophobicContact CB-CB 4.06Å; E328-R334 HydrophobicContact CB-CG 4.45Å; E328-R334 HydrophobicContact CG-CB 4.12Å; E328-R334 VanDerWaalsContact O-CZ 3.22Å; E328-R334 PolarHBondContact O-NE 3.43Å; E328-R334 PolarHBondContact O-NH2 3.1Å; E328-L337 HydrophobicContact CB-CD1 4.26Å; E328-L337 HydrophobicContact CG-CD1 4.47Å
329	W	95.1	Very high	94.9	Very high	210 Å²	210	62.7 Å²	62.7	80%	0.795	31%	0.311	S	S	*	.	S	Bend	trans	-86.3	-32.9	-175.3	63.8	-84.5	0	0	0	111.9	S327 L331	S327-W329 PolarHBondContact O-N 2.9Å; W329-L331 PolarHBondContact O-N 3.42Å
330	D	97.4	Very high	95.5	Very high	61 Å²	61	64.1 Å²	64.1	33%	0.326	32%	0.316	S	S	.	.	S	Bend	trans	-76.9	120.2	176.7	-177.1	-82.8	0	0	0	110.3	E328 E332 R333 R334	E328-D330 PolarHBondContact OE1-N 3.42Å; D330-E332 VanDerWaalsContact C-N 3.31Å; D330-E332 PolarHBondContact O-N 2.87Å; D330-E332 PolarHBondContact OD1-N 3.24Å; D330-R333 HydrophobicContact CB-CB 3.96Å; D330-R333 PolarHBondContact O-N 3Å; D330-R333 WeakPolarHBondContact OD1-CB 3.35Å; D330-R333 PolarHBondContact OD1-N 3.49Å; D330-R334 VanDerWaalsContact O-CB 3.31Å; D330-R334 WeakPolarHBondContact O-CB 3.37Å; D330-R334 PolarHBondContact O-N 3.44Å
331	L	96.9	Very high	95.9	Very high	75 Å²	75	56 Å²	56	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-65.9	-34.4	-173.7	-60.7	-174.8	0	0	0	112.5	D296 W329 R334 A335 T357	D296-L331 HydrophobicContact CB-CD2 4.17Å; W329-L331 PolarHBondContact O-N 3.42Å; L331-R334 VanDerWaalsContact CD2-NH1 3.27Å; L331-R334 PolarHBondContact O-N 3.4Å; L331-A335 WeakPolarHBondContact O-CB 3.29Å; L331-A335 PolarHBondContact O-N 3.08Å; L331-T357 HydrophobicContact CB-CG2 3.84Å; L331-T357 WeakPolarHBondContact O-CG2 3.24Å
332	E	96.8	Very high	96	Very high	102 Å²	102	55.7 Å²	55.7	48%	0.477	28%	0.28	S	S	.	.	H	α-helix	trans	-74.5	-41.2	-178.6	-168.8	169.9	173.3	0	0	110.5	D330 R334 A335 E336 P353 T357	D330-E332 VanDerWaalsContact C-N 3.31Å; D330-E332 PolarHBondContact O-N 2.87Å; D330-E332 PolarHBondContact OD1-N 3.24Å; E332-R334 VanDerWaalsContact C-N 3.33Å; E332-R334 PolarHBondContact O-N 2.94Å; E332-A335 PolarHBondContact O-N 3.2Å; E332-E336 PolarHBondContact O-N 3.26Å; E332-P353 HydrophobicContact CG-CB 3.78Å; E332-T357 HydrophobicContact CB-CG2 4.35Å
333	R	97.3	Very high	96.1	Very high	127 Å²	127	53.7 Å²	53.7	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-42	171.7	-174.4	58.1	178.6	174.1	2.6	111.5	E328 D330 E336 L337	E328-R333 HydrophobicContact CG-CB 3.87Å; E328-R333 HydrophobicContact CG-CG 3.81Å; D330-R333 HydrophobicContact CB-CB 3.96Å; D330-R333 PolarHBondContact O-N 3Å; D330-R333 WeakPolarHBondContact OD1-CB 3.35Å; D330-R333 PolarHBondContact OD1-N 3.49Å; R333-E336 PolarHBondContact O-N 3.5Å; R333-L337 WeakPolarHBondContact O-CG 3.45Å; R333-L337 PolarHBondContact O-N 2.94Å
334	R	98	Very high	96.1	Very high	18 Å²	18	55.9 Å²	55.9	7%	0.068	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-44.2	175.2	-173.6	-170.9	-59.3	151.1	7.1	111.6	D296 F301 G325 E328 D330 L331 E332 E336 L337 M338	D296-R334 WeakPolarHBondContact O-CD 3.17Å; D296-R334 PolarHBondContact O-NH1 3.45Å; F301-R334 HydrophobicContact CE2-CG 3.81Å; G325-R334 WeakPolarHBondContact O-CG 3.36Å; E328-R334 HydrophobicContact CB-CB 4.06Å; E328-R334 HydrophobicContact CB-CG 4.45Å; E328-R334 HydrophobicContact CG-CB 4.12Å; E328-R334 VanDerWaalsContact O-CZ 3.22Å; E328-R334 PolarHBondContact O-NE 3.43Å; E328-R334 PolarHBondContact O-NH2 3.1Å; D330-R334 VanDerWaalsContact O-CB 3.31Å; D330-R334 WeakPolarHBondContact O-CB 3.37Å; D330-R334 PolarHBondContact O-N 3.44Å; L331-R334 VanDerWaalsContact CD2-NH1 3.27Å; L331-R334 PolarHBondContact O-N 3.4Å; E332-R334 VanDerWaalsContact C-N 3.33Å; E332-R334 PolarHBondContact O-N 2.94Å; R334-E336 VanDerWaalsContact C-N 3.33Å; R334-E336 PolarHBondContact O-N 3.28Å; R334-L337 PolarHBondContact O-N 3.27Å; R334-M338 PolarHBondContact O-N 3.06Å
335	A	97.8	Very high	96	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-39	176.1	0	0	0	0	0	111.8	S297 L331 E332 M338 L339 P353 V356 T357	S297-A335 WeakPolarHBondContact OG-CA 3.35Å; S297-A335 WeakPolarHBondContact OG-CB 3.15Å; L331-A335 WeakPolarHBondContact O-CB 3.29Å; L331-A335 PolarHBondContact O-N 3.08Å; E332-A335 PolarHBondContact O-N 3.2Å; A335-M338 WeakPolarHBondContact O-CB 3.39Å; A335-M338 PolarHBondContact O-N 3.13Å; A335-L339 WeakPolarHBondContact O-CG 3.24Å; A335-L339 PolarHBondContact O-N 2.99Å; A335-P353 HydrophobicContact CB-CB 3.98Å; A335-V356 HydrophobicContact CB-CB 4.13Å; A335-V356 HydrophobicContact CB-CG1 4.23Å; A335-T357 HydrophobicContact CB-CG2 4.16Å
336	E	97.7	Very high	96	Very high	38 Å²	38	57 Å²	57	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-43	173.7	176.6	51.8	-145.4	0	0	112.3	E332 R333 R334 M338 L339 Q340 R348 P353	E332-E336 PolarHBondContact O-N 3.26Å; R333-E336 PolarHBondContact O-N 3.5Å; R334-E336 VanDerWaalsContact C-N 3.33Å; R334-E336 PolarHBondContact O-N 3.28Å; E336-M338 VanDerWaalsContact C-N 3.33Å; E336-M338 PolarHBondContact O-N 3.11Å; E336-L339 PolarHBondContact O-N 3.41Å; E336-Q340 WeakPolarHBondContact O-CG 3.35Å; E336-Q340 PolarHBondContact O-N 3.47Å; E336-Q340 WeakPolarHBondContact OE1-CG 3.27Å; E336-Q340 PolarHBondContact OE1-NE2 3.13Å; E336-R348 IonicContact OE1-CZ 3.21Å; E336-R348 IonicContact OE1-NH1 2.81Å; E336-R348 PolarHBondContact OE1-NH1 3.43Å; E336-R348 IonicContact OE1-NH2 2.79Å; E336-R348 PolarHBondContact OE1-NH2 3Å; E336-R348 IonicContact OE2-CZ 2.66Å; E336-R348 IonicContact OE2-NH1 3.68Å; E336-R348 IonicContact OE2-NH2 3.44Å; E336-R348 PolarHBondContact OE2-NH2 3.43Å; E336-P353 HydrophobicContact CB-CB 4.34Å; E336-P353 HydrophobicContact CB-CG 3.74Å; E336-P353 HydrophobicContact CG-CG 4.48Å; E336-P353 VanDerWaalsContact OE2-CG 3.27Å; E336-P353 WeakPolarHBondContact OE2-CG 3.4Å
337	L	97.8	Very high	95.9	Very high	39 Å²	39	55.1 Å²	55.1	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-43.9	174.4	-67.1	173.8	0	0	0	111	F301 E328 R333 R334 L339 Q340 E341	F301-L337 HydrophobicContact CZ-CB 4.07Å; E328-L337 HydrophobicContact CB-CD1 4.26Å; E328-L337 HydrophobicContact CG-CD1 4.47Å; R333-L337 WeakPolarHBondContact O-CG 3.45Å; R333-L337 PolarHBondContact O-N 2.94Å; R334-L337 PolarHBondContact O-N 3.27Å; L337-L339 VanDerWaalsContact C-N 3.32Å; L337-L339 PolarHBondContact O-N 2.85Å; L337-Q340 WeakPolarHBondContact O-CB 3.45Å; L337-Q340 PolarHBondContact O-N 3.18Å; L337-Q340 VanDerWaalsContact O-N 3.16Å; L337-E341 WeakPolarHBondContact O-CG 3.07Å; L337-E341 PolarHBondContact O-N 2.69Å; L337-E341 VanDerWaalsContact O-N 3.1Å
338	M	97.7	Very high	95.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.9	-43.4	174.7	-179.1	-81.1	-65.2	0	0	111.8	Y300 F301 L304 R334 A335 E336 Q340 E341 A342 V356 F367	Y300-M338 HydrophobicContact CD2-CE 3.64Å; Y300-M338 HydrophobicContact CD2-SD 4.28Å; Y300-M338 HydrophobicContact CE2-CE 4.41Å; Y300-M338 HydrophobicContact CG-CE 4.17Å; Y300-M338 HydrophobicContact CG-SD 4.2Å; F301-M338 HydrophobicContact CD2-CB 4.07Å; F301-M338 HydrophobicContact CD2-CG 4.31Å; F301-M338 HydrophobicContact CE1-CB 4.4Å; F301-M338 HydrophobicContact CE2-CB 3.61Å; F301-M338 HydrophobicContact CE2-CG 4.34Å; F301-M338 HydrophobicContact CZ-CB 3.79Å; L304-M338 HydrophobicContact CD1-CG 3.89Å; L304-M338 HydrophobicContact CD1-SD 3.98Å; R334-M338 PolarHBondContact O-N 3.06Å; A335-M338 WeakPolarHBondContact O-CB 3.39Å; A335-M338 PolarHBondContact O-N 3.13Å; E336-M338 VanDerWaalsContact C-N 3.33Å; E336-M338 PolarHBondContact O-N 3.11Å; M338-Q340 VanDerWaalsContact C-N 3.32Å; M338-Q340 PolarHBondContact O-N 2.74Å; M338-E341 WeakPolarHBondContact O-CB 3.26Å; M338-E341 PolarHBondContact O-N 3.46Å; M338-E341 VanDerWaalsContact O-N 3.17Å; M338-A342 PolarHBondContact O-N 3.36Å; M338-V356 HydrophobicContact CE-CG1 4.4Å; M338-V356 HydrophobicContact CE-CG2 3.95Å; M338-F367 HydrophobicContact CE-CE1 4.31Å; M338-F367 HydrophobicContact CE-CZ 4.44Å; M338-F367 HydrophobicContact SD-CE1 4.04Å; M338-F367 HydrophobicContact SD-CZ 3.84Å
339	L	97.2	Very high	95.5	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.3	-24.4	178.6	-68	174.7	0	0	0	113.6	A335 E336 L337 A343 R348 V351 P353 F367	A335-L339 WeakPolarHBondContact O-CG 3.24Å; A335-L339 PolarHBondContact O-N 2.99Å; E336-L339 PolarHBondContact O-N 3.41Å; L337-L339 VanDerWaalsContact C-N 3.32Å; L337-L339 PolarHBondContact O-N 2.85Å; L339-A343 WeakPolarHBondContact O-CB 3.18Å; L339-A343 PolarHBondContact O-N 3.33Å; L339-R348 HydrophobicContact CB-CG 4.38Å; L339-V351 HydrophobicContact CD1-CG2 4.41Å; L339-V351 HydrophobicContact CD2-CG2 3.54Å; L339-P353 HydrophobicContact CD1-CG 4.05Å; L339-F367 HydrophobicContact CD2-CE2 3.92Å; L339-F367 HydrophobicContact CD2-CZ 3.98Å
340	Q	96.8	Very high	95.3	Very high	77 Å²	77	43.6 Å²	43.6	36%	0.36	21%	0.208	S	C	.	.	H	α-helix	trans	-69.5	-39.1	169.3	-70.8	170.4	10.9	0	0	111.1	E336 L337 M338 A343 K344	E336-Q340 WeakPolarHBondContact O-CG 3.35Å; E336-Q340 PolarHBondContact O-N 3.47Å; E336-Q340 WeakPolarHBondContact OE1-CG 3.27Å; E336-Q340 PolarHBondContact OE1-NE2 3.13Å; L337-Q340 WeakPolarHBondContact O-CB 3.45Å; L337-Q340 PolarHBondContact O-N 3.18Å; L337-Q340 VanDerWaalsContact O-N 3.16Å; M338-Q340 VanDerWaalsContact C-N 3.32Å; M338-Q340 PolarHBondContact O-N 2.74Å; Q340-A343 WeakPolarHBondContact O-CB 3.34Å; Q340-A343 PolarHBondContact O-N 2.68Å; Q340-K344 PolarHBondContact O-N 3.49Å
341	E	96.5	Very high	95.2	Very high	13 Å²	13	41 Å²	41	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-65.7	-43.5	173.1	-61.7	-53.8	126	0	0	111.5	F301 L304 I321 N322 L337 M338 A343 K344	F301-E341 HydrophobicContact CE1-CG 4.05Å; L304-E341 HydrophobicContact CD1-CB 4.13Å; I321-E341 WeakPolarHBondContact CA-OE2 3.5Å; I321-E341 HydrophobicContact CD1-CB 4.3Å; I321-E341 HydrophobicContact CG2-CB 4.06Å; I321-E341 HydrophobicContact CG2-CG 4.08Å; N322-E341 PolarHBondContact N-OE2 3.22Å; L337-E341 WeakPolarHBondContact O-CG 3.07Å; L337-E341 PolarHBondContact O-N 2.69Å; L337-E341 VanDerWaalsContact O-N 3.1Å; M338-E341 WeakPolarHBondContact O-CB 3.26Å; M338-E341 PolarHBondContact O-N 3.46Å; M338-E341 VanDerWaalsContact O-N 3.17Å; E341-A343 PolarHBondContact O-N 2.89Å; E341-K344 WeakPolarHBondContact O-CB 3.14Å; E341-K344 PolarHBondContact O-N 2.87Å; E341-K344 VanDerWaalsContact O-N 3.1Å; E341-K344 WeakPolarHBondContact OE1-CE 3.38Å; E341-K344 IonicContact OE1-NZ 3.28Å; E341-K344 PolarHBondContact OE1-NZ 3.42Å; E341-K344 WeakPolarHBondContact OE2-CE 3.41Å; E341-K344 IonicContact OE2-NZ 3.61Å; E341-K344 PolarHBondContact OE2-NZ 3.42Å
342	A	96.3	Very high	95	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-30.8	173.2	0	0	0	0	0	113	L304 M338 K344 L345 D346 C347 F367	L304-A342 HydrophobicContact CD1-CB 4.19Å; L304-A342 HydrophobicContact CD2-CB 3.97Å; M338-A342 PolarHBondContact O-N 3.36Å; A342-K344 VanDerWaalsContact C-N 3.28Å; A342-K344 PolarHBondContact O-N 3.24Å; A342-L345 PolarHBondContact O-N 3.32Å; A342-D346 PolarHBondContact O-N 2.93Å; A342-C347 PolarHBondContact O-N 2.76Å; A342-F367 HydrophobicContact CB-CE2 3.95Å; A342-F367 HydrophobicContact CB-CZ 3.87Å
343	A	94.9	Very high	95	Very high	46 Å²	46	34.7 Å²	34.7	38%	0.38	17%	0.168	S	C	.	.	H	α-helix	trans	-65.4	-30.1	176.1	0	0	0	0	0	112.8	L339 Q340 E341 L345 D346 R348	L339-A343 WeakPolarHBondContact O-CB 3.18Å; L339-A343 PolarHBondContact O-N 3.33Å; Q340-A343 WeakPolarHBondContact O-CB 3.34Å; Q340-A343 PolarHBondContact O-N 2.68Å; E341-A343 PolarHBondContact O-N 2.89Å; A343-L345 PolarHBondContact O-N 2.93Å; A343-D346 PolarHBondContact O-N 3.33Å; A343-R348 HydrophobicContact CB-CB 4.01Å
344	K	93.8	Very high	94.8	Very high	98 Å²	98	36.1 Å²	36.1	43%	0.426	17%	0.173	S	C	.	.	H	α-helix	trans	-63.7	-29	174.8	-58.9	176.7	-173.2	169.5	0	111.9	I319 Q340 E341 A342 D346	I319-K344 HydrophobicContact CG2-CB 3.85Å; Q340-K344 PolarHBondContact O-N 3.49Å; E341-K344 WeakPolarHBondContact O-CB 3.14Å; E341-K344 PolarHBondContact O-N 2.87Å; E341-K344 VanDerWaalsContact O-N 3.1Å; E341-K344 WeakPolarHBondContact OE1-CE 3.38Å; E341-K344 IonicContact OE1-NZ 3.28Å; E341-K344 PolarHBondContact OE1-NZ 3.42Å; E341-K344 WeakPolarHBondContact OE2-CE 3.41Å; E341-K344 IonicContact OE2-NZ 3.61Å; E341-K344 PolarHBondContact OE2-NZ 3.42Å; A342-K344 VanDerWaalsContact C-N 3.28Å; A342-K344 PolarHBondContact O-N 3.24Å; K344-D346 VanDerWaalsContact C-N 3.32Å
345	L	91.3	Very high	94.6	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	7.1	175	-60.2	-179.5	0	0	0	113.1	L304 I307 I319 I321 A342 A343 C347 H375	L304-L345 HydrophobicContact CD2-CD1 3.79Å; I307-L345 HydrophobicContact CD1-CD1 4.45Å; I307-L345 HydrophobicContact CG1-CD1 4.24Å; I319-L345 HydrophobicContact CB-CD2 4.1Å; I319-L345 HydrophobicContact CD1-CD2 3.78Å; I319-L345 HydrophobicContact CG2-CD2 3.85Å; I321-L345 HydrophobicContact CD1-CD1 4.43Å; A342-L345 PolarHBondContact O-N 3.32Å; A343-L345 PolarHBondContact O-N 2.93Å; L345-C347 HydrophobicContact CB-CB 4.33Å; L345-C347 PolarHBondContact O-N 3.48Å; L345-C347 PolarHBondContact O-SG 2.86Å; L345-H375 PolarHBondContact O-NE2 2.78Å
346	D	90.8	Very high	94.5	Very high	89 Å²	89	35.5 Å²	35.5	48%	0.476	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	26.3	-171.2	-165.2	34	0	0	0	114.7	K133 A342 A343 K344	K133-D346 PolarHBondContact NZ-O 3.35Å; K133-D346 VanDerWaalsContact NZ-O 3.12Å; K133-D346 IonicContact NZ-OD1 2.75Å; K133-D346 PolarHBondContact NZ-OD1 3.23Å; K133-D346 IonicContact NZ-OD2 2.78Å; K133-D346 PolarHBondContact NZ-OD2 3.48Å; A342-D346 PolarHBondContact O-N 2.93Å; A343-D346 PolarHBondContact O-N 3.33Å; K344-D346 VanDerWaalsContact C-N 3.32Å
347	C	93.3	Very high	94.4	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.			trans	-110.3	9.7	-170.9	-70.9	0	0	0	0	115.6	A342 L345 Q349 F367 N370 L371 M374	A342-C347 PolarHBondContact O-N 2.76Å; L345-C347 HydrophobicContact CB-CB 4.33Å; L345-C347 PolarHBondContact O-N 3.48Å; L345-C347 PolarHBondContact O-SG 2.86Å; C347-Q349 PolarHBondContact O-N 3.01Å; C347-F367 WeakPolarHBondContact O-CD2 3.2Å; C347-F367 WeakPolarHBondContact O-CE2 3.17Å; C347-N370 WeakPolarHBondContact CA-ND2 3.13Å; C347-N370 PolarHBondContact O-ND2 2.74Å; C347-L371 HydrophobicContact CB-CD2 3.37Å; C347-L371 HydrophobicContact CB-CG 4.32Å; C347-M374 VanDerWaalsContact SG-CB 3.53Å
348	R	93.1	Very high	94.2	Very high	84 Å²	84	36.4 Å²	36.4	32%	0.317	18%	0.183	S	C	.	.			trans	-61.3	-9.7	-175.5	-179	169.9	177.2	112.4	2.8	116	E336 L339 A343	E336-R348 IonicContact OE1-CZ 3.21Å; E336-R348 IonicContact OE1-NH1 2.81Å; E336-R348 PolarHBondContact OE1-NH1 3.43Å; E336-R348 IonicContact OE1-NH2 2.79Å; E336-R348 PolarHBondContact OE1-NH2 3Å; E336-R348 IonicContact OE2-CZ 2.66Å; E336-R348 IonicContact OE2-NH1 3.68Å; E336-R348 IonicContact OE2-NH2 3.44Å; E336-R348 PolarHBondContact OE2-NH2 3.43Å; L339-R348 HydrophobicContact CB-CG 4.38Å; A343-R348 HydrophobicContact CB-CB 4.01Å
349	Q	89.4	Confident	94	Very high	38 Å²	38	37 Å²	37	18%	0.178	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	166.5	-168.6	-58.7	-57.7	-35.5	0	0	113.8	K133 C347 V351 F367	K133-Q349 HydrophobicContact CD-CG 3.89Å; K133-Q349 VanDerWaalsContact CD-NE2 3.3Å; C347-Q349 PolarHBondContact O-N 3.01Å; Q349-V351 VanDerWaalsContact C-N 3.31Å; Q349-V351 PolarHBondContact O-N 3.36Å; Q349-V351 VanDerWaalsContact O-N 3.12Å; Q349-F367 WeakPolarHBondContact O-CD2 3.48Å
350	F	91.8	Very high	93.8	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.026	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.5	-34.1	174.8	-55.9	-72.7	0	0	0	118.7	A126 W130 I233 L237 A366 F367 N370	A126-F350 WeakPolarHBondContact CB-O 3.38Å; W130-F350 HydrophobicContact CB-CE1 4.1Å; W130-F350 HydrophobicContact CB-CZ 4.48Å; W130-F350 AromaticContact CD1-CE1 3.74Å; W130-F350 AromaticContact CD1-CZ 3.28Å; W130-F350 HydrophobicContact CD2-CE1 4.38Å; W130-F350 HydrophobicContact CD2-CZ 4.41Å; W130-F350 AromaticContact CG-CE1 3.8Å; W130-F350 HydrophobicContact CG-CE1 3.8Å; W130-F350 AromaticContact CG-CZ 3.83Å; W130-F350 HydrophobicContact CG-CZ 3.83Å; W130-F350 AromaticContact NE1-CZ 3.58Å; I233-F350 HydrophobicContact CG2-CE1 3.72Å; I233-F350 HydrophobicContact CG2-CZ 4.12Å; L237-F350 HydrophobicContact CD1-CE1 4.25Å; L237-F350 HydrophobicContact CD1-CE2 4.18Å; L237-F350 HydrophobicContact CD1-CZ 3.85Å; L237-F350 HydrophobicContact CD2-CE2 3.95Å; L237-F350 HydrophobicContact CD2-CZ 3.94Å; L237-F350 HydrophobicContact CG-CZ 4.31Å; F350-A366 HydrophobicContact CB-CB 3.92Å; F350-A366 HydrophobicContact CD1-CB 3.82Å; F350-A366 HydrophobicContact CD2-CB 4.12Å; F350-A366 HydrophobicContact CE1-CB 4.37Å; F350-A366 HydrophobicContact CG-CB 3.67Å; F350-F367 HydrophobicContact CB-CB 4.48Å; F350-N370 HydrophobicContact CD2-CB 4.03Å; F350-N370 HydrophobicContact CE2-CB 3.84Å
351	V	93.9	Very high	93.7	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.042	20%	0.2	C	C	.	.			trans	-119.8	144.7	-177.1	-66.3	0	0	0	0	112.6	L339 Q349 D355 V356 L363 F367	L339-V351 HydrophobicContact CD1-CG2 4.41Å; L339-V351 HydrophobicContact CD2-CG2 3.54Å; Q349-V351 VanDerWaalsContact C-N 3.31Å; Q349-V351 PolarHBondContact O-N 3.36Å; Q349-V351 VanDerWaalsContact O-N 3.12Å; V351-D355 HydrophobicContact CB-CB 4.17Å; V351-D355 HydrophobicContact CG1-CB 4.31Å; V351-V356 HydrophobicContact CB-CG2 4.13Å; V351-V356 HydrophobicContact CG2-CG2 4.07Å; V351-L363 VanDerWaalsContact CG1-C 3.43Å; V351-L363 HydrophobicContact CG1-CB 3.73Å; V351-L363 WeakPolarHBondContact CG1-O 3.43Å; V351-F367 HydrophobicContact CG1-CB 3.85Å; V351-F367 HydrophobicContact CG1-CG 4.46Å; V351-F367 HydrophobicContact CG2-CB 3.91Å; V351-F367 HydrophobicContact CG2-CD1 4.14Å; V351-F367 HydrophobicContact CG2-CD2 3.72Å; V351-F367 HydrophobicContact CG2-CE2 4.23Å; V351-F367 HydrophobicContact CG2-CG 3.66Å
352	S	93.8	Very high	93.4	Very high	26 Å²	26	39.9 Å²	39.9	18%	0.182	21%	0.21	C	C	.	.			trans	-98.1	166.8	161.1	74	0	0	0	0	110.6	R354 D355 V356	S352-R354 PolarHBondContact O-N 2.94Å; S352-D355 WeakPolarHBondContact CA-OD2 3.39Å; S352-D355 VanDerWaalsContact CB-OD2 3.23Å; S352-D355 WeakPolarHBondContact CB-OD2 3.49Å; S352-D355 PolarHBondContact N-OD2 3.09Å; S352-D355 WeakPolarHBondContact O-CB 3.3Å; S352-D355 PolarHBondContact O-N 3.3Å; S352-D355 PolarHBondContact OG-N 2.76Å; S352-D355 PolarHBondContact OG-OD2 2.7Å; S352-V356 PolarHBondContact O-N 2.94Å
353	P	96	Very high	93.3	Very high	19 Å²	19	39.9 Å²	39.9	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-52.8	-39.3	174.4	-28.2	36.6	0	0	0	113.1	E332 A335 E336 L339 D355 V356 T357	E332-P353 HydrophobicContact CG-CB 3.78Å; A335-P353 HydrophobicContact CB-CB 3.98Å; E336-P353 HydrophobicContact CB-CB 4.34Å; E336-P353 HydrophobicContact CB-CG 3.74Å; E336-P353 HydrophobicContact CG-CG 4.48Å; E336-P353 VanDerWaalsContact OE2-CG 3.27Å; E336-P353 WeakPolarHBondContact OE2-CG 3.4Å; L339-P353 HydrophobicContact CD1-CG 4.05Å; P353-D355 PolarHBondContact O-N 2.98Å; P353-V356 PolarHBondContact O-N 3.12Å; P353-T357 WeakPolarHBondContact O-CG2 3.39Å; P353-T357 PolarHBondContact O-N 3.36Å; P353-T357 PolarHBondContact O-OG1 2.63Å
354	R	93.9	Very high	93.4	Very high	156 Å²	156	37.7 Å²	37.7	59%	0.589	19%	0.192	S	C	*	.	H	α-helix	trans	-67.9	-32.3	177.5	-171.7	175.7	176.7	-169.2	-4.1	113.2	S352 V356 T357 S358	S352-R354 PolarHBondContact O-N 2.94Å; R354-V356 VanDerWaalsContact C-N 3.33Å; R354-T357 WeakPolarHBondContact CA-OG1 3.47Å; R354-T357 PolarHBondContact O-OG1 2.79Å; R354-S358 WeakPolarHBondContact O-CB 3.47Å; R354-S358 PolarHBondContact O-N 3.25Å; R354-S358 PolarHBondContact O-OG 2.94Å
355	D	93.1	Very high	93.5	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.032	18%	0.175	C	C	.	.	H	α-helix	trans	-69.8	-35.1	177.9	-59.4	-41.8	0	0	0	111.8	E122 V351 S352 P353 S358 G359 N360 L363 N364	E122-D355 WeakPolarHBondContact CB-OD1 3.47Å; E122-D355 WeakPolarHBondContact CG-OD1 3.03Å; V351-D355 HydrophobicContact CB-CB 4.17Å; V351-D355 HydrophobicContact CG1-CB 4.31Å; S352-D355 WeakPolarHBondContact CA-OD2 3.39Å; S352-D355 VanDerWaalsContact CB-OD2 3.23Å; S352-D355 WeakPolarHBondContact CB-OD2 3.49Å; S352-D355 PolarHBondContact N-OD2 3.09Å; S352-D355 WeakPolarHBondContact O-CB 3.3Å; S352-D355 PolarHBondContact O-N 3.3Å; S352-D355 PolarHBondContact OG-N 2.76Å; S352-D355 PolarHBondContact OG-OD2 2.7Å; P353-D355 PolarHBondContact O-N 2.98Å; D355-S358 WeakPolarHBondContact CA-OG 3.36Å; D355-S358 PolarHBondContact O-OG 2.93Å; D355-G359 PolarHBondContact O-N 3.37Å; D355-N360 HydrophobicContact CB-CB 4.42Å; D355-N360 PolarHBondContact O-N 3.23Å; D355-L363 HydrophobicContact CB-CD1 4.13Å; D355-N364 PolarHBondContact O-ND2 2.85Å; D355-N364 VanDerWaalsContact O-ND2 3.12Å
356	V	95.8	Very high	93.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.6	-55.2	172.5	-179.9	0	0	0	0	109.5	I294 K295 S297 Y300 A335 M338 V351 S352 P353 R354 S358 G359	I294-V356 HydrophobicContact CD1-CG1 4.29Å; I294-V356 WeakPolarHBondContact CD1-O 3.31Å; K295-V356 WeakPolarHBondContact CA-O 3.32Å; S297-V356 WeakPolarHBondContact OG-CG1 3.48Å; Y300-V356 HydrophobicContact CD2-CG1 4.24Å; Y300-V356 HydrophobicContact CE2-CG1 4.14Å; A335-V356 HydrophobicContact CB-CB 4.13Å; A335-V356 HydrophobicContact CB-CG1 4.23Å; M338-V356 HydrophobicContact CE-CG1 4.4Å; M338-V356 HydrophobicContact CE-CG2 3.95Å; V351-V356 HydrophobicContact CB-CG2 4.13Å; V351-V356 HydrophobicContact CG2-CG2 4.07Å; S352-V356 PolarHBondContact O-N 2.94Å; P353-V356 PolarHBondContact O-N 3.12Å; R354-V356 VanDerWaalsContact C-N 3.33Å; V356-S358 VanDerWaalsContact C-N 3.29Å; V356-S358 PolarHBondContact O-N 3.42Å; V356-G359 PolarHBondContact O-N 3.29Å
357	T	96.1	Very high	93.9	Very high	28 Å²	28	29.2 Å²	29.2	17%	0.172	15%	0.151	C	C	.	.	H	α-helix	trans	-70.5	-21.7	-175.4	60.2	0	0	0	0	114.2	K295 L331 E332 A335 P353 R354	K295-T357 WeakPolarHBondContact CE-O 3.4Å; L331-T357 HydrophobicContact CB-CG2 3.84Å; L331-T357 WeakPolarHBondContact O-CG2 3.24Å; E332-T357 HydrophobicContact CB-CG2 4.35Å; A335-T357 HydrophobicContact CB-CG2 4.16Å; P353-T357 WeakPolarHBondContact O-CG2 3.39Å; P353-T357 PolarHBondContact O-N 3.36Å; P353-T357 PolarHBondContact O-OG1 2.63Å; R354-T357 WeakPolarHBondContact CA-OG1 3.47Å; R354-T357 PolarHBondContact O-OG1 2.79Å
358	S	93.7	Very high	94.1	Very high	67 Å²	67	29.2 Å²	29.2	47%	0.469	15%	0.151	S	C	.	.	H	α-helix	trans	-80.8	-18.7	170.6	62.2	0	0	0	0	113	R354 D355 V356	R354-S358 WeakPolarHBondContact O-CB 3.47Å; R354-S358 PolarHBondContact O-N 3.25Å; R354-S358 PolarHBondContact O-OG 2.94Å; D355-S358 WeakPolarHBondContact CA-OG 3.36Å; D355-S358 PolarHBondContact O-OG 2.93Å; V356-S358 VanDerWaalsContact C-N 3.29Å; V356-S358 PolarHBondContact O-N 3.42Å
359	G	92.4	Very high	94.2	Very high	13 Å²	13	25.2 Å²	25.2	13%	0.134	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	38.3	-178.4	0	0	0	0	0	113.1	S291 D355 V356 S361	S291-G359 WeakPolarHBondContact CA-O 3.33Å; S291-G359 VanDerWaalsContact CB-O 3.24Å; S291-G359 WeakPolarHBondContact CB-O 3.36Å; S291-G359 VanDerWaalsContact O-CA 3.28Å; S291-G359 WeakPolarHBondContact O-CA 3.4Å; D355-G359 PolarHBondContact O-N 3.37Å; V356-G359 PolarHBondContact O-N 3.29Å; G359-S361 PolarHBondContact O-N 3Å
360	N	93.6	Very high	94.5	Very high	34 Å²	34	24.4 Å²	24.4	18%	0.182	13%	0.133	C	C	.	.			trans	-67	94.8	178.1	-174.3	-32.4	0	0	0	110.5	D355 K362 L363 N364	D355-N360 HydrophobicContact CB-CB 4.42Å; D355-N360 PolarHBondContact O-N 3.23Å; N360-K362 PolarHBondContact O-N 3.33Å; N360-K362 VanDerWaalsContact O-N 3.16Å; N360-K362 PolarHBondContact OD1-N 3.23Å; N360-L363 HydrophobicContact CB-CB 4.48Å; N360-L363 PolarHBondContact O-N 3.2Å; N360-L363 PolarHBondContact OD1-N 2.77Å; N360-N364 PolarHBondContact N-ND2 3.38Å; N360-N364 WeakPolarHBondContact O-CB 3.44Å; N360-N364 PolarHBondContact O-N 2.9Å; N360-N364 PolarHBondContact O-ND2 3.11Å
361	S	93.6	Very high	94.7	Very high	57 Å²	57	24.1 Å²	24.1	40%	0.399	13%	0.132	S	C	.	.	H	α-helix	trans	-53.4	-39.6	-174.1	-173	0	0	0	0	113.5	F290 G359 T365	F290-S361 WeakPolarHBondContact O-CA 3.49Å; G359-S361 PolarHBondContact O-N 3Å; S361-T365 VanDerWaalsContact O-CB 3.28Å; S361-T365 WeakPolarHBondContact O-CB 3.36Å; S361-T365 PolarHBondContact O-N 3.45Å; S361-T365 PolarHBondContact O-OG1 3.32Å
362	K	91.8	Very high	94.8	Very high	60 Å²	60	23.8 Å²	23.8	26%	0.261	13%	0.13	S	C	.	.	H	α-helix	trans	-64.9	-52.7	-177.3	-173.9	-169.6	-79.5	171.3	0	111.4	E123 W230 N360 T365 A366	E123-K362 HydrophobicContact CG-CD 4.34Å; E123-K362 VanDerWaalsContact OE1-CD 3.31Å; E123-K362 WeakPolarHBondContact OE1-CD 3.4Å; E123-K362 WeakPolarHBondContact OE1-CE 3.43Å; E123-K362 IonicContact OE1-NZ 3.6Å; E123-K362 PolarHBondContact OE1-NZ 3.15Å; E123-K362 IonicContact OE2-NZ 2.74Å; E123-K362 PolarHBondContact OE2-NZ 3.44Å; E123-K362 VanDerWaalsContact OE2-NZ 3.13Å; W230-K362 HydrophobicContact CD2-CD 3.5Å; W230-K362 HydrophobicContact CD2-CG 3.74Å; W230-K362 VanDerWaalsContact CE2-CG 3.47Å; W230-K362 HydrophobicContact CE3-CD 3.83Å; W230-K362 HydrophobicContact CE3-CG 3.87Å; W230-K362 HydrophobicContact CG-CD 3.86Å; W230-K362 HydrophobicContact CH2-CD 4.36Å; W230-K362 HydrophobicContact CH2-CG 3.5Å; W230-K362 VanDerWaalsContact CH2-CG 3.5Å; W230-K362 HydrophobicContact CZ2-CD 4.08Å; W230-K362 HydrophobicContact CZ2-CG 3.36Å; W230-K362 HydrophobicContact CZ3-CD 4.24Å; W230-K362 HydrophobicContact CZ3-CG 3.75Å; N360-K362 PolarHBondContact O-N 3.33Å; N360-K362 VanDerWaalsContact O-N 3.16Å; N360-K362 PolarHBondContact OD1-N 3.23Å; K362-T365 PolarHBondContact O-N 2.65Å; K362-A366 PolarHBondContact O-N 3.46Å
363	L	94.1	Very high	94.7	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.4	-38.2	-178.1	-62.8	-177.5	0	0	0	111.6	E122 E123 A126 F127 V351 D355 N360 A366 F367	E122-L363 HydrophobicContact CB-CD1 3.89Å; E123-L363 HydrophobicContact CG-CD2 4.27Å; A126-L363 HydrophobicContact CB-CD1 4.26Å; A126-L363 HydrophobicContact CB-CD2 3.74Å; F127-L363 HydrophobicContact CE1-CD2 4.19Å; V351-L363 VanDerWaalsContact CG1-C 3.43Å; V351-L363 HydrophobicContact CG1-CB 3.73Å; V351-L363 WeakPolarHBondContact CG1-O 3.43Å; D355-L363 HydrophobicContact CB-CD1 4.13Å; N360-L363 HydrophobicContact CB-CB 4.48Å; N360-L363 PolarHBondContact O-N 3.2Å; N360-L363 PolarHBondContact OD1-N 2.77Å; L363-A366 WeakPolarHBondContact O-CB 3.39Å; L363-A366 PolarHBondContact O-N 3.12Å; L363-F367 WeakPolarHBondContact O-CB 3.13Å; L363-F367 PolarHBondContact O-N 2.87Å
364	N	96	Very high	94.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-40.1	175.4	-77.5	-72.9	0	0	0	112.1	F290 I294 Y300 D355 N360 A366 F367 V368	F290-N364 HydrophobicContact CB-CB 4.1Å; F290-N364 VanDerWaalsContact O-CB 3.26Å; F290-N364 WeakPolarHBondContact O-CB 3.39Å; I294-N364 HydrophobicContact CD1-CB 4.31Å; I294-N364 VanDerWaalsContact CD1-CG 3.48Å; I294-N364 WeakPolarHBondContact CD1-OD1 3.48Å; I294-N364 HydrophobicContact CG1-CB 4.41Å; Y300-N364 WeakPolarHBondContact OH-CB 3.42Å; Y300-N364 PolarHBondContact OH-OD1 3.31Å; Y300-N364 VanDerWaalsContact OH-OD1 3.11Å; D355-N364 PolarHBondContact O-ND2 2.85Å; D355-N364 VanDerWaalsContact O-ND2 3.12Å; N360-N364 PolarHBondContact N-ND2 3.38Å; N360-N364 WeakPolarHBondContact O-CB 3.44Å; N360-N364 PolarHBondContact O-N 2.9Å; N360-N364 PolarHBondContact O-ND2 3.11Å; N364-A366 VanDerWaalsContact C-N 3.31Å; N364-A366 PolarHBondContact O-N 2.88Å; N364-F367 PolarHBondContact O-N 3.15Å; N364-V368 WeakPolarHBondContact O-CB 3.3Å; N364-V368 VanDerWaalsContact O-CG2 3.26Å; N364-V368 WeakPolarHBondContact O-CG2 3.39Å; N364-V368 PolarHBondContact O-N 3.5Å
365	T	95.6	Very high	94.4	Very high	12 Å²	12	23 Å²	23	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-61.3	-41.3	172.4	-56.7	0	0	0	0	111	F238 E268 L271 F290 S361 K362 V368 A369	F238-T365 HydrophobicContact CE1-CG2 4.18Å; F238-T365 HydrophobicContact CZ-CG2 3.76Å; E268-T365 HydrophobicContact CG-CG2 4.37Å; L271-T365 HydrophobicContact CD1-CG2 4.4Å; F290-T365 HydrophobicContact CD2-CG2 4.27Å; F290-T365 WeakPolarHBondContact CD2-OG1 3.42Å; F290-T365 HydrophobicContact CE2-CG2 4.5Å; S361-T365 VanDerWaalsContact O-CB 3.28Å; S361-T365 WeakPolarHBondContact O-CB 3.36Å; S361-T365 PolarHBondContact O-N 3.45Å; S361-T365 PolarHBondContact O-OG1 3.32Å; K362-T365 PolarHBondContact O-N 2.65Å; T365-V368 PolarHBondContact O-N 2.72Å; T365-A369 WeakPolarHBondContact O-CB 3.48Å; T365-A369 PolarHBondContact O-N 3.37Å
366	A	94.9	Very high	94.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-65.7	-40.8	177.4	0	0	0	0	0	112.6	W230 L237 F350 K362 L363 N364 A369 N370	W230-A366 HydrophobicContact CH2-CB 4.19Å; W230-A366 HydrophobicContact CZ3-CB 3.93Å; L237-A366 HydrophobicContact CD1-CB 3.7Å; F350-A366 HydrophobicContact CB-CB 3.92Å; F350-A366 HydrophobicContact CD1-CB 3.82Å; F350-A366 HydrophobicContact CD2-CB 4.12Å; F350-A366 HydrophobicContact CE1-CB 4.37Å; F350-A366 HydrophobicContact CG-CB 3.67Å; K362-A366 PolarHBondContact O-N 3.46Å; L363-A366 WeakPolarHBondContact O-CB 3.39Å; L363-A366 PolarHBondContact O-N 3.12Å; N364-A366 VanDerWaalsContact C-N 3.31Å; N364-A366 PolarHBondContact O-N 2.88Å; A366-A369 PolarHBondContact O-N 3.01Å; A366-N370 WeakPolarHBondContact O-CB 3.41Å; A366-N370 PolarHBondContact O-N 2.86Å
367	F	96.6	Very high	93.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-46.1	173.6	174.2	-113.4	0	0	0	111.7	Y300 M338 L339 A342 C347 Q349 F350 V351 L363 N364 N370 L371	Y300-F367 HydrophobicContact CD1-CD1 4.42Å; Y300-F367 AromaticContact CD1-CE1 3.96Å; Y300-F367 HydrophobicContact CD1-CE1 3.96Å; Y300-F367 HydrophobicContact CD2-CE1 4.29Å; Y300-F367 AromaticContact CE1-CD1 3.99Å; Y300-F367 HydrophobicContact CE1-CD1 3.99Å; Y300-F367 HydrophobicContact CE1-CE1 4.01Å; Y300-F367 HydrophobicContact CE2-CD1 4.28Å; Y300-F367 HydrophobicContact CE2-CE1 4.28Å; Y300-F367 HydrophobicContact CG-CE1 4.13Å; Y300-F367 AromaticContact CZ-CD1 3.9Å; M338-F367 HydrophobicContact CE-CE1 4.31Å; M338-F367 HydrophobicContact CE-CZ 4.44Å; M338-F367 HydrophobicContact SD-CE1 4.04Å; M338-F367 HydrophobicContact SD-CZ 3.84Å; L339-F367 HydrophobicContact CD2-CE2 3.92Å; L339-F367 HydrophobicContact CD2-CZ 3.98Å; A342-F367 HydrophobicContact CB-CE2 3.95Å; A342-F367 HydrophobicContact CB-CZ 3.87Å; C347-F367 WeakPolarHBondContact O-CD2 3.2Å; C347-F367 WeakPolarHBondContact O-CE2 3.17Å; Q349-F367 WeakPolarHBondContact O-CD2 3.48Å; F350-F367 HydrophobicContact CB-CB 4.48Å; V351-F367 HydrophobicContact CG1-CB 3.85Å; V351-F367 HydrophobicContact CG1-CG 4.46Å; V351-F367 HydrophobicContact CG2-CB 3.91Å; V351-F367 HydrophobicContact CG2-CD1 4.14Å; V351-F367 HydrophobicContact CG2-CD2 3.72Å; V351-F367 HydrophobicContact CG2-CE2 4.23Å; V351-F367 HydrophobicContact CG2-CG 3.66Å; L363-F367 WeakPolarHBondContact O-CB 3.13Å; L363-F367 PolarHBondContact O-N 2.87Å; N364-F367 PolarHBondContact O-N 3.15Å; F367-N370 WeakPolarHBondContact O-CB 3.45Å; F367-N370 PolarHBondContact O-N 3.29Å; F367-L371 HydrophobicContact CD1-CD1 4.07Å; F367-L371 HydrophobicContact CE1-CD1 3.64Å; F367-L371 HydrophobicContact CE1-CG 4.49Å; F367-L371 HydrophobicContact CE2-CD1 4.39Å; F367-L371 HydrophobicContact CE2-CG 4.44Å; F367-L371 HydrophobicContact CZ-CD1 3.83Å; F367-L371 HydrophobicContact CZ-CD2 4.44Å; F367-L371 HydrophobicContact CZ-CG 4.32Å; F367-L371 WeakPolarHBondContact O-CG 3.33Å; F367-L371 PolarHBondContact O-N 2.83Å
368	V	97.1	Very high	93.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-42.8	177.1	173.2	0	0	0	0	111.9	L271 W274 V275 F290 Y300 N364 T365 N370 L371 F372	L271-V368 HydrophobicContact CB-CG1 4.29Å; L271-V368 HydrophobicContact CD1-CG1 4.45Å; L271-V368 HydrophobicContact CD2-CG1 4.17Å; W274-V368 HydrophobicContact CE3-CG1 4.19Å; W274-V368 HydrophobicContact CZ3-CG1 3.91Å; V275-V368 HydrophobicContact CG2-CG1 3.61Å; F290-V368 HydrophobicContact CD1-CG2 3.99Å; F290-V368 HydrophobicContact CE1-CB 4.32Å; F290-V368 HydrophobicContact CE1-CG1 3.93Å; F290-V368 HydrophobicContact CE1-CG2 3.89Å; F290-V368 HydrophobicContact CZ-CB 4.43Å; F290-V368 HydrophobicContact CZ-CG1 3.84Å; F290-V368 HydrophobicContact CZ-CG2 4.48Å; Y300-V368 HydrophobicContact CE1-CG2 3.56Å; N364-V368 WeakPolarHBondContact O-CB 3.3Å; N364-V368 VanDerWaalsContact O-CG2 3.26Å; N364-V368 WeakPolarHBondContact O-CG2 3.39Å; N364-V368 PolarHBondContact O-N 3.5Å; T365-V368 PolarHBondContact O-N 2.72Å; V368-N370 VanDerWaalsContact C-N 3.3Å; V368-N370 PolarHBondContact O-N 3.31Å; V368-L371 WeakPolarHBondContact O-CB 3.27Å; V368-L371 PolarHBondContact O-N 3.44Å; V368-F372 PolarHBondContact O-N 3.41Å
369	A	96.2	Very high	92.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.8	-41.1	175	0	0	0	0	0	111.9	L237 F238 I241 L271 T365 A366 F372 N373	L237-A369 HydrophobicContact CB-CB 4Å; L237-A369 HydrophobicContact CD1-CB 4.42Å; L237-A369 HydrophobicContact CD2-CB 4.49Å; F238-A369 HydrophobicContact CD1-CB 4.13Å; F238-A369 HydrophobicContact CE1-CB 3.86Å; I241-A369 HydrophobicContact CD1-CB 4.03Å; L271-A369 HydrophobicContact CD1-CB 3.73Å; T365-A369 WeakPolarHBondContact O-CB 3.48Å; T365-A369 PolarHBondContact O-N 3.37Å; A366-A369 PolarHBondContact O-N 3.01Å; A369-F372 PolarHBondContact O-N 3.07Å; A369-N373 VanDerWaalsContact O-CG 3.26Å; A369-N373 PolarHBondContact O-N 3.05Å; A369-N373 PolarHBondContact O-ND2 3.32Å
370	N	95.1	Very high	90.6	Very high	21 Å²	21	38.8 Å²	38.8	11%	0.112	20%	0.204	C	C	.	.	H	α-helix	trans	-63.8	-40.3	175.3	-173.5	68.6	0	0	0	112.2	L237 C347 F350 A366 F367 V368 M374	L237-N370 HydrophobicContact CD2-CB 4.48Å; C347-N370 WeakPolarHBondContact CA-ND2 3.13Å; C347-N370 PolarHBondContact O-ND2 2.74Å; F350-N370 HydrophobicContact CD2-CB 4.03Å; F350-N370 HydrophobicContact CE2-CB 3.84Å; A366-N370 WeakPolarHBondContact O-CB 3.41Å; A366-N370 PolarHBondContact O-N 2.86Å; F367-N370 WeakPolarHBondContact O-CB 3.45Å; F367-N370 PolarHBondContact O-N 3.29Å; V368-N370 VanDerWaalsContact C-N 3.3Å; V368-N370 PolarHBondContact O-N 3.31Å; N370-M374 WeakPolarHBondContact O-CB 3.49Å; N370-M374 VanDerWaalsContact O-CG 3.25Å; N370-M374 WeakPolarHBondContact O-CG 3.43Å; N370-M374 PolarHBondContact O-N 2.76Å
371	L	95.6	Very high	88.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-46.8	173.4	-70.2	170.2	0	0	0	111.5	W274 L303 L304 I307 C347 F367 V368 M374 H375	W274-L371 HydrophobicContact CH2-CB 4.03Å; L303-L371 HydrophobicContact CD2-CD1 4.05Å; L304-L371 HydrophobicContact CD2-CD1 4.46Å; L304-L371 HydrophobicContact CD2-CD2 3.69Å; I307-L371 HydrophobicContact CD1-CB 4.11Å; I307-L371 HydrophobicContact CD1-CD2 4.05Å; C347-L371 HydrophobicContact CB-CD2 3.37Å; C347-L371 HydrophobicContact CB-CG 4.32Å; F367-L371 HydrophobicContact CD1-CD1 4.07Å; F367-L371 HydrophobicContact CE1-CD1 3.64Å; F367-L371 HydrophobicContact CE1-CG 4.49Å; F367-L371 HydrophobicContact CE2-CD1 4.39Å; F367-L371 HydrophobicContact CE2-CG 4.44Å; F367-L371 HydrophobicContact CZ-CD1 3.83Å; F367-L371 HydrophobicContact CZ-CD2 4.44Å; F367-L371 HydrophobicContact CZ-CG 4.32Å; F367-L371 WeakPolarHBondContact O-CG 3.33Å; F367-L371 PolarHBondContact O-N 2.83Å; V368-L371 WeakPolarHBondContact O-CB 3.27Å; V368-L371 PolarHBondContact O-N 3.44Å; L371-M374 PolarHBondContact O-N 2.88Å; L371-H375 CarbonylContact O-C 3.51Å; L371-H375 PolarHBondContact O-N 3.14Å
372	F	95.4	Very high	86.5	Confident	1 Å²	1	46.4 Å²	46.4	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-48.4	177.9	175.5	-92.1	0	0	0	111.9	I241 N246 L249 L271 W274 V368 A369 M374 H375 P376 L378	I241-F372 HydrophobicContact CB-CE1 4.34Å; I241-F372 HydrophobicContact CD1-CD1 4.3Å; I241-F372 HydrophobicContact CG1-CD1 3.74Å; I241-F372 HydrophobicContact CG1-CE1 3.9Å; I241-F372 HydrophobicContact CG2-CE1 4.41Å; N246-F372 VanDerWaalsContact ND2-CZ 3.34Å; N246-F372 WeakPolarHBondContact ND2-CZ 3.23Å; L249-F372 HydrophobicContact CD1-CZ 4.17Å; L249-F372 HydrophobicContact CD2-CE2 3.6Å; L249-F372 HydrophobicContact CD2-CZ 3.58Å; L249-F372 HydrophobicContact CG-CE2 4.39Å; L249-F372 HydrophobicContact CG-CZ 3.95Å; L271-F372 HydrophobicContact CD2-CB 3.67Å; L271-F372 HydrophobicContact CD2-CD2 4.4Å; L271-F372 HydrophobicContact CD2-CG 3.96Å; W274-F372 AromaticContact CD1-CD2 3.69Å; W274-F372 AromaticContact CD1-CE2 3.85Å; W274-F372 HydrophobicContact CD2-CB 4.38Å; W274-F372 AromaticContact CD2-CD2 3.68Å; W274-F372 HydrophobicContact CD2-CD2 3.68Å; W274-F372 AromaticContact CE2-CD2 3.63Å; W274-F372 HydrophobicContact CE3-CB 4.24Å; W274-F372 HydrophobicContact CE3-CD2 4.32Å; W274-F372 AromaticContact CG-CD2 3.72Å; W274-F372 HydrophobicContact CG-CD2 3.72Å; W274-F372 HydrophobicContact CG-CE2 4.16Å; W274-F372 HydrophobicContact CH2-CB 4.13Å; W274-F372 HydrophobicContact CZ2-CB 4.25Å; W274-F372 HydrophobicContact CZ2-CD2 4.22Å; W274-F372 HydrophobicContact CZ3-CB 4.12Å; W274-F372 AromaticContact NE1-CD2 3.59Å; V368-F372 PolarHBondContact O-N 3.41Å; A369-F372 PolarHBondContact O-N 3.07Å; F372-M374 VanDerWaalsContact C-N 3.26Å; F372-M374 PolarHBondContact O-N 3.06Å; F372-H375 CarbonylContact O-C 3.53Å; F372-H375 PolarHBondContact O-N 3.28Å; F372-P376 HydrophobicContact CD2-CB 4.49Å; F372-P376 HydrophobicContact CE2-CB 4.24Å; F372-P376 WeakPolarHBondContact O-CA 3.47Å; F372-P376 WeakPolarHBondContact O-CD 3.39Å; F372-P376 WeakPolarHBondContact O-CG 3.45Å; F372-P376 VanDerWaalsContact O-N 3.12Å; F372-L378 HydrophobicContact CE2-CD1 4.27Å
373	N	92.4	Very high	84.6	Confident	53 Å²	53	49.2 Å²	49.2	28%	0.283	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-31.7	-177	-70.3	-21.1	0	0	0	112.8	L237 A369	L237-N373 PolarHBondContact O-ND2 2.93Å; A369-N373 VanDerWaalsContact O-CG 3.26Å; A369-N373 PolarHBondContact O-N 3.05Å; A369-N373 PolarHBondContact O-ND2 3.32Å
374	M	90.7	Very high	82.2	Confident	91 Å²	91	56 Å²	56	45%	0.448	28%	0.284	S	S	.	.	H	α-helix	trans	-87.4	-39.9	-179.8	-65.4	-64.4	-66.1	0	0	112.4	C347 N370 L371 F372	C347-M374 VanDerWaalsContact SG-CB 3.53Å; N370-M374 WeakPolarHBondContact O-CB 3.49Å; N370-M374 VanDerWaalsContact O-CG 3.25Å; N370-M374 WeakPolarHBondContact O-CG 3.43Å; N370-M374 PolarHBondContact O-N 2.76Å; L371-M374 PolarHBondContact O-N 2.88Å; F372-M374 VanDerWaalsContact C-N 3.26Å; F372-M374 PolarHBondContact O-N 3.06Å
375	H	91.9	Very high	80.1	Confident	39 Å²	39	59.6 Å²	59.6	18%	0.181	30%	0.303	C	S	.	.			trans	-140.1	75.7	-174.2	-57.7	-78.8	0	0	0	110.5	I307 L345 L371 F372 G377	I307-H375 HydrophobicContact CB-CB 4.19Å; I307-H375 HydrophobicContact CD1-CB 4.22Å; I307-H375 HydrophobicContact CG1-CB 4.22Å; L345-H375 PolarHBondContact O-NE2 2.78Å; L371-H375 CarbonylContact O-C 3.51Å; L371-H375 PolarHBondContact O-N 3.14Å; F372-H375 CarbonylContact O-C 3.53Å; F372-H375 PolarHBondContact O-N 3.28Å; H375-G377 PolarHBondContact O-N 3.07Å
376	P	90.6	Very high	77.5	Confident	38 Å²	38	66.1 Å²	66.1	25%	0.247	34%	0.338	C	S	.	.			trans	-59.5	-34.3	179.7	-21.5	28.6	0	0	0	112.8	W274 H278 F372 L378	W274-P376 PolarHBondContact NE1-O 3.04Å; H278-P376 PolarHBondContact NE2-O 2.95Å; F372-P376 HydrophobicContact CD2-CB 4.49Å; F372-P376 HydrophobicContact CE2-CB 4.24Å; F372-P376 WeakPolarHBondContact O-CA 3.47Å; F372-P376 WeakPolarHBondContact O-CD 3.39Å; F372-P376 WeakPolarHBondContact O-CG 3.45Å; F372-P376 VanDerWaalsContact O-N 3.12Å; P376-L378 PolarHBondContact O-N 3.44Å
377	G	87	Confident	75.2	Confident	42 Å²	42	69.5 Å²	69.5	43%	0.433	37%	0.373	S	S	.	.			trans	61.9	14.6	179.2	0	0	0	0	0	114.7	H278 H375	H278-G377 PolarHBondContact CE1-O 3.39Å; H278-G377 VanDerWaalsContact CE1-O 3.31Å; H375-G377 PolarHBondContact O-N 3.07Å
378	L	85.3	Confident	73	Confident	25 Å²	25	75.8 Å²	75.8	13%	0.131	40%	0.402	C	S	.	.			trans	-91.8	122.2	179.3	-62.2	174.6	0	0	0	109.3	G248 L249 L252 Y277 F372 P376	G248-L378 VanDerWaalsContact C-CD1 3.46Å; G248-L378 VanDerWaalsContact O-CD1 3.32Å; G248-L378 WeakPolarHBondContact O-CD1 3.41Å; L249-L378 HydrophobicContact CD2-CD1 4.06Å; L249-L378 HydrophobicContact CG-CD1 4.47Å; L252-L378 HydrophobicContact CD2-CD2 4.01Å; Y277-L378 HydrophobicContact CD1-CD2 3.81Å; Y277-L378 HydrophobicContact CE1-CD2 3.71Å; F372-L378 HydrophobicContact CE2-CD1 4.27Å; P376-L378 PolarHBondContact O-N 3.44Å
379	Q	70.4	Confident	71.1	Confident	163 Å²	163	83.7 Å²	83.7	76%	0.762	44%	0.439	S	S	*	.			trans	-68.6	137.1	168.9	-65.9	-173	-3.3	0	0	108.6	A381	Q379-A381 PolarHBondContact O-N 2.89Å
380	K	59.6	Low	69.7	Low	179 Å²	179	85.6 Å²	85.6	78%	0.778	45%	0.448	S	S	*	.			trans	-56.7	111.3	170.2	-74.2	-169.6	177.5	-168	0	107.5	K382	K380-K382 PolarHBondContact O-N 3.32Å
381	A	54	Low	68.4	Low	39 Å²	39	90.8 Å²	90.8	32%	0.322	47%	0.472	S	S	.	.			trans	-59.7	132.1	-179.2	0	0	0	0	0	108.4	A251 Q379 F383	A251-A381 HydrophobicContact CB-CB 4.43Å; Q379-A381 PolarHBondContact O-N 2.89Å; A381-F383 HydrophobicContact CB-CD2 3.37Å; A381-F383 HydrophobicContact CB-CE2 3.94Å; A381-F383 HydrophobicContact CB-CG 4.36Å; A381-F383 PolarHBondContact O-N 3.43Å
382	K	47.3	Very low	67.4	Low	211 Å²	211	93.7 Å²	93.7	92%	0.917	50%	0.496	S	S	*	.			trans	-73.2	39.4	168.6	-64.7	-178.5	-179.9	176.3	0	110.5	K380 N384	K380-K382 PolarHBondContact O-N 3.32Å; K382-N384 PolarHBondContact O-N 3.01Å
383	F	50.8	Low	66.9	Low	120 Å²	120	96.2 Å²	96.2	53%	0.526	51%	0.508	S	S	.	.			trans	-70.6	116	165.4	-79.6	-71.6	0	0	0	105.7	I250 A381 L385	I250-F383 HydrophobicContact CG2-CD2 4.17Å; A381-F383 HydrophobicContact CB-CD2 3.37Å; A381-F383 HydrophobicContact CB-CE2 3.94Å; A381-F383 HydrophobicContact CB-CG 4.36Å; A381-F383 PolarHBondContact O-N 3.43Å; F383-L385 HydrophobicContact CB-CG 4.28Å; F383-L385 PolarHBondContact O-N 3.06Å
384	N	43.2	Very low	66.8	Low	141 Å²	141	96.2 Å²	96.2	75%	0.754	51%	0.51	S	S	*	.			trans	-65.9	81.2	162.8	-76.5	-13.3	0	0	0	106.7	K382 D386	K382-N384 PolarHBondContact O-N 3.01Å; N384-D386 PolarHBondContact O-N 3.15Å
385	L	53.2	Low	66.6	Low	76 Å²	76	95.6 Å²	95.6	40%	0.398	50%	0.502	S	S	.	.			trans	-73	58.7	162.3	-71.1	160.9	0	0	0	107.4	I250 F383 G387 E388	I250-L385 HydrophobicContact CD1-CD1 3.69Å; F383-L385 HydrophobicContact CB-CG 4.28Å; F383-L385 PolarHBondContact O-N 3.06Å; L385-G387 PolarHBondContact O-N 3.3Å; L385-E388 HydrophobicContact CD2-CB 4.27Å
386	D	39.5	Very low	66.5	Low	149 Å²	149	96.5 Å²	96.5	80%	0.797	51%	0.507	S	S	*	.	S	Bend	trans	-70.9	77.1	168.5	-75.5	-31.2	0	0	0	107.1	N384	N384-D386 PolarHBondContact O-N 3.15Å
387	G	47.2	Very low	66.6	Low	71 Å²	71	95 Å²	95	73%	0.732	50%	0.497	S	S	*	.	S	Bend	trans	124.9	-8.6	162.4	0	0	0	0	0	118.8	L385 H389	L385-G387 PolarHBondContact O-N 3.3Å; G387-H389 PolarHBondContact O-N 2.83Å
388	E	50	Low	66.7	Low	133 Å²	133	95.4 Å²	95.4	62%	0.621	49%	0.487	S	S	*	.			trans	-88.3	88.7	172.8	-73.8	-170	170.1	0	0	110.5	L385 I390	L385-E388 HydrophobicContact CD2-CB 4.27Å; E388-I390 PolarHBondContact O-N 3.49Å; E388-I390 VanDerWaalsContact O-N 3.17Å
389	H	57.8	Low	67.1	Low	166 Å²	166	94.5 Å²	94.5	77%	0.769	48%	0.482	S	S	*	.			trans	-69.7	107.4	170	-169.8	63	0	0	0	108.8	G387 E391	G387-H389 PolarHBondContact O-N 2.83Å; H389-E391 PolarHBondContact O-N 3.45Å
390	I	66.2	Low	68.3	Low	39 Å²	39	86.7 Å²	86.7	20%	0.2	45%	0.445	C	S	.	.			trans	-66.5	102.8	171.9	-56.9	178.5	0	0	0	107.3	I243 T244 I250 L259 M263 E388 A392	I243-I390 HydrophobicContact CG2-CD1 3.7Å; T244-I390 HydrophobicContact CG2-CG2 3.86Å; I250-I390 HydrophobicContact CD1-CD1 3.86Å; L259-I390 HydrophobicContact CD2-CD1 4.23Å; L259-I390 HydrophobicContact CD2-CG1 4.41Å; M263-I390 HydrophobicContact SD-CG2 3.89Å; E388-I390 PolarHBondContact O-N 3.49Å; E388-I390 VanDerWaalsContact O-N 3.17Å; I390-A392 PolarHBondContact O-N 3.48Å
391	E	69.2	Low	69.9	Low	130 Å²	130	80.1 Å²	80.1	61%	0.607	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-65.7	116	177.1	-77.6	-166.8	-178.5	0	0	109.8	H389 R488	H389-E391 PolarHBondContact O-N 3.45Å; E391-R488 IonicContact OE2-CZ 2.83Å; E391-R488 IonicContact OE2-NH1 3.13Å; E391-R488 PolarHBondContact OE2-NH1 3.08Å
392	A	74.6	Confident	71.8	Confident	61 Å²	61	78.7 Å²	78.7	50%	0.504	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-64.6	150.4	174.4	0	0	0	0	0	111.9	T244 I390 T394	T244-A392 HydrophobicContact CG2-CB 4.46Å; I390-A392 PolarHBondContact O-N 3.48Å; A392-T394 PolarHBondContact O-N 3.39Å
393	E	85	Confident	74.1	Confident	54 Å²	54	68.7 Å²	68.7	25%	0.252	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-53.2	123.9	171.4	-173.8	-174.6	-136.9	0	0	110.2	E397 K398 R401	E393-E397 HydrophobicContact CG-CB 3.62Å; E393-K398 VanDerWaalsContact CD-CA 3.49Å; E393-K398 HydrophobicContact CG-CB 4.24Å; E393-K398 WeakPolarHBondContact OE1-CA 3.15Å; E393-K398 PolarHBondContact OE1-N 3.43Å; E393-K398 VanDerWaalsContact OE2-CB 3.25Å; E393-K398 WeakPolarHBondContact OE2-CB 3.17Å; E393-K398 WeakPolarHBondContact OE2-CG 3.36Å; E393-R401 IonicContact OE1-CZ 3.74Å; E393-R401 IonicContact OE1-NE 2.86Å; E393-R401 PolarHBondContact OE1-NE 3.45Å; E393-R401 IonicContact OE1-NH2 3.78Å; E393-R401 IonicContact OE2-CZ 3.68Å; E393-R401 IonicContact OE2-NE 2.65Å; E393-R401 PolarHBondContact OE2-NE 3.1Å; E393-R401 IonicContact OE2-NH2 3.35Å; E393-R401 PolarHBondContact OE2-NH2 3.42Å
394	T	88.9	Confident	76.2	Confident	53 Å²	53	63 Å²	63	33%	0.325	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-71.3	158.6	175.4	63.9	0	0	0	0	111	A392 E396 E397 K398	A392-T394 PolarHBondContact O-N 3.39Å; T394-E396 VanDerWaalsContact C-N 3.25Å; T394-E396 PolarHBondContact O-N 3.44Å; T394-E397 WeakPolarHBondContact CB-OE2 3.49Å; T394-E397 PolarHBondContact N-OE2 3.32Å; T394-E397 PolarHBondContact O-N 2.9Å; T394-E397 VanDerWaalsContact O-N 3.17Å; T394-E397 VanDerWaalsContact OG1-CG 3.26Å; T394-E397 WeakPolarHBondContact OG1-CG 3.45Å; T394-E397 PolarHBondContact OG1-N 3.06Å; T394-E397 PolarHBondContact OG1-OE2 2.91Å; T394-K398 PolarHBondContact O-N 3.15Å
395	R	87.4	Confident	78.6	Confident	78 Å²	78	56.4 Å²	56.4	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-58.7	-34.9	176.7	-62.9	-169.6	-49.6	-138	-7	113.5	T399 L603 D605 E609	R395-T399 WeakPolarHBondContact O-CB 3.32Å; R395-T399 PolarHBondContact O-N 3.25Å; R395-T399 PolarHBondContact O-OG1 3.31Å; R395-L603 HydrophobicContact CB-CD1 4.13Å; R395-L603 HydrophobicContact CG-CD1 4.22Å; R395-D605 IonicContact NH1-OD1 3.79Å; R395-E609 IonicContact CZ-OE1 3.46Å; R395-E609 VanDerWaalsContact CZ-OE1 3.25Å; R395-E609 IonicContact CZ-OE2 2.99Å; R395-E609 IonicContact NH1-OE1 2.72Å; R395-E609 PolarHBondContact NH1-OE1 2.89Å; R395-E609 IonicContact NH2-OE1 3.56Å; R395-E609 PolarHBondContact NH2-OE1 2.97Å; R395-E609 IonicContact NH2-OE2 2.84Å; R395-E609 PolarHBondContact NH2-OE2 3.27Å
396	E	89.3	Confident	80.5	Confident	59 Å²	59	52.9 Å²	52.9	28%	0.276	28%	0.28	S	S	.	.	H	α-helix	trans	-66.4	-46	177.1	-173.7	175.8	-149.5	0	0	110.5	T394 T399 F400 K613	T394-E396 VanDerWaalsContact C-N 3.25Å; T394-E396 PolarHBondContact O-N 3.44Å; E396-T399 PolarHBondContact O-N 3.25Å; E396-F400 HydrophobicContact CG-CD2 4.17Å; E396-F400 HydrophobicContact CG-CE1 4.31Å; E396-F400 HydrophobicContact CG-CE2 3.59Å; E396-F400 HydrophobicContact CG-CZ 3.65Å; E396-F400 WeakPolarHBondContact O-CG 3.25Å; E396-F400 PolarHBondContact O-N 2.86Å; E396-K613 WeakPolarHBondContact OE1-CD 3.34Å; E396-K613 IonicContact OE1-NZ 3.55Å; E396-K613 PolarHBondContact OE1-NZ 3.5Å
397	E	91.8	Very high	83	Confident	7 Å²	7	46.1 Å²	46.1	3%	0.033	24%	0.244	C	C	.	.	H	α-helix	trans	-59.5	-48.3	176	-73.1	155	176.8	0	0	111.6	E393 T394 T399 F400 R401 L416 Y417 R488 L492	E393-E397 HydrophobicContact CG-CB 3.62Å; T394-E397 WeakPolarHBondContact CB-OE2 3.49Å; T394-E397 PolarHBondContact N-OE2 3.32Å; T394-E397 PolarHBondContact O-N 2.9Å; T394-E397 VanDerWaalsContact O-N 3.17Å; T394-E397 VanDerWaalsContact OG1-CG 3.26Å; T394-E397 WeakPolarHBondContact OG1-CG 3.45Å; T394-E397 PolarHBondContact OG1-N 3.06Å; T394-E397 PolarHBondContact OG1-OE2 2.91Å; E397-T399 VanDerWaalsContact C-N 3.3Å; E397-T399 PolarHBondContact O-N 3.18Å; E397-F400 PolarHBondContact O-N 3.26Å; E397-R401 WeakPolarHBondContact O-CB 3.4Å; E397-R401 PolarHBondContact O-N 3.35Å; E397-L416 HydrophobicContact CB-CD2 4.46Å; E397-L416 HydrophobicContact CG-CD2 4.05Å; E397-Y417 HydrophobicContact CG-CE2 4.32Å; E397-Y417 WeakPolarHBondContact CG-OH 3.13Å; E397-Y417 VanDerWaalsContact OE1-CE2 3.28Å; E397-Y417 WeakPolarHBondContact OE1-CE2 3.48Å; E397-Y417 VanDerWaalsContact OE1-CZ 3.28Å; E397-Y417 PolarHBondContact OE1-OH 3.09Å; E397-R488 IonicContact OE1-CZ 2.72Å; E397-R488 IonicContact OE1-NE 3.95Å; E397-R488 PolarHBondContact OE1-NE 3.42Å; E397-R488 IonicContact OE1-NH2 3.18Å; E397-R488 PolarHBondContact OE1-NH2 3.36Å; E397-R488 IonicContact OE2-NH2 2.58Å; E397-R488 PolarHBondContact OE2-NH2 3.31Å; E397-L492 HydrophobicContact CG-CD2 3.97Å
398	K	90.6	Very high	85	Confident	50 Å²	50	44.2 Å²	44.2	22%	0.217	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-43.5	176.7	-174.2	168.8	-179.7	176.2	0	112.3	E393 T394 R401 N402	E393-K398 VanDerWaalsContact CD-CA 3.49Å; E393-K398 HydrophobicContact CG-CB 4.24Å; E393-K398 WeakPolarHBondContact OE1-CA 3.15Å; E393-K398 PolarHBondContact OE1-N 3.43Å; E393-K398 VanDerWaalsContact OE2-CB 3.25Å; E393-K398 WeakPolarHBondContact OE2-CB 3.17Å; E393-K398 WeakPolarHBondContact OE2-CG 3.36Å; T394-K398 PolarHBondContact O-N 3.15Å; K398-R401 PolarHBondContact O-N 3.18Å; K398-N402 WeakPolarHBondContact O-CB 3.3Å; K398-N402 VanDerWaalsContact O-CG 3.3Å; K398-N402 PolarHBondContact O-N 2.89Å
399	T	92.6	Very high	87.1	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-46.4	178.1	-59.8	0	0	0	0	110.8	R395 E396 E397 N402 W403 M499 M614	R395-T399 WeakPolarHBondContact O-CB 3.32Å; R395-T399 PolarHBondContact O-N 3.25Å; R395-T399 PolarHBondContact O-OG1 3.31Å; E396-T399 PolarHBondContact O-N 3.25Å; E397-T399 VanDerWaalsContact C-N 3.3Å; E397-T399 PolarHBondContact O-N 3.18Å; T399-N402 PolarHBondContact O-N 3.48Å; T399-W403 VanDerWaalsContact O-CB 3.3Å; T399-W403 WeakPolarHBondContact O-CB 3.49Å; T399-W403 PolarHBondContact O-N 3.28Å; T399-M499 HydrophobicContact CG2-CE 4.22Å; T399-M614 HydrophobicContact CG2-CE 3.3Å; T399-M614 HydrophobicContact CG2-SD 4.21Å
400	F	95.3	Very high	88.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-43.8	177.5	-71	-15.5	0	0	0	112.2	E396 E397 W403 M404 L492 V495 W496 M499	E396-F400 HydrophobicContact CG-CD2 4.17Å; E396-F400 HydrophobicContact CG-CE1 4.31Å; E396-F400 HydrophobicContact CG-CE2 3.59Å; E396-F400 HydrophobicContact CG-CZ 3.65Å; E396-F400 WeakPolarHBondContact O-CG 3.25Å; E396-F400 PolarHBondContact O-N 2.86Å; E397-F400 PolarHBondContact O-N 3.26Å; F400-W403 PolarHBondContact O-N 3.04Å; F400-M404 HydrophobicContact CB-CE 4.48Å; F400-M404 WeakPolarHBondContact O-CE 3.35Å; F400-M404 VanDerWaalsContact O-CG 3.28Å; F400-M404 WeakPolarHBondContact O-CG 3.4Å; F400-M404 PolarHBondContact O-N 2.83Å; F400-L492 HydrophobicContact CD2-CD2 3.63Å; F400-L492 HydrophobicContact CE2-CD2 3.7Å; F400-V495 HydrophobicContact CB-CG1 3.7Å; F400-V495 HydrophobicContact CD1-CG1 4.14Å; F400-V495 HydrophobicContact CD2-CB 4.19Å; F400-V495 HydrophobicContact CD2-CG1 3.65Å; F400-V495 HydrophobicContact CE2-CG1 4.3Å; F400-V495 HydrophobicContact CG-CG1 3.56Å; F400-W496 HydrophobicContact CE1-CE3 4.19Å; F400-W496 HydrophobicContact CE2-CB 4.44Å; F400-W496 HydrophobicContact CZ-CB 3.91Å; F400-W496 HydrophobicContact CZ-CE3 4.15Å; F400-M499 HydrophobicContact CD1-SD 3.65Å; F400-M499 HydrophobicContact CE1-SD 3.6Å
401	R	94.6	Very high	89.8	Confident	41 Å²	41	36 Å²	36	16%	0.155	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-50.7	174.9	-178.7	172	58.2	93	-5.6	111.8	E393 E397 K398 W403 M404 N405 V413 N414	E393-R401 IonicContact OE1-CZ 3.74Å; E393-R401 IonicContact OE1-NE 2.86Å; E393-R401 PolarHBondContact OE1-NE 3.45Å; E393-R401 IonicContact OE1-NH2 3.78Å; E393-R401 IonicContact OE2-CZ 3.68Å; E393-R401 IonicContact OE2-NE 2.65Å; E393-R401 PolarHBondContact OE2-NE 3.1Å; E393-R401 IonicContact OE2-NH2 3.35Å; E393-R401 PolarHBondContact OE2-NH2 3.42Å; E397-R401 WeakPolarHBondContact O-CB 3.4Å; E397-R401 PolarHBondContact O-N 3.35Å; K398-R401 PolarHBondContact O-N 3.18Å; R401-W403 VanDerWaalsContact C-N 3.34Å; R401-W403 PolarHBondContact O-N 2.91Å; R401-M404 PolarHBondContact O-N 2.79Å; R401-N405 WeakPolarHBondContact O-CB 3.39Å; R401-N405 PolarHBondContact O-N 3.39Å; R401-N405 PolarHBondContact O-ND2 2.9Å; R401-V413 WeakPolarHBondContact CD-O 3.48Å; R401-V413 HydrophobicContact CG-CB 4.38Å; R401-V413 HydrophobicContact CG-CG1 4.15Å; R401-V413 VanDerWaalsContact CG-O 3.29Å; R401-V413 WeakPolarHBondContact CG-O 3.31Å; R401-N414 WeakPolarHBondContact CD-O 3.43Å
402	N	94.2	Very high	90.9	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.043	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-41.1	178.5	-72.8	-4	0	0	0	112.1	A204 G206 K398 T399 S406	A204-N402 WeakPolarHBondContact O-CB 3.46Å; A204-N402 PolarHBondContact O-ND2 3.28Å; G206-N402 WeakPolarHBondContact CA-O 3.13Å; K398-N402 WeakPolarHBondContact O-CB 3.3Å; K398-N402 VanDerWaalsContact O-CG 3.3Å; K398-N402 PolarHBondContact O-N 2.89Å; T399-N402 PolarHBondContact O-N 3.48Å; N402-S406 WeakPolarHBondContact O-CB 3.5Å; N402-S406 PolarHBondContact O-N 3Å; N402-S406 PolarHBondContact O-OG 3.17Å
403	W	94.1	Very high	91.8	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	16%	0.164	C	C	.	.	H	α-helix	trans	-62.3	-45	175.6	167.7	66.4	0	0	0	112.5	T399 F400 R401 S406 L407 L429 V495 L498 M499 Y502 Y601	T399-W403 VanDerWaalsContact O-CB 3.3Å; T399-W403 WeakPolarHBondContact O-CB 3.49Å; T399-W403 PolarHBondContact O-N 3.28Å; F400-W403 PolarHBondContact O-N 3.04Å; R401-W403 VanDerWaalsContact C-N 3.34Å; R401-W403 PolarHBondContact O-N 2.91Å; W403-S406 PolarHBondContact O-OG 3.19Å; W403-L407 HydrophobicContact CZ2-CD1 3.76Å; W403-L407 WeakPolarHBondContact O-CG 3.41Å; W403-L407 PolarHBondContact O-N 3.05Å; W403-L429 HydrophobicContact CH2-CD2 4.14Å; W403-L429 HydrophobicContact CZ3-CD1 4.4Å; W403-L429 HydrophobicContact CZ3-CD2 4.44Å; W403-V495 HydrophobicContact CE3-CG1 4.39Å; W403-V495 HydrophobicContact CZ3-CG1 4.04Å; W403-L498 HydrophobicContact CH2-CB 3.79Å; W403-L498 HydrophobicContact CZ3-CB 4.36Å; W403-M499 HydrophobicContact CB-CE 4.39Å; W403-M499 HydrophobicContact CD2-CB 4.01Å; W403-M499 HydrophobicContact CD2-CG 3.78Å; W403-M499 HydrophobicContact CD2-SD 4.35Å; W403-M499 HydrophobicContact CE3-CB 3.87Å; W403-M499 HydrophobicContact CE3-CG 4.09Å; W403-M499 HydrophobicContact CG-CE 4.28Å; W403-M499 HydrophobicContact CG-CG 4.15Å; W403-M499 HydrophobicContact CG-SD 4.36Å; W403-M499 HydrophobicContact CH2-CB 3.9Å; W403-M499 VanDerWaalsContact CZ2-CA 3.5Å; W403-M499 HydrophobicContact CZ2-CB 4.02Å; W403-M499 HydrophobicContact CZ2-CG 4.33Å; W403-M499 HydrophobicContact CZ3-CB 3.81Å; W403-M499 HydrophobicContact CZ3-CG 4.5Å; W403-Y502 HydrophobicContact CZ2-CD1 4.38Å; W403-Y502 HydrophobicContact CZ2-CG 4.04Å; W403-Y502 AromaticContact NE1-CD1 3.37Å; W403-Y502 AromaticContact NE1-CE1 3.74Å; W403-Y502 AromaticContact NE1-CG 3.87Å; W403-Y601 HydrophobicContact CB-CD1 4.02Å; W403-Y601 HydrophobicContact CB-CE1 4.09Å; W403-Y601 HydrophobicContact CB-CG 4.34Å; W403-Y601 AromaticContact CD1-CE2 3.81Å; W403-Y601 AromaticContact CD1-CZ 3.93Å
404	M	95.3	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.2	-45.1	178.4	-64.9	179.8	-69.5	0	0	111.4	F400 R401 S406 L407 V409 V413 L416 L420 V425 L429 V495	F400-M404 HydrophobicContact CB-CE 4.48Å; F400-M404 WeakPolarHBondContact O-CE 3.35Å; F400-M404 VanDerWaalsContact O-CG 3.28Å; F400-M404 WeakPolarHBondContact O-CG 3.4Å; F400-M404 PolarHBondContact O-N 2.83Å; R401-M404 PolarHBondContact O-N 2.79Å; M404-S406 VanDerWaalsContact C-N 3.31Å; M404-S406 PolarHBondContact O-N 3.42Å; M404-L407 WeakPolarHBondContact O-CB 3.41Å; M404-L407 PolarHBondContact O-N 3.28Å; M404-L407 VanDerWaalsContact O-N 3.15Å; M404-V409 HydrophobicContact CB-CG2 4.32Å; M404-V409 WeakPolarHBondContact O-CG2 3.36Å; M404-V413 HydrophobicContact CE-CB 4.49Å; M404-V413 HydrophobicContact CE-CG1 4.06Å; M404-V413 HydrophobicContact CE-CG2 4.33Å; M404-L416 HydrophobicContact CE-CD1 3.19Å; M404-L416 HydrophobicContact SD-CD1 4.43Å; M404-L420 HydrophobicContact CE-CD1 4.29Å; M404-L420 HydrophobicContact SD-CD1 4.35Å; M404-L420 HydrophobicContact SD-CD2 4.24Å; M404-V425 HydrophobicContact SD-CG1 4.39Å; M404-L429 HydrophobicContact CB-CD1 4.39Å; M404-L429 HydrophobicContact CB-CD2 4.25Å; M404-L429 HydrophobicContact CG-CD1 3.59Å; M404-L429 HydrophobicContact CG-CD2 4Å; M404-L429 HydrophobicContact CG-CG 4.42Å; M404-L429 HydrophobicContact SD-CD1 3.52Å; M404-L429 VanDerWaalsContact SD-CD1 3.52Å; M404-V495 HydrophobicContact SD-CG1 4.22Å; M404-V495 HydrophobicContact SD-CG2 4.48Å
405	N	94.8	Very high	92	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-35.4	179.9	-74.7	-30.5	0	0	0	112.7	T208 R401 L407 G408 R412 V413	T208-N405 PolarHBondContact OG1-O 3.17Å; R401-N405 WeakPolarHBondContact O-CB 3.39Å; R401-N405 PolarHBondContact O-N 3.39Å; R401-N405 PolarHBondContact O-ND2 2.9Å; N405-L407 PolarHBondContact O-N 3.1Å; N405-G408 PolarHBondContact O-N 3Å; N405-R412 WeakPolarHBondContact OD1-CG 3.39Å; N405-V413 PolarHBondContact ND2-O 3.4Å; N405-V413 PolarHBondContact OD1-N 3.28Å
406	S	92.1	Very high	92.2	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-66.7	-24.1	177.3	76	0	0	0	0	113.2	S203 C207 V210 N402 W403 M404 G408 Y601	S203-S406 WeakPolarHBondContact O-CB 3.46Å; S203-S406 WeakPolarHBondContact OG-CB 3.48Å; C207-S406 WeakPolarHBondContact O-CA 3.45Å; V210-S406 WeakPolarHBondContact CG2-O 3.24Å; N402-S406 WeakPolarHBondContact O-CB 3.5Å; N402-S406 PolarHBondContact O-N 3Å; N402-S406 PolarHBondContact O-OG 3.17Å; W403-S406 PolarHBondContact O-OG 3.19Å; M404-S406 VanDerWaalsContact C-N 3.31Å; M404-S406 PolarHBondContact O-N 3.42Å; S406-G408 PolarHBondContact O-N 3.33Å; S406-Y601 PolarHBondContact OG-OH 3.3Å
407	L	91.2	Very high	92.3	Very high	7 Å²	7	26.2 Å²	26.2	4%	0.037	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-5.2	174.5	-61.6	178.8	0	0	0	113.6	W403 M404 N405 L429 K432 Y502	W403-L407 HydrophobicContact CZ2-CD1 3.76Å; W403-L407 WeakPolarHBondContact O-CG 3.41Å; W403-L407 PolarHBondContact O-N 3.05Å; M404-L407 WeakPolarHBondContact O-CB 3.41Å; M404-L407 PolarHBondContact O-N 3.28Å; M404-L407 VanDerWaalsContact O-N 3.15Å; N405-L407 PolarHBondContact O-N 3.1Å; L407-L429 HydrophobicContact CD1-CD2 3.73Å; L407-K432 HydrophobicContact CB-CG 4.4Å; L407-K432 HydrophobicContact CD1-CB 4.28Å; L407-K432 HydrophobicContact CD1-CG 4.33Å; L407-K432 WeakPolarHBondContact O-CE 3.42Å; L407-K432 PolarHBondContact O-NZ 2.8Å; L407-Y502 HydrophobicContact CD1-CD2 4.42Å; L407-Y502 HydrophobicContact CD1-CE2 4.33Å; L407-Y502 HydrophobicContact CD2-CE1 4.35Å; L407-Y502 HydrophobicContact CD2-CE2 3.65Å; L407-Y502 WeakPolarHBondContact CD2-OH 3.5Å
408	G	91	Very high	92.2	Very high	32 Å²	32	30.4 Å²	30.4	33%	0.33	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	74	43.7	177.9	0	0	0	0	0	113	N405 S406	N405-G408 PolarHBondContact O-N 3Å; S406-G408 PolarHBondContact O-N 3.33Å
409	V	93.1	Very high	92.3	Very high	12 Å²	12	29.8 Å²	29.8	7%	0.073	16%	0.156	C	C	.	.			trans	-70.6	150.1	171.2	-61.9	0	0	0	0	110.9	M404 V413 V425 Q428 L429	M404-V409 HydrophobicContact CB-CG2 4.32Å; M404-V409 WeakPolarHBondContact O-CG2 3.36Å; V409-V413 HydrophobicContact CG2-CG2 4.11Å; V409-V425 HydrophobicContact CB-CG1 4.11Å; V409-V425 HydrophobicContact CG1-CG1 4.17Å; V409-V425 HydrophobicContact CG2-CG1 4.05Å; V409-Q428 HydrophobicContact CG1-CB 4.35Å; V409-L429 HydrophobicContact CG1-CD2 3.8Å; V409-L429 HydrophobicContact CG1-CG 4.12Å
410	S	90.3	Very high	92.5	Very high	86 Å²	86	29.6 Å²	29.6	60%	0.601	16%	0.155	S	C	*	.	S	Bend	trans	-134.8	124.1	178.5	179.6	0	0	0	0	110.7	Q428	S410-Q428 PolarHBondContact O-NE2 3.11Å
411	P	91.3	Very high	92.5	Very high	66 Å²	66	30.4 Å²	30.4	43%	0.429	16%	0.16	S	C	.	.	S	Bend	cis	-68.3	164.1	2.6	29.3	-35.4	0	0	0	113.2
412	R	91.1	Very high	92.5	Very high	85 Å²	85	29.6 Å²	29.6	32%	0.321	16%	0.159	S	C	.	.			trans	-65.7	136.5	174	-174.4	179.2	-177.4	83.9	-0.1	108.8	G206 N405 N414	G206-R412 PolarHBondContact O-NH1 3.16Å; G206-R412 PolarHBondContact O-NH2 3Å; N405-R412 WeakPolarHBondContact OD1-CG 3.39Å; R412-N414 PolarHBondContact O-N 3.26Å
413	V	93.6	Very high	92.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.157	C	C	.	.			trans	-83	114.9	177.3	-176.7	0	0	0	0	109.2	R401 M404 N405 V409 D419 V425	R401-V413 WeakPolarHBondContact CD-O 3.48Å; R401-V413 HydrophobicContact CG-CB 4.38Å; R401-V413 HydrophobicContact CG-CG1 4.15Å; R401-V413 VanDerWaalsContact CG-O 3.29Å; R401-V413 WeakPolarHBondContact CG-O 3.31Å; M404-V413 HydrophobicContact CE-CB 4.49Å; M404-V413 HydrophobicContact CE-CG1 4.06Å; M404-V413 HydrophobicContact CE-CG2 4.33Å; N405-V413 PolarHBondContact ND2-O 3.4Å; N405-V413 PolarHBondContact OD1-N 3.28Å; V409-V413 HydrophobicContact CG2-CG2 4.11Å; V413-D419 HydrophobicContact CG1-CB 4.24Å; V413-V425 HydrophobicContact CG2-CG1 3.83Å; V413-V425 HydrophobicContact CG2-CG2 4.21Å
414	N	89.9	Confident	92.8	Very high	40 Å²	40	29.6 Å²	29.6	21%	0.214	16%	0.159	C	C	.	.	S	Bend	trans	-99.9	-44	169	-59.3	-51.3	0	0	0	110	R401 R412 D419	R401-N414 WeakPolarHBondContact CD-O 3.43Å; R412-N414 PolarHBondContact O-N 3.26Å; N414-D419 PolarHBondContact N-OD2 2.89Å
415	H	88.9	Confident	92.9	Very high	46 Å²	46	29.6 Å²	29.6	21%	0.213	16%	0.159	C	C	.	.			trans	-126.2	107.8	-174.2	-62.8	-63.5	0	0	0	111.1	M263 S264 L265 Y417 R418 D419	M263-H415 PolarHBondContact O-CD2 3.44Å; M263-H415 PolarHBondContact O-CE1 3.31Å; M263-H415 PolarHBondContact O-NE2 2.93Å; S264-H415 PolarHBondContact O-CD2 3.22Å; L265-H415 PolarHBondContact O-NE2 2.94Å; H415-Y417 VanDerWaalsContact C-N 3.32Å; H415-Y417 PolarHBondContact O-N 3.43Å; H415-R418 HydrophobicContact CB-CB 4.32Å; H415-R418 PolarHBondContact O-N 3.48Å; H415-R418 VanDerWaalsContact O-N 3.14Å; H415-D419 PolarHBondContact N-OD2 2.82Å; H415-D419 WeakPolarHBondContact O-CB 3.39Å; H415-D419 PolarHBondContact O-N 2.96Å
416	L	91.4	Very high	93	Very high	7 Å²	7	29.5 Å²	29.5	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-52.4	-48.7	-171.9	-166.3	71	0	0	0	112.5	E397 M404 R418 L420 T491 L492	E397-L416 HydrophobicContact CB-CD2 4.46Å; E397-L416 HydrophobicContact CG-CD2 4.05Å; M404-L416 HydrophobicContact CE-CD1 3.19Å; M404-L416 HydrophobicContact SD-CD1 4.43Å; L416-R418 VanDerWaalsContact C-N 3.26Å; L416-R418 PolarHBondContact O-N 3.38Å; L416-L420 HydrophobicContact CD1-CD1 3.28Å; L416-L420 HydrophobicContact CG-CD1 3.73Å; L416-L420 WeakPolarHBondContact O-CB 3.4Å; L416-L420 VanDerWaalsContact O-CD1 3.28Å; L416-L420 WeakPolarHBondContact O-CD1 3.43Å; L416-T491 HydrophobicContact CD2-CG2 4.46Å; L416-T491 HydrophobicContact CG-CG2 4.18Å; L416-L492 HydrophobicContact CD2-CD2 3.6Å
417	Y	91.4	Very high	93.3	Very high	53 Å²	53	29.5 Å²	29.5	21%	0.208	16%	0.158	C	C	.	.	H	α-helix	trans	-83.5	5.4	-172.4	-52.2	-55.2	0	0	0	115	E397 H415 C421 G486 R488 T491 L492	E397-Y417 HydrophobicContact CG-CE2 4.32Å; E397-Y417 WeakPolarHBondContact CG-OH 3.13Å; E397-Y417 VanDerWaalsContact OE1-CE2 3.28Å; E397-Y417 WeakPolarHBondContact OE1-CE2 3.48Å; E397-Y417 VanDerWaalsContact OE1-CZ 3.28Å; E397-Y417 PolarHBondContact OE1-OH 3.09Å; H415-Y417 VanDerWaalsContact C-N 3.32Å; H415-Y417 PolarHBondContact O-N 3.43Å; Y417-C421 PolarHBondContact O-SG 3.49Å; Y417-G486 VanDerWaalsContact O-CA 3.28Å; Y417-G486 WeakPolarHBondContact O-CA 3.22Å; Y417-R488 HydrophobicContact CD1-CB 4.45Å; Y417-R488 VanDerWaalsContact CE1-CA 3.47Å; Y417-R488 HydrophobicContact CE1-CB 4.03Å; Y417-R488 HydrophobicContact CE1-CG 4.04Å; Y417-R488 HydrophobicContact CE2-CB 4.46Å; Y417-R488 HydrophobicContact CE2-CG 4.14Å; Y417-R488 WeakPolarHBondContact OH-CG 3.35Å; Y417-T491 HydrophobicContact CD1-CG2 4.11Å; Y417-T491 HydrophobicContact CE1-CG2 4.17Å; Y417-L492 HydrophobicContact CE1-CG 4.28Å; Y417-L492 WeakPolarHBondContact OH-CD1 3.37Å; Y417-L492 WeakPolarHBondContact OH-CD2 3.28Å; Y417-L492 VanDerWaalsContact OH-CG 3.3Å; Y417-L492 WeakPolarHBondContact OH-CG 3.46Å
418	R	89.7	Confident	93.6	Very high	94 Å²	94	30.8 Å²	30.8	36%	0.355	16%	0.164	S	C	.	.	H	α-helix	trans	-122	-44.7	175.6	-68.8	-171.3	175.6	-136.9	-5.9	111.5	D260 S264 H415 L416 L420 C421	D260-R418 VanDerWaalsContact C-NH2 3.29Å; D260-R418 PolarHBondContact O-NH1 2.87Å; D260-R418 PolarHBondContact O-NH2 3Å; D260-R418 IonicContact OD1-NH2 3.65Å; D260-R418 IonicContact OD2-NH2 2.69Å; D260-R418 PolarHBondContact OD2-NH2 2.75Å; S264-R418 PolarHBondContact OG-NH1 2.92Å; H415-R418 HydrophobicContact CB-CB 4.32Å; H415-R418 PolarHBondContact O-N 3.48Å; H415-R418 VanDerWaalsContact O-N 3.14Å; L416-R418 VanDerWaalsContact C-N 3.26Å; L416-R418 PolarHBondContact O-N 3.38Å; R418-L420 PolarHBondContact O-N 2.85Å; R418-C421 WeakPolarHBondContact O-CB 3.35Å; R418-C421 PolarHBondContact O-N 3.33Å
419	D	93.2	Very high	93.8	Very high	37 Å²	37	29.3 Å²	29.3	20%	0.198	15%	0.149	C	C	.	.	H	α-helix	trans	-73.6	-16.2	-175.6	-60.8	-17.7	0	0	0	112.8	V413 N414 H415	V413-D419 HydrophobicContact CG1-CB 4.24Å; N414-D419 PolarHBondContact N-OD2 2.89Å; H415-D419 PolarHBondContact N-OD2 2.82Å; H415-D419 WeakPolarHBondContact O-CB 3.39Å; H415-D419 PolarHBondContact O-N 2.96Å
420	L	95.9	Very high	93.9	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-8	175.4	-71.7	161.6	0	0	0	113.3	M404 L416 R418 D422 G423 V425 I426 T491 V495	M404-L420 HydrophobicContact CE-CD1 4.29Å; M404-L420 HydrophobicContact SD-CD1 4.35Å; M404-L420 HydrophobicContact SD-CD2 4.24Å; L416-L420 HydrophobicContact CD1-CD1 3.28Å; L416-L420 HydrophobicContact CG-CD1 3.73Å; L416-L420 WeakPolarHBondContact O-CB 3.4Å; L416-L420 VanDerWaalsContact O-CD1 3.28Å; L416-L420 WeakPolarHBondContact O-CD1 3.43Å; R418-L420 PolarHBondContact O-N 2.85Å; L420-D422 VanDerWaalsContact C-N 3.27Å; L420-D422 PolarHBondContact O-N 3.44Å; L420-G423 PolarHBondContact O-N 3.39Å; L420-G423 VanDerWaalsContact O-N 3.08Å; L420-V425 HydrophobicContact CD2-CB 3.82Å; L420-V425 HydrophobicContact CD2-CG1 3.68Å; L420-I426 HydrophobicContact CB-CD1 4.37Å; L420-I426 HydrophobicContact CB-CG1 4.48Å; L420-I426 HydrophobicContact CD2-CD1 4.2Å; L420-I426 HydrophobicContact CD2-CG1 3.46Å; L420-I426 VanDerWaalsContact CD2-CG1 3.46Å; L420-T491 HydrophobicContact CD1-CG2 3.68Å; L420-V495 HydrophobicContact CD1-CG2 4.08Å
421	C	95.2	Very high	94.1	Very high	17 Å²	17	28.5 Å²	28.5	12%	0.115	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-12.7	-170.2	-68	0	0	0	0	115	Y417 R418 C460 L483 N484 G486	Y417-C421 PolarHBondContact O-SG 3.49Å; R418-C421 WeakPolarHBondContact O-CB 3.35Å; R418-C421 PolarHBondContact O-N 3.33Å; C421-C460 PolarHBondContact O-SG 2.89Å; C421-L483 PolarHBondContact SG-O 2.76Å; C421-L483 VanDerWaalsContact SG-O 3.37Å; C421-N484 WeakPolarHBondContact CB-O 3.38Å; C421-N484 WeakPolarHBondContact O-CA 3.48Å; C421-N484 PolarHBondContact O-ND2 3.48Å; C421-G486 VanDerWaalsContact SG-CA 3.56Å
422	D	94.9	Very high	94	Very high	24 Å²	24	29.5 Å²	29.5	13%	0.128	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-2.1	172.8	72.5	8.7	0	0	0	113.7	L420 L424 Y447 K456 N459	L420-D422 VanDerWaalsContact C-N 3.27Å; L420-D422 PolarHBondContact O-N 3.44Å; D422-L424 PolarHBondContact O-N 2.94Å; D422-L424 WeakPolarHBondContact OD1-CB 3.45Å; D422-L424 PolarHBondContact OD1-N 3.05Å; D422-Y447 HydrophobicContact CB-CE2 4.06Å; D422-K456 HydrophobicContact CB-CB 4.29Å; D422-K456 HydrophobicContact CB-CD 4.06Å; D422-K456 HydrophobicContact CB-CG 3.77Å; D422-N459 WeakPolarHBondContact O-CB 3.4Å; D422-N459 PolarHBondContact O-ND2 3.25Å
423	G	96.7	Very high	93.9	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	72.5	-6	179.3	0	0	0	0	0	115.8	L420 I426 L427	L420-G423 PolarHBondContact O-N 3.39Å; L420-G423 VanDerWaalsContact O-N 3.08Å; G423-I426 PolarHBondContact O-N 3.26Å; G423-L427 WeakPolarHBondContact O-CD1 3.33Å; G423-L427 VanDerWaalsContact O-CG 3.23Å; G423-L427 WeakPolarHBondContact O-CG 3.46Å; G423-L427 PolarHBondContact O-N 3.43Å
424	L	97.1	Very high	93.7	Very high	9 Å²	9	33.5 Å²	33.5	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-45	-173.1	-69.2	-177.9	0	0	0	112.7	D422 I426 L427 Q428 V442 P445	D422-L424 PolarHBondContact O-N 2.94Å; D422-L424 WeakPolarHBondContact OD1-CB 3.45Å; D422-L424 PolarHBondContact OD1-N 3.05Å; L424-I426 VanDerWaalsContact C-N 3.31Å; L424-I426 PolarHBondContact O-N 2.95Å; L424-L427 PolarHBondContact O-N 3.32Å; L424-Q428 WeakPolarHBondContact O-CG 3.22Å; L424-Q428 PolarHBondContact O-N 3.44Å; L424-Q428 PolarHBondContact O-NE2 3.49Å; L424-V442 HydrophobicContact CD2-CG1 3.36Å; L424-P445 HydrophobicContact CD1-CG 4.31Å
425	V	97.4	Very high	93.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.2	172.4	0	0	0	0	110.3	M404 V409 V413 L420 L427 Q428 L429	M404-V425 HydrophobicContact SD-CG1 4.39Å; V409-V425 HydrophobicContact CB-CG1 4.11Å; V409-V425 HydrophobicContact CG1-CG1 4.17Å; V409-V425 HydrophobicContact CG2-CG1 4.05Å; V413-V425 HydrophobicContact CG2-CG1 3.83Å; V413-V425 HydrophobicContact CG2-CG2 4.21Å; L420-V425 HydrophobicContact CD2-CB 3.82Å; L420-V425 HydrophobicContact CD2-CG1 3.68Å; V425-L427 VanDerWaalsContact C-N 3.33Å; V425-L427 PolarHBondContact O-N 3.28Å; V425-Q428 PolarHBondContact O-N 2.91Å; V425-L429 HydrophobicContact CG1-CD1 4.07Å; V425-L429 HydrophobicContact CG1-CG 4.45Å; V425-L429 VanDerWaalsContact O-CG 3.28Å; V425-L429 WeakPolarHBondContact O-CG 3.44Å; V425-L429 PolarHBondContact O-N 3.48Å
426	I	97.9	Very high	93.9	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-60.8	-44.2	177.2	-58.8	174	0	0	0	110.8	L420 G423 L424 L429 L430 A463 L483 L494 L498	L420-I426 HydrophobicContact CB-CD1 4.37Å; L420-I426 HydrophobicContact CB-CG1 4.48Å; L420-I426 HydrophobicContact CD2-CD1 4.2Å; L420-I426 HydrophobicContact CD2-CG1 3.46Å; L420-I426 VanDerWaalsContact CD2-CG1 3.46Å; G423-I426 PolarHBondContact O-N 3.26Å; L424-I426 VanDerWaalsContact C-N 3.31Å; L424-I426 PolarHBondContact O-N 2.95Å; I426-L429 PolarHBondContact O-N 3.25Å; I426-L430 HydrophobicContact CG2-CD1 4.47Å; I426-L430 WeakPolarHBondContact O-CG 3.46Å; I426-L430 PolarHBondContact O-N 3.03Å; I426-A463 HydrophobicContact CB-CB 4.28Å; I426-A463 HydrophobicContact CG2-CB 3.76Å; I426-L483 HydrophobicContact CD1-CD1 3.93Å; I426-L494 HydrophobicContact CD1-CD2 4.03Å; I426-L494 HydrophobicContact CG2-CD2 3.84Å; I426-L498 HydrophobicContact CG2-CD1 4.22Å
427	L	98.1	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-41.8	177.3	-69.9	164.6	0	0	0	111.7	G423 L424 V425 L429 L430 E431 V437 W439 V442 N459 Y462 A463 L466	G423-L427 WeakPolarHBondContact O-CD1 3.33Å; G423-L427 VanDerWaalsContact O-CG 3.23Å; G423-L427 WeakPolarHBondContact O-CG 3.46Å; G423-L427 PolarHBondContact O-N 3.43Å; L424-L427 PolarHBondContact O-N 3.32Å; V425-L427 VanDerWaalsContact C-N 3.33Å; V425-L427 PolarHBondContact O-N 3.28Å; L427-L429 VanDerWaalsContact C-N 3.34Å; L427-L429 PolarHBondContact O-N 3.03Å; L427-L430 HydrophobicContact CD2-CD1 4.33Å; L427-L430 WeakPolarHBondContact O-CB 3.25Å; L427-L430 PolarHBondContact O-N 2.87Å; L427-E431 PolarHBondContact O-N 3.3Å; L427-V437 HydrophobicContact CB-CG1 4.33Å; L427-V437 HydrophobicContact CD2-CG1 3.98Å; L427-V437 HydrophobicContact CD2-CG2 4.44Å; L427-V437 WeakPolarHBondContact O-CG2 3.41Å; L427-W439 HydrophobicContact CB-CH2 3.88Å; L427-W439 HydrophobicContact CB-CZ3 4.37Å; L427-V442 HydrophobicContact CD1-CB 4.42Å; L427-V442 HydrophobicContact CD1-CG1 3.74Å; L427-V442 HydrophobicContact CD1-CG2 3.76Å; L427-N459 HydrophobicContact CD1-CB 4.36Å; L427-Y462 HydrophobicContact CD2-CD1 3.82Å; L427-Y462 HydrophobicContact CD2-CE1 4.14Å; L427-A463 HydrophobicContact CD2-CB 3.94Å; L427-A463 HydrophobicContact CG-CB 4.13Å; L427-L466 HydrophobicContact CD2-CD1 4.04Å
428	Q	96.9	Very high	94.4	Very high	34 Å²	34	36.7 Å²	36.7	16%	0.159	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-42.7	173.4	-70.7	168.9	61.6	0	0	111.9	V409 S410 L424 V425 L430 E431 K432 W439	V409-Q428 HydrophobicContact CG1-CB 4.35Å; S410-Q428 PolarHBondContact O-NE2 3.11Å; L424-Q428 WeakPolarHBondContact O-CG 3.22Å; L424-Q428 PolarHBondContact O-N 3.44Å; L424-Q428 PolarHBondContact O-NE2 3.49Å; V425-Q428 PolarHBondContact O-N 2.91Å; Q428-L430 VanDerWaalsContact C-N 3.31Å; Q428-L430 PolarHBondContact O-N 3.25Å; Q428-E431 WeakPolarHBondContact O-CB 3.38Å; Q428-E431 PolarHBondContact O-N 3.21Å; Q428-K432 WeakPolarHBondContact O-CG 3.42Å; Q428-K432 PolarHBondContact O-N 3.25Å; Q428-K432 VanDerWaalsContact O-N 3.15Å; Q428-W439 HydrophobicContact CG-CH2 3.78Å; Q428-W439 HydrophobicContact CG-CZ2 4.19Å
429	L	95.7	Very high	94.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-63.9	-36.2	177.8	-67.3	168.5	0	0	0	112.2	W403 M404 L407 V409 V425 I426 L427 E431 K432 V433 L498	W403-L429 HydrophobicContact CH2-CD2 4.14Å; W403-L429 HydrophobicContact CZ3-CD1 4.4Å; W403-L429 HydrophobicContact CZ3-CD2 4.44Å; M404-L429 HydrophobicContact CB-CD1 4.39Å; M404-L429 HydrophobicContact CB-CD2 4.25Å; M404-L429 HydrophobicContact CG-CD1 3.59Å; M404-L429 HydrophobicContact CG-CD2 4Å; M404-L429 HydrophobicContact CG-CG 4.42Å; M404-L429 HydrophobicContact SD-CD1 3.52Å; M404-L429 VanDerWaalsContact SD-CD1 3.52Å; L407-L429 HydrophobicContact CD1-CD2 3.73Å; V409-L429 HydrophobicContact CG1-CD2 3.8Å; V409-L429 HydrophobicContact CG1-CG 4.12Å; V425-L429 HydrophobicContact CG1-CD1 4.07Å; V425-L429 HydrophobicContact CG1-CG 4.45Å; V425-L429 VanDerWaalsContact O-CG 3.28Å; V425-L429 WeakPolarHBondContact O-CG 3.44Å; V425-L429 PolarHBondContact O-N 3.48Å; I426-L429 PolarHBondContact O-N 3.25Å; L427-L429 VanDerWaalsContact C-N 3.34Å; L427-L429 PolarHBondContact O-N 3.03Å; L429-E431 VanDerWaalsContact C-N 3.3Å; L429-E431 PolarHBondContact O-N 3.4Å; L429-K432 WeakPolarHBondContact O-CB 3.32Å; L429-K432 PolarHBondContact O-N 2.99Å; L429-K432 VanDerWaalsContact O-N 3.09Å; L429-V433 WeakPolarHBondContact O-CG2 3.47Å; L429-V433 PolarHBondContact O-N 3.3Å; L429-L498 HydrophobicContact CB-CD1 4.21Å; L429-L498 HydrophobicContact CD1-CD1 4.32Å
430	L	95.6	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-42.5	173.1	-78.4	167.5	0	0	0	111.6	I426 L427 Q428 K432 V433 K434 V435 V437 A463 L466 L498	I426-L430 HydrophobicContact CG2-CD1 4.47Å; I426-L430 WeakPolarHBondContact O-CG 3.46Å; I426-L430 PolarHBondContact O-N 3.03Å; L427-L430 HydrophobicContact CD2-CD1 4.33Å; L427-L430 WeakPolarHBondContact O-CB 3.25Å; L427-L430 PolarHBondContact O-N 2.87Å; Q428-L430 VanDerWaalsContact C-N 3.31Å; Q428-L430 PolarHBondContact O-N 3.25Å; L430-K432 PolarHBondContact O-N 3.11Å; L430-V433 HydrophobicContact CD2-CG2 4.5Å; L430-V433 CarbonylContact O-C 3.38Å; L430-V433 WeakPolarHBondContact O-CG2 3.38Å; L430-V433 PolarHBondContact O-N 3.45Å; L430-K434 PolarHBondContact O-N 3.2Å; L430-V435 CarbonylContact C-O 3.57Å; L430-V435 HydrophobicContact CB-CB 4.12Å; L430-V435 HydrophobicContact CB-CG1 4.44Å; L430-V435 HydrophobicContact CD2-CB 4.11Å; L430-V435 HydrophobicContact CD2-CG1 4.22Å; L430-V435 HydrophobicContact CD2-CG2 4.12Å; L430-V435 WeakPolarHBondContact O-CB 2.86Å; L430-V435 PolarHBondContact O-N 3.44Å; L430-V437 HydrophobicContact CB-CG2 4.08Å; L430-A463 HydrophobicContact CD1-CB 4.41Å; L430-L466 HydrophobicContact CD1-CB 3.89Å; L430-L466 HydrophobicContact CD1-CD1 4.09Å; L430-L498 HydrophobicContact CD2-CD2 3.72Å; L430-L498 HydrophobicContact CG-CD2 4.06Å
431	E	93.4	Very high	94.8	Very high	81 Å²	81	50.5 Å²	50.5	38%	0.379	24%	0.238	S	C	.	.	H	α-helix	trans	-64.7	-38.7	173.8	-66	-169.9	125.9	0	0	112.7	L427 Q428 L429 V433 K434 V435 V437 W439	L427-E431 PolarHBondContact O-N 3.3Å; Q428-E431 WeakPolarHBondContact O-CB 3.38Å; Q428-E431 PolarHBondContact O-N 3.21Å; L429-E431 VanDerWaalsContact C-N 3.3Å; L429-E431 PolarHBondContact O-N 3.4Å; E431-V433 PolarHBondContact O-N 2.99Å; E431-K434 WeakPolarHBondContact O-CA 3.5Å; E431-K434 PolarHBondContact O-N 3.16Å; E431-V435 WeakPolarHBondContact CA-O 3.31Å; E431-V437 HydrophobicContact CG-CB 3.9Å; E431-V437 HydrophobicContact CG-CG2 3.63Å; E431-W439 HydrophobicContact CG-CZ2 4.44Å; E431-W439 PolarHBondContact OE1-NE1 3.27Å; E431-W439 VanDerWaalsContact OE2-CZ2 3.31Å; E431-W439 WeakPolarHBondContact OE2-CZ2 3.37Å; E431-W439 PolarHBondContact OE2-NE1 3.12Å
432	K	90.1	Very high	94.9	Very high	88 Å²	88	50.2 Å²	50.2	38%	0.383	24%	0.235	S	C	.	.	H	α-helix	trans	-61.9	-28.1	175.9	-57.6	-66.9	173.9	163.2	0	111.8	L407 Q428 L429 L430	L407-K432 HydrophobicContact CB-CG 4.4Å; L407-K432 HydrophobicContact CD1-CB 4.28Å; L407-K432 HydrophobicContact CD1-CG 4.33Å; L407-K432 WeakPolarHBondContact O-CE 3.42Å; L407-K432 PolarHBondContact O-NZ 2.8Å; Q428-K432 WeakPolarHBondContact O-CG 3.42Å; Q428-K432 PolarHBondContact O-N 3.25Å; Q428-K432 VanDerWaalsContact O-N 3.15Å; L429-K432 WeakPolarHBondContact O-CB 3.32Å; L429-K432 PolarHBondContact O-N 2.99Å; L429-K432 VanDerWaalsContact O-N 3.09Å; L430-K432 PolarHBondContact O-N 3.11Å
433	V	88.5	Confident	94.9	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	24.6	172.8	-56.6	0	0	0	0	113.9	L429 L430 E431 V435 L498 R501 Y502 M505	L429-V433 WeakPolarHBondContact O-CG2 3.47Å; L429-V433 PolarHBondContact O-N 3.3Å; L430-V433 HydrophobicContact CD2-CG2 4.5Å; L430-V433 CarbonylContact O-C 3.38Å; L430-V433 WeakPolarHBondContact O-CG2 3.38Å; L430-V433 PolarHBondContact O-N 3.45Å; E431-V433 PolarHBondContact O-N 2.99Å; V433-V435 HydrophobicContact CG2-CG2 4.17Å; V433-V435 PolarHBondContact O-N 3.07Å; V433-L498 HydrophobicContact CG2-CD2 3.95Å; V433-R501 HydrophobicContact CB-CG 4.2Å; V433-R501 PolarHBondContact O-NE 3.48Å; V433-Y502 HydrophobicContact CG1-CD2 4.33Å; V433-M505 VanDerWaalsContact C-CE 3.45Å; V433-M505 WeakPolarHBondContact CA-SD 2.93Å; V433-M505 HydrophobicContact CB-SD 3.63Å; V433-M505 HydrophobicContact CG1-SD 4.31Å; V433-M505 WeakPolarHBondContact O-CE 3.04Å
434	K	88.8	Confident	94.8	Very high	168 Å²	168	55.4 Å²	55.4	73%	0.73	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	33.3	175	-52.6	-72.8	-179.4	-175.8	0	114.1	L430 E431 M505	L430-K434 PolarHBondContact O-N 3.2Å; E431-K434 WeakPolarHBondContact O-CA 3.5Å; E431-K434 PolarHBondContact O-N 3.16Å; K434-M505 HydrophobicContact CB-CE 3.58Å; K434-M505 HydrophobicContact CG-CE 3.15Å
435	V	91.3	Very high	94.5	Very high	6 Å²	6	58.6 Å²	58.6	4%	0.036	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-94.3	123.7	165.2	178.1	0	0	0	0	107.4	L430 E431 V433 V437 L466 E470 A471	L430-V435 CarbonylContact C-O 3.57Å; L430-V435 HydrophobicContact CB-CB 4.12Å; L430-V435 HydrophobicContact CB-CG1 4.44Å; L430-V435 HydrophobicContact CD2-CB 4.11Å; L430-V435 HydrophobicContact CD2-CG1 4.22Å; L430-V435 HydrophobicContact CD2-CG2 4.12Å; L430-V435 WeakPolarHBondContact O-CB 2.86Å; L430-V435 PolarHBondContact O-N 3.44Å; E431-V435 WeakPolarHBondContact CA-O 3.31Å; V433-V435 HydrophobicContact CG2-CG2 4.17Å; V433-V435 PolarHBondContact O-N 3.07Å; V435-V437 PolarHBondContact O-N 2.67Å; V435-L466 HydrophobicContact CG1-CB 4.19Å; V435-E470 HydrophobicContact CG1-CB 3.84Å; V435-A471 HydrophobicContact CG2-CB 3.79Å
436	V	93.7	Very high	94.2	Very high	128 Å²	128	64.7 Å²	64.7	78%	0.776	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-73.1	124	-177	180	0	0	0	0	109.7
437	V	96.3	Very high	93.8	Very high	10 Å²	10	66.9 Å²	66.9	6%	0.061	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-103.6	131.6	176.9	179.4	0	0	0	0	109.9	L427 L430 E431 V435 W439 V442 Y462 L466	L427-V437 HydrophobicContact CB-CG1 4.33Å; L427-V437 HydrophobicContact CD2-CG1 3.98Å; L427-V437 HydrophobicContact CD2-CG2 4.44Å; L427-V437 WeakPolarHBondContact O-CG2 3.41Å; L430-V437 HydrophobicContact CB-CG2 4.08Å; E431-V437 HydrophobicContact CG-CB 3.9Å; E431-V437 HydrophobicContact CG-CG2 3.63Å; V435-V437 PolarHBondContact O-N 2.67Å; V437-W439 HydrophobicContact CB-CZ2 4.46Å; V437-W439 HydrophobicContact CG1-CD2 4.13Å; V437-W439 HydrophobicContact CG1-CG 4.44Å; V437-W439 HydrophobicContact CG1-CZ2 4.17Å; V437-W439 PolarHBondContact O-N 3.42Å; V437-V442 HydrophobicContact CG1-CG2 4.26Å; V437-Y462 HydrophobicContact CG1-CE1 4.05Å; V437-L466 HydrophobicContact CB-CD1 4.49Å; V437-L466 HydrophobicContact CG1-CD1 4.49Å; V437-L466 HydrophobicContact CG2-CD1 3.9Å
438	N	96.4	Very high	93.2	Very high	68 Å²	68	70.7 Å²	70.7	36%	0.364	36%	0.357	S	S	.	.			trans	-90.5	91.4	171.6	-174.6	-9.6	0	0	0	110.1	K440 K441 Y462	N438-K440 PolarHBondContact O-N 2.78Å; N438-K440 VanDerWaalsContact O-N 3.08Å; N438-K440 WeakPolarHBondContact OD1-CB 3.46Å; N438-K440 PolarHBondContact OD1-N 2.92Å; N438-K440 VanDerWaalsContact OD1-N 3.15Å; N438-K441 PolarHBondContact O-N 2.74Å; N438-Y462 WeakPolarHBondContact CB-OH 3.33Å; N438-Y462 PolarHBondContact N-OH 2.9Å
439	W	96.4	Very high	92.6	Very high	89 Å²	89	79.1 Å²	79.1	34%	0.337	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-59.7	-18.1	-179.7	-68.5	102.3	0	0	0	114.8	L427 Q428 E431 V437 K441 V442	L427-W439 HydrophobicContact CB-CH2 3.88Å; L427-W439 HydrophobicContact CB-CZ3 4.37Å; Q428-W439 HydrophobicContact CG-CH2 3.78Å; Q428-W439 HydrophobicContact CG-CZ2 4.19Å; E431-W439 HydrophobicContact CG-CZ2 4.44Å; E431-W439 PolarHBondContact OE1-NE1 3.27Å; E431-W439 VanDerWaalsContact OE2-CZ2 3.31Å; E431-W439 WeakPolarHBondContact OE2-CZ2 3.37Å; E431-W439 PolarHBondContact OE2-NE1 3.12Å; V437-W439 HydrophobicContact CB-CZ2 4.46Å; V437-W439 HydrophobicContact CG1-CD2 4.13Å; V437-W439 HydrophobicContact CG1-CG 4.44Å; V437-W439 HydrophobicContact CG1-CZ2 4.17Å; V437-W439 PolarHBondContact O-N 3.42Å; W439-K441 PolarHBondContact O-N 3.47Å; W439-V442 HydrophobicContact CD2-CG2 4.5Å; W439-V442 HydrophobicContact CE3-CB 3.95Å; W439-V442 HydrophobicContact CE3-CG1 4Å; W439-V442 HydrophobicContact CE3-CG2 3.86Å; W439-V442 HydrophobicContact CZ3-CB 4.39Å; W439-V442 HydrophobicContact CZ3-CG1 3.96Å; W439-V442 HydrophobicContact CZ3-CG2 4.29Å; W439-V442 PolarHBondContact O-N 3.42Å
440	K	95.8	Very high	92	Very high	198 Å²	198	86.9 Å²	86.9	86%	0.861	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-68.2	-18.9	173.6	-59.7	-177.5	177.2	-179.6	0	113.1	N438	N438-K440 PolarHBondContact O-N 2.78Å; N438-K440 VanDerWaalsContact O-N 3.08Å; N438-K440 WeakPolarHBondContact OD1-CB 3.46Å; N438-K440 PolarHBondContact OD1-N 2.92Å; N438-K440 VanDerWaalsContact OD1-N 3.15Å
441	K	94.5	Very high	91.6	Very high	137 Å²	137	88.6 Å²	88.6	60%	0.596	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-93.1	-4.7	176.2	-64.8	-173.5	175.6	-175.5	0	113.1	N438 W439 Y462	N438-K441 PolarHBondContact O-N 2.74Å; W439-K441 PolarHBondContact O-N 3.47Å; K441-Y462 HydrophobicContact CB-CE1 4.35Å
442	V	97	Very high	91.4	Very high	10 Å²	10	84.9 Å²	84.9	6%	0.061	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-95.2	130	-172.1	-178.2	0	0	0	0	109.6	L424 L427 V437 W439 Y462	L424-V442 HydrophobicContact CD2-CG1 3.36Å; L427-V442 HydrophobicContact CD1-CB 4.42Å; L427-V442 HydrophobicContact CD1-CG1 3.74Å; L427-V442 HydrophobicContact CD1-CG2 3.76Å; V437-V442 HydrophobicContact CG1-CG2 4.26Å; W439-V442 HydrophobicContact CD2-CG2 4.5Å; W439-V442 HydrophobicContact CE3-CB 3.95Å; W439-V442 HydrophobicContact CE3-CG1 4Å; W439-V442 HydrophobicContact CE3-CG2 3.86Å; W439-V442 HydrophobicContact CZ3-CB 4.39Å; W439-V442 HydrophobicContact CZ3-CG1 3.96Å; W439-V442 HydrophobicContact CZ3-CG2 4.29Å; W439-V442 PolarHBondContact O-N 3.42Å; V442-Y462 HydrophobicContact CG2-CD1 4.16Å; V442-Y462 HydrophobicContact CG2-CE1 4.11Å
443	N	96.1	Very high	91.5	Very high	34 Å²	34	85.4 Å²	85.4	18%	0.182	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-86.3	124	176.3	-59	-71.6	0	0	0	109.9	Y447 K455 E458 N459	N443-Y447 HydrophobicContact CB-CE1 4.12Å; N443-Y447 WeakPolarHBondContact O-CE1 3.38Å; N443-Y447 PolarHBondContact O-OH 2.96Å; N443-K455 HydrophobicContact CB-CB 3.96Å; N443-K455 HydrophobicContact CB-CD 4Å; N443-K455 PolarHBondContact ND2-O 2.84Å; N443-K455 WeakPolarHBondContact OD1-CD 3.36Å; N443-K455 PolarHBondContact OD1-NZ 3.35Å; N443-E458 PolarHBondContact ND2-OE2 3.02Å; N443-N459 PolarHBondContact N-OD1 3.28Å; N443-N459 PolarHBondContact ND2-OD1 3.43Å; N443-N459 PolarHBondContact O-ND2 3.24Å
444	N	93.8	Very high	91.8	Very high	100 Å²	100	91.4 Å²	91.4	54%	0.535	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-102.1	151.7	-178.9	-63.8	-67.8	0	0	0	111.7
445	P	90.1	Very high	92.1	Very high	75 Å²	75	86.9 Å²	86.9	49%	0.487	46%	0.455	S	S	.	.	S	Bend	trans	-64.8	160.1	169.4	28.7	-36.7	0	0	0	111.6	L424 Y447	L424-P445 HydrophobicContact CD1-CG 4.31Å; P445-Y447 HydrophobicContact CB-CD2 4.14Å; P445-Y447 HydrophobicContact CB-CE2 3.95Å
446	P	91	Very high	92.4	Very high	128 Å²	128	89.9 Å²	89.9	83%	0.831	47%	0.468	S	S	*	.	S	Bend	cis	-73	135	-0.4	29.6	-34.3	0	0	0	112.3
447	Y	89.4	Confident	92.5	Very high	48 Å²	48	86.1 Å²	86.1	19%	0.188	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-83.1	137.5	177.9	-61	-67	0	0	0	110.5	D422 N443 P445 K455 K456	D422-Y447 HydrophobicContact CB-CE2 4.06Å; N443-Y447 HydrophobicContact CB-CE1 4.12Å; N443-Y447 WeakPolarHBondContact O-CE1 3.38Å; N443-Y447 PolarHBondContact O-OH 2.96Å; P445-Y447 HydrophobicContact CB-CD2 4.14Å; P445-Y447 HydrophobicContact CB-CE2 3.95Å; Y447-K455 HydrophobicContact CD1-CB 3.97Å; Y447-K455 HydrophobicContact CE1-CB 4.24Å; Y447-K456 HydrophobicContact CD2-CD 4.46Å; Y447-K456 VanDerWaalsContact CD2-CE 3.49Å; Y447-K456 HydrophobicContact CD2-CG 4.16Å; Y447-K456 HydrophobicContact CE1-CG 4.48Å; Y447-K456 HydrophobicContact CE2-CG 4.01Å; Y447-K456 HydrophobicContact CG-CG 4.44Å
448	P	87	Confident	92.6	Very high	81 Å²	81	89.8 Å²	89.8	53%	0.526	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-60.8	145.6	174.4	-22.4	33	0	0	0	112	L450 G452	P448-L450 VanDerWaalsContact C-N 3.29Å; P448-L450 WeakPolarHBondContact CB-O 3.43Å; P448-L450 PolarHBondContact O-N 2.97Å; P448-G452 WeakPolarHBondContact O-CA 3.47Å; P448-G452 PolarHBondContact O-N 3.43Å
449	Q	84.6	Confident	92.7	Very high	210 Å²	210	86.6 Å²	86.6	98%	0.981	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-43.9	176.3	-74.7	-177.5	-6.5	0	0	111.9
450	L	83.2	Confident	92.8	Very high	165 Å²	165	82.4 Å²	82.4	86%	0.864	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	121.3	173.3	-99.5	142	0	0	0	110.2	P448 G452	P448-L450 VanDerWaalsContact C-N 3.29Å; P448-L450 WeakPolarHBondContact CB-O 3.43Å; P448-L450 PolarHBondContact O-N 2.97Å; L450-G452 VanDerWaalsContact C-N 3.29Å; L450-G452 PolarHBondContact O-N 3.24Å
451	G	86.4	Confident	92.9	Very high	35 Å²	35	76.7 Å²	76.7	36%	0.361	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.2	-3.6	178.8	0	0	0	0	0	115.1	N453 M454 K455	G451-N453 VanDerWaalsContact C-N 3.27Å; G451-N453 PolarHBondContact O-N 2.87Å; G451-M454 WeakPolarHBondContact O-CB 3.44Å; G451-M454 PolarHBondContact O-N 2.99Å; G451-M454 VanDerWaalsContact O-N 3.07Å; G451-K455 PolarHBondContact O-N 3.32Å
452	G	89.6	Confident	93	Very high	4 Å²	4	71.8 Å²	71.8	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-57.2	-38.7	174.6	0	0	0	0	0	113	P448 L450 M454 K455 K456	P448-G452 WeakPolarHBondContact O-CA 3.47Å; P448-G452 PolarHBondContact O-N 3.43Å; L450-G452 VanDerWaalsContact C-N 3.29Å; L450-G452 PolarHBondContact O-N 3.24Å; G452-M454 VanDerWaalsContact C-N 3.32Å; G452-M454 PolarHBondContact O-N 2.91Å; G452-K455 WeakPolarHBondContact O-CB 3.48Å; G452-K455 PolarHBondContact O-N 2.63Å; G452-K456 WeakPolarHBondContact O-CG 3.4Å; G452-K456 PolarHBondContact O-N 2.81Å; G452-K456 VanDerWaalsContact O-N 3.08Å
453	N	92.1	Very high	93.1	Very high	98 Å²	98	71.3 Å²	71.3	52%	0.524	38%	0.381	S	S	.	.	H	α-helix	trans	-65	-36	176	-163.3	54.7	0	0	0	112.7	G451 K455 K456 L457 N484	G451-N453 VanDerWaalsContact C-N 3.27Å; G451-N453 PolarHBondContact O-N 2.87Å; N453-K455 VanDerWaalsContact C-N 3.28Å; N453-K455 PolarHBondContact O-N 3.24Å; N453-K456 PolarHBondContact O-N 3.17Å; N453-L457 WeakPolarHBondContact O-CB 3.4Å; N453-L457 PolarHBondContact O-N 3.45Å; N453-N484 PolarHBondContact ND2-OD1 2.9Å; N453-N484 VanDerWaalsContact ND2-OD1 3.12Å; N453-N484 PolarHBondContact OD1-ND2 2.68Å; N453-N484 PolarHBondContact OD1-OD1 2.97Å; N453-N484 VanDerWaalsContact OD1-OD1 3.1Å
454	M	94.7	Very high	93.2	Very high	127 Å²	127	70.1 Å²	70.1	63%	0.626	37%	0.374	S	S	*	.	H	α-helix	trans	-63.6	-37.4	175.2	-60.9	176.4	70.1	0	0	111.2	G451 G452 L457 E458	G451-M454 WeakPolarHBondContact O-CB 3.44Å; G451-M454 PolarHBondContact O-N 2.99Å; G451-M454 VanDerWaalsContact O-N 3.07Å; G452-M454 VanDerWaalsContact C-N 3.32Å; G452-M454 PolarHBondContact O-N 2.91Å; M454-L457 PolarHBondContact O-N 2.93Å; M454-E458 WeakPolarHBondContact O-CG 3.26Å; M454-E458 PolarHBondContact O-N 2.73Å
455	K	95.4	Very high	93.3	Very high	73 Å²	73	71.2 Å²	71.2	32%	0.317	37%	0.374	S	S	.	.	H	α-helix	trans	-65.4	-40.7	176.3	-66.6	-76	154.1	-151.4	0	112.5	N443 Y447 G451 G452 N453 E458 N459	N443-K455 HydrophobicContact CB-CB 3.96Å; N443-K455 HydrophobicContact CB-CD 4Å; N443-K455 PolarHBondContact ND2-O 2.84Å; N443-K455 WeakPolarHBondContact OD1-CD 3.36Å; N443-K455 PolarHBondContact OD1-NZ 3.35Å; Y447-K455 HydrophobicContact CD1-CB 3.97Å; Y447-K455 HydrophobicContact CE1-CB 4.24Å; G451-K455 PolarHBondContact O-N 3.32Å; G452-K455 WeakPolarHBondContact O-CB 3.48Å; G452-K455 PolarHBondContact O-N 2.63Å; N453-K455 VanDerWaalsContact C-N 3.28Å; N453-K455 PolarHBondContact O-N 3.24Å; K455-E458 IonicContact NZ-OE1 3.69Å; K455-E458 PolarHBondContact NZ-OE1 2.9Å; K455-E458 IonicContact NZ-OE2 2.66Å; K455-E458 PolarHBondContact NZ-OE2 3.31Å; K455-N459 PolarHBondContact O-N 2.95Å
456	K	96.1	Very high	93.6	Very high	69 Å²	69	68.2 Å²	68.2	30%	0.3	35%	0.354	S	S	.	.	H	α-helix	trans	-63.4	-46.3	172.2	-67.2	-176.9	-178.7	-175.4	0	111.4	D422 Y447 G452 N453 E458 N459 C460 N484	D422-K456 HydrophobicContact CB-CB 4.29Å; D422-K456 HydrophobicContact CB-CD 4.06Å; D422-K456 HydrophobicContact CB-CG 3.77Å; Y447-K456 HydrophobicContact CD2-CD 4.46Å; Y447-K456 VanDerWaalsContact CD2-CE 3.49Å; Y447-K456 HydrophobicContact CD2-CG 4.16Å; Y447-K456 HydrophobicContact CE1-CG 4.48Å; Y447-K456 HydrophobicContact CE2-CG 4.01Å; Y447-K456 HydrophobicContact CG-CG 4.44Å; G452-K456 WeakPolarHBondContact O-CG 3.4Å; G452-K456 PolarHBondContact O-N 2.81Å; G452-K456 VanDerWaalsContact O-N 3.08Å; N453-K456 PolarHBondContact O-N 3.17Å; K456-E458 PolarHBondContact O-N 2.78Å; K456-N459 WeakPolarHBondContact O-CB 3.28Å; K456-N459 PolarHBondContact O-N 3.49Å; K456-N459 VanDerWaalsContact O-N 3.13Å; K456-C460 PolarHBondContact O-N 3.1Å; K456-C460 PolarHBondContact O-SG 3.25Å; K456-N484 VanDerWaalsContact CB-ND2 3.34Å; K456-N484 WeakPolarHBondContact CB-ND2 3.42Å
457	L	97.3	Very high	93.8	Very high	49 Å²	49	62.1 Å²	62.1	26%	0.257	31%	0.314	S	S	.	.	H	α-helix	trans	-61.2	-40.2	177	-179.6	60.6	0	0	0	112.7	N453 M454 N459 C460 N461 E481 N484	N453-L457 WeakPolarHBondContact O-CB 3.4Å; N453-L457 PolarHBondContact O-N 3.45Å; M454-L457 PolarHBondContact O-N 2.93Å; L457-N459 VanDerWaalsContact C-N 3.31Å; L457-N459 PolarHBondContact O-N 3.38Å; L457-C460 PolarHBondContact O-N 3Å; L457-N461 WeakPolarHBondContact O-CB 3.38Å; L457-N461 PolarHBondContact O-N 3.28Å; L457-N461 PolarHBondContact O-ND2 3.31Å; L457-E481 HydrophobicContact CD1-CB 4.19Å; L457-N484 HydrophobicContact CD1-CB 4.06Å
458	E	97.6	Very high	94	Very high	88 Å²	88	63.6 Å²	63.6	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-56.3	-44.7	172.8	-78.4	170.7	-172.7	0	0	111.5	N443 M454 K455 K456 Y462	N443-E458 PolarHBondContact ND2-OE2 3.02Å; M454-E458 WeakPolarHBondContact O-CG 3.26Å; M454-E458 PolarHBondContact O-N 2.73Å; K455-E458 IonicContact NZ-OE1 3.69Å; K455-E458 PolarHBondContact NZ-OE1 2.9Å; K455-E458 IonicContact NZ-OE2 2.66Å; K455-E458 PolarHBondContact NZ-OE2 3.31Å; K456-E458 PolarHBondContact O-N 2.78Å; E458-Y462 WeakPolarHBondContact O-CB 3.41Å; E458-Y462 PolarHBondContact O-N 2.97Å
459	N	98.2	Very high	94.2	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-64.2	-47.6	176	-70.1	-9.2	0	0	0	111.9	D422 L427 N443 K455 K456 L457 N461 Y462 A463	D422-N459 WeakPolarHBondContact O-CB 3.4Å; D422-N459 PolarHBondContact O-ND2 3.25Å; L427-N459 HydrophobicContact CD1-CB 4.36Å; N443-N459 PolarHBondContact N-OD1 3.28Å; N443-N459 PolarHBondContact ND2-OD1 3.43Å; N443-N459 PolarHBondContact O-ND2 3.24Å; K455-N459 PolarHBondContact O-N 2.95Å; K456-N459 WeakPolarHBondContact O-CB 3.28Å; K456-N459 PolarHBondContact O-N 3.49Å; K456-N459 VanDerWaalsContact O-N 3.13Å; L457-N459 VanDerWaalsContact C-N 3.31Å; L457-N459 PolarHBondContact O-N 3.38Å; N459-N461 VanDerWaalsContact C-N 3.34Å; N459-N461 PolarHBondContact O-N 3.32Å; N459-Y462 WeakPolarHBondContact O-CB 3.48Å; N459-Y462 PolarHBondContact O-N 3.46Å; N459-Y462 VanDerWaalsContact O-N 3.15Å; N459-A463 WeakPolarHBondContact O-CB 3.4Å; N459-A463 PolarHBondContact O-N 3.28Å
460	C	98.2	Very high	94.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-42.8	178.3	-67.3	0	0	0	0	111.7	C421 K456 L457 Y462 A463 V464 G480 L483 N484	C421-C460 PolarHBondContact O-SG 2.89Å; K456-C460 PolarHBondContact O-N 3.1Å; K456-C460 PolarHBondContact O-SG 3.25Å; L457-C460 PolarHBondContact O-N 3Å; C460-Y462 VanDerWaalsContact C-N 3.33Å; C460-Y462 PolarHBondContact O-N 3.01Å; C460-A463 PolarHBondContact O-N 2.96Å; C460-V464 WeakPolarHBondContact O-CG2 3.5Å; C460-V464 PolarHBondContact O-N 3.23Å; C460-G480 VanDerWaalsContact CB-O 3.26Å; C460-G480 WeakPolarHBondContact CB-O 3.42Å; C460-L483 HydrophobicContact CB-CB 4.19Å; C460-N484 HydrophobicContact CB-CB 4.41Å
461	N	98.1	Very high	94.6	Very high	78 Å²	78	51.3 Å²	51.3	42%	0.417	26%	0.255	S	S	.	.	H	α-helix	trans	-61.1	-42.3	174.4	-80	-36.4	0	0	0	111.7	L457 N459 V464 K465 G480	L457-N461 WeakPolarHBondContact O-CB 3.38Å; L457-N461 PolarHBondContact O-N 3.28Å; L457-N461 PolarHBondContact O-ND2 3.31Å; N459-N461 VanDerWaalsContact C-N 3.34Å; N459-N461 PolarHBondContact O-N 3.32Å; N461-V464 PolarHBondContact O-N 3.44Å; N461-K465 WeakPolarHBondContact O-CB 2.74Å; N461-K465 PolarHBondContact O-N 3.36Å; N461-G480 VanDerWaalsContact OD1-CA 3.29Å; N461-G480 WeakPolarHBondContact OD1-CA 3.42Å; N461-G480 PolarHBondContact OD1-N 3.2Å
462	Y	98.3	Very high	94.6	Very high	35 Å²	35	56.8 Å²	56.8	14%	0.137	27%	0.269	C	S	.	.	H	α-helix	trans	-64.3	-42.7	176.1	-178.1	-138.5	0	0	0	112.1	L427 V437 N438 K441 V442 E458 N459 C460 K465 L466	L427-Y462 HydrophobicContact CD2-CD1 3.82Å; L427-Y462 HydrophobicContact CD2-CE1 4.14Å; V437-Y462 HydrophobicContact CG1-CE1 4.05Å; N438-Y462 WeakPolarHBondContact CB-OH 3.33Å; N438-Y462 PolarHBondContact N-OH 2.9Å; K441-Y462 HydrophobicContact CB-CE1 4.35Å; V442-Y462 HydrophobicContact CG2-CD1 4.16Å; V442-Y462 HydrophobicContact CG2-CE1 4.11Å; E458-Y462 WeakPolarHBondContact O-CB 3.41Å; E458-Y462 PolarHBondContact O-N 2.97Å; N459-Y462 WeakPolarHBondContact O-CB 3.48Å; N459-Y462 PolarHBondContact O-N 3.46Å; N459-Y462 VanDerWaalsContact O-N 3.15Å; C460-Y462 VanDerWaalsContact C-N 3.33Å; C460-Y462 PolarHBondContact O-N 3.01Å; Y462-K465 WeakPolarHBondContact O-CB 3.25Å; Y462-K465 PolarHBondContact O-N 2.95Å; Y462-L466 HydrophobicContact CD1-CD1 4.47Å; Y462-L466 HydrophobicContact CD2-CD1 4.37Å; Y462-L466 HydrophobicContact CD2-CG 4.09Å; Y462-L466 HydrophobicContact CE1-CD1 3.97Å; Y462-L466 HydrophobicContact CE2-CD1 3.82Å; Y462-L466 HydrophobicContact CE2-CD2 3.77Å; Y462-L466 HydrophobicContact CE2-CG 3.62Å; Y462-L466 WeakPolarHBondContact O-CG 3.24Å; Y462-L466 PolarHBondContact O-N 2.72Å
463	A	97.9	Very high	94.7	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-44.8	177	0	0	0	0	0	112.1	I426 L427 L430 N459 C460 K465 L466 S467	I426-A463 HydrophobicContact CB-CB 4.28Å; I426-A463 HydrophobicContact CG2-CB 3.76Å; L427-A463 HydrophobicContact CD2-CB 3.94Å; L427-A463 HydrophobicContact CG-CB 4.13Å; L430-A463 HydrophobicContact CD1-CB 4.41Å; N459-A463 WeakPolarHBondContact O-CB 3.4Å; N459-A463 PolarHBondContact O-N 3.28Å; C460-A463 PolarHBondContact O-N 2.96Å; A463-K465 VanDerWaalsContact C-N 3.34Å; A463-K465 PolarHBondContact O-N 3.34Å; A463-L466 PolarHBondContact O-N 2.95Å; A463-S467 WeakPolarHBondContact O-CB 3.45Å; A463-S467 PolarHBondContact O-N 2.67Å; A463-S467 PolarHBondContact O-OG 3.08Å
464	V	97.5	Very high	94.4	Very high	8 Å²	8	56 Å²	56	5%	0.048	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-41.4	175.2	172	0	0	0	0	111.1	C460 N461 S467 K468 V478 L483	C460-V464 WeakPolarHBondContact O-CG2 3.5Å; C460-V464 PolarHBondContact O-N 3.23Å; N461-V464 PolarHBondContact O-N 3.44Å; V464-S467 WeakPolarHBondContact O-CB 3.16Å; V464-S467 PolarHBondContact O-N 2.8Å; V464-K468 HydrophobicContact CG1-CD 4.01Å; V464-K468 HydrophobicContact CG1-CG 4.47Å; V464-K468 WeakPolarHBondContact O-CG 3.41Å; V464-K468 PolarHBondContact O-N 3.5Å; V464-V478 HydrophobicContact CG2-CG1 4.29Å; V464-L483 HydrophobicContact CG2-CD1 3.4Å; V464-L483 VanDerWaalsContact CG2-CD1 3.4Å; V464-L483 HydrophobicContact CG2-CG 4.33Å
465	K	96.7	Very high	94.2	Very high	123 Å²	123	50.4 Å²	50.4	54%	0.535	24%	0.243	S	C	.	.	H	α-helix	trans	-58.7	-52.6	176.3	-176.3	179.9	178.3	171.4	0	111.3	N461 Y462 A463 S467 K468 D469	N461-K465 WeakPolarHBondContact O-CB 2.74Å; N461-K465 PolarHBondContact O-N 3.36Å; Y462-K465 WeakPolarHBondContact O-CB 3.25Å; Y462-K465 PolarHBondContact O-N 2.95Å; A463-K465 VanDerWaalsContact C-N 3.34Å; A463-K465 PolarHBondContact O-N 3.34Å; K465-S467 VanDerWaalsContact C-N 3.26Å; K465-S467 PolarHBondContact O-N 3.15Å; K465-K468 PolarHBondContact O-N 2.98Å; K465-D469 WeakPolarHBondContact CE-OD2 3.42Å; K465-D469 WeakPolarHBondContact CG-OD2 3.28Å; K465-D469 VanDerWaalsContact O-CB 3.28Å; K465-D469 WeakPolarHBondContact O-CB 3.29Å; K465-D469 PolarHBondContact O-N 3Å
466	L	96.8	Very high	93.7	Very high	12 Å²	12	53.4 Å²	53.4	6%	0.063	27%	0.267	C	S	.	.	H	α-helix	trans	-58.9	-40.1	177.2	-70.7	178.9	0	0	0	112	L427 L430 V435 V437 Y462 A463 K468 E470 A471	L427-L466 HydrophobicContact CD2-CD1 4.04Å; L430-L466 HydrophobicContact CD1-CB 3.89Å; L430-L466 HydrophobicContact CD1-CD1 4.09Å; V435-L466 HydrophobicContact CG1-CB 4.19Å; V437-L466 HydrophobicContact CB-CD1 4.49Å; V437-L466 HydrophobicContact CG1-CD1 4.49Å; V437-L466 HydrophobicContact CG2-CD1 3.9Å; Y462-L466 HydrophobicContact CD1-CD1 4.47Å; Y462-L466 HydrophobicContact CD2-CD1 4.37Å; Y462-L466 HydrophobicContact CD2-CG 4.09Å; Y462-L466 HydrophobicContact CE1-CD1 3.97Å; Y462-L466 HydrophobicContact CE2-CD1 3.82Å; Y462-L466 HydrophobicContact CE2-CD2 3.77Å; Y462-L466 HydrophobicContact CE2-CG 3.62Å; Y462-L466 WeakPolarHBondContact O-CG 3.24Å; Y462-L466 PolarHBondContact O-N 2.72Å; A463-L466 PolarHBondContact O-N 2.95Å; L466-K468 PolarHBondContact O-N 2.92Å; L466-E470 HydrophobicContact CD2-CG 3.84Å; L466-E470 WeakPolarHBondContact O-CA 3.35Å; L466-E470 WeakPolarHBondContact O-CB 3.42Å; L466-E470 PolarHBondContact O-N 2.95Å; L466-A471 PolarHBondContact O-N 2.94Å
467	S	94.6	Very high	93.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.7	-39	179.4	-60	0	0	0	0	112.7	A463 V464 K465 A471 K472 F473 L475	A463-S467 WeakPolarHBondContact O-CB 3.45Å; A463-S467 PolarHBondContact O-N 2.67Å; A463-S467 PolarHBondContact O-OG 3.08Å; V464-S467 WeakPolarHBondContact O-CB 3.16Å; V464-S467 PolarHBondContact O-N 2.8Å; K465-S467 VanDerWaalsContact C-N 3.26Å; K465-S467 PolarHBondContact O-N 3.15Å; S467-A471 CarbonylContact O-C 3.58Å; S467-A471 WeakPolarHBondContact O-CB 3.35Å; S467-K472 PolarHBondContact O-N 2.75Å; S467-F473 WeakPolarHBondContact O-CB 3.19Å; S467-F473 PolarHBondContact O-N 2.82Å; S467-L475 VanDerWaalsContact CB-CD1 3.48Å
468	K	92.9	Very high	93.2	Very high	80 Å²	80	50.7 Å²	50.7	35%	0.348	27%	0.269	S	S	.	.	H	α-helix	trans	-79.9	-48.6	177.4	-70.7	178.1	-179.9	173.1	0	112.3	V464 K465 L466 K472 L475 V478	V464-K468 HydrophobicContact CG1-CD 4.01Å; V464-K468 HydrophobicContact CG1-CG 4.47Å; V464-K468 WeakPolarHBondContact O-CG 3.41Å; V464-K468 PolarHBondContact O-N 3.5Å; K465-K468 PolarHBondContact O-N 2.98Å; L466-K468 PolarHBondContact O-N 2.92Å; K468-K472 WeakPolarHBondContact O-CA 3.28Å; K468-K472 PolarHBondContact O-N 2.66Å; K468-L475 VanDerWaalsContact CE-O 3.32Å; K468-L475 WeakPolarHBondContact CE-O 3.28Å; K468-L475 HydrophobicContact CG-CB 4.15Å; K468-L475 HydrophobicContact CG-CD1 4.09Å; K468-V478 WeakPolarHBondContact CE-O 3.41Å; K468-V478 PolarHBondContact NZ-O 3.2Å
469	D	91.8	Very high	93.1	Very high	73 Å²	73	47.7 Å²	47.7	39%	0.39	26%	0.262	S	S	.	.	H	α-helix	trans	-82.8	-42	-168.1	-64.9	-10.6	0	0	0	112	K465 K472	K465-D469 WeakPolarHBondContact CE-OD2 3.42Å; K465-D469 WeakPolarHBondContact CG-OD2 3.28Å; K465-D469 VanDerWaalsContact O-CB 3.28Å; K465-D469 WeakPolarHBondContact O-CB 3.29Å; K465-D469 PolarHBondContact O-N 3Å; D469-K472 WeakPolarHBondContact O-CD 3.44Å; D469-K472 WeakPolarHBondContact O-CE 3.45Å; D469-K472 PolarHBondContact O-NZ 3.5Å
470	E	89.1	Confident	93	Very high	123 Å²	123	47.7 Å²	47.7	58%	0.575	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-46.6	-175.1	-55.3	-59.1	155.1	0	0	111.4	V435 L466 K472	V435-E470 HydrophobicContact CG1-CB 3.84Å; L466-E470 HydrophobicContact CD2-CG 3.84Å; L466-E470 WeakPolarHBondContact O-CA 3.35Å; L466-E470 WeakPolarHBondContact O-CB 3.42Å; L466-E470 PolarHBondContact O-N 2.95Å; E470-K472 VanDerWaalsContact C-N 3.31Å; E470-K472 PolarHBondContact O-N 2.82Å
471	A	86.6	Confident	92.9	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.008	29%	0.288	C	S	.	.	S	Bend	trans	-78.9	-16.5	-179.8	0	0	0	0	0	113.1	V435 L466 S467 F473 R501	V435-A471 HydrophobicContact CG2-CB 3.79Å; L466-A471 PolarHBondContact O-N 2.94Å; S467-A471 CarbonylContact O-C 3.58Å; S467-A471 WeakPolarHBondContact O-CB 3.35Å; A471-F473 HydrophobicContact CB-CD1 3.94Å; A471-F473 HydrophobicContact CB-CD2 4.03Å; A471-F473 HydrophobicContact CB-CE1 3.81Å; A471-F473 HydrophobicContact CB-CE2 3.86Å; A471-F473 HydrophobicContact CB-CG 4.05Å; A471-F473 HydrophobicContact CB-CZ 3.76Å; A471-F473 PolarHBondContact O-N 3.47Å; A471-R501 PolarHBondContact O-NH1 2.94Å
472	K	88.3	Confident	92.9	Very high	150 Å²	150	51.2 Å²	51.2	65%	0.652	28%	0.277	S	S	*	.			trans	58.9	29.7	-178.4	-53.2	-57.2	-172	-170.2	0	114.1	S467 K468 D469 E470	S467-K472 PolarHBondContact O-N 2.75Å; K468-K472 WeakPolarHBondContact O-CA 3.28Å; K468-K472 PolarHBondContact O-N 2.66Å; D469-K472 WeakPolarHBondContact O-CD 3.44Å; D469-K472 WeakPolarHBondContact O-CE 3.45Å; D469-K472 PolarHBondContact O-NZ 3.5Å; E470-K472 VanDerWaalsContact C-N 3.31Å; E470-K472 PolarHBondContact O-N 2.82Å
473	F	89.7	Confident	92.8	Very high	9 Å²	9	49.6 Å²	49.6	4%	0.039	27%	0.271	C	S	.	.			trans	-67.5	142	178.6	-65.1	-22.1	0	0	0	112.4	S467 A471 L475 L494 Q497 L498 R501	S467-F473 WeakPolarHBondContact O-CB 3.19Å; S467-F473 PolarHBondContact O-N 2.82Å; A471-F473 HydrophobicContact CB-CD1 3.94Å; A471-F473 HydrophobicContact CB-CD2 4.03Å; A471-F473 HydrophobicContact CB-CE1 3.81Å; A471-F473 HydrophobicContact CB-CE2 3.86Å; A471-F473 HydrophobicContact CB-CG 4.05Å; A471-F473 HydrophobicContact CB-CZ 3.76Å; A471-F473 PolarHBondContact O-N 3.47Å; F473-L475 HydrophobicContact CB-CD1 3.85Å; F473-L475 HydrophobicContact CB-CD2 4.31Å; F473-L475 HydrophobicContact CB-CG 3.69Å; F473-L475 HydrophobicContact CD2-CD1 4.37Å; F473-L475 PolarHBondContact O-N 3.3Å; F473-L475 VanDerWaalsContact O-N 3.11Å; F473-L494 HydrophobicContact CD2-CD1 4.23Å; F473-Q497 HydrophobicContact CB-CB 4.2Å; F473-Q497 HydrophobicContact CB-CG 4.3Å; F473-Q497 HydrophobicContact CD1-CB 4.03Å; F473-Q497 HydrophobicContact CD2-CB 3.7Å; F473-Q497 HydrophobicContact CE1-CB 4.27Å; F473-Q497 HydrophobicContact CE2-CB 4.01Å; F473-Q497 HydrophobicContact CG-CB 3.74Å; F473-Q497 HydrophobicContact CG-CG 4.37Å; F473-Q497 HydrophobicContact CZ-CB 4.28Å; F473-L498 HydrophobicContact CE2-CD2 3.67Å; F473-L498 HydrophobicContact CE2-CG 3.92Å; F473-L498 HydrophobicContact CZ-CD2 4.12Å; F473-R501 HydrophobicContact CE1-CB 3.7Å; F473-R501 HydrophobicContact CE1-CG 4.1Å; F473-R501 HydrophobicContact CZ-CB 3.8Å; F473-R501 HydrophobicContact CZ-CG 4.29Å
474	S	87.7	Confident	92.7	Very high	78 Å²	78	50.4 Å²	50.4	55%	0.545	28%	0.275	S	S	.	.			trans	-77.6	95.8	169.5	-166.5	0	0	0	0	110.1
475	L	88.9	Confident	92.6	Very high	9 Å²	9	56.2 Å²	56.2	5%	0.047	30%	0.302	C	S	.	.			trans	-123.3	55.9	-175	-65.5	176.4	0	0	0	111.1	S467 K468 F473 G477 V478 L494 Q497	S467-L475 VanDerWaalsContact CB-CD1 3.48Å; K468-L475 VanDerWaalsContact CE-O 3.32Å; K468-L475 WeakPolarHBondContact CE-O 3.28Å; K468-L475 HydrophobicContact CG-CB 4.15Å; K468-L475 HydrophobicContact CG-CD1 4.09Å; F473-L475 HydrophobicContact CB-CD1 3.85Å; F473-L475 HydrophobicContact CB-CD2 4.31Å; F473-L475 HydrophobicContact CB-CG 3.69Å; F473-L475 HydrophobicContact CD2-CD1 4.37Å; F473-L475 PolarHBondContact O-N 3.3Å; F473-L475 VanDerWaalsContact O-N 3.11Å; L475-G477 PolarHBondContact O-N 3.39Å; L475-V478 HydrophobicContact CB-CB 4.04Å; L475-V478 HydrophobicContact CB-CG2 4.14Å; L475-V478 HydrophobicContact CD2-CG2 4.17Å; L475-V478 PolarHBondContact O-N 3.19Å; L475-L494 HydrophobicContact CD1-CD1 3.76Å; L475-L494 HydrophobicContact CD2-CB 4.37Å; L475-L494 HydrophobicContact CD2-CD1 4.06Å; L475-Q497 HydrophobicContact CD2-CG 4.16Å
476	V	85.8	Confident	92.4	Very high	136 Å²	136	51 Å²	51	82%	0.824	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	126.7	177.7	-177.3	0	0	0	0	109	V478	V476-V478 PolarHBondContact O-N 3.05Å
477	G	88.6	Confident	92.3	Very high	57 Å²	57	52 Å²	52	59%	0.588	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	-8.6	179.6	0	0	0	0	0	115.9	L475 G479 N482	L475-G477 PolarHBondContact O-N 3.39Å; G477-G479 PolarHBondContact O-N 2.93Å; G477-N482 PolarHBondContact O-OD1 2.95Å
478	V	93.8	Very high	92.2	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.024	31%	0.307	C	S	.	.			trans	-81.8	115	178.2	-177.5	0	0	0	0	110.1	V464 K468 L475 V476 L483 H490	V464-V478 HydrophobicContact CG2-CG1 4.29Å; K468-V478 WeakPolarHBondContact CE-O 3.41Å; K468-V478 PolarHBondContact NZ-O 3.2Å; L475-V478 HydrophobicContact CB-CB 4.04Å; L475-V478 HydrophobicContact CB-CG2 4.14Å; L475-V478 HydrophobicContact CD2-CG2 4.17Å; L475-V478 PolarHBondContact O-N 3.19Å; V476-V478 PolarHBondContact O-N 3.05Å; V478-L483 HydrophobicContact CG1-CD2 4.43Å; V478-H490 HydrophobicContact CG1-CB 4.33Å; V478-H490 HydrophobicContact CG2-CB 4.34Å
479	G	95.5	Very high	92.2	Very high	24 Å²	24	57.2 Å²	57.2	25%	0.247	32%	0.32	C	S	.	.			trans	-111.3	166.9	170.5	0	0	0	0	0	112.6	G477 E481 N482	G477-G479 PolarHBondContact O-N 2.93Å; G479-E481 VanDerWaalsContact C-N 3.27Å; G479-E481 PolarHBondContact O-N 2.94Å; G479-N482 PolarHBondContact N-OD1 3.48Å; G479-N482 PolarHBondContact O-N 3.33Å
480	G	96.5	Very high	92.4	Very high	1 Å²	1	56 Å²	56	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-30.3	176.3	0	0	0	0	0	112.8	C460 N461 L483 N484	C460-G480 VanDerWaalsContact CB-O 3.26Å; C460-G480 WeakPolarHBondContact CB-O 3.42Å; N461-G480 VanDerWaalsContact OD1-CA 3.29Å; N461-G480 WeakPolarHBondContact OD1-CA 3.42Å; N461-G480 PolarHBondContact OD1-N 3.2Å; G480-L483 PolarHBondContact O-N 2.95Å; G480-N484 WeakPolarHBondContact O-CB 3.45Å; G480-N484 PolarHBondContact O-N 3.39Å
481	E	97	Very high	92.8	Very high	116 Å²	116	50.2 Å²	50.2	54%	0.542	29%	0.285	S	S	.	.	H	α-helix	trans	-58.7	-48.7	173.4	-175.4	171.3	-146.9	0	0	111.4	L457 G479 L483 N484 E485	L457-E481 HydrophobicContact CD1-CB 4.19Å; G479-E481 VanDerWaalsContact C-N 3.27Å; G479-E481 PolarHBondContact O-N 2.94Å; E481-L483 PolarHBondContact O-N 3.13Å; E481-L483 VanDerWaalsContact O-N 3.17Å; E481-N484 PolarHBondContact O-N 3.49Å; E481-E485 HydrophobicContact CG-CG 4.41Å; E481-E485 WeakPolarHBondContact O-CB 3.46Å; E481-E485 WeakPolarHBondContact O-CG 3.44Å; E481-E485 PolarHBondContact O-N 3.02Å
482	N	96.4	Very high	93.2	Very high	36 Å²	36	51.2 Å²	51.2	19%	0.193	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-34.2	179.3	-48.4	121.9	0	0	0	112.8	G477 G479 G486 S487 H490	G477-N482 PolarHBondContact O-OD1 2.95Å; G479-N482 PolarHBondContact N-OD1 3.48Å; G479-N482 PolarHBondContact O-N 3.33Å; N482-G486 PolarHBondContact O-N 2.88Å; N482-S487 WeakPolarHBondContact O-CA 3.36Å; N482-S487 WeakPolarHBondContact O-CB 3.33Å; N482-S487 PolarHBondContact O-N 2.93Å; N482-H490 HydrophobicContact CB-CB 3.81Å
483	L	96.2	Very high	93.4	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-74.8	-41.5	176.9	-59.3	178.5	0	0	0	111.4	C421 I426 C460 V464 V478 G480 E481 E485 G486 L494	C421-L483 PolarHBondContact SG-O 2.76Å; C421-L483 VanDerWaalsContact SG-O 3.37Å; I426-L483 HydrophobicContact CD1-CD1 3.93Å; C460-L483 HydrophobicContact CB-CB 4.19Å; V464-L483 HydrophobicContact CG2-CD1 3.4Å; V464-L483 VanDerWaalsContact CG2-CD1 3.4Å; V464-L483 HydrophobicContact CG2-CG 4.33Å; V478-L483 HydrophobicContact CG1-CD2 4.43Å; G480-L483 PolarHBondContact O-N 2.95Å; E481-L483 PolarHBondContact O-N 3.13Å; E481-L483 VanDerWaalsContact O-N 3.17Å; L483-E485 VanDerWaalsContact C-N 3.28Å; L483-E485 PolarHBondContact O-N 3.38Å; L483-G486 PolarHBondContact O-N 3.39Å; L483-G486 VanDerWaalsContact O-N 3.12Å; L483-L494 HydrophobicContact CD1-CD2 3.59Å; L483-L494 HydrophobicContact CD2-CD2 4.11Å
484	N	96.8	Very high	93.7	Very high	16 Å²	16	45.5 Å²	45.5	9%	0.086	27%	0.272	C	S	.	.	H	α-helix	trans	-66.9	-30.5	179.3	179	-126	0	0	0	112.4	C421 N453 K456 L457 C460 G480 E481 G486	C421-N484 WeakPolarHBondContact CB-O 3.38Å; C421-N484 WeakPolarHBondContact O-CA 3.48Å; C421-N484 PolarHBondContact O-ND2 3.48Å; N453-N484 PolarHBondContact ND2-OD1 2.9Å; N453-N484 VanDerWaalsContact ND2-OD1 3.12Å; N453-N484 PolarHBondContact OD1-ND2 2.68Å; N453-N484 PolarHBondContact OD1-OD1 2.97Å; N453-N484 VanDerWaalsContact OD1-OD1 3.1Å; K456-N484 VanDerWaalsContact CB-ND2 3.34Å; K456-N484 WeakPolarHBondContact CB-ND2 3.42Å; L457-N484 HydrophobicContact CD1-CB 4.06Å; C460-N484 HydrophobicContact CB-CB 4.41Å; G480-N484 WeakPolarHBondContact O-CB 3.45Å; G480-N484 PolarHBondContact O-N 3.39Å; E481-N484 PolarHBondContact O-N 3.49Å; N484-G486 VanDerWaalsContact C-N 3.3Å
485	E	94.8	Very high	94.1	Very high	130 Å²	130	41.8 Å²	41.8	61%	0.607	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-3.6	173.4	-67.4	175.3	158.2	0	0	113.8	E481 L483	E481-E485 HydrophobicContact CG-CG 4.41Å; E481-E485 WeakPolarHBondContact O-CB 3.46Å; E481-E485 WeakPolarHBondContact O-CG 3.44Å; E481-E485 PolarHBondContact O-N 3.02Å; L483-E485 VanDerWaalsContact C-N 3.28Å; L483-E485 PolarHBondContact O-N 3.38Å
486	G	92.6	Very high	94.3	Very high	13 Å²	13	42.7 Å²	42.7	13%	0.134	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	27.6	-179.9	0	0	0	0	0	114.2	Y417 C421 N482 L483 N484 R488	Y417-G486 VanDerWaalsContact O-CA 3.28Å; Y417-G486 WeakPolarHBondContact O-CA 3.22Å; C421-G486 VanDerWaalsContact SG-CA 3.56Å; N482-G486 PolarHBondContact O-N 2.88Å; L483-G486 PolarHBondContact O-N 3.39Å; L483-G486 VanDerWaalsContact O-N 3.12Å; N484-G486 VanDerWaalsContact C-N 3.3Å; G486-R488 PolarHBondContact O-N 3.25Å; G486-R488 VanDerWaalsContact O-N 3.12Å
487	S	94.9	Very high	94.6	Very high	34 Å²	34	37.3 Å²	37.3	24%	0.238	22%	0.215	C	C	.	.			trans	-62.2	117.2	-178.2	-174.2	0	0	0	0	112	N482 T489 H490 T491	N482-S487 WeakPolarHBondContact O-CA 3.36Å; N482-S487 WeakPolarHBondContact O-CB 3.33Å; N482-S487 PolarHBondContact O-N 2.93Å; S487-T489 PolarHBondContact O-N 3.31Å; S487-H490 PolarHBondContact O-N 3.22Å; S487-H490 PolarHBondContact OG-ND1 3.28Å; S487-T491 VanDerWaalsContact O-CB 3.28Å; S487-T491 WeakPolarHBondContact O-CB 3.48Å; S487-T491 PolarHBondContact O-N 2.95Å; S487-T491 PolarHBondContact O-OG1 3.47Å
488	R	93	Very high	94.8	Very high	87 Å²	87	34.6 Å²	34.6	33%	0.328	19%	0.187	S	C	.	.	H	α-helix	trans	-51.5	-57.4	-177.3	178.3	160	-164.2	-167.6	16.3	113.3	E391 E397 Y417 G486 H490 T491 L492	E391-R488 IonicContact OE2-CZ 2.83Å; E391-R488 IonicContact OE2-NH1 3.13Å; E391-R488 PolarHBondContact OE2-NH1 3.08Å; E397-R488 IonicContact OE1-CZ 2.72Å; E397-R488 IonicContact OE1-NE 3.95Å; E397-R488 PolarHBondContact OE1-NE 3.42Å; E397-R488 IonicContact OE1-NH2 3.18Å; E397-R488 PolarHBondContact OE1-NH2 3.36Å; E397-R488 IonicContact OE2-NH2 2.58Å; E397-R488 PolarHBondContact OE2-NH2 3.31Å; Y417-R488 HydrophobicContact CD1-CB 4.45Å; Y417-R488 VanDerWaalsContact CE1-CA 3.47Å; Y417-R488 HydrophobicContact CE1-CB 4.03Å; Y417-R488 HydrophobicContact CE1-CG 4.04Å; Y417-R488 HydrophobicContact CE2-CB 4.46Å; Y417-R488 HydrophobicContact CE2-CG 4.14Å; Y417-R488 WeakPolarHBondContact OH-CG 3.35Å; G486-R488 PolarHBondContact O-N 3.25Å; G486-R488 VanDerWaalsContact O-N 3.12Å; R488-H490 PolarHBondContact O-N 3.21Å; R488-T491 PolarHBondContact O-N 2.73Å; R488-L492 HydrophobicContact CG-CD1 3.99Å; R488-L492 WeakPolarHBondContact O-CB 3.35Å; R488-L492 VanDerWaalsContact O-CG 3.31Å; R488-L492 WeakPolarHBondContact O-CG 3.08Å; R488-L492 PolarHBondContact O-N 3Å
489	T	93.5	Very high	94.7	Very high	103 Å²	103	34.5 Å²	34.5	63%	0.632	19%	0.186	S	C	*	.	H	α-helix	trans	-59.9	-45.5	-176.8	-54.7	0	0	0	0	112.4	S487 A493	S487-T489 PolarHBondContact O-N 3.31Å; T489-A493 VanDerWaalsContact O-CB 3.27Å; T489-A493 WeakPolarHBondContact O-CB 3.33Å; T489-A493 PolarHBondContact O-N 3.44Å
490	H	95.7	Very high	94.2	Very high	47 Å²	47	34.7 Å²	34.7	22%	0.218	18%	0.18	C	C	.	.	H	α-helix	trans	-73.4	-38.7	-175.9	-59.8	97.9	0	0	0	111.8	V478 N482 S487 R488 A493 L494	V478-H490 HydrophobicContact CG1-CB 4.33Å; V478-H490 HydrophobicContact CG2-CB 4.34Å; N482-H490 HydrophobicContact CB-CB 3.81Å; S487-H490 PolarHBondContact O-N 3.22Å; S487-H490 PolarHBondContact OG-ND1 3.28Å; R488-H490 PolarHBondContact O-N 3.21Å; H490-A493 PolarHBondContact O-N 2.77Å; H490-L494 PolarHBondContact O-N 3.36Å; H490-L494 VanDerWaalsContact O-N 3.07Å
491	T	96.1	Very high	93.7	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-51.1	175.6	-57.7	0	0	0	0	110.5	L416 Y417 L420 S487 R488 A493 L494 V495	L416-T491 HydrophobicContact CD2-CG2 4.46Å; L416-T491 HydrophobicContact CG-CG2 4.18Å; Y417-T491 HydrophobicContact CD1-CG2 4.11Å; Y417-T491 HydrophobicContact CE1-CG2 4.17Å; L420-T491 HydrophobicContact CD1-CG2 3.68Å; S487-T491 VanDerWaalsContact O-CB 3.28Å; S487-T491 WeakPolarHBondContact O-CB 3.48Å; S487-T491 PolarHBondContact O-N 2.95Å; S487-T491 PolarHBondContact O-OG1 3.47Å; R488-T491 PolarHBondContact O-N 2.73Å; T491-A493 VanDerWaalsContact C-N 3.31Å; T491-A493 PolarHBondContact O-N 3.17Å; T491-L494 PolarHBondContact O-N 2.77Å; T491-V495 HydrophobicContact CG2-CG2 4.24Å; T491-V495 WeakPolarHBondContact O-CB 3.43Å; T491-V495 VanDerWaalsContact O-CG2 3.25Å; T491-V495 WeakPolarHBondContact O-CG2 3.41Å; T491-V495 PolarHBondContact O-N 2.96Å
492	L	94.7	Very high	93.2	Very high	21 Å²	21	34.6 Å²	34.6	11%	0.11	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-39.1	177.2	-70.2	176	0	0	0	112.4	E397 F400 L416 Y417 R488 W496	E397-L492 HydrophobicContact CG-CD2 3.97Å; F400-L492 HydrophobicContact CD2-CD2 3.63Å; F400-L492 HydrophobicContact CE2-CD2 3.7Å; L416-L492 HydrophobicContact CD2-CD2 3.6Å; Y417-L492 HydrophobicContact CE1-CG 4.28Å; Y417-L492 WeakPolarHBondContact OH-CD1 3.37Å; Y417-L492 WeakPolarHBondContact OH-CD2 3.28Å; Y417-L492 VanDerWaalsContact OH-CG 3.3Å; Y417-L492 WeakPolarHBondContact OH-CG 3.46Å; R488-L492 HydrophobicContact CG-CD1 3.99Å; R488-L492 WeakPolarHBondContact O-CB 3.35Å; R488-L492 VanDerWaalsContact O-CG 3.31Å; R488-L492 WeakPolarHBondContact O-CG 3.08Å; R488-L492 PolarHBondContact O-N 3Å; L492-W496 WeakPolarHBondContact O-CB 3.45Å; L492-W496 PolarHBondContact O-N 3.46Å
493	A	93.9	Very high	92.4	Very high	38 Å²	38	33.3 Å²	33.3	31%	0.314	17%	0.168	S	C	.	.	H	α-helix	trans	-61.5	-45.2	177.1	0	0	0	0	0	111.9	T489 H490 T491 Q497	T489-A493 VanDerWaalsContact O-CB 3.27Å; T489-A493 WeakPolarHBondContact O-CB 3.33Å; T489-A493 PolarHBondContact O-N 3.44Å; H490-A493 PolarHBondContact O-N 2.77Å; T491-A493 VanDerWaalsContact C-N 3.31Å; T491-A493 PolarHBondContact O-N 3.17Å; A493-Q497 WeakPolarHBondContact O-CG 3.39Å; A493-Q497 PolarHBondContact O-N 2.72Å
494	L	95.8	Very high	91.4	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-68.3	-47.6	178.4	177.4	59.2	0	0	0	112.2	I426 F473 L475 L483 H490 T491 W496 Q497 L498	I426-L494 HydrophobicContact CD1-CD2 4.03Å; I426-L494 HydrophobicContact CG2-CD2 3.84Å; F473-L494 HydrophobicContact CD2-CD1 4.23Å; L475-L494 HydrophobicContact CD1-CD1 3.76Å; L475-L494 HydrophobicContact CD2-CB 4.37Å; L475-L494 HydrophobicContact CD2-CD1 4.06Å; L483-L494 HydrophobicContact CD1-CD2 3.59Å; L483-L494 HydrophobicContact CD2-CD2 4.11Å; H490-L494 PolarHBondContact O-N 3.36Å; H490-L494 VanDerWaalsContact O-N 3.07Å; T491-L494 PolarHBondContact O-N 2.77Å; L494-W496 VanDerWaalsContact C-N 3.28Å; L494-W496 PolarHBondContact O-N 3.17Å; L494-Q497 PolarHBondContact O-N 3.46Å; L494-Q497 VanDerWaalsContact O-N 3.1Å; L494-L498 HydrophobicContact CD1-CD1 4.4Å; L494-L498 HydrophobicContact CD1-CG 4.47Å; L494-L498 HydrophobicContact CG-CD1 4.16Å; L494-L498 PolarHBondContact O-N 3.23Å
495	V	95.8	Very high	90.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-39.3	-179.4	175.6	0	0	0	0	110.9	F400 W403 M404 L420 T491 Q497 L498 M499	F400-V495 HydrophobicContact CB-CG1 3.7Å; F400-V495 HydrophobicContact CD1-CG1 4.14Å; F400-V495 HydrophobicContact CD2-CB 4.19Å; F400-V495 HydrophobicContact CD2-CG1 3.65Å; F400-V495 HydrophobicContact CE2-CG1 4.3Å; F400-V495 HydrophobicContact CG-CG1 3.56Å; W403-V495 HydrophobicContact CE3-CG1 4.39Å; W403-V495 HydrophobicContact CZ3-CG1 4.04Å; M404-V495 HydrophobicContact SD-CG1 4.22Å; M404-V495 HydrophobicContact SD-CG2 4.48Å; L420-V495 HydrophobicContact CD1-CG2 4.08Å; T491-V495 HydrophobicContact CG2-CG2 4.24Å; T491-V495 WeakPolarHBondContact O-CB 3.43Å; T491-V495 VanDerWaalsContact O-CG2 3.25Å; T491-V495 WeakPolarHBondContact O-CG2 3.41Å; T491-V495 PolarHBondContact O-N 2.96Å; V495-Q497 PolarHBondContact O-N 2.92Å; V495-L498 PolarHBondContact O-N 2.96Å; V495-M499 WeakPolarHBondContact O-CB 3.41Å; V495-M499 PolarHBondContact O-N 3.07Å
496	W	93.4	Very high	88.4	Confident	27 Å²	27	31.9 Å²	31.9	10%	0.102	17%	0.166	C	C	.	.	H	α-helix	trans	-58.8	-46.6	172.1	168	-114.2	0	0	0	112.6	F400 L492 L494 L498 M499 R500 K613 M616 T617	F400-W496 HydrophobicContact CE1-CE3 4.19Å; F400-W496 HydrophobicContact CE2-CB 4.44Å; F400-W496 HydrophobicContact CZ-CB 3.91Å; F400-W496 HydrophobicContact CZ-CE3 4.15Å; L492-W496 WeakPolarHBondContact O-CB 3.45Å; L492-W496 PolarHBondContact O-N 3.46Å; L494-W496 VanDerWaalsContact C-N 3.28Å; L494-W496 PolarHBondContact O-N 3.17Å; W496-L498 VanDerWaalsContact C-N 3.31Å; W496-L498 PolarHBondContact O-N 2.8Å; W496-M499 PolarHBondContact O-N 3.36Å; W496-R500 HydrophobicContact CH2-CB 4.49Å; W496-R500 HydrophobicContact CZ2-CB 4.26Å; W496-R500 HydrophobicContact CZ2-CG 4.4Å; W496-R500 VanDerWaalsContact O-CB 3.24Å; W496-R500 WeakPolarHBondContact O-CB 3.42Å; W496-R500 PolarHBondContact O-N 3Å; W496-K613 HydrophobicContact CD2-CB 4.49Å; W496-K613 HydrophobicContact CD2-CD 3.67Å; W496-K613 HydrophobicContact CD2-CG 4.11Å; W496-K613 HydrophobicContact CE3-CB 4.14Å; W496-K613 HydrophobicContact CE3-CD 3.87Å; W496-K613 HydrophobicContact CE3-CG 4.25Å; W496-K613 HydrophobicContact CG-CD 4.14Å; W496-K613 HydrophobicContact CH2-CB 3.43Å; W496-K613 VanDerWaalsContact CH2-CB 3.43Å; W496-K613 HydrophobicContact CH2-CD 4.33Å; W496-K613 HydrophobicContact CH2-CG 3.8Å; W496-K613 WeakPolarHBondContact CH2-O 3.46Å; W496-K613 HydrophobicContact CZ2-CB 3.82Å; W496-K613 HydrophobicContact CZ2-CD 4.15Å; W496-K613 HydrophobicContact CZ2-CG 3.62Å; W496-K613 HydrophobicContact CZ3-CB 3.61Å; W496-K613 HydrophobicContact CZ3-CD 4.2Å; W496-K613 HydrophobicContact CZ3-CG 4.11Å; W496-M616 HydrophobicContact CH2-CE 3.55Å; W496-M616 HydrophobicContact CZ2-CE 3.77Å; W496-T617 HydrophobicContact CH2-CG2 4.09Å; W496-T617 HydrophobicContact CZ3-CG2 4Å
497	Q	91.6	Very high	86.7	Confident	23 Å²	23	31.7 Å²	31.7	11%	0.107	16%	0.162	C	C	.	.	H	α-helix	trans	-63.6	-39.3	178.9	-66.7	-65.5	-6.3	0	0	111.7	F473 L475 A493 L494 V495 R500 R501	F473-Q497 HydrophobicContact CB-CB 4.2Å; F473-Q497 HydrophobicContact CB-CG 4.3Å; F473-Q497 HydrophobicContact CD1-CB 4.03Å; F473-Q497 HydrophobicContact CD2-CB 3.7Å; F473-Q497 HydrophobicContact CE1-CB 4.27Å; F473-Q497 HydrophobicContact CE2-CB 4.01Å; F473-Q497 HydrophobicContact CG-CB 3.74Å; F473-Q497 HydrophobicContact CG-CG 4.37Å; F473-Q497 HydrophobicContact CZ-CB 4.28Å; L475-Q497 HydrophobicContact CD2-CG 4.16Å; A493-Q497 WeakPolarHBondContact O-CG 3.39Å; A493-Q497 PolarHBondContact O-N 2.72Å; L494-Q497 PolarHBondContact O-N 3.46Å; L494-Q497 VanDerWaalsContact O-N 3.1Å; V495-Q497 PolarHBondContact O-N 2.92Å; Q497-R500 PolarHBondContact O-N 3.32Å; Q497-R501 WeakPolarHBondContact O-CB 3.48Å; Q497-R501 PolarHBondContact O-N 2.85Å
498	L	93.2	Very high	84.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-49.5	173.9	-70.6	164.5	0	0	0	111.5	W403 I426 L429 L430 V433 F473 L494 V495 W496 R500 R501 Y502	W403-L498 HydrophobicContact CH2-CB 3.79Å; W403-L498 HydrophobicContact CZ3-CB 4.36Å; I426-L498 HydrophobicContact CG2-CD1 4.22Å; L429-L498 HydrophobicContact CB-CD1 4.21Å; L429-L498 HydrophobicContact CD1-CD1 4.32Å; L430-L498 HydrophobicContact CD2-CD2 3.72Å; L430-L498 HydrophobicContact CG-CD2 4.06Å; V433-L498 HydrophobicContact CG2-CD2 3.95Å; F473-L498 HydrophobicContact CE2-CD2 3.67Å; F473-L498 HydrophobicContact CE2-CG 3.92Å; F473-L498 HydrophobicContact CZ-CD2 4.12Å; L494-L498 HydrophobicContact CD1-CD1 4.4Å; L494-L498 HydrophobicContact CD1-CG 4.47Å; L494-L498 HydrophobicContact CG-CD1 4.16Å; L494-L498 PolarHBondContact O-N 3.23Å; V495-L498 PolarHBondContact O-N 2.96Å; W496-L498 VanDerWaalsContact C-N 3.31Å; W496-L498 PolarHBondContact O-N 2.8Å; L498-R500 VanDerWaalsContact C-N 3.34Å; L498-R500 PolarHBondContact O-N 3.48Å; L498-R501 PolarHBondContact O-N 2.96Å; L498-Y502 WeakPolarHBondContact O-CB 3.21Å; L498-Y502 PolarHBondContact O-N 3.44Å
499	M	90.8	Very high	82.6	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-41.2	178.8	-172.2	-177.3	-177	0	0	111.9	T399 F400 W403 V495 W496 Y502 T503 Y601	T399-M499 HydrophobicContact CG2-CE 4.22Å; F400-M499 HydrophobicContact CD1-SD 3.65Å; F400-M499 HydrophobicContact CE1-SD 3.6Å; W403-M499 HydrophobicContact CB-CE 4.39Å; W403-M499 HydrophobicContact CD2-CB 4.01Å; W403-M499 HydrophobicContact CD2-CG 3.78Å; W403-M499 HydrophobicContact CD2-SD 4.35Å; W403-M499 HydrophobicContact CE3-CB 3.87Å; W403-M499 HydrophobicContact CE3-CG 4.09Å; W403-M499 HydrophobicContact CG-CE 4.28Å; W403-M499 HydrophobicContact CG-CG 4.15Å; W403-M499 HydrophobicContact CG-SD 4.36Å; W403-M499 HydrophobicContact CH2-CB 3.9Å; W403-M499 VanDerWaalsContact CZ2-CA 3.5Å; W403-M499 HydrophobicContact CZ2-CB 4.02Å; W403-M499 HydrophobicContact CZ2-CG 4.33Å; W403-M499 HydrophobicContact CZ3-CB 3.81Å; W403-M499 HydrophobicContact CZ3-CG 4.5Å; V495-M499 WeakPolarHBondContact O-CB 3.41Å; V495-M499 PolarHBondContact O-N 3.07Å; W496-M499 PolarHBondContact O-N 3.36Å; M499-Y502 WeakPolarHBondContact O-CB 3.47Å; M499-Y502 PolarHBondContact O-N 3.43Å; M499-T503 WeakPolarHBondContact O-CB 3.38Å; M499-T503 PolarHBondContact O-N 3.5Å; M499-T503 PolarHBondContact O-OG1 2.95Å; M499-Y601 HydrophobicContact CE-CD2 4.23Å; M499-Y601 HydrophobicContact CE-CG 4.27Å
500	R	86.6	Confident	80.3	Confident	28 Å²	28	33.5 Å²	33.5	11%	0.106	18%	0.176	C	C	.	.	H	α-helix	trans	-61.9	-49.7	176.5	-179.8	173.5	-175.3	-127.7	0.2	111.1	W496 Q497 L498 Y502 T503 V504 E514 D518 M616	W496-R500 HydrophobicContact CH2-CB 4.49Å; W496-R500 HydrophobicContact CZ2-CB 4.26Å; W496-R500 HydrophobicContact CZ2-CG 4.4Å; W496-R500 VanDerWaalsContact O-CB 3.24Å; W496-R500 WeakPolarHBondContact O-CB 3.42Å; W496-R500 PolarHBondContact O-N 3Å; Q497-R500 PolarHBondContact O-N 3.32Å; L498-R500 VanDerWaalsContact C-N 3.34Å; L498-R500 PolarHBondContact O-N 3.48Å; R500-Y502 PolarHBondContact O-N 3.11Å; R500-T503 PolarHBondContact O-N 3.23Å; R500-V504 WeakPolarHBondContact O-CG2 3.19Å; R500-V504 PolarHBondContact O-N 3.25Å; R500-E514 IonicContact NH1-OE2 2.67Å; R500-E514 PolarHBondContact NH1-OE2 3.19Å; R500-E514 PolarHBondContact NH2-O 3.29Å; R500-D518 IonicContact CZ-OD1 3.47Å; R500-D518 IonicContact NE-OD1 2.63Å; R500-D518 IonicContact NH2-OD1 2.78Å; R500-D518 PolarHBondContact NH2-OD1 3.25Å; R500-D518 IonicContact NH2-OD2 2.78Å; R500-D518 PolarHBondContact NH2-OD2 3.19Å; R500-M616 HydrophobicContact CG-CE 3.86Å
501	R	86.1	Confident	77.7	Confident	73 Å²	73	34.7 Å²	34.7	28%	0.275	20%	0.201	S	C	.	.	H	α-helix	trans	-60.4	-45.7	176.1	-173.2	-177.6	176.5	109.3	-4.8	110.9	V433 A471 F473 Q497 L498 T503 V504 M505	V433-R501 HydrophobicContact CB-CG 4.2Å; V433-R501 PolarHBondContact O-NE 3.48Å; A471-R501 PolarHBondContact O-NH1 2.94Å; F473-R501 HydrophobicContact CE1-CB 3.7Å; F473-R501 HydrophobicContact CE1-CG 4.1Å; F473-R501 HydrophobicContact CZ-CB 3.8Å; F473-R501 HydrophobicContact CZ-CG 4.29Å; Q497-R501 WeakPolarHBondContact O-CB 3.48Å; Q497-R501 PolarHBondContact O-N 2.85Å; L498-R501 PolarHBondContact O-N 2.96Å; R501-T503 VanDerWaalsContact C-N 3.28Å; R501-T503 PolarHBondContact O-N 3.46Å; R501-V504 PolarHBondContact O-N 2.94Å; R501-M505 HydrophobicContact CG-CG 4.01Å; R501-M505 HydrophobicContact CG-SD 3.77Å; R501-M505 WeakPolarHBondContact O-CB 3.45Å; R501-M505 WeakPolarHBondContact O-CG 3.43Å; R501-M505 PolarHBondContact O-N 3.29Å
502	Y	85.8	Confident	75.3	Confident	43 Å²	43	37.6 Å²	37.6	17%	0.169	22%	0.219	C	C	.	.	H	α-helix	trans	-54.2	-45.5	175.9	177.7	-97.8	0	0	0	112.2	W403 L407 V433 L498 M499 R500	W403-Y502 HydrophobicContact CZ2-CD1 4.38Å; W403-Y502 HydrophobicContact CZ2-CG 4.04Å; W403-Y502 AromaticContact NE1-CD1 3.37Å; W403-Y502 AromaticContact NE1-CE1 3.74Å; W403-Y502 AromaticContact NE1-CG 3.87Å; L407-Y502 HydrophobicContact CD1-CD2 4.42Å; L407-Y502 HydrophobicContact CD1-CE2 4.33Å; L407-Y502 HydrophobicContact CD2-CE1 4.35Å; L407-Y502 HydrophobicContact CD2-CE2 3.65Å; L407-Y502 WeakPolarHBondContact CD2-OH 3.5Å; V433-Y502 HydrophobicContact CG1-CD2 4.33Å; L498-Y502 WeakPolarHBondContact O-CB 3.21Å; L498-Y502 PolarHBondContact O-N 3.44Å; M499-Y502 WeakPolarHBondContact O-CB 3.47Å; M499-Y502 PolarHBondContact O-N 3.43Å; R500-Y502 PolarHBondContact O-N 3.11Å
503	T	80.1	Confident	73.3	Confident	9 Å²	9	38.8 Å²	38.8	6%	0.055	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-46.4	-179	-54.4	0	0	0	0	111.5	M499 R500 R501 M505 V506 T617 A620	M499-T503 WeakPolarHBondContact O-CB 3.38Å; M499-T503 PolarHBondContact O-N 3.5Å; M499-T503 PolarHBondContact O-OG1 2.95Å; R500-T503 PolarHBondContact O-N 3.23Å; R501-T503 VanDerWaalsContact C-N 3.28Å; R501-T503 PolarHBondContact O-N 3.46Å; T503-M505 VanDerWaalsContact C-N 3.33Å; T503-V506 WeakPolarHBondContact O-CB 3.4Å; T503-V506 PolarHBondContact O-N 3.18Å; T503-T617 HydrophobicContact CG2-CG2 4.48Å; T503-A620 HydrophobicContact CG2-CB 3.61Å
504	V	75.3	Confident	71.3	Confident	22 Å²	22	40.1 Å²	40.1	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-76.6	-20.7	-179.3	178	0	0	0	0	112	R500 R501 V506 L507 S508 A517	R500-V504 WeakPolarHBondContact O-CG2 3.19Å; R500-V504 PolarHBondContact O-N 3.25Å; R501-V504 PolarHBondContact O-N 2.94Å; V504-V506 PolarHBondContact O-N 3.38Å; V504-L507 HydrophobicContact CG1-CB 4.5Å; V504-L507 HydrophobicContact CG1-CD1 4.42Å; V504-L507 CarbonylContact O-C 3.31Å; V504-L507 WeakPolarHBondContact O-CA 3.26Å; V504-L507 WeakPolarHBondContact O-CB 3.5Å; V504-L507 PolarHBondContact O-N 3.01Å; V504-S508 PolarHBondContact O-N 3.31Å; V504-A517 HydrophobicContact CG1-CB 3.84Å; V504-A517 HydrophobicContact CG2-CB 4.4Å
505	M	70.3	Confident	69.4	Low	43 Å²	43	49.1 Å²	49.1	21%	0.212	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-24.8	173.4	-87.8	177.1	69.8	0	0	113.5	V433 K434 R501 T503 L507 S508	V433-M505 VanDerWaalsContact C-CE 3.45Å; V433-M505 WeakPolarHBondContact CA-SD 2.93Å; V433-M505 HydrophobicContact CB-SD 3.63Å; V433-M505 HydrophobicContact CG1-SD 4.31Å; V433-M505 WeakPolarHBondContact O-CE 3.04Å; K434-M505 HydrophobicContact CB-CE 3.58Å; K434-M505 HydrophobicContact CG-CE 3.15Å; R501-M505 HydrophobicContact CG-CG 4.01Å; R501-M505 HydrophobicContact CG-SD 3.77Å; R501-M505 WeakPolarHBondContact O-CB 3.45Å; R501-M505 WeakPolarHBondContact O-CG 3.43Å; R501-M505 PolarHBondContact O-N 3.29Å; T503-M505 VanDerWaalsContact C-N 3.33Å; M505-L507 PolarHBondContact O-N 3.38Å; M505-S508 VanDerWaalsContact CA-OG 3.3Å; M505-S508 WeakPolarHBondContact CA-OG 3.42Å; M505-S508 PolarHBondContact O-N 3.33Å; M505-S508 VanDerWaalsContact O-N 3.15Å; M505-S508 PolarHBondContact O-OG 2.75Å
506	V	57.4	Low	67.6	Low	53 Å²	53	52.9 Å²	52.9	32%	0.321	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.7	166	-178.8	0	0	0	0	111	T503 V504 K628	T503-V506 WeakPolarHBondContact O-CB 3.4Å; T503-V506 PolarHBondContact O-N 3.18Å; V504-V506 PolarHBondContact O-N 3.38Å; V506-K628 HydrophobicContact CG1-CD 4.33Å
507	L	56.8	Low	66.5	Low	8 Å²	8	51.7 Å²	51.7	4%	0.042	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-12.8	177.1	-44.5	173.3	0	0	0	113.1	V504 M505 D509 L510 I521 A620 M623 M627	V504-L507 HydrophobicContact CG1-CB 4.5Å; V504-L507 HydrophobicContact CG1-CD1 4.42Å; V504-L507 CarbonylContact O-C 3.31Å; V504-L507 WeakPolarHBondContact O-CA 3.26Å; V504-L507 WeakPolarHBondContact O-CB 3.5Å; V504-L507 PolarHBondContact O-N 3.01Å; M505-L507 PolarHBondContact O-N 3.38Å; L507-D509 VanDerWaalsContact C-N 3.25Å; L507-D509 PolarHBondContact O-N 3.24Å; L507-D509 VanDerWaalsContact O-N 3.12Å; L507-L510 VanDerWaalsContact O-CB 3.27Å; L507-L510 WeakPolarHBondContact O-CB 3.39Å; L507-L510 WeakPolarHBondContact O-CD1 3.49Å; L507-L510 VanDerWaalsContact O-CG 3.31Å; L507-L510 WeakPolarHBondContact O-CG 3.35Å; L507-L510 PolarHBondContact O-N 3.05Å; L507-I521 HydrophobicContact CD1-CD1 4.22Å; L507-I521 HydrophobicContact CD1-CG1 4.1Å; L507-A620 HydrophobicContact CD1-CB 4.44Å; L507-M623 HydrophobicContact CD1-SD 4.14Å; L507-M623 HydrophobicContact CD2-CB 4.23Å; L507-M623 HydrophobicContact CD2-CG 3.9Å; L507-M623 HydrophobicContact CD2-SD 4.26Å; L507-M627 HydrophobicContact CD2-SD 4.01Å
508	S	52.2	Low	66.1	Low	58 Å²	58	53.1 Å²	53.1	41%	0.406	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-73.7	-3.8	-165.5	63.9	0	0	0	0	116.1	V504 M505 L510 G511	V504-S508 PolarHBondContact O-N 3.31Å; M505-S508 VanDerWaalsContact CA-OG 3.3Å; M505-S508 WeakPolarHBondContact CA-OG 3.42Å; M505-S508 PolarHBondContact O-N 3.33Å; M505-S508 VanDerWaalsContact O-N 3.15Å; M505-S508 PolarHBondContact O-OG 2.75Å; S508-L510 PolarHBondContact O-N 3.11Å; S508-G511 PolarHBondContact O-N 3.39Å
509	D	50	Low	65.7	Low	130 Å²	130	58.1 Å²	58.1	70%	0.695	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-59.3	-9.1	161.8	-74.4	-8.6	0	0	0	112.3	L507 K631	L507-D509 VanDerWaalsContact C-N 3.25Å; L507-D509 PolarHBondContact O-N 3.24Å; L507-D509 VanDerWaalsContact O-N 3.12Å; D509-K631 IonicContact OD2-NZ 3.06Å; D509-K631 PolarHBondContact OD2-NZ 3.26Å
510	L	44.7	Very low	65.4	Low	74 Å²	74	61.2 Å²	61.2	39%	0.387	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-98.4	1.6	-178.9	-59.9	168.3	0	0	0	114.3	L507 S508 T512 F520 M627	L507-L510 VanDerWaalsContact O-CB 3.27Å; L507-L510 WeakPolarHBondContact O-CB 3.39Å; L507-L510 WeakPolarHBondContact O-CD1 3.49Å; L507-L510 VanDerWaalsContact O-CG 3.31Å; L507-L510 WeakPolarHBondContact O-CG 3.35Å; L507-L510 PolarHBondContact O-N 3.05Å; S508-L510 PolarHBondContact O-N 3.11Å; L510-T512 PolarHBondContact O-N 3.41Å; L510-F520 HydrophobicContact CD1-CE1 3.81Å; L510-F520 HydrophobicContact CD1-CZ 3.97Å; L510-M627 HydrophobicContact CD1-CE 3.67Å; L510-M627 HydrophobicContact CD1-SD 3.55Å; L510-M627 VanDerWaalsContact CD1-SD 3.55Å
511	G	42.3	Very low	65.6	Low	73 Å²	73	59.9 Å²	59.9	75%	0.753	33%	0.334	S	S	*	.			trans	68.3	22.5	165.6	0	0	0	0	0	117.8	S508	S508-G511 PolarHBondContact O-N 3.39Å
512	T	44.4	Very low	65.8	Low	62 Å²	62	57.1 Å²	57.1	38%	0.38	33%	0.325	S	S	.	.			trans	-109.5	140.1	-175.6	48.6	0	0	0	0	113.9	L510 V516	L510-T512 PolarHBondContact O-N 3.41Å; T512-V516 HydrophobicContact CG2-CG1 3.94Å
513	G	52	Low	66.2	Low	47 Å²	47	59 Å²	59	49%	0.485	34%	0.338	S	S	.	.			trans	-75.6	172.9	-179.6	0	0	0	0	0	115.1	K515 V516 A517	G513-K515 PolarHBondContact O-N 3.36Å; G513-V516 WeakPolarHBondContact O-CB 3.43Å; G513-V516 PolarHBondContact O-N 2.98Å; G513-V516 VanDerWaalsContact O-N 3.09Å; G513-A517 PolarHBondContact O-N 3.02Å
514	E	54	Low	66.7	Low	66 Å²	66	60.1 Å²	60.1	31%	0.308	34%	0.341	S	S	.	.	H	α-helix	trans	-59	-43.9	-165.4	-70.4	-171.2	170.5	0	0	116.9	R500 V516	R500-E514 IonicContact NH1-OE2 2.67Å; R500-E514 PolarHBondContact NH1-OE2 3.19Å; R500-E514 PolarHBondContact NH2-O 3.29Å; E514-V516 VanDerWaalsContact C-N 3.31Å
515	K	54	Low	67.7	Low	189 Å²	189	59 Å²	59	82%	0.822	34%	0.335	S	S	*	.	H	α-helix	trans	-76.9	-23.7	178.2	-75.4	-173.3	178.1	-180	0	112.4	G513 A517	G513-K515 PolarHBondContact O-N 3.36Å; K515-A517 VanDerWaalsContact C-N 3.33Å
516	V	59.3	Low	68.9	Low	81 Å²	81	58.8 Å²	58.8	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-73.2	-33.3	175.6	-176.3	0	0	0	0	109.5	T512 G513 E514 F520	T512-V516 HydrophobicContact CG2-CG1 3.94Å; G513-V516 WeakPolarHBondContact O-CB 3.43Å; G513-V516 PolarHBondContact O-N 2.98Å; G513-V516 VanDerWaalsContact O-N 3.09Å; E514-V516 VanDerWaalsContact C-N 3.31Å; V516-F520 WeakPolarHBondContact O-CB 3.49Å; V516-F520 PolarHBondContact O-N 3.2Å
517	A	70.6	Confident	70.7	Confident	2 Å²	2	59.2 Å²	59.2	2%	0.017	34%	0.339	C	S	.	.	H	α-helix	trans	-59.8	-47.4	179.1	0	0	0	0	0	113.5	V504 G513 K515 Q519 F520 I521	V504-A517 HydrophobicContact CG1-CB 3.84Å; V504-A517 HydrophobicContact CG2-CB 4.4Å; G513-A517 PolarHBondContact O-N 3.02Å; K515-A517 VanDerWaalsContact C-N 3.33Å; A517-Q519 PolarHBondContact O-N 3.02Å; A517-F520 WeakPolarHBondContact O-CB 3.41Å; A517-F520 PolarHBondContact O-N 3.08Å; A517-I521 WeakPolarHBondContact O-CD1 3.26Å; A517-I521 VanDerWaalsContact O-CG1 3.22Å; A517-I521 WeakPolarHBondContact O-CG1 3.19Å; A517-I521 PolarHBondContact O-N 3.11Å
518	D	81.6	Confident	72.5	Confident	52 Å²	52	59.4 Å²	59.4	28%	0.278	34%	0.341	S	S	.	.	H	α-helix	trans	-62.6	-46.6	-178.1	-71.2	16.3	0	0	0	111.8	R500 F520 I521 L522 F541	R500-D518 IonicContact CZ-OD1 3.47Å; R500-D518 IonicContact NE-OD1 2.63Å; R500-D518 IonicContact NH2-OD1 2.78Å; R500-D518 PolarHBondContact NH2-OD1 3.25Å; R500-D518 IonicContact NH2-OD2 2.78Å; R500-D518 PolarHBondContact NH2-OD2 3.19Å; D518-F520 VanDerWaalsContact C-N 3.33Å; D518-I521 PolarHBondContact O-N 3.49Å; D518-L522 WeakPolarHBondContact O-CG 3.4Å; D518-L522 PolarHBondContact O-N 3.45Å; D518-F541 HydrophobicContact CB-CE2 4.07Å
519	Q	85.1	Confident	74.5	Confident	105 Å²	105	56.7 Å²	56.7	49%	0.491	32%	0.322	S	S	.	.	H	α-helix	trans	-67.3	-36.8	177.5	-170.5	62.5	47.2	0	0	111.5	A517 L522 N523	A517-Q519 PolarHBondContact O-N 3.02Å; Q519-L522 PolarHBondContact O-N 3.2Å; Q519-N523 PolarHBondContact NE2-OD1 3.37Å; Q519-N523 WeakPolarHBondContact O-CB 3.15Å; Q519-N523 PolarHBondContact O-N 3.44Å; Q519-N523 PolarHBondContact O-ND2 3.08Å; Q519-N523 PolarHBondContact O-OD1 2.89Å
520	F	85.5	Confident	76.7	Confident	67 Å²	67	57.7 Å²	57.7	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-63.1	-44.5	176.3	179.6	-110.1	0	0	0	111.6	L510 V516 A517 D518 N523 W524 M623 M627	L510-F520 HydrophobicContact CD1-CE1 3.81Å; L510-F520 HydrophobicContact CD1-CZ 3.97Å; V516-F520 WeakPolarHBondContact O-CB 3.49Å; V516-F520 PolarHBondContact O-N 3.2Å; A517-F520 WeakPolarHBondContact O-CB 3.41Å; A517-F520 PolarHBondContact O-N 3.08Å; D518-F520 VanDerWaalsContact C-N 3.33Å; F520-N523 PolarHBondContact O-N 3.19Å; F520-W524 WeakPolarHBondContact O-CB 3.44Å; F520-W524 PolarHBondContact O-N 2.9Å; F520-M623 HydrophobicContact CD1-CE 3.51Å; F520-M623 HydrophobicContact CD1-SD 4.44Å; F520-M623 HydrophobicContact CE1-CE 3.08Å; F520-M623 HydrophobicContact CE1-SD 4.4Å; F520-M623 HydrophobicContact CG-CE 4.47Å; F520-M623 HydrophobicContact CZ-CE 3.72Å; F520-M627 HydrophobicContact CE1-CE 4.17Å; F520-M627 HydrophobicContact CZ-CE 4.11Å
521	I	89.1	Confident	79	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-48	174.5	-65.2	157.1	0	0	0	110.1	L507 A517 D518 N523 W524 V525 F541 M616 F619 A620 M623	L507-I521 HydrophobicContact CD1-CD1 4.22Å; L507-I521 HydrophobicContact CD1-CG1 4.1Å; A517-I521 WeakPolarHBondContact O-CD1 3.26Å; A517-I521 VanDerWaalsContact O-CG1 3.22Å; A517-I521 WeakPolarHBondContact O-CG1 3.19Å; A517-I521 PolarHBondContact O-N 3.11Å; D518-I521 PolarHBondContact O-N 3.49Å; I521-N523 PolarHBondContact O-N 3.47Å; I521-W524 PolarHBondContact O-N 2.74Å; I521-V525 HydrophobicContact CG2-CG2 4.38Å; I521-V525 WeakPolarHBondContact O-CG2 3.13Å; I521-V525 PolarHBondContact O-N 3.21Å; I521-F541 HydrophobicContact CB-CZ 4.03Å; I521-F541 HydrophobicContact CG2-CE1 4.05Å; I521-F541 HydrophobicContact CG2-CZ 3.75Å; I521-M616 HydrophobicContact CD1-CG 4.46Å; I521-M616 HydrophobicContact CD1-SD 4.21Å; I521-F619 HydrophobicContact CG2-CB 3.81Å; I521-A620 HydrophobicContact CD1-CB 3.82Å; I521-M623 HydrophobicContact CB-SD 4.27Å; I521-M623 HydrophobicContact CG1-SD 3.8Å; I521-M623 HydrophobicContact CG2-SD 4.47Å
522	L	92.2	Very high	81.4	Confident	15 Å²	15	63.2 Å²	63.2	8%	0.079	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-42.7	178.5	-75.5	173.1	0	0	0	112.8	D518 Q519 V525 N526 I538 F541	D518-L522 WeakPolarHBondContact O-CG 3.4Å; D518-L522 PolarHBondContact O-N 3.45Å; Q519-L522 PolarHBondContact O-N 3.2Å; L522-V525 PolarHBondContact O-N 3.42Å; L522-N526 PolarHBondContact O-N 2.99Å; L522-N526 VanDerWaalsContact O-N 3.14Å; L522-N526 PolarHBondContact O-ND2 2.9Å; L522-N526 VanDerWaalsContact O-ND2 3.08Å; L522-I538 HydrophobicContact CD2-CD1 3.78Å; L522-I538 HydrophobicContact CD2-CG1 4.14Å; L522-F541 HydrophobicContact CD1-CD2 4.48Å; L522-F541 HydrophobicContact CD1-CE2 4.2Å; L522-F541 HydrophobicContact CD1-CZ 4.43Å; L522-F541 HydrophobicContact CD2-CD1 3.79Å; L522-F541 HydrophobicContact CD2-CD2 4.44Å; L522-F541 HydrophobicContact CD2-CE1 3.52Å; L522-F541 HydrophobicContact CD2-CE2 4.21Å; L522-F541 HydrophobicContact CD2-CG 4.24Å; L522-F541 HydrophobicContact CD2-CZ 3.76Å; L522-F541 HydrophobicContact CG-CD1 4.48Å; L522-F541 HydrophobicContact CG-CD2 4.43Å; L522-F541 HydrophobicContact CG-CE1 3.94Å; L522-F541 HydrophobicContact CG-CE2 3.88Å; L522-F541 HydrophobicContact CG-CZ 3.61Å
523	N	92.4	Very high	83.6	Confident	84 Å²	84	71 Å²	71	45%	0.449	35%	0.345	S	S	.	.	H	α-helix	trans	-64.5	-44.3	177.4	-70.8	-7.6	0	0	0	110.7	Q519 F520 I521 N526 S527	Q519-N523 PolarHBondContact NE2-OD1 3.37Å; Q519-N523 WeakPolarHBondContact O-CB 3.15Å; Q519-N523 PolarHBondContact O-N 3.44Å; Q519-N523 PolarHBondContact O-ND2 3.08Å; Q519-N523 PolarHBondContact O-OD1 2.89Å; F520-N523 PolarHBondContact O-N 3.19Å; I521-N523 PolarHBondContact O-N 3.47Å; N523-N526 PolarHBondContact O-N 3.03Å; N523-S527 VanDerWaalsContact O-CB 3.32Å; N523-S527 WeakPolarHBondContact O-CB 3.42Å; N523-S527 PolarHBondContact O-N 3.06Å; N523-S527 PolarHBondContact O-OG 3.31Å
524	W	92.3	Very high	85.5	Confident	31 Å²	31	70.9 Å²	70.9	12%	0.117	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-49.6	176.4	173.4	82.3	0	0	0	111.4	F520 I521 N526 S527 T528 L555 I559 M623 D626	F520-W524 WeakPolarHBondContact O-CB 3.44Å; F520-W524 PolarHBondContact O-N 2.9Å; I521-W524 PolarHBondContact O-N 2.74Å; W524-N526 VanDerWaalsContact C-N 3.34Å; W524-N526 PolarHBondContact O-N 3.39Å; W524-S527 PolarHBondContact O-N 3.21Å; W524-T528 PolarHBondContact NE1-OG1 2.9Å; W524-T528 WeakPolarHBondContact O-CB 3.36Å; W524-T528 PolarHBondContact O-N 2.98Å; W524-T528 PolarHBondContact O-OG1 3.21Å; W524-L555 HydrophobicContact CH2-CD1 3.95Å; W524-L555 HydrophobicContact CH2-CD2 4.18Å; W524-L555 HydrophobicContact CH2-CG 4.35Å; W524-L555 HydrophobicContact CZ3-CD1 4.11Å; W524-L555 HydrophobicContact CZ3-CD2 3.85Å; W524-L555 HydrophobicContact CZ3-CG 4.45Å; W524-I559 HydrophobicContact CH2-CG2 4.24Å; W524-I559 HydrophobicContact CZ2-CG2 4.2Å; W524-M623 HydrophobicContact CB-CE 3.54Å; W524-M623 HydrophobicContact CB-SD 4.04Å; W524-M623 HydrophobicContact CD2-CB 4Å; W524-M623 HydrophobicContact CD2-CE 4.03Å; W524-M623 HydrophobicContact CD2-CG 3.55Å; W524-M623 HydrophobicContact CD2-SD 3.88Å; W524-M623 HydrophobicContact CE3-CB 3.57Å; W524-M623 HydrophobicContact CE3-CG 3.62Å; W524-M623 HydrophobicContact CE3-SD 3.86Å; W524-M623 HydrophobicContact CG-CE 3.51Å; W524-M623 HydrophobicContact CG-CG 4.05Å; W524-M623 HydrophobicContact CG-SD 3.94Å; W524-M623 HydrophobicContact CH2-CB 3.8Å; W524-M623 HydrophobicContact CH2-CG 4.28Å; W524-M623 HydrophobicContact CZ2-CB 4.18Å; W524-M623 HydrophobicContact CZ2-CG 4.2Å; W524-M623 HydrophobicContact CZ3-CB 3.45Å; W524-M623 VanDerWaalsContact CZ3-CB 3.45Å; W524-M623 HydrophobicContact CZ3-CG 3.99Å; W524-D626 HydrophobicContact CZ2-CB 3.96Å
525	V	95.3	Very high	87.1	Confident	0 Å²	0	75 Å²	75	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-53.5	-51.7	178.3	170.6	0	0	0	0	111	I521 L522 T528 L529 I538 L555 F619	I521-V525 HydrophobicContact CG2-CG2 4.38Å; I521-V525 WeakPolarHBondContact O-CG2 3.13Å; I521-V525 PolarHBondContact O-N 3.21Å; L522-V525 PolarHBondContact O-N 3.42Å; V525-T528 PolarHBondContact O-N 3.17Å; V525-L529 HydrophobicContact CG1-CD1 3.75Å; V525-L529 HydrophobicContact CG1-CG 4.49Å; V525-L529 WeakPolarHBondContact O-CB 3.39Å; V525-L529 VanDerWaalsContact O-CG 3.24Å; V525-L529 WeakPolarHBondContact O-CG 3.31Å; V525-L529 PolarHBondContact O-N 3.4Å; V525-I538 HydrophobicContact CB-CD1 4.48Å; V525-I538 HydrophobicContact CG1-CD1 3.88Å; V525-I538 HydrophobicContact CG1-CG1 4.03Å; V525-L555 HydrophobicContact CG1-CD2 4.34Å; V525-L555 HydrophobicContact CG2-CD2 4.07Å; V525-F619 HydrophobicContact CG1-CD1 4.19Å; V525-F619 HydrophobicContact CG1-CE1 4.02Å; V525-F619 HydrophobicContact CG2-CB 4.05Å; V525-F619 HydrophobicContact CG2-CD1 3.51Å; V525-F619 HydrophobicContact CG2-CE1 4.2Å; V525-F619 HydrophobicContact CG2-CG 3.96Å
526	N	96.3	Very high	88.9	Confident	37 Å²	37	66.4 Å²	66.4	20%	0.198	32%	0.319	C	S	.	.	H	α-helix	trans	-70.4	-35.4	-177	-71.6	-49.3	0	0	0	112.9	L522 N523 W524 K530 Q537 I538	L522-N526 PolarHBondContact O-N 2.99Å; L522-N526 VanDerWaalsContact O-N 3.14Å; L522-N526 PolarHBondContact O-ND2 2.9Å; L522-N526 VanDerWaalsContact O-ND2 3.08Å; N523-N526 PolarHBondContact O-N 3.03Å; W524-N526 VanDerWaalsContact C-N 3.34Å; W524-N526 PolarHBondContact O-N 3.39Å; N526-K530 WeakPolarHBondContact O-CB 3.3Å; N526-K530 PolarHBondContact O-N 3.24Å; N526-Q537 WeakPolarHBondContact OD1-CA 3.37Å; N526-I538 PolarHBondContact ND2-O 2.86Å; N526-I538 PolarHBondContact OD1-N 3.19Å; N526-I538 PolarHBondContact OD1-O 3.22Å
527	S	94.9	Very high	90.5	Very high	62 Å²	62	67.6 Å²	67.6	43%	0.434	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-48.8	173.3	-74.7	0	0	0	0	111.3	N523 W524 L529 K530 E531	N523-S527 VanDerWaalsContact O-CB 3.32Å; N523-S527 WeakPolarHBondContact O-CB 3.42Å; N523-S527 PolarHBondContact O-N 3.06Å; N523-S527 PolarHBondContact O-OG 3.31Å; W524-S527 PolarHBondContact O-N 3.21Å; S527-L529 PolarHBondContact O-N 3.39Å; S527-K530 PolarHBondContact O-N 3.25Å; S527-E531 WeakPolarHBondContact O-CB 3.41Å; S527-E531 VanDerWaalsContact O-CG 3.3Å; S527-E531 WeakPolarHBondContact O-CG 3.39Å; S527-E531 PolarHBondContact O-N 2.78Å
528	T	94.2	Very high	91.7	Very high	13 Å²	13	67.8 Å²	67.8	8%	0.08	32%	0.319	C	S	.	.	H	α-helix	trans	-60.8	-45.9	179.3	-59.7	0	0	0	0	111.7	W524 V525 K530 E531 K532 L555 I559	W524-T528 PolarHBondContact NE1-OG1 2.9Å; W524-T528 WeakPolarHBondContact O-CB 3.36Å; W524-T528 PolarHBondContact O-N 2.98Å; W524-T528 PolarHBondContact O-OG1 3.21Å; V525-T528 PolarHBondContact O-N 3.17Å; T528-K530 VanDerWaalsContact C-N 3.35Å; T528-K530 PolarHBondContact O-N 3.27Å; T528-E531 PolarHBondContact O-N 3.29Å; T528-K532 PolarHBondContact O-N 3.18Å; T528-K532 VanDerWaalsContact O-N 3.11Å; T528-L555 HydrophobicContact CG2-CD1 3.81Å; T528-I559 HydrophobicContact CG2-CG2 4.35Å
529	L	95.1	Very high	92.3	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.1	-42.3	177	-70.5	171.5	0	0	0	111.6	V525 S527 K532 R533 K534 T536 D554 L555	V525-L529 HydrophobicContact CG1-CD1 3.75Å; V525-L529 HydrophobicContact CG1-CG 4.49Å; V525-L529 WeakPolarHBondContact O-CB 3.39Å; V525-L529 VanDerWaalsContact O-CG 3.24Å; V525-L529 WeakPolarHBondContact O-CG 3.31Å; V525-L529 PolarHBondContact O-N 3.4Å; S527-L529 PolarHBondContact O-N 3.39Å; L529-K532 CarbonylContact O-C 3.33Å; L529-K532 PolarHBondContact O-N 3.34Å; L529-R533 PolarHBondContact O-N 3.38Å; L529-R533 VanDerWaalsContact O-N 3.15Å; L529-K534 HydrophobicContact CB-CB 4.19Å; L529-K534 HydrophobicContact CD2-CB 3.86Å; L529-K534 HydrophobicContact CD2-CG 3.9Å; L529-K534 PolarHBondContact O-N 3.07Å; L529-T536 WeakPolarHBondContact CD1-O 3.28Å; L529-D554 HydrophobicContact CD2-CB 3.76Å; L529-L555 HydrophobicContact CD2-CB 4.11Å; L529-L555 HydrophobicContact CD2-CD1 4.45Å; L529-L555 HydrophobicContact CG-CD1 4.42Å
530	K	95	Very high	92.8	Very high	151 Å²	151	66.8 Å²	66.8	66%	0.657	33%	0.328	S	S	*	.	H	α-helix	trans	-67.1	-44.1	178.8	-174.2	178.8	179.3	-178.3	0	112.5	N526 S527 T528 K532 R533	N526-K530 WeakPolarHBondContact O-CB 3.3Å; N526-K530 PolarHBondContact O-N 3.24Å; S527-K530 PolarHBondContact O-N 3.25Å; T528-K530 VanDerWaalsContact C-N 3.35Å; T528-K530 PolarHBondContact O-N 3.27Å; K530-K532 VanDerWaalsContact C-N 3.28Å; K530-K532 PolarHBondContact O-N 3Å; K530-R533 PolarHBondContact O-N 2.94Å
531	E	93.4	Very high	93.2	Very high	143 Å²	143	64.4 Å²	64.4	67%	0.668	32%	0.318	S	S	*	.	H	α-helix	trans	-60.2	-39.2	177.6	-76.7	171.1	-168	0	0	111.8	S527 T528 R533	S527-E531 WeakPolarHBondContact O-CB 3.41Å; S527-E531 VanDerWaalsContact O-CG 3.3Å; S527-E531 WeakPolarHBondContact O-CG 3.39Å; S527-E531 PolarHBondContact O-N 2.78Å; T528-E531 PolarHBondContact O-N 3.29Å; E531-R533 VanDerWaalsContact C-N 3.26Å; E531-R533 PolarHBondContact O-N 2.96Å
532	K	91.9	Very high	93.5	Very high	121 Å²	121	71.7 Å²	71.7	53%	0.526	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	11.1	176.4	-60.8	-61.5	-172.9	177.2	0	114	T528 L529 K530 K534	T528-K532 PolarHBondContact O-N 3.18Å; T528-K532 VanDerWaalsContact O-N 3.11Å; L529-K532 CarbonylContact O-C 3.33Å; L529-K532 PolarHBondContact O-N 3.34Å; K530-K532 VanDerWaalsContact C-N 3.28Å; K530-K532 PolarHBondContact O-N 3Å; K532-K534 VanDerWaalsContact C-N 3.29Å; K532-K534 HydrophobicContact CB-CG 4.4Å; K532-K534 PolarHBondContact O-N 3.4Å
533	R	92.3	Very high	93.7	Very high	224 Å²	224	72.7 Å²	72.7	85%	0.845	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	41.6	175.9	-55	-179.6	-178.2	179.1	0.5	113.2	L529 K530 E531	L529-R533 PolarHBondContact O-N 3.38Å; L529-R533 VanDerWaalsContact O-N 3.15Å; K530-R533 PolarHBondContact O-N 2.94Å; E531-R533 VanDerWaalsContact C-N 3.26Å; E531-R533 PolarHBondContact O-N 2.96Å
534	K	92.1	Very high	93.8	Very high	45 Å²	45	77 Å²	77	20%	0.196	37%	0.37	C	S	.	.			trans	-83	147.9	172.2	-59.8	-59.5	-173.8	-177.9	0	110.7	L529 K532 D554 D557 S558	L529-K534 HydrophobicContact CB-CB 4.19Å; L529-K534 HydrophobicContact CD2-CB 3.86Å; L529-K534 HydrophobicContact CD2-CG 3.9Å; L529-K534 PolarHBondContact O-N 3.07Å; K532-K534 VanDerWaalsContact C-N 3.29Å; K532-K534 HydrophobicContact CB-CG 4.4Å; K532-K534 PolarHBondContact O-N 3.4Å; K534-D554 HydrophobicContact CB-CB 4.23Å; K534-D554 HydrophobicContact CD-CB 4.2Å; K534-D554 HydrophobicContact CG-CB 4.1Å; K534-D557 WeakPolarHBondContact CE-OD2 3.39Å; K534-D557 IonicContact NZ-OD2 2.75Å; K534-D557 PolarHBondContact NZ-OD2 3.17Å; K534-S558 WeakPolarHBondContact CG-OG 3.25Å
535	D	86.4	Confident	93.9	Very high	152 Å²	152	78.4 Å²	78.4	81%	0.813	38%	0.379	S	S	*	.	S	Bend	trans	-79.9	-21.4	-177.7	-60.6	-41.6	0	0	0	112.8
536	T	91.9	Very high	93.9	Very high	10 Å²	10	78.4 Å²	78.4	6%	0.061	38%	0.379	C	S	.	.			trans	-84.2	140.8	-177.7	55.6	0	0	0	0	111.9	L529 L545 L550 P551 D554	L529-T536 WeakPolarHBondContact CD1-O 3.28Å; T536-L545 HydrophobicContact CG2-CD2 4.14Å; T536-L550 HydrophobicContact CG2-CB 4.05Å; T536-P551 HydrophobicContact CG2-CG 4.3Å; T536-D554 WeakPolarHBondContact CB-OD2 3.38Å; T536-D554 WeakPolarHBondContact CG2-OD2 3.16Å; T536-D554 WeakPolarHBondContact OG1-CB 3.18Å; T536-D554 PolarHBondContact OG1-OD2 3.28Å
537	Q	93.1	Very high	93.9	Very high	106 Å²	106	77.2 Å²	77.2	50%	0.495	37%	0.374	S	S	.	.			trans	-144.4	153.3	171.1	-68.3	-174.7	-3.9	0	0	108.8	N526	N526-Q537 WeakPolarHBondContact OD1-CA 3.37Å
538	I	95.7	Very high	93.9	Very high	5 Å²	5	75 Å²	75	3%	0.026	36%	0.358	C	S	.	.			trans	-123.7	133.1	178.8	59.6	171.7	0	0	0	110.9	L522 V525 N526 D543 I546 P551 F619	L522-I538 HydrophobicContact CD2-CD1 3.78Å; L522-I538 HydrophobicContact CD2-CG1 4.14Å; V525-I538 HydrophobicContact CB-CD1 4.48Å; V525-I538 HydrophobicContact CG1-CD1 3.88Å; V525-I538 HydrophobicContact CG1-CG1 4.03Å; N526-I538 PolarHBondContact ND2-O 2.86Å; N526-I538 PolarHBondContact OD1-N 3.19Å; N526-I538 PolarHBondContact OD1-O 3.22Å; I538-D543 HydrophobicContact CB-CB 4.22Å; I538-D543 HydrophobicContact CG2-CB 4.36Å; I538-I546 HydrophobicContact CD1-CD1 4.49Å; I538-I546 HydrophobicContact CG2-CD1 4.18Å; I538-I546 HydrophobicContact CG2-CG1 3.86Å; I538-P551 HydrophobicContact CG2-CB 3.87Å; I538-P551 HydrophobicContact CG2-CG 3.96Å; I538-F619 HydrophobicContact CD1-CD2 4.3Å; I538-F619 HydrophobicContact CD1-CE1 4.26Å; I538-F619 HydrophobicContact CD1-CE2 3.78Å; I538-F619 HydrophobicContact CD1-CZ 3.76Å
539	S	94.2	Very high	94.1	Very high	97 Å²	97	74.4 Å²	74.4	68%	0.678	35%	0.354	S	S	*	.	S	Bend	trans	-81.4	-27.9	177.2	58	0	0	0	0	113	D543	S539-D543 PolarHBondContact N-OD2 2.79Å; S539-D543 PolarHBondContact OG-OD2 2.81Å
540	S	94.9	Very high	94.1	Very high	39 Å²	39	75.2 Å²	75.2	27%	0.273	36%	0.358	S	S	.	.	S	Bend	trans	-164.8	172.5	178.7	67.6	0	0	0	0	110.6	K542 D543	S540-K542 PolarHBondContact O-N 2.93Å; S540-K542 PolarHBondContact OG-N 3.48Å; S540-D543 VanDerWaalsContact O-CB 3.26Å; S540-D543 WeakPolarHBondContact O-CB 3.27Å; S540-D543 PolarHBondContact O-N 2.5Å; S540-D543 VanDerWaalsContact O-N 3.08Å
541	F	94.4	Very high	94.2	Very high	17 Å²	17	68 Å²	68	8%	0.075	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	2.8	170.5	-55.2	-57.1	0	0	0	114.3	D518 I521 L522 P612 V615 M616 F619	D518-F541 HydrophobicContact CB-CE2 4.07Å; I521-F541 HydrophobicContact CB-CZ 4.03Å; I521-F541 HydrophobicContact CG2-CE1 4.05Å; I521-F541 HydrophobicContact CG2-CZ 3.75Å; L522-F541 HydrophobicContact CD1-CD2 4.48Å; L522-F541 HydrophobicContact CD1-CE2 4.2Å; L522-F541 HydrophobicContact CD1-CZ 4.43Å; L522-F541 HydrophobicContact CD2-CD1 3.79Å; L522-F541 HydrophobicContact CD2-CD2 4.44Å; L522-F541 HydrophobicContact CD2-CE1 3.52Å; L522-F541 HydrophobicContact CD2-CE2 4.21Å; L522-F541 HydrophobicContact CD2-CG 4.24Å; L522-F541 HydrophobicContact CD2-CZ 3.76Å; L522-F541 HydrophobicContact CG-CD1 4.48Å; L522-F541 HydrophobicContact CG-CD2 4.43Å; L522-F541 HydrophobicContact CG-CE1 3.94Å; L522-F541 HydrophobicContact CG-CE2 3.88Å; L522-F541 HydrophobicContact CG-CZ 3.61Å; F541-P612 HydrophobicContact CB-CB 4.47Å; F541-V615 HydrophobicContact CB-CG1 4.06Å; F541-V615 HydrophobicContact CD1-CG1 4.15Å; F541-M616 HydrophobicContact CD1-CB 4.18Å; F541-M616 HydrophobicContact CD2-CB 3.79Å; F541-M616 HydrophobicContact CD2-CG 3.94Å; F541-M616 HydrophobicContact CE1-CB 4.29Å; F541-M616 HydrophobicContact CE1-CG 4.33Å; F541-M616 HydrophobicContact CE2-CB 3.91Å; F541-M616 HydrophobicContact CE2-CG 3.54Å; F541-M616 HydrophobicContact CG-CB 3.93Å; F541-M616 HydrophobicContact CG-CG 4.48Å; F541-M616 HydrophobicContact CZ-CB 4.15Å; F541-M616 HydrophobicContact CZ-CG 3.76Å; F541-F619 AromaticContact CD1-CD2 3.94Å; F541-F619 HydrophobicContact CD1-CD2 3.94Å; F541-F619 HydrophobicContact CD1-CE2 4.49Å; F541-F619 HydrophobicContact CE1-CB 4.25Å; F541-F619 AromaticContact CE1-CD2 3.92Å; F541-F619 HydrophobicContact CE1-CD2 3.92Å; F541-F619 HydrophobicContact CE1-CG 4.38Å
542	K	95.6	Very high	94.4	Very high	154 Å²	154	61.2 Å²	61.2	67%	0.67	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	4	172.8	-65.2	177.7	-179.3	-177.6	0	112.4	S540 K544 P612	S540-K542 PolarHBondContact O-N 2.93Å; S540-K542 PolarHBondContact OG-N 3.48Å; K542-K544 PolarHBondContact O-N 2.78Å; K542-P612 HydrophobicContact CD-CG 4.39Å; K542-P612 HydrophobicContact CG-CB 4.07Å; K542-P612 HydrophobicContact CG-CG 3.59Å
543	D	95.5	Very high	94.6	Very high	35 Å²	35	55.5 Å²	55.5	19%	0.187	27%	0.27	C	S	.	.			trans	-63.8	127.3	-176	-161.4	-48.6	0	0	0	111.2	I538 S539 S540 L545 I546	I538-D543 HydrophobicContact CB-CB 4.22Å; I538-D543 HydrophobicContact CG2-CB 4.36Å; S539-D543 PolarHBondContact N-OD2 2.79Å; S539-D543 PolarHBondContact OG-OD2 2.81Å; S540-D543 VanDerWaalsContact O-CB 3.26Å; S540-D543 WeakPolarHBondContact O-CB 3.27Å; S540-D543 PolarHBondContact O-N 2.5Å; S540-D543 VanDerWaalsContact O-N 3.08Å; D543-L545 PolarHBondContact O-N 3.13Å; D543-L545 WeakPolarHBondContact OD1-CB 3.48Å; D543-L545 PolarHBondContact OD1-N 2.73Å; D543-I546 HydrophobicContact CB-CD1 4.03Å; D543-I546 HydrophobicContact CB-CG1 4.26Å; D543-I546 VanDerWaalsContact O-CB 3.27Å; D543-I546 WeakPolarHBondContact O-CB 3.23Å; D543-I546 WeakPolarHBondContact O-CG1 3.49Å; D543-I546 PolarHBondContact O-N 2.79Å; D543-I546 VanDerWaalsContact O-N 3.08Å
544	K	94.3	Very high	94.8	Very high	176 Å²	176	45 Å²	45	77%	0.765	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-63.6	-23.3	-177	-71.5	-172.2	177.3	-177.8	0	112.8	K542 I546 S547	K542-K544 PolarHBondContact O-N 2.78Å; K544-I546 PolarHBondContact O-N 2.93Å; K544-S547 WeakPolarHBondContact O-CB 3.34Å; K544-S547 PolarHBondContact O-N 3.37Å; K544-S547 VanDerWaalsContact O-N 3.09Å; K544-S547 PolarHBondContact O-OG 3.21Å
545	L	94.4	Very high	95	Very high	60 Å²	60	42.9 Å²	42.9	31%	0.314	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-60.4	-28.6	176.3	-173.7	61.6	0	0	0	111.7	T536 D543 S547 T548 P551	T536-L545 HydrophobicContact CG2-CD2 4.14Å; D543-L545 PolarHBondContact O-N 3.13Å; D543-L545 WeakPolarHBondContact OD1-CB 3.48Å; D543-L545 PolarHBondContact OD1-N 2.73Å; L545-S547 PolarHBondContact O-N 3.35Å; L545-T548 HydrophobicContact CD1-CG2 4.42Å; L545-T548 WeakPolarHBondContact O-CB 3.41Å; L545-T548 PolarHBondContact O-N 2.7Å; L545-T548 PolarHBondContact O-OG1 3.14Å; L545-P551 HydrophobicContact CB-CG 4.32Å; L545-P551 HydrophobicContact CD2-CG 3.79Å; L545-P551 HydrophobicContact CG-CG 3.64Å
546	I	96.5	Very high	95.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-61	-29.1	177.7	-59.9	170.5	0	0	0	111.5	I538 D543 K544 T548 S549 L607 V610 V615 F619	I538-I546 HydrophobicContact CD1-CD1 4.49Å; I538-I546 HydrophobicContact CG2-CD1 4.18Å; I538-I546 HydrophobicContact CG2-CG1 3.86Å; D543-I546 HydrophobicContact CB-CD1 4.03Å; D543-I546 HydrophobicContact CB-CG1 4.26Å; D543-I546 VanDerWaalsContact O-CB 3.27Å; D543-I546 WeakPolarHBondContact O-CB 3.23Å; D543-I546 WeakPolarHBondContact O-CG1 3.49Å; D543-I546 PolarHBondContact O-N 2.79Å; D543-I546 VanDerWaalsContact O-N 3.08Å; K544-I546 PolarHBondContact O-N 2.93Å; I546-T548 PolarHBondContact O-N 2.91Å; I546-S549 WeakPolarHBondContact O-CA 3.44Å; I546-S549 PolarHBondContact O-N 3.45Å; I546-L607 HydrophobicContact CG2-CD2 4.17Å; I546-V610 HydrophobicContact CB-CG1 4.27Å; I546-V610 HydrophobicContact CB-CG2 4.48Å; I546-V615 HydrophobicContact CD1-CG1 3.67Å; I546-V615 HydrophobicContact CG2-CG1 3.94Å; I546-V615 HydrophobicContact CG2-CG2 3.95Å; I546-F619 HydrophobicContact CD1-CE2 4.2Å
547	S	96.3	Very high	95.6	Very high	12 Å²	12	36.3 Å²	36.3	8%	0.084	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-59.9	-19.2	175.7	71.6	0	0	0	0	113.9	K544 L545 K582 L607 V608	K544-S547 WeakPolarHBondContact O-CB 3.34Å; K544-S547 PolarHBondContact O-N 3.37Å; K544-S547 VanDerWaalsContact O-N 3.09Å; K544-S547 PolarHBondContact O-OG 3.21Å; L545-S547 PolarHBondContact O-N 3.35Å; S547-K582 VanDerWaalsContact O-CB 3.31Å; S547-K582 WeakPolarHBondContact O-CB 3.28Å; S547-K582 WeakPolarHBondContact O-CD 3.28Å; S547-K582 VanDerWaalsContact O-CG 3.3Å; S547-K582 WeakPolarHBondContact O-CG 3.34Å; S547-K582 PolarHBondContact OG-NZ 3.18Å; S547-K582 VanDerWaalsContact OG-NZ 3.1Å; S547-L607 WeakPolarHBondContact CA-O 3.49Å; S547-V608 WeakPolarHBondContact CB-O 3.48Å
548	T	95.5	Very high	95.7	Very high	16 Å²	16	31.7 Å²	31.7	10%	0.098	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-85.2	-12.7	175.9	70.3	0	0	0	0	113.4	L545 I546 L550 L577 N585	L545-T548 HydrophobicContact CD1-CG2 4.42Å; L545-T548 WeakPolarHBondContact O-CB 3.41Å; L545-T548 PolarHBondContact O-N 2.7Å; L545-T548 PolarHBondContact O-OG1 3.14Å; I546-T548 PolarHBondContact O-N 2.91Å; T548-L550 PolarHBondContact O-N 2.97Å; T548-L550 WeakPolarHBondContact OG1-CB 3.16Å; T548-L550 WeakPolarHBondContact OG1-CG 3.18Å; T548-L550 PolarHBondContact OG1-N 3.12Å; T548-L577 HydrophobicContact CG2-CD1 3.59Å; T548-N585 WeakPolarHBondContact O-CB 3.5Å; T548-N585 PolarHBondContact O-ND2 3.27Å
549	S	97.1	Very high	95.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	57.5	1.8	-166.8	-54	0	0	0	0	115.6	I546 V552 I553 A586	I546-S549 WeakPolarHBondContact O-CA 3.44Å; I546-S549 PolarHBondContact O-N 3.45Å; S549-V552 WeakPolarHBondContact O-CB 3.46Å; S549-V552 PolarHBondContact O-N 3.44Å; S549-V552 VanDerWaalsContact O-N 3.11Å; S549-I553 WeakPolarHBondContact O-CG1 3.3Å; S549-I553 PolarHBondContact O-N 3.4Å; S549-A586 VanDerWaalsContact OG-CA 3.24Å; S549-A586 WeakPolarHBondContact OG-CA 3.32Å; S549-A586 WeakPolarHBondContact OG-CB 3.47Å; S549-A586 PolarHBondContact OG-N 3.4Å
550	L	95.6	Very high	95.4	Very high	17 Å²	17	27.3 Å²	27.3	9%	0.089	14%	0.136	C	C	.	.	H	α-helix	trans	-59.6	-43.2	179.7	-63.6	173.6	0	0	0	113.1	T536 T548 V552 I553 D554 V569 R571 L577	T536-L550 HydrophobicContact CG2-CB 4.05Å; T548-L550 PolarHBondContact O-N 2.97Å; T548-L550 WeakPolarHBondContact OG1-CB 3.16Å; T548-L550 WeakPolarHBondContact OG1-CG 3.18Å; T548-L550 PolarHBondContact OG1-N 3.12Å; L550-V552 PolarHBondContact O-N 3.02Å; L550-I553 PolarHBondContact O-N 3.37Å; L550-D554 WeakPolarHBondContact O-CB 3.36Å; L550-D554 PolarHBondContact O-N 3.28Å; L550-V569 HydrophobicContact CD2-CG1 3.66Å; L550-R571 HydrophobicContact CD2-CG 4.16Å; L550-L577 HydrophobicContact CD1-CD1 4.33Å
551	P	96.6	Very high	95.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-34	175.5	-23.2	34	0	0	0	113.3	T536 I538 L545 L555	T536-P551 HydrophobicContact CG2-CG 4.3Å; I538-P551 HydrophobicContact CG2-CB 3.87Å; I538-P551 HydrophobicContact CG2-CG 3.96Å; L545-P551 HydrophobicContact CB-CG 4.32Å; L545-P551 HydrophobicContact CD2-CG 3.79Å; L545-P551 HydrophobicContact CG-CG 3.64Å; P551-L555 WeakPolarHBondContact O-CB 3.36Å; P551-L555 PolarHBondContact O-N 2.81Å; P551-L555 VanDerWaalsContact O-N 3.08Å
552	V	97.4	Very high	94.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-70.8	-44.5	177.7	-177.7	0	0	0	0	110	S549 L550 L555 I556 A589 L607 V618 F619 L622	S549-V552 WeakPolarHBondContact O-CB 3.46Å; S549-V552 PolarHBondContact O-N 3.44Å; S549-V552 VanDerWaalsContact O-N 3.11Å; L550-V552 PolarHBondContact O-N 3.02Å; V552-L555 PolarHBondContact O-N 2.93Å; V552-I556 HydrophobicContact CG1-CD1 4.05Å; V552-I556 VanDerWaalsContact O-CG1 3.27Å; V552-I556 WeakPolarHBondContact O-CG1 3.19Å; V552-I556 PolarHBondContact O-N 3.08Å; V552-A589 HydrophobicContact CB-CB 4.41Å; V552-A589 HydrophobicContact CG1-CB 4.06Å; V552-L607 HydrophobicContact CG2-CD1 4.42Å; V552-L607 HydrophobicContact CG2-CD2 4.26Å; V552-V618 HydrophobicContact CG1-CG1 4Å; V552-F619 HydrophobicContact CG2-CE1 4.19Å; V552-F619 HydrophobicContact CG2-CZ 3.84Å; V552-L622 HydrophobicContact CG1-CD1 4.07Å
553	I	96.9	Very high	94.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-45.7	178.9	-63.9	167.4	0	0	0	111.1	S549 L550 L555 I556 D557 V564 W566 V569 N585 Y588 A589	S549-I553 WeakPolarHBondContact O-CG1 3.3Å; S549-I553 PolarHBondContact O-N 3.4Å; L550-I553 PolarHBondContact O-N 3.37Å; I553-L555 VanDerWaalsContact C-N 3.26Å; I553-L555 PolarHBondContact O-N 3.37Å; I553-I556 PolarHBondContact O-N 2.89Å; I553-D557 PolarHBondContact O-N 2.92Å; I553-V564 HydrophobicContact CG2-CG1 3.56Å; I553-V564 HydrophobicContact CG2-CG2 4.11Å; I553-W566 HydrophobicContact CG2-CH2 3.72Å; I553-W566 HydrophobicContact CG2-CZ3 3.79Å; I553-V569 HydrophobicContact CD1-CG1 3.93Å; I553-V569 HydrophobicContact CD1-CG2 4.24Å; I553-V569 HydrophobicContact CG2-CG2 4.09Å; I553-N585 HydrophobicContact CD1-CB 4.2Å; I553-Y588 HydrophobicContact CD1-CD1 4.27Å; I553-A589 HydrophobicContact CD1-CB 4.33Å; I553-A589 HydrophobicContact CG1-CB 3.74Å
554	D	95.9	Very high	94.2	Very high	4 Å²	4	28 Å²	28	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-60.4	-38.2	176.1	-81.7	-22.2	0	0	0	111.4	L529 K534 T536 L550 D557 S558 W566 R571	L529-D554 HydrophobicContact CD2-CB 3.76Å; K534-D554 HydrophobicContact CB-CB 4.23Å; K534-D554 HydrophobicContact CD-CB 4.2Å; K534-D554 HydrophobicContact CG-CB 4.1Å; T536-D554 WeakPolarHBondContact CB-OD2 3.38Å; T536-D554 WeakPolarHBondContact CG2-OD2 3.16Å; T536-D554 WeakPolarHBondContact OG1-CB 3.18Å; T536-D554 PolarHBondContact OG1-OD2 3.28Å; L550-D554 WeakPolarHBondContact O-CB 3.36Å; L550-D554 PolarHBondContact O-N 3.28Å; D554-D557 PolarHBondContact O-N 3.28Å; D554-S558 WeakPolarHBondContact O-CB 3.27Å; D554-S558 PolarHBondContact O-N 3.29Å; D554-S558 PolarHBondContact O-OG 3.18Å; D554-W566 WeakPolarHBondContact OD1-CH2 3.45Å; D554-R571 IonicContact OD1-NH2 2.63Å
555	L	96.8	Very high	94.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.6	-42.4	176.5	-177.3	64.8	0	0	0	111.2	W524 V525 T528 L529 P551 V552 I553 D557 S558 I559 F619 L622	W524-L555 HydrophobicContact CH2-CD1 3.95Å; W524-L555 HydrophobicContact CH2-CD2 4.18Å; W524-L555 HydrophobicContact CH2-CG 4.35Å; W524-L555 HydrophobicContact CZ3-CD1 4.11Å; W524-L555 HydrophobicContact CZ3-CD2 3.85Å; W524-L555 HydrophobicContact CZ3-CG 4.45Å; V525-L555 HydrophobicContact CG1-CD2 4.34Å; V525-L555 HydrophobicContact CG2-CD2 4.07Å; T528-L555 HydrophobicContact CG2-CD1 3.81Å; L529-L555 HydrophobicContact CD2-CB 4.11Å; L529-L555 HydrophobicContact CD2-CD1 4.45Å; L529-L555 HydrophobicContact CG-CD1 4.42Å; P551-L555 WeakPolarHBondContact O-CB 3.36Å; P551-L555 PolarHBondContact O-N 2.81Å; P551-L555 VanDerWaalsContact O-N 3.08Å; V552-L555 PolarHBondContact O-N 2.93Å; I553-L555 VanDerWaalsContact C-N 3.26Å; I553-L555 PolarHBondContact O-N 3.37Å; L555-D557 VanDerWaalsContact C-N 3.33Å; L555-D557 PolarHBondContact O-N 3.44Å; L555-S558 WeakPolarHBondContact O-CB 3.46Å; L555-S558 PolarHBondContact O-N 3.4Å; L555-S558 VanDerWaalsContact O-N 3.14Å; L555-I559 HydrophobicContact CD1-CG2 4.46Å; L555-I559 WeakPolarHBondContact O-CG1 3.29Å; L555-I559 PolarHBondContact O-N 3.41Å; L555-F619 HydrophobicContact CD2-CD1 3.5Å; L555-F619 HydrophobicContact CD2-CE1 3.79Å; L555-L622 HydrophobicContact CD2-CB 4.34Å; L555-L622 HydrophobicContact CD2-CD1 3.88Å; L555-L622 HydrophobicContact CG-CD1 4.48Å
556	I	96.3	Very high	94.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.7	-45.4	174	-71.4	164.3	0	0	0	110.6	V552 I553 S558 I559 A560 V564 A589 L592 A593 I596 L622	V552-I556 HydrophobicContact CG1-CD1 4.05Å; V552-I556 VanDerWaalsContact O-CG1 3.27Å; V552-I556 WeakPolarHBondContact O-CG1 3.19Å; V552-I556 PolarHBondContact O-N 3.08Å; I553-I556 PolarHBondContact O-N 2.89Å; I556-S558 VanDerWaalsContact C-N 3.27Å; I556-S558 PolarHBondContact O-N 3.46Å; I556-I559 WeakPolarHBondContact O-CG1 3.34Å; I556-I559 PolarHBondContact O-N 3.24Å; I556-A560 WeakPolarHBondContact O-CA 3.3Å; I556-A560 PolarHBondContact O-N 3.25Å; I556-V564 HydrophobicContact CG2-CG2 4.04Å; I556-A589 WeakPolarHBondContact CD1-O 3.42Å; I556-L592 HydrophobicContact CD1-CB 4.01Å; I556-L592 HydrophobicContact CG2-CB 4.29Å; I556-A593 HydrophobicContact CD1-CB 4.09Å; I556-I596 HydrophobicContact CG1-CD1 4.48Å; I556-I596 HydrophobicContact CG2-CD1 4.37Å; I556-I596 HydrophobicContact CG2-CG2 4.45Å; I556-L622 HydrophobicContact CD1-CD2 4.44Å; I556-L622 HydrophobicContact CG1-CD1 4.21Å; I556-L622 HydrophobicContact CG1-CD2 3.8Å
557	D	95.6	Very high	93.9	Very high	25 Å²	25	30.9 Å²	30.9	13%	0.134	17%	0.171	C	C	.	.	H	α-helix	trans	-64	-34.1	176.5	-169.7	67.2	0	0	0	112.2	K534 I553 D554 L555 A560 P561 V564 W566	K534-D557 WeakPolarHBondContact CE-OD2 3.39Å; K534-D557 IonicContact NZ-OD2 2.75Å; K534-D557 PolarHBondContact NZ-OD2 3.17Å; I553-D557 PolarHBondContact O-N 2.92Å; D554-D557 PolarHBondContact O-N 3.28Å; L555-D557 VanDerWaalsContact C-N 3.33Å; L555-D557 PolarHBondContact O-N 3.44Å; D557-A560 CarbonylContact O-C 3.42Å; D557-P561 WeakPolarHBondContact O-CA 3.46Å; D557-V564 HydrophobicContact CB-CB 4.2Å; D557-V564 HydrophobicContact CB-CG2 3.7Å; D557-W566 HydrophobicContact CB-CZ2 3.88Å
558	S	94.7	Very high	93.6	Very high	8 Å²	8	32 Å²	32	6%	0.056	18%	0.175	C	C	.	.	H	α-helix	trans	-67.6	-39.9	177.7	-62.6	0	0	0	0	112.6	K534 D554 L555 I556	K534-S558 WeakPolarHBondContact CG-OG 3.25Å; D554-S558 WeakPolarHBondContact O-CB 3.27Å; D554-S558 PolarHBondContact O-N 3.29Å; D554-S558 PolarHBondContact O-OG 3.18Å; L555-S558 WeakPolarHBondContact O-CB 3.46Å; L555-S558 PolarHBondContact O-N 3.4Å; L555-S558 VanDerWaalsContact O-N 3.14Å; I556-S558 VanDerWaalsContact C-N 3.27Å; I556-S558 PolarHBondContact O-N 3.46Å
559	I	92.8	Very high	93.5	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-86	-33.6	178.8	67.6	-176.5	0	0	0	111.8	W524 T528 L555 I556 I596 L622 D626 R629	W524-I559 HydrophobicContact CH2-CG2 4.24Å; W524-I559 HydrophobicContact CZ2-CG2 4.2Å; T528-I559 HydrophobicContact CG2-CG2 4.35Å; L555-I559 HydrophobicContact CD1-CG2 4.46Å; L555-I559 WeakPolarHBondContact O-CG1 3.29Å; L555-I559 PolarHBondContact O-N 3.41Å; I556-I559 WeakPolarHBondContact O-CG1 3.34Å; I556-I559 PolarHBondContact O-N 3.24Å; I559-I596 HydrophobicContact CD1-CD1 3.56Å; I559-I596 HydrophobicContact CG1-CD1 4.1Å; I559-L622 HydrophobicContact CD1-CB 4.2Å; I559-L622 HydrophobicContact CD1-CD2 3.95Å; I559-D626 HydrophobicContact CB-CB 4.26Å; I559-D626 HydrophobicContact CG2-CB 3.92Å; I559-R629 PolarHBondContact O-NH1 2.86Å; I559-R629 PolarHBondContact O-NH2 3.33Å
560	A	90.6	Very high	93.3	Very high	9 Å²	9	36.3 Å²	36.3	7%	0.074	19%	0.194	C	C	.	.	S	Bend	trans	-131	81	-179.1	0	0	0	0	0	110.2	I556 D557 M563 I596	I556-A560 WeakPolarHBondContact O-CA 3.3Å; I556-A560 PolarHBondContact O-N 3.25Å; D557-A560 CarbonylContact O-C 3.42Å; A560-M563 HydrophobicContact CB-CB 4.32Å; A560-M563 HydrophobicContact CB-CG 3.71Å; A560-M563 WeakPolarHBondContact O-CB 3.15Å; A560-M563 WeakPolarHBondContact O-CG 3.43Å; A560-M563 PolarHBondContact O-N 3.35Å; A560-I596 HydrophobicContact CB-CB 4.45Å; A560-I596 HydrophobicContact CB-CG2 3.8Å
561	P	87.8	Confident	92.8	Very high	82 Å²	82	40.9 Å²	40.9	53%	0.532	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	146.2	-179.3	-24.6	34.4	0	0	0	111.8	D557 M563	D557-P561 WeakPolarHBondContact O-CA 3.46Å; P561-M563 PolarHBondContact O-N 2.86Å
562	S	86	Confident	91.8	Very high	116 Å²	116	42.1 Å²	42.1	81%	0.811	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.2	-0.7	179.8	-44.2	0	0	0	0	115.9
563	M	88.6	Confident	90.3	Very high	51 Å²	51	50.6 Å²	50.6	25%	0.251	26%	0.262	S	S	.	.			trans	-76.8	-29.3	172.8	-69.2	-63.3	156.5	0	0	112.8	E193 A560 P561 L592 I596	E193-M563 WeakPolarHBondContact OE1-CE 3.28Å; A560-M563 HydrophobicContact CB-CB 4.32Å; A560-M563 HydrophobicContact CB-CG 3.71Å; A560-M563 WeakPolarHBondContact O-CB 3.15Å; A560-M563 WeakPolarHBondContact O-CG 3.43Å; A560-M563 PolarHBondContact O-N 3.35Å; P561-M563 PolarHBondContact O-N 2.86Å; M563-L592 WeakPolarHBondContact O-CD2 3.33Å; M563-I596 HydrophobicContact CB-CG2 4.34Å; M563-I596 HydrophobicContact CG-CG2 3.95Å
564	V	93.5	Very high	88.6	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.055	31%	0.307	C	S	.	.			trans	-87.2	121.6	-177.7	-178.2	0	0	0	0	110.3	I553 I556 D557 W566 V569 Y588 L592	I553-V564 HydrophobicContact CG2-CG1 3.56Å; I553-V564 HydrophobicContact CG2-CG2 4.11Å; I556-V564 HydrophobicContact CG2-CG2 4.04Å; D557-V564 HydrophobicContact CB-CB 4.2Å; D557-V564 HydrophobicContact CB-CG2 3.7Å; V564-W566 HydrophobicContact CB-CZ2 4.35Å; V564-W566 HydrophobicContact CG1-CD2 3.79Å; V564-W566 HydrophobicContact CG1-CE3 4.11Å; V564-W566 HydrophobicContact CG1-CG 4.23Å; V564-W566 HydrophobicContact CG1-CH2 4.14Å; V564-W566 HydrophobicContact CG1-CZ2 3.87Å; V564-W566 HydrophobicContact CG1-CZ3 4.26Å; V564-W566 PolarHBondContact O-N 2.99Å; V564-V569 HydrophobicContact CG1-CG2 4.16Å; V564-Y588 HydrophobicContact CG1-CE1 4.33Å; V564-L592 HydrophobicContact CG2-CD1 4.01Å
565	K	93	Very high	87	Confident	85 Å²	85	63.8 Å²	63.8	37%	0.37	34%	0.338	S	S	.	.			trans	-92.8	93.7	171.2	-64.6	179.9	-175.7	169.2	0	108.5	D567 M568 Y588	K565-D567 VanDerWaalsContact C-OD1 3.31Å; K565-D567 WeakPolarHBondContact CB-OD1 3.44Å; K565-D567 PolarHBondContact O-N 3.41Å; K565-M568 HydrophobicContact CB-CE 4.35Å; K565-M568 HydrophobicContact CB-CG 3.95Å; K565-M568 HydrophobicContact CB-SD 3.81Å; K565-M568 HydrophobicContact CD-CE 3.54Å; K565-M568 HydrophobicContact CD-SD 3.81Å; K565-M568 HydrophobicContact CG-SD 4.43Å; K565-M568 WeakPolarHBondContact O-CB 3.43Å; K565-M568 PolarHBondContact O-N 3.13Å; K565-Y588 PolarHBondContact N-OH 3.38Å
566	W	92.9	Very high	86.1	Confident	83 Å²	83	69 Å²	69	31%	0.314	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-62.8	-23.2	-171.6	-72	103.3	0	0	0	114.4	I553 D554 D557 V564 M568 V569	I553-W566 HydrophobicContact CG2-CH2 3.72Å; I553-W566 HydrophobicContact CG2-CZ3 3.79Å; D554-W566 WeakPolarHBondContact OD1-CH2 3.45Å; D557-W566 HydrophobicContact CB-CZ2 3.88Å; V564-W566 HydrophobicContact CB-CZ2 4.35Å; V564-W566 HydrophobicContact CG1-CD2 3.79Å; V564-W566 HydrophobicContact CG1-CE3 4.11Å; V564-W566 HydrophobicContact CG1-CG 4.23Å; V564-W566 HydrophobicContact CG1-CH2 4.14Å; V564-W566 HydrophobicContact CG1-CZ2 3.87Å; V564-W566 HydrophobicContact CG1-CZ3 4.26Å; V564-W566 PolarHBondContact O-N 2.99Å; W566-M568 PolarHBondContact O-N 3.42Å; W566-V569 HydrophobicContact CE3-CB 4.11Å; W566-V569 HydrophobicContact CE3-CG1 4.36Å; W566-V569 HydrophobicContact CE3-CG2 3.96Å; W566-V569 HydrophobicContact CZ3-CB 4.47Å; W566-V569 HydrophobicContact CZ3-CG1 4.27Å; W566-V569 HydrophobicContact CZ3-CG2 4.26Å; W566-V569 PolarHBondContact O-N 2.82Å; W566-V569 VanDerWaalsContact O-N 3.15Å
567	D	92.2	Very high	85.6	Confident	129 Å²	129	69.6 Å²	69.6	69%	0.69	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-61.7	-24.8	171.2	59.4	-62.4	0	0	0	113	K565	K565-D567 VanDerWaalsContact C-OD1 3.31Å; K565-D567 WeakPolarHBondContact CB-OD1 3.44Å; K565-D567 PolarHBondContact O-N 3.41Å
568	M	89.2	Confident	85.4	Confident	36 Å²	36	75.9 Å²	75.9	18%	0.177	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-85.2	-14.7	177.7	-56.9	-176.5	169.5	0	0	113	R179 K565 W566 Y588	R179-M568 HydrophobicContact CB-CE 4.11Å; R179-M568 HydrophobicContact CB-SD 3.72Å; K565-M568 HydrophobicContact CB-CE 4.35Å; K565-M568 HydrophobicContact CB-CG 3.95Å; K565-M568 HydrophobicContact CB-SD 3.81Å; K565-M568 HydrophobicContact CD-CE 3.54Å; K565-M568 HydrophobicContact CD-SD 3.81Å; K565-M568 HydrophobicContact CG-SD 4.43Å; K565-M568 WeakPolarHBondContact O-CB 3.43Å; K565-M568 PolarHBondContact O-N 3.13Å; W566-M568 PolarHBondContact O-N 3.42Å; M568-Y588 HydrophobicContact CB-CE2 4.27Å; M568-Y588 HydrophobicContact SD-CE2 3.85Å
569	V	93.5	Very high	85.2	Confident	13 Å²	13	81 Å²	81	8%	0.079	43%	0.426	C	S	.	.			trans	-91.4	123.5	-173.4	-176.9	0	0	0	0	110.4	L550 I553 V564 W566 Y588	L550-V569 HydrophobicContact CD2-CG1 3.66Å; I553-V569 HydrophobicContact CD1-CG1 3.93Å; I553-V569 HydrophobicContact CD1-CG2 4.24Å; I553-V569 HydrophobicContact CG2-CG2 4.09Å; V564-V569 HydrophobicContact CG1-CG2 4.16Å; W566-V569 HydrophobicContact CE3-CB 4.11Å; W566-V569 HydrophobicContact CE3-CG1 4.36Å; W566-V569 HydrophobicContact CE3-CG2 3.96Å; W566-V569 HydrophobicContact CZ3-CB 4.47Å; W566-V569 HydrophobicContact CZ3-CG1 4.27Å; W566-V569 HydrophobicContact CZ3-CG2 4.26Å; W566-V569 PolarHBondContact O-N 2.82Å; W566-V569 VanDerWaalsContact O-N 3.15Å; V569-Y588 HydrophobicContact CG2-CD1 4.09Å; V569-Y588 HydrophobicContact CG2-CE1 3.78Å
570	K	92.4	Very high	85.2	Confident	93 Å²	93	87.1 Å²	87.1	40%	0.404	46%	0.458	S	S	.	.			trans	-82.5	131.7	174.6	-55.8	-55.8	-178.7	-174.4	0	109.8	L577 E581 N585	K570-L577 HydrophobicContact CB-CD2 3.74Å; K570-L577 WeakPolarHBondContact O-CD2 3.48Å; K570-E581 HydrophobicContact CB-CB 4.01Å; K570-E581 HydrophobicContact CB-CG 4.44Å; K570-E581 HydrophobicContact CG-CB 4.28Å; K570-E581 HydrophobicContact CG-CG 4.43Å; K570-N585 PolarHBondContact N-OD1 2.98Å; K570-N585 PolarHBondContact O-ND2 3.49Å
571	R	87.1	Confident	85.3	Confident	113 Å²	113	89.3 Å²	89.3	43%	0.426	47%	0.467	S	S	.	.			trans	-112	-4.8	174.3	-68.2	-176.7	174.3	-105.5	-0.9	113.5	L550 D554	L550-R571 HydrophobicContact CD2-CG 4.16Å; D554-R571 IonicContact OD1-NH2 2.63Å
572	G	74.4	Confident	85.7	Confident	27 Å²	27	87.3 Å²	87.3	28%	0.278	45%	0.45	S	S	.	.			trans	72.4	158.9	-179.4	0	0	0	0	0	113.5
573	E	65.5	Low	86.2	Confident	177 Å²	177	83.8 Å²	83.8	83%	0.827	42%	0.422	S	S	*	.	B	Isolated β-bridge	trans	-81.1	132.1	170.3	-68.9	-179.8	-178.9	0	0	109.4	G575 V576	E573-G575 PolarHBondContact O-N 3.44Å; E573-G575 VanDerWaalsContact O-N 3.13Å; E573-V576 PolarHBondContact O-N 2.86Å
574	K	61.1	Low	86.5	Confident	217 Å²	217	83.6 Å²	83.6	94%	0.943	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	23.5	-178.4	-54.8	179	-179.3	176.5	0	114.8
575	G	64.1	Low	86.7	Confident	65 Å²	65	83.1 Å²	83.1	67%	0.67	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	10	175.8	0	0	0	0	0	115.4	E573	E573-G575 PolarHBondContact O-N 3.44Å; E573-G575 VanDerWaalsContact O-N 3.13Å
576	V	75.9	Confident	86.9	Confident	110 Å²	110	79.1 Å²	79.1	67%	0.667	40%	0.401	S	S	*	.	B	Isolated β-bridge	trans	-109.9	119.3	174.9	-175.6	0	0	0	0	109.5	E573	E573-V576 PolarHBondContact O-N 2.86Å
577	L	87.2	Confident	87.1	Confident	12 Å²	12	77.6 Å²	77.6	6%	0.063	40%	0.397	C	S	.	.			trans	-95.9	132.6	175.8	-79.9	146.6	0	0	0	110.7	T548 L550 K570 E581 K582	T548-L577 HydrophobicContact CG2-CD1 3.59Å; L550-L577 HydrophobicContact CD1-CD1 4.33Å; K570-L577 HydrophobicContact CB-CD2 3.74Å; K570-L577 WeakPolarHBondContact O-CD2 3.48Å; L577-E581 HydrophobicContact CD2-CB 3.55Å; L577-E581 HydrophobicContact CD2-CG 4.47Å; L577-K582 HydrophobicContact CB-CG 3.84Å; L577-K582 WeakPolarHBondContact O-CE 3.28Å
578	K	90.6	Very high	87.3	Confident	156 Å²	156	71.5 Å²	71.5	68%	0.678	37%	0.365	S	S	*	.			trans	-69.9	158.6	170.7	-64.2	-179.3	-176.6	175.6	0	110.4	D580 E581 K582	K578-D580 VanDerWaalsContact C-N 3.26Å; K578-D580 PolarHBondContact O-N 3.32Å; K578-E581 HydrophobicContact CB-CG 4.29Å; K578-E581 PolarHBondContact N-OE2 2.83Å; K578-E581 WeakPolarHBondContact O-CB 3.48Å; K578-E581 PolarHBondContact O-N 3.4Å; K578-K582 WeakPolarHBondContact O-CG 3.41Å; K578-K582 PolarHBondContact O-N 3.47Å
579	N	90.8	Very high	87.7	Confident	117 Å²	117	69.8 Å²	69.8	63%	0.626	36%	0.356	S	S	*	.	H	α-helix	trans	-57.4	-39	-179.9	-75.6	-6.5	0	0	0	112.6	E581 K582 I583	N579-E581 VanDerWaalsContact C-N 3.29Å; N579-E581 PolarHBondContact O-N 2.74Å; N579-K582 WeakPolarHBondContact O-CB 3.37Å; N579-K582 PolarHBondContact O-N 3.4Å; N579-I583 PolarHBondContact O-N 2.82Å
580	D	92.1	Very high	87.9	Confident	129 Å²	129	69.3 Å²	69.3	69%	0.69	35%	0.353	S	S	*	.	H	α-helix	trans	-65.2	-32.3	177.2	-59.8	-22.5	0	0	0	112.8	K578 I583 N584	K578-D580 VanDerWaalsContact C-N 3.26Å; K578-D580 PolarHBondContact O-N 3.32Å; D580-I583 VanDerWaalsContact O-CG2 3.22Å; D580-I583 WeakPolarHBondContact O-CG2 3.28Å; D580-N584 VanDerWaalsContact O-CB 3.25Å; D580-N584 WeakPolarHBondContact O-CB 3.28Å; D580-N584 PolarHBondContact O-N 3.15Å; D580-N584 VanDerWaalsContact O-N 3.08Å
581	E	94.4	Very high	88.2	Confident	56 Å²	56	65 Å²	65	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-76.1	-37.3	175.3	-59.9	176.8	130.1	0	0	111.2	K570 L577 K578 N579 N584 N585	K570-E581 HydrophobicContact CB-CB 4.01Å; K570-E581 HydrophobicContact CB-CG 4.44Å; K570-E581 HydrophobicContact CG-CB 4.28Å; K570-E581 HydrophobicContact CG-CG 4.43Å; L577-E581 HydrophobicContact CD2-CB 3.55Å; L577-E581 HydrophobicContact CD2-CG 4.47Å; K578-E581 HydrophobicContact CB-CG 4.29Å; K578-E581 PolarHBondContact N-OE2 2.83Å; K578-E581 WeakPolarHBondContact O-CB 3.48Å; K578-E581 PolarHBondContact O-N 3.4Å; N579-E581 VanDerWaalsContact C-N 3.29Å; N579-E581 PolarHBondContact O-N 2.74Å; E581-N584 PolarHBondContact O-N 3.4Å; E581-N585 PolarHBondContact O-N 3.05Å
582	K	95.5	Very high	88.7	Confident	40 Å²	40	59.8 Å²	59.8	17%	0.174	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-47.9	174.6	-70.3	-178.2	178.7	-169	0	111.5	S547 L577 K578 N579 N584 N585 A586 V608	S547-K582 VanDerWaalsContact O-CB 3.31Å; S547-K582 WeakPolarHBondContact O-CB 3.28Å; S547-K582 WeakPolarHBondContact O-CD 3.28Å; S547-K582 VanDerWaalsContact O-CG 3.3Å; S547-K582 WeakPolarHBondContact O-CG 3.34Å; S547-K582 PolarHBondContact OG-NZ 3.18Å; S547-K582 VanDerWaalsContact OG-NZ 3.1Å; L577-K582 HydrophobicContact CB-CG 3.84Å; L577-K582 WeakPolarHBondContact O-CE 3.28Å; K578-K582 WeakPolarHBondContact O-CG 3.41Å; K578-K582 PolarHBondContact O-N 3.47Å; N579-K582 WeakPolarHBondContact O-CB 3.37Å; N579-K582 PolarHBondContact O-N 3.4Å; K582-N584 VanDerWaalsContact C-N 3.31Å; K582-N584 PolarHBondContact O-N 3.1Å; K582-N585 PolarHBondContact O-N 2.92Å; K582-A586 WeakPolarHBondContact O-CB 3.4Å; K582-A586 PolarHBondContact O-N 3.28Å; K582-V608 HydrophobicContact CB-CG1 4.14Å; K582-V608 HydrophobicContact CB-CG2 4.05Å; K582-V608 HydrophobicContact CD-CG1 4.39Å
583	I	95.9	Very high	89.7	Confident	41 Å²	41	58.5 Å²	58.5	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-36.4	177.5	-164.1	70.3	0	0	0	110.9	N579 D580 A586 K587 P604 V608	N579-I583 PolarHBondContact O-N 2.82Å; D580-I583 VanDerWaalsContact O-CG2 3.22Å; D580-I583 WeakPolarHBondContact O-CG2 3.28Å; I583-A586 PolarHBondContact O-N 2.99Å; I583-K587 WeakPolarHBondContact O-CG 3.28Å; I583-K587 PolarHBondContact O-N 3.16Å; I583-P604 HydrophobicContact CD1-CB 3.62Å; I583-P604 HydrophobicContact CG1-CB 4.45Å; I583-V608 HydrophobicContact CB-CG2 4.31Å; I583-V608 HydrophobicContact CD1-CG2 3.94Å
584	N	95.8	Very high	91.2	Very high	47 Å²	47	50.4 Å²	50.4	25%	0.251	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-45.7	174.6	-172.4	-90	0	0	0	112.2	R179 D580 E581 K582 A586 Y588	R179-N584 PolarHBondContact NH1-OD1 2.89Å; R179-N584 VanDerWaalsContact NH2-CG 3.33Å; R179-N584 PolarHBondContact NH2-ND2 3.31Å; R179-N584 PolarHBondContact NH2-O 3.23Å; R179-N584 PolarHBondContact NH2-OD1 2.78Å; D580-N584 VanDerWaalsContact O-CB 3.25Å; D580-N584 WeakPolarHBondContact O-CB 3.28Å; D580-N584 PolarHBondContact O-N 3.15Å; D580-N584 VanDerWaalsContact O-N 3.08Å; E581-N584 PolarHBondContact O-N 3.4Å; K582-N584 VanDerWaalsContact C-N 3.31Å; K582-N584 PolarHBondContact O-N 3.1Å; N584-A586 VanDerWaalsContact C-N 3.34Å; N584-Y588 WeakPolarHBondContact O-CB 3.36Å; N584-Y588 PolarHBondContact O-N 3.16Å
585	N	97	Very high	92.9	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-37.8	174.5	-76.8	-4.9	0	0	0	112	T548 I553 K570 E581 K582 Y588 A589	T548-N585 WeakPolarHBondContact O-CB 3.5Å; T548-N585 PolarHBondContact O-ND2 3.27Å; I553-N585 HydrophobicContact CD1-CB 4.2Å; K570-N585 PolarHBondContact N-OD1 2.98Å; K570-N585 PolarHBondContact O-ND2 3.49Å; E581-N585 PolarHBondContact O-N 3.05Å; K582-N585 PolarHBondContact O-N 2.92Å; N585-Y588 WeakPolarHBondContact O-CB 3.26Å; N585-Y588 PolarHBondContact O-N 3.08Å; N585-A589 VanDerWaalsContact O-CB 3.32Å; N585-A589 WeakPolarHBondContact O-CB 3.47Å; N585-A589 PolarHBondContact O-N 3.43Å
586	A	97.3	Very high	94.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-44.3	179.6	0	0	0	0	0	112	S549 K582 I583 N584 Y588 A589 I590 P604 L607 V608	S549-A586 VanDerWaalsContact OG-CA 3.24Å; S549-A586 WeakPolarHBondContact OG-CA 3.32Å; S549-A586 WeakPolarHBondContact OG-CB 3.47Å; S549-A586 PolarHBondContact OG-N 3.4Å; K582-A586 WeakPolarHBondContact O-CB 3.4Å; K582-A586 PolarHBondContact O-N 3.28Å; I583-A586 PolarHBondContact O-N 2.99Å; N584-A586 VanDerWaalsContact C-N 3.34Å; A586-Y588 VanDerWaalsContact C-N 3.27Å; A586-Y588 PolarHBondContact O-N 2.92Å; A586-A589 PolarHBondContact O-N 3.31Å; A586-I590 WeakPolarHBondContact O-CG1 3.36Å; A586-I590 PolarHBondContact O-N 3.18Å; A586-P604 HydrophobicContact CB-CB 3.8Å; A586-P604 WeakPolarHBondContact CB-O 3.2Å; A586-L607 HydrophobicContact CB-CB 4.23Å; A586-L607 HydrophobicContact CB-CD1 4.3Å; A586-V608 HydrophobicContact CB-CG2 3.94Å
587	K	96.9	Very high	95	Very high	51 Å²	51	34.5 Å²	34.5	22%	0.222	18%	0.175	C	C	.	.	H	α-helix	trans	-55.3	-45	172.3	-76.8	-178.5	174.5	-170.1	0	111.1	D174 D177 I583 S591 P604	D174-K587 IonicContact OD1-NZ 3.62Å; D174-K587 PolarHBondContact OD1-NZ 3.4Å; D174-K587 IonicContact OD2-NZ 2.8Å; D174-K587 PolarHBondContact OD2-NZ 3.13Å; D177-K587 HydrophobicContact CB-CB 4.47Å; I583-K587 WeakPolarHBondContact O-CG 3.28Å; I583-K587 PolarHBondContact O-N 3.16Å; K587-S591 WeakPolarHBondContact O-CB 3.02Å; K587-S591 PolarHBondContact O-N 3.04Å; K587-S591 VanDerWaalsContact O-N 3.16Å; K587-S591 PolarHBondContact O-OG 3.48Å; K587-P604 HydrophobicContact CB-CG 4.39Å; K587-P604 HydrophobicContact CG-CB 3.92Å; K587-P604 HydrophobicContact CG-CG 3.66Å
588	Y	97.6	Very high	95.1	Very high	2 Å²	2	34 Å²	34	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-48.7	177.5	-173.9	-116.3	0	0	0	112.3	D177 V180 I553 V564 K565 M568 V569 N584 N585 A586 S591 L592	D177-Y588 WeakPolarHBondContact OD2-CA 3.38Å; D177-Y588 PolarHBondContact OD2-N 3.45Å; V180-Y588 HydrophobicContact CG2-CD2 3.5Å; V180-Y588 HydrophobicContact CG2-CE2 3.52Å; I553-Y588 HydrophobicContact CD1-CD1 4.27Å; V564-Y588 HydrophobicContact CG1-CE1 4.33Å; K565-Y588 PolarHBondContact N-OH 3.38Å; M568-Y588 HydrophobicContact CB-CE2 4.27Å; M568-Y588 HydrophobicContact SD-CE2 3.85Å; V569-Y588 HydrophobicContact CG2-CD1 4.09Å; V569-Y588 HydrophobicContact CG2-CE1 3.78Å; N584-Y588 WeakPolarHBondContact O-CB 3.36Å; N584-Y588 PolarHBondContact O-N 3.16Å; N585-Y588 WeakPolarHBondContact O-CB 3.26Å; N585-Y588 PolarHBondContact O-N 3.08Å; A586-Y588 VanDerWaalsContact C-N 3.27Å; A586-Y588 PolarHBondContact O-N 2.92Å; Y588-S591 PolarHBondContact O-N 3.33Å; Y588-L592 HydrophobicContact CD1-CD1 3.72Å; Y588-L592 HydrophobicContact CD1-CG 4.47Å; Y588-L592 HydrophobicContact CD2-CG 4.48Å; Y588-L592 HydrophobicContact CE1-CD1 3.24Å; Y588-L592 HydrophobicContact CE1-CG 4.14Å; Y588-L592 HydrophobicContact CE2-CD1 4.11Å; Y588-L592 HydrophobicContact CE2-CD2 4.46Å; Y588-L592 HydrophobicContact CE2-CG 4.14Å; Y588-L592 HydrophobicContact CG-CD1 4.32Å; Y588-L592 VanDerWaalsContact CZ-CD1 3.44Å; Y588-L592 WeakPolarHBondContact O-CB 3.49Å; Y588-L592 WeakPolarHBondContact O-CG 3.29Å; Y588-L592 PolarHBondContact O-N 3.14Å
589	A	97.6	Very high	95	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.3	-45.2	-178.6	0	0	0	0	0	112.7	V552 I553 I556 N585 A586 L592 A593 L607	V552-A589 HydrophobicContact CB-CB 4.41Å; V552-A589 HydrophobicContact CG1-CB 4.06Å; I553-A589 HydrophobicContact CD1-CB 4.33Å; I553-A589 HydrophobicContact CG1-CB 3.74Å; I556-A589 WeakPolarHBondContact CD1-O 3.42Å; N585-A589 VanDerWaalsContact O-CB 3.32Å; N585-A589 WeakPolarHBondContact O-CB 3.47Å; N585-A589 PolarHBondContact O-N 3.43Å; A586-A589 PolarHBondContact O-N 3.31Å; A589-L592 PolarHBondContact O-N 3.36Å; A589-A593 WeakPolarHBondContact O-CB 3.09Å; A589-A593 PolarHBondContact O-N 2.99Å; A589-L607 HydrophobicContact CB-CD1 4.49Å
590	I	97.6	Very high	95	Very high	3 Å²	3	27 Å²	27	2%	0.015	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-43.4	178.3	-65.5	-65.6	0	0	0	110.7	A586 A593 R594 V600 A602 L607 V618	A586-I590 WeakPolarHBondContact O-CG1 3.36Å; A586-I590 PolarHBondContact O-N 3.18Å; I590-A593 PolarHBondContact O-N 2.84Å; I590-R594 WeakPolarHBondContact O-CG 3.48Å; I590-R594 PolarHBondContact O-N 3.37Å; I590-V600 HydrophobicContact CD1-CG1 3.72Å; I590-A602 HydrophobicContact CD1-CB 4.18Å; I590-L607 HydrophobicContact CD1-CD1 3.88Å; I590-L607 HydrophobicContact CD1-CG 4.39Å; I590-L607 HydrophobicContact CG1-CD1 4.07Å; I590-V618 HydrophobicContact CD1-CG2 4.19Å
591	S	97.6	Very high	95	Very high	3 Å²	3	21.8 Å²	21.8	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-66.4	-40.9	178.6	-58.8	0	0	0	0	111.7	D177 L197 K587 Y588 R594 K595	D177-S591 WeakPolarHBondContact CB-OG 3.32Å; D177-S591 PolarHBondContact N-OG 3.02Å; L197-S591 WeakPolarHBondContact CD1-O 3.33Å; K587-S591 WeakPolarHBondContact O-CB 3.02Å; K587-S591 PolarHBondContact O-N 3.04Å; K587-S591 VanDerWaalsContact O-N 3.16Å; K587-S591 PolarHBondContact O-OG 3.48Å; Y588-S591 PolarHBondContact O-N 3.33Å; S591-R594 PolarHBondContact O-N 2.87Å; S591-K595 WeakPolarHBondContact O-CB 3.23Å; S591-K595 PolarHBondContact O-N 2.91Å
592	L	97.3	Very high	94.9	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-62	-45	173.1	-80.6	177.8	0	0	0	112.4	V180 I556 M563 V564 Y588 A589 R594 K595 I596	V180-L592 HydrophobicContact CG1-CD2 3.99Å; V180-L592 HydrophobicContact CG1-CG 4.47Å; V180-L592 HydrophobicContact CG2-CD2 4.2Å; V180-L592 HydrophobicContact CG2-CG 4.09Å; I556-L592 HydrophobicContact CD1-CB 4.01Å; I556-L592 HydrophobicContact CG2-CB 4.29Å; M563-L592 WeakPolarHBondContact O-CD2 3.33Å; V564-L592 HydrophobicContact CG2-CD1 4.01Å; Y588-L592 HydrophobicContact CD1-CD1 3.72Å; Y588-L592 HydrophobicContact CD1-CG 4.47Å; Y588-L592 HydrophobicContact CD2-CG 4.48Å; Y588-L592 HydrophobicContact CE1-CD1 3.24Å; Y588-L592 HydrophobicContact CE1-CG 4.14Å; Y588-L592 HydrophobicContact CE2-CD1 4.11Å; Y588-L592 HydrophobicContact CE2-CD2 4.46Å; Y588-L592 HydrophobicContact CE2-CG 4.14Å; Y588-L592 HydrophobicContact CG-CD1 4.32Å; Y588-L592 VanDerWaalsContact CZ-CD1 3.44Å; Y588-L592 WeakPolarHBondContact O-CB 3.49Å; Y588-L592 WeakPolarHBondContact O-CG 3.29Å; Y588-L592 PolarHBondContact O-N 3.14Å; A589-L592 PolarHBondContact O-N 3.36Å; L592-R594 VanDerWaalsContact C-N 3.26Å; L592-R594 PolarHBondContact O-N 3Å; L592-K595 PolarHBondContact O-N 2.82Å; L592-K595 VanDerWaalsContact O-N 3.1Å; L592-I596 PolarHBondContact O-N 2.95Å
593	A	96.8	Very high	94.7	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-56.7	-43.1	176.5	0	0	0	0	0	111.1	I556 A589 I590 I596 G597 A598 V600 L622	I556-A593 HydrophobicContact CD1-CB 4.09Å; A589-A593 WeakPolarHBondContact O-CB 3.09Å; A589-A593 PolarHBondContact O-N 2.99Å; I590-A593 PolarHBondContact O-N 2.84Å; A593-I596 WeakPolarHBondContact O-CG1 3.46Å; A593-G597 PolarHBondContact O-N 3.42Å; A593-A598 HydrophobicContact CB-CB 4.38Å; A593-A598 WeakPolarHBondContact O-CA 3.27Å; A593-A598 VanDerWaalsContact O-CB 3.24Å; A593-A598 WeakPolarHBondContact O-CB 3.33Å; A593-A598 PolarHBondContact O-N 3.26Å; A593-V600 HydrophobicContact CB-CG2 3.88Å; A593-L622 HydrophobicContact CB-CD2 3.9Å
594	R	96.5	Very high	94.7	Very high	7 Å²	7	17.8 Å²	17.8	3%	0.026	9%	0.087	C	C	.	.	H	α-helix	trans	-67	-39.4	175.4	-70	178.2	-175.5	153.5	5	112.6	T175 L197 N200 S201 A204 I590 S591 L592 G597 V600	T175-R594 PolarHBondContact O-NH1 2.8Å; L197-R594 HydrophobicContact CD1-CB 3.92Å; N200-R594 HydrophobicContact CB-CB 3.85Å; N200-R594 HydrophobicContact CB-CG 4.04Å; N200-R594 PolarHBondContact ND2-O 3.45Å; S201-R594 WeakPolarHBondContact OG-CD 3.44Å; A204-R594 VanDerWaalsContact CB-NH2 3.28Å; I590-R594 WeakPolarHBondContact O-CG 3.48Å; I590-R594 PolarHBondContact O-N 3.37Å; S591-R594 PolarHBondContact O-N 2.87Å; L592-R594 VanDerWaalsContact C-N 3.26Å; L592-R594 PolarHBondContact O-N 3Å; R594-G597 PolarHBondContact O-N 3.11Å; R594-G597 VanDerWaalsContact O-N 3.16Å; R594-V600 PolarHBondContact NE-O 2.87Å; R594-V600 PolarHBondContact NH2-O 2.66Å; R594-V600 VanDerWaalsContact NH2-O 3.13Å
595	K	95.8	Very high	94.6	Very high	12 Å²	12	18.6 Å²	18.6	5%	0.052	9%	0.091	C	C	.	.	H	α-helix	trans	-62.4	-43.6	178.4	-177	174.5	179.7	179.5	0	112.5	V180 N182 E193 V196 L197 S591 L592 G597	V180-K595 HydrophobicContact CG1-CB 3.92Å; V180-K595 HydrophobicContact CG1-CD 3.44Å; V180-K595 VanDerWaalsContact CG1-CD 3.44Å; V180-K595 HydrophobicContact CG1-CG 4.28Å; V180-K595 PolarHBondContact O-NZ 2.98Å; N182-K595 VanDerWaalsContact CG-NZ 3.28Å; N182-K595 WeakPolarHBondContact ND2-CE 3.34Å; N182-K595 PolarHBondContact ND2-NZ 3.19Å; N182-K595 VanDerWaalsContact ND2-NZ 3.16Å; N182-K595 PolarHBondContact OD1-NZ 3.16Å; E193-K595 HydrophobicContact CB-CD 4.45Å; E193-K595 HydrophobicContact CB-CG 4.05Å; E193-K595 WeakPolarHBondContact OE2-CE 3.46Å; E193-K595 IonicContact OE2-NZ 2.69Å; V196-K595 WeakPolarHBondContact CG1-O 3.37Å; L197-K595 HydrophobicContact CB-CB 4.16Å; L197-K595 HydrophobicContact CB-CG 4.42Å; L197-K595 HydrophobicContact CD1-CB 4.25Å; S591-K595 WeakPolarHBondContact O-CB 3.23Å; S591-K595 PolarHBondContact O-N 2.91Å; L592-K595 PolarHBondContact O-N 2.82Å; L592-K595 VanDerWaalsContact O-N 3.1Å; K595-G597 PolarHBondContact O-N 3.26Å
596	I	93.8	Very high	94.5	Very high	24 Å²	24	18.9 Å²	18.9	12%	0.123	9%	0.093	C	C	.	.	H	α-helix	trans	-69.1	-20.6	177.8	65.8	169.6	0	0	0	112	I556 I559 A560 M563 L592 A593 L622 H625	I556-I596 HydrophobicContact CG1-CD1 4.48Å; I556-I596 HydrophobicContact CG2-CD1 4.37Å; I556-I596 HydrophobicContact CG2-CG2 4.45Å; I559-I596 HydrophobicContact CD1-CD1 3.56Å; I559-I596 HydrophobicContact CG1-CD1 4.1Å; A560-I596 HydrophobicContact CB-CB 4.45Å; A560-I596 HydrophobicContact CB-CG2 3.8Å; M563-I596 HydrophobicContact CB-CG2 4.34Å; M563-I596 HydrophobicContact CG-CG2 3.95Å; L592-I596 PolarHBondContact O-N 2.95Å; A593-I596 WeakPolarHBondContact O-CG1 3.46Å; I596-L622 HydrophobicContact CD1-CD2 3.87Å; I596-H625 PolarHBondContact O-CE1 3.06Å; I596-H625 PolarHBondContact O-NE2 2.9Å
597	G	90.8	Very high	94.5	Very high	23 Å²	23	18.9 Å²	18.9	24%	0.237	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	117.9	6.8	175.9	0	0	0	0	0	114.9	N200 A593 R594 K595	N200-G597 WeakPolarHBondContact ND2-CA 3.39Å; A593-G597 PolarHBondContact O-N 3.42Å; R594-G597 PolarHBondContact O-N 3.11Å; R594-G597 VanDerWaalsContact O-N 3.16Å; K595-G597 PolarHBondContact O-N 3.26Å
598	A	90.4	Very high	94.5	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.008	9%	0.091	C	C	.	.			trans	-76.1	129.9	174.8	0	0	0	0	0	110.7	A593 V600 C621 L622 H625	A593-A598 HydrophobicContact CB-CB 4.38Å; A593-A598 WeakPolarHBondContact O-CA 3.27Å; A593-A598 VanDerWaalsContact O-CB 3.24Å; A593-A598 WeakPolarHBondContact O-CB 3.33Å; A593-A598 PolarHBondContact O-N 3.26Å; A598-V600 VanDerWaalsContact C-N 3.34Å; A598-V600 HydrophobicContact CB-CG2 4.06Å; A598-V600 PolarHBondContact O-N 2.99Å; A598-C621 HydrophobicContact CB-CB 4.33Å; A598-L622 HydrophobicContact CB-CD2 4.01Å; A598-H625 HydrophobicContact CB-CB 4.25Å
599	R	87.8	Confident	94.4	Very high	123 Å²	123	22 Å²	22	46%	0.464	11%	0.111	S	C	.	.			trans	-83.4	75.3	-178	-66.5	-177.4	178.7	-176.9	-1.8	111.2	C621	R599-C621 PolarHBondContact O-SG 3.06Å
600	V	91.4	Very high	94.3	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.024	12%	0.117	C	C	.	.			trans	-95.6	120.9	-175.3	-179.9	0	0	0	0	111.7	I590 A593 R594 A598 A602 V618 C621	I590-V600 HydrophobicContact CD1-CG1 3.72Å; A593-V600 HydrophobicContact CB-CG2 3.88Å; R594-V600 PolarHBondContact NE-O 2.87Å; R594-V600 PolarHBondContact NH2-O 2.66Å; R594-V600 VanDerWaalsContact NH2-O 3.13Å; A598-V600 VanDerWaalsContact C-N 3.34Å; A598-V600 HydrophobicContact CB-CG2 4.06Å; A598-V600 PolarHBondContact O-N 2.99Å; V600-A602 HydrophobicContact CG1-CB 3.95Å; V600-V618 HydrophobicContact CG1-CG2 3.8Å; V600-C621 HydrophobicContact CG2-CB 3.95Å
601	Y	90.8	Very high	94.2	Very high	18 Å²	18	27.2 Å²	27.2	7%	0.071	14%	0.135	C	C	.	.			trans	-96.4	-13.5	174.8	-67.1	-90.8	0	0	0	113.7	S203 W403 S406 M499	S203-Y601 WeakPolarHBondContact O-CE1 3.43Å; S203-Y601 PolarHBondContact OG-OH 3.01Å; W403-Y601 HydrophobicContact CB-CD1 4.02Å; W403-Y601 HydrophobicContact CB-CE1 4.09Å; W403-Y601 HydrophobicContact CB-CG 4.34Å; W403-Y601 AromaticContact CD1-CE2 3.81Å; W403-Y601 AromaticContact CD1-CZ 3.93Å; S406-Y601 PolarHBondContact OG-OH 3.3Å; M499-Y601 HydrophobicContact CE-CD2 4.23Å; M499-Y601 HydrophobicContact CE-CG 4.27Å
602	A	92.1	Very high	94	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.15	C	C	.	.			trans	-59.2	144.9	178	0	0	0	0	0	111.8	I590 V600 D606 M614 V618	I590-A602 HydrophobicContact CD1-CB 4.18Å; V600-A602 HydrophobicContact CG1-CB 3.95Å; A602-D606 HydrophobicContact CB-CB 4.46Å; A602-M614 VanDerWaalsContact CA-CE 3.5Å; A602-M614 HydrophobicContact CB-CB 4.26Å; A602-M614 HydrophobicContact CB-CE 3.89Å; A602-V618 HydrophobicContact CB-CG2 3.46Å; A602-V618 VanDerWaalsContact CB-CG2 3.46Å
603	L	93	Very high	93.6	Very high	39 Å²	39	33 Å²	33	20%	0.204	17%	0.165	C	C	.	.			trans	-89.7	156.8	173.8	-62.8	176.7	0	0	0	110.2	R395 D605 D606	R395-L603 HydrophobicContact CB-CD1 4.13Å; R395-L603 HydrophobicContact CG-CD1 4.22Å; L603-D605 PolarHBondContact O-N 3.12Å; L603-D606 PolarHBondContact N-OD2 3.24Å; L603-D606 WeakPolarHBondContact O-CB 3.34Å; L603-D606 PolarHBondContact O-N 2.83Å
604	P	94.9	Very high	93.3	Very high	15 Å²	15	33.4 Å²	33.4	10%	0.097	17%	0.167	C	C	.	.	H	α-helix	trans	-52	-41.6	175.4	-29.6	37.9	0	0	0	113.1	I583 A586 K587 D606 L607 V608	I583-P604 HydrophobicContact CD1-CB 3.62Å; I583-P604 HydrophobicContact CG1-CB 4.45Å; A586-P604 HydrophobicContact CB-CB 3.8Å; A586-P604 WeakPolarHBondContact CB-O 3.2Å; K587-P604 HydrophobicContact CB-CG 4.39Å; K587-P604 HydrophobicContact CG-CB 3.92Å; K587-P604 HydrophobicContact CG-CG 3.66Å; P604-D606 PolarHBondContact O-N 2.98Å; P604-L607 PolarHBondContact O-N 2.99Å; P604-L607 VanDerWaalsContact O-N 3.14Å; P604-V608 PolarHBondContact O-N 2.84Å
605	D	94.8	Very high	93.2	Very high	63 Å²	63	33 Å²	33	34%	0.337	17%	0.166	S	C	.	.	H	α-helix	trans	-61.8	-29.7	178.4	-54.7	-102.5	0	0	0	113.6	R395 L603 L607 V608 E609	R395-D605 IonicContact NH1-OD1 3.79Å; L603-D605 PolarHBondContact O-N 3.12Å; D605-L607 PolarHBondContact O-N 3.48Å; D605-V608 PolarHBondContact O-N 3.1Å; D605-E609 WeakPolarHBondContact O-CB 3.43Å; D605-E609 PolarHBondContact O-N 3.12Å
606	D	94.8	Very high	93.1	Very high	7 Å²	7	32.7 Å²	32.7	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-32.1	178.1	-66	-41.5	0	0	0	111.7	A602 L603 P604 V610 K611 M614	A602-D606 HydrophobicContact CB-CB 4.46Å; L603-D606 PolarHBondContact N-OD2 3.24Å; L603-D606 WeakPolarHBondContact O-CB 3.34Å; L603-D606 PolarHBondContact O-N 2.83Å; P604-D606 PolarHBondContact O-N 2.98Å; D606-V610 WeakPolarHBondContact O-CA 3.22Å; D606-V610 PolarHBondContact O-N 3.18Å; D606-V610 VanDerWaalsContact O-N 3.15Å; D606-K611 HydrophobicContact CB-CB 4.27Å; D606-K611 HydrophobicContact CB-CG 4.41Å; D606-K611 PolarHBondContact O-N 3.08Å; D606-M614 HydrophobicContact CB-CB 3.69Å; D606-M614 HydrophobicContact CB-CG 4.23Å
607	L	96.3	Very high	92.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-74.3	-47.5	173	-65.4	-178.5	0	0	0	110.9	I546 S547 V552 A586 A589 I590 P604 D605 E609 V610 V615 V618	I546-L607 HydrophobicContact CG2-CD2 4.17Å; S547-L607 WeakPolarHBondContact CA-O 3.49Å; V552-L607 HydrophobicContact CG2-CD1 4.42Å; V552-L607 HydrophobicContact CG2-CD2 4.26Å; A586-L607 HydrophobicContact CB-CB 4.23Å; A586-L607 HydrophobicContact CB-CD1 4.3Å; A589-L607 HydrophobicContact CB-CD1 4.49Å; I590-L607 HydrophobicContact CD1-CD1 3.88Å; I590-L607 HydrophobicContact CD1-CG 4.39Å; I590-L607 HydrophobicContact CG1-CD1 4.07Å; P604-L607 PolarHBondContact O-N 2.99Å; P604-L607 VanDerWaalsContact O-N 3.14Å; D605-L607 PolarHBondContact O-N 3.48Å; L607-E609 VanDerWaalsContact C-N 3.34Å; L607-E609 PolarHBondContact O-N 3.07Å; L607-V610 PolarHBondContact O-N 2.89Å; L607-V610 VanDerWaalsContact O-N 3.09Å; L607-V615 HydrophobicContact CD2-CG2 4.19Å; L607-V618 HydrophobicContact CD2-CG2 4.24Å
608	V	96.4	Very high	93	Very high	28 Å²	28	30.6 Å²	30.6	17%	0.17	15%	0.148	C	C	.	.	H	α-helix	trans	-60.9	-42.8	-178.3	178.9	0	0	0	0	111.6	S547 K582 I583 A586 P604 D605 V610	S547-V608 WeakPolarHBondContact CB-O 3.48Å; K582-V608 HydrophobicContact CB-CG1 4.14Å; K582-V608 HydrophobicContact CB-CG2 4.05Å; K582-V608 HydrophobicContact CD-CG1 4.39Å; I583-V608 HydrophobicContact CB-CG2 4.31Å; I583-V608 HydrophobicContact CD1-CG2 3.94Å; A586-V608 HydrophobicContact CB-CG2 3.94Å; P604-V608 PolarHBondContact O-N 2.84Å; D605-V608 PolarHBondContact O-N 3.1Å; V608-V610 VanDerWaalsContact C-N 3.32Å
609	E	96.2	Very high	93.2	Very high	91 Å²	91	30.6 Å²	30.6	43%	0.425	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-3.7	177.4	-66.4	178.9	-146.2	0	0	113.7	R395 D605 L607 K611	R395-E609 IonicContact CZ-OE1 3.46Å; R395-E609 VanDerWaalsContact CZ-OE1 3.25Å; R395-E609 IonicContact CZ-OE2 2.99Å; R395-E609 IonicContact NH1-OE1 2.72Å; R395-E609 PolarHBondContact NH1-OE1 2.89Å; R395-E609 IonicContact NH2-OE1 3.56Å; R395-E609 PolarHBondContact NH2-OE1 2.97Å; R395-E609 IonicContact NH2-OE2 2.84Å; R395-E609 PolarHBondContact NH2-OE2 3.27Å; D605-E609 WeakPolarHBondContact O-CB 3.43Å; D605-E609 PolarHBondContact O-N 3.12Å; L607-E609 VanDerWaalsContact C-N 3.34Å; L607-E609 PolarHBondContact O-N 3.07Å; E609-K611 HydrophobicContact CB-CG 4.38Å; E609-K611 WeakPolarHBondContact OE2-CE 3.34Å; E609-K611 IonicContact OE2-NZ 3.58Å; E609-K611 PolarHBondContact OE2-NZ 3.42Å
610	V	96.4	Very high	93.3	Very high	23 Å²	23	24.7 Å²	24.7	14%	0.139	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	53.8	179.3	-163.3	0	0	0	0	111.7	I546 D606 L607 V608 P612 V615	I546-V610 HydrophobicContact CB-CG1 4.27Å; I546-V610 HydrophobicContact CB-CG2 4.48Å; D606-V610 WeakPolarHBondContact O-CA 3.22Å; D606-V610 PolarHBondContact O-N 3.18Å; D606-V610 VanDerWaalsContact O-N 3.15Å; L607-V610 PolarHBondContact O-N 2.89Å; L607-V610 VanDerWaalsContact O-N 3.09Å; V608-V610 VanDerWaalsContact C-N 3.32Å; V610-P612 WeakPolarHBondContact O-CD 3.47Å; V610-V615 HydrophobicContact CG1-CG2 4.49Å
611	K	94.9	Very high	93.3	Very high	88 Å²	88	25.6 Å²	25.6	38%	0.383	13%	0.131	S	C	.	.			trans	-71.8	107.2	176.1	-64.9	-61.7	-177.9	-168.1	0	109.6	D606 E609 K613 M614 V615	D606-K611 HydrophobicContact CB-CB 4.27Å; D606-K611 HydrophobicContact CB-CG 4.41Å; D606-K611 PolarHBondContact O-N 3.08Å; E609-K611 HydrophobicContact CB-CG 4.38Å; E609-K611 WeakPolarHBondContact OE2-CE 3.34Å; E609-K611 IonicContact OE2-NZ 3.58Å; E609-K611 PolarHBondContact OE2-NZ 3.42Å; K611-K613 VanDerWaalsContact C-N 3.31Å; K611-K613 PolarHBondContact O-N 2.88Å; K611-K613 VanDerWaalsContact O-N 3.14Å; K611-M614 HydrophobicContact CB-CB 4.27Å; K611-M614 HydrophobicContact CB-CG 4.43Å; K611-M614 PolarHBondContact O-N 3.36Å; K611-V615 WeakPolarHBondContact O-CB 3.12Å; K611-V615 VanDerWaalsContact O-CG2 3.3Å; K611-V615 WeakPolarHBondContact O-CG2 3.5Å; K611-V615 PolarHBondContact O-N 3.21Å
612	P	92	Very high	93.4	Very high	52 Å²	52	24.7 Å²	24.7	34%	0.338	13%	0.128	S	C	.	.	H	α-helix	trans	-63.6	-35.1	-162	-26.7	38.4	0	0	0	114.1	F541 K542 V610 M616	F541-P612 HydrophobicContact CB-CB 4.47Å; K542-P612 HydrophobicContact CD-CG 4.39Å; K542-P612 HydrophobicContact CG-CB 4.07Å; K542-P612 HydrophobicContact CG-CG 3.59Å; V610-P612 WeakPolarHBondContact O-CD 3.47Å; P612-M616 WeakPolarHBondContact O-CB 3.47Å; P612-M616 PolarHBondContact O-N 2.84Å
613	K	89.9	Confident	93.3	Very high	75 Å²	75	24.7 Å²	24.7	33%	0.326	13%	0.128	S	C	.	.	H	α-helix	trans	-58.9	-52.5	175	-72.5	-174.1	-177	177	0	111.3	E396 W496 K611 M616 T617	E396-K613 WeakPolarHBondContact OE1-CD 3.34Å; E396-K613 IonicContact OE1-NZ 3.55Å; E396-K613 PolarHBondContact OE1-NZ 3.5Å; W496-K613 HydrophobicContact CD2-CB 4.49Å; W496-K613 HydrophobicContact CD2-CD 3.67Å; W496-K613 HydrophobicContact CD2-CG 4.11Å; W496-K613 HydrophobicContact CE3-CB 4.14Å; W496-K613 HydrophobicContact CE3-CD 3.87Å; W496-K613 HydrophobicContact CE3-CG 4.25Å; W496-K613 HydrophobicContact CG-CD 4.14Å; W496-K613 HydrophobicContact CH2-CB 3.43Å; W496-K613 VanDerWaalsContact CH2-CB 3.43Å; W496-K613 HydrophobicContact CH2-CD 4.33Å; W496-K613 HydrophobicContact CH2-CG 3.8Å; W496-K613 WeakPolarHBondContact CH2-O 3.46Å; W496-K613 HydrophobicContact CZ2-CB 3.82Å; W496-K613 HydrophobicContact CZ2-CD 4.15Å; W496-K613 HydrophobicContact CZ2-CG 3.62Å; W496-K613 HydrophobicContact CZ3-CB 3.61Å; W496-K613 HydrophobicContact CZ3-CD 4.2Å; W496-K613 HydrophobicContact CZ3-CG 4.11Å; K611-K613 VanDerWaalsContact C-N 3.31Å; K611-K613 PolarHBondContact O-N 2.88Å; K611-K613 VanDerWaalsContact O-N 3.14Å; K613-M616 PolarHBondContact O-N 2.88Å; K613-T617 WeakPolarHBondContact O-CG2 3.04Å; K613-T617 PolarHBondContact O-N 3.46Å
614	M	91.5	Very high	92.8	Very high	8 Å²	8	22.9 Å²	22.9	4%	0.039	12%	0.119	C	C	.	.	H	α-helix	trans	-72.7	-37.1	-177	-62.4	-50.1	-67.7	0	0	112.1	T399 A602 D606 K611 M616 T617 V618	T399-M614 HydrophobicContact CG2-CE 3.3Å; T399-M614 HydrophobicContact CG2-SD 4.21Å; A602-M614 VanDerWaalsContact CA-CE 3.5Å; A602-M614 HydrophobicContact CB-CB 4.26Å; A602-M614 HydrophobicContact CB-CE 3.89Å; D606-M614 HydrophobicContact CB-CB 3.69Å; D606-M614 HydrophobicContact CB-CG 4.23Å; K611-M614 HydrophobicContact CB-CB 4.27Å; K611-M614 HydrophobicContact CB-CG 4.43Å; K611-M614 PolarHBondContact O-N 3.36Å; M614-M616 VanDerWaalsContact C-N 3.34Å; M614-M616 PolarHBondContact O-N 3.19Å; M614-T617 PolarHBondContact O-N 3.28Å; M614-T617 PolarHBondContact O-OG1 3.39Å; M614-V618 WeakPolarHBondContact O-CG2 3.34Å; M614-V618 PolarHBondContact O-N 2.88Å; M614-V618 VanDerWaalsContact O-N 3.11Å
615	V	94.4	Very high	92.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.7	-45.4	173	168.7	0	0	0	0	111	F541 I546 L607 V610 K611 T617 V618 F619	F541-V615 HydrophobicContact CB-CG1 4.06Å; F541-V615 HydrophobicContact CD1-CG1 4.15Å; I546-V615 HydrophobicContact CD1-CG1 3.67Å; I546-V615 HydrophobicContact CG2-CG1 3.94Å; I546-V615 HydrophobicContact CG2-CG2 3.95Å; L607-V615 HydrophobicContact CD2-CG2 4.19Å; V610-V615 HydrophobicContact CG1-CG2 4.49Å; K611-V615 WeakPolarHBondContact O-CB 3.12Å; K611-V615 VanDerWaalsContact O-CG2 3.3Å; K611-V615 WeakPolarHBondContact O-CG2 3.5Å; K611-V615 PolarHBondContact O-N 3.21Å; V615-T617 VanDerWaalsContact C-N 3.33Å; V615-T617 PolarHBondContact O-N 3.44Å; V615-V618 WeakPolarHBondContact O-CB 3.5Å; V615-V618 PolarHBondContact O-N 2.91Å; V615-F619 HydrophobicContact CG1-CD2 3.93Å; V615-F619 HydrophobicContact CG1-CE2 3.68Å; V615-F619 VanDerWaalsContact O-CD2 3.24Å; V615-F619 WeakPolarHBondContact O-CD2 3.46Å; V615-F619 PolarHBondContact O-N 3.34Å
616	M	91.7	Very high	92	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.02	12%	0.116	C	C	.	.	H	α-helix	trans	-60	-42.9	177.1	179.2	-81.6	-73	0	0	111.6	W496 R500 I521 F541 P612 K613 M614 V618 F619 A620	W496-M616 HydrophobicContact CH2-CE 3.55Å; W496-M616 HydrophobicContact CZ2-CE 3.77Å; R500-M616 HydrophobicContact CG-CE 3.86Å; I521-M616 HydrophobicContact CD1-CG 4.46Å; I521-M616 HydrophobicContact CD1-SD 4.21Å; F541-M616 HydrophobicContact CD1-CB 4.18Å; F541-M616 HydrophobicContact CD2-CB 3.79Å; F541-M616 HydrophobicContact CD2-CG 3.94Å; F541-M616 HydrophobicContact CE1-CB 4.29Å; F541-M616 HydrophobicContact CE1-CG 4.33Å; F541-M616 HydrophobicContact CE2-CB 3.91Å; F541-M616 HydrophobicContact CE2-CG 3.54Å; F541-M616 HydrophobicContact CG-CB 3.93Å; F541-M616 HydrophobicContact CG-CG 4.48Å; F541-M616 HydrophobicContact CZ-CB 4.15Å; F541-M616 HydrophobicContact CZ-CG 3.76Å; P612-M616 WeakPolarHBondContact O-CB 3.47Å; P612-M616 PolarHBondContact O-N 2.84Å; K613-M616 PolarHBondContact O-N 2.88Å; M614-M616 VanDerWaalsContact C-N 3.34Å; M614-M616 PolarHBondContact O-N 3.19Å; M616-V618 VanDerWaalsContact C-N 3.32Å; M616-V618 PolarHBondContact O-N 3.28Å; M616-F619 PolarHBondContact O-N 3.21Å; M616-A620 WeakPolarHBondContact O-CB 3.44Å; M616-A620 PolarHBondContact O-N 3.14Å; M616-A620 HydrophobicContact SD-CB 4.21Å
617	T	90.5	Very high	91.3	Very high	4 Å²	4	24.8 Å²	24.8	3%	0.025	13%	0.126	C	C	.	.	H	α-helix	trans	-65.9	-33.5	179.6	61.8	0	0	0	0	112.5	W496 T503 K613 M614 V615 A620 C621	W496-T617 HydrophobicContact CH2-CG2 4.09Å; W496-T617 HydrophobicContact CZ3-CG2 4Å; T503-T617 HydrophobicContact CG2-CG2 4.48Å; K613-T617 WeakPolarHBondContact O-CG2 3.04Å; K613-T617 PolarHBondContact O-N 3.46Å; M614-T617 PolarHBondContact O-N 3.28Å; M614-T617 PolarHBondContact O-OG1 3.39Å; V615-T617 VanDerWaalsContact C-N 3.33Å; V615-T617 PolarHBondContact O-N 3.44Å; T617-A620 PolarHBondContact O-N 3.38Å; T617-C621 VanDerWaalsContact O-CB 3.3Å; T617-C621 WeakPolarHBondContact O-CB 3.34Å; T617-C621 PolarHBondContact O-N 3.17Å; T617-C621 PolarHBondContact O-SG 2.73Å
618	V	93.9	Very high	90.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-58.8	-53.8	172.6	174.1	0	0	0	0	110.7	V552 I590 V600 A602 L607 M614 V615 M616 A620 C621 L622	V552-V618 HydrophobicContact CG1-CG1 4Å; I590-V618 HydrophobicContact CD1-CG2 4.19Å; V600-V618 HydrophobicContact CG1-CG2 3.8Å; A602-V618 HydrophobicContact CB-CG2 3.46Å; A602-V618 VanDerWaalsContact CB-CG2 3.46Å; L607-V618 HydrophobicContact CD2-CG2 4.24Å; M614-V618 WeakPolarHBondContact O-CG2 3.34Å; M614-V618 PolarHBondContact O-N 2.88Å; M614-V618 VanDerWaalsContact O-N 3.11Å; V615-V618 WeakPolarHBondContact O-CB 3.5Å; V615-V618 PolarHBondContact O-N 2.91Å; M616-V618 VanDerWaalsContact C-N 3.32Å; M616-V618 PolarHBondContact O-N 3.28Å; V618-A620 PolarHBondContact O-N 2.95Å; V618-C621 PolarHBondContact O-N 3.17Å; V618-L622 HydrophobicContact CG1-CD1 4.17Å; V618-L622 WeakPolarHBondContact O-CG 3.47Å; V618-L622 PolarHBondContact O-N 3.5Å
619	F	94.3	Very high	88.7	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-40.4	-179.8	-72.7	-67.3	0	0	0	112.5	I521 V525 I538 F541 I546 V552 L555 V615 M616 C621 L622 M623	I521-F619 HydrophobicContact CG2-CB 3.81Å; V525-F619 HydrophobicContact CG1-CD1 4.19Å; V525-F619 HydrophobicContact CG1-CE1 4.02Å; V525-F619 HydrophobicContact CG2-CB 4.05Å; V525-F619 HydrophobicContact CG2-CD1 3.51Å; V525-F619 HydrophobicContact CG2-CE1 4.2Å; V525-F619 HydrophobicContact CG2-CG 3.96Å; I538-F619 HydrophobicContact CD1-CD2 4.3Å; I538-F619 HydrophobicContact CD1-CE1 4.26Å; I538-F619 HydrophobicContact CD1-CE2 3.78Å; I538-F619 HydrophobicContact CD1-CZ 3.76Å; F541-F619 AromaticContact CD1-CD2 3.94Å; F541-F619 HydrophobicContact CD1-CD2 3.94Å; F541-F619 HydrophobicContact CD1-CE2 4.49Å; F541-F619 HydrophobicContact CE1-CB 4.25Å; F541-F619 AromaticContact CE1-CD2 3.92Å; F541-F619 HydrophobicContact CE1-CD2 3.92Å; F541-F619 HydrophobicContact CE1-CG 4.38Å; I546-F619 HydrophobicContact CD1-CE2 4.2Å; V552-F619 HydrophobicContact CG2-CE1 4.19Å; V552-F619 HydrophobicContact CG2-CZ 3.84Å; L555-F619 HydrophobicContact CD2-CD1 3.5Å; L555-F619 HydrophobicContact CD2-CE1 3.79Å; V615-F619 HydrophobicContact CG1-CD2 3.93Å; V615-F619 HydrophobicContact CG1-CE2 3.68Å; V615-F619 VanDerWaalsContact O-CD2 3.24Å; V615-F619 WeakPolarHBondContact O-CD2 3.46Å; V615-F619 PolarHBondContact O-N 3.34Å; M616-F619 PolarHBondContact O-N 3.21Å; F619-C621 VanDerWaalsContact C-N 3.34Å; F619-C621 PolarHBondContact O-N 3.25Å; F619-L622 PolarHBondContact O-N 2.78Å; F619-M623 WeakPolarHBondContact O-CB 3.4Å; F619-M623 PolarHBondContact O-N 3.41Å
620	A	90.2	Very high	86.8	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-39.6	176.1	0	0	0	0	0	112.2	T503 L507 I521 M616 T617 V618 M623 G624	T503-A620 HydrophobicContact CG2-CB 3.61Å; L507-A620 HydrophobicContact CD1-CB 4.44Å; I521-A620 HydrophobicContact CD1-CB 3.82Å; M616-A620 WeakPolarHBondContact O-CB 3.44Å; M616-A620 PolarHBondContact O-N 3.14Å; M616-A620 HydrophobicContact SD-CB 4.21Å; T617-A620 PolarHBondContact O-N 3.38Å; V618-A620 PolarHBondContact O-N 2.95Å; A620-M623 PolarHBondContact O-N 3.08Å; A620-G624 PolarHBondContact O-N 3.2Å
621	C	89.8	Confident	84.3	Confident	22 Å²	22	37.7 Å²	37.7	15%	0.149	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-38.9	175.8	-76.4	0	0	0	0	112.5	A598 R599 V600 T617 V618 F619 H625	A598-C621 HydrophobicContact CB-CB 4.33Å; R599-C621 PolarHBondContact O-SG 3.06Å; V600-C621 HydrophobicContact CG2-CB 3.95Å; T617-C621 VanDerWaalsContact O-CB 3.3Å; T617-C621 WeakPolarHBondContact O-CB 3.34Å; T617-C621 PolarHBondContact O-N 3.17Å; T617-C621 PolarHBondContact O-SG 2.73Å; V618-C621 PolarHBondContact O-N 3.17Å; F619-C621 VanDerWaalsContact C-N 3.34Å; F619-C621 PolarHBondContact O-N 3.25Å; C621-H625 WeakPolarHBondContact O-CB 3.12Å; C621-H625 PolarHBondContact O-N 3.08Å
622	L	92.5	Very high	81.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.2	-44.6	174.7	-69.2	172.4	0	0	0	111.4	V552 L555 I556 I559 A593 I596 A598 V618 F619 H625 D626	V552-L622 HydrophobicContact CG1-CD1 4.07Å; L555-L622 HydrophobicContact CD2-CB 4.34Å; L555-L622 HydrophobicContact CD2-CD1 3.88Å; L555-L622 HydrophobicContact CG-CD1 4.48Å; I556-L622 HydrophobicContact CD1-CD2 4.44Å; I556-L622 HydrophobicContact CG1-CD1 4.21Å; I556-L622 HydrophobicContact CG1-CD2 3.8Å; I559-L622 HydrophobicContact CD1-CB 4.2Å; I559-L622 HydrophobicContact CD1-CD2 3.95Å; A593-L622 HydrophobicContact CB-CD2 3.9Å; I596-L622 HydrophobicContact CD1-CD2 3.87Å; A598-L622 HydrophobicContact CB-CD2 4.01Å; V618-L622 HydrophobicContact CG1-CD1 4.17Å; V618-L622 WeakPolarHBondContact O-CG 3.47Å; V618-L622 PolarHBondContact O-N 3.5Å; F619-L622 PolarHBondContact O-N 2.78Å; L622-H625 WeakPolarHBondContact O-CB 3.38Å; L622-H625 PolarHBondContact O-N 2.58Å; L622-D626 PolarHBondContact O-N 3.09Å
623	M	89.9	Confident	80.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-48.4	174	-174	175	-172.7	0	0	112.1	L507 F520 I521 W524 F619 A620 H625 D626 M627	L507-M623 HydrophobicContact CD1-SD 4.14Å; L507-M623 HydrophobicContact CD2-CB 4.23Å; L507-M623 HydrophobicContact CD2-CG 3.9Å; L507-M623 HydrophobicContact CD2-SD 4.26Å; F520-M623 HydrophobicContact CD1-CE 3.51Å; F520-M623 HydrophobicContact CD1-SD 4.44Å; F520-M623 HydrophobicContact CE1-CE 3.08Å; F520-M623 HydrophobicContact CE1-SD 4.4Å; F520-M623 HydrophobicContact CG-CE 4.47Å; F520-M623 HydrophobicContact CZ-CE 3.72Å; I521-M623 HydrophobicContact CB-SD 4.27Å; I521-M623 HydrophobicContact CG1-SD 3.8Å; I521-M623 HydrophobicContact CG2-SD 4.47Å; W524-M623 HydrophobicContact CB-CE 3.54Å; W524-M623 HydrophobicContact CB-SD 4.04Å; W524-M623 HydrophobicContact CD2-CB 4Å; W524-M623 HydrophobicContact CD2-CE 4.03Å; W524-M623 HydrophobicContact CD2-CG 3.55Å; W524-M623 HydrophobicContact CD2-SD 3.88Å; W524-M623 HydrophobicContact CE3-CB 3.57Å; W524-M623 HydrophobicContact CE3-CG 3.62Å; W524-M623 HydrophobicContact CE3-SD 3.86Å; W524-M623 HydrophobicContact CG-CE 3.51Å; W524-M623 HydrophobicContact CG-CG 4.05Å; W524-M623 HydrophobicContact CG-SD 3.94Å; W524-M623 HydrophobicContact CH2-CB 3.8Å; W524-M623 HydrophobicContact CH2-CG 4.28Å; W524-M623 HydrophobicContact CZ2-CB 4.18Å; W524-M623 HydrophobicContact CZ2-CG 4.2Å; W524-M623 HydrophobicContact CZ3-CB 3.45Å; W524-M623 VanDerWaalsContact CZ3-CB 3.45Å; W524-M623 HydrophobicContact CZ3-CG 3.99Å; F619-M623 WeakPolarHBondContact O-CB 3.4Å; F619-M623 PolarHBondContact O-N 3.41Å; A620-M623 PolarHBondContact O-N 3.08Å; M623-H625 PolarHBondContact O-N 2.72Å; M623-D626 PolarHBondContact O-N 3.29Å; M623-M627 HydrophobicContact CE-CE 3.21Å; M623-M627 HydrophobicContact CE-SD 3.93Å; M623-M627 HydrophobicContact CG-CE 4.16Å; M623-M627 HydrophobicContact CG-CG 4.44Å; M623-M627 HydrophobicContact CG-SD 3.94Å; M623-M627 WeakPolarHBondContact O-CB 3.35Å; M623-M627 VanDerWaalsContact O-CG 3.32Å; M623-M627 WeakPolarHBondContact O-CG 3.23Å; M623-M627 PolarHBondContact O-N 2.9Å
624	G	84.1	Confident	80.4	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-63.5	-29.3	178.7	0	0	0	0	0	112.9	A620 K628	A620-G624 PolarHBondContact O-N 3.2Å; G624-K628 WeakPolarHBondContact O-CB 3.32Å; G624-K628 VanDerWaalsContact O-CG 3.28Å; G624-K628 WeakPolarHBondContact O-CG 3.44Å; G624-K628 PolarHBondContact O-N 2.66Å
625	H	85.4	Confident	79.8	Confident	41 Å²	41	42.1 Å²	42.1	19%	0.19	20%	0.204	C	C	.	.	H	α-helix	trans	-70.2	-51	172	176.6	70.2	0	0	0	111.8	I596 A598 C621 L622 M623 M627 K628 R629	I596-H625 PolarHBondContact O-CE1 3.06Å; I596-H625 PolarHBondContact O-NE2 2.9Å; A598-H625 HydrophobicContact CB-CB 4.25Å; C621-H625 WeakPolarHBondContact O-CB 3.12Å; C621-H625 PolarHBondContact O-N 3.08Å; L622-H625 WeakPolarHBondContact O-CB 3.38Å; L622-H625 PolarHBondContact O-N 2.58Å; M623-H625 PolarHBondContact O-N 2.72Å; H625-M627 PolarHBondContact O-N 3.18Å; H625-K628 PolarHBondContact O-N 3.36Å; H625-R629 PolarHBondContact O-N 3.42Å; H625-R629 VanDerWaalsContact O-N 3.11Å
626	D	86.6	Confident	79	Confident	35 Å²	35	44.6 Å²	44.6	19%	0.187	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-44.3	-179.3	-173	53.1	0	0	0	112.1	W524 I559 L622 M623 K628 R629 G630	W524-D626 HydrophobicContact CZ2-CB 3.96Å; I559-D626 HydrophobicContact CB-CB 4.26Å; I559-D626 HydrophobicContact CG2-CB 3.92Å; L622-D626 PolarHBondContact O-N 3.09Å; M623-D626 PolarHBondContact O-N 3.29Å; D626-K628 VanDerWaalsContact C-N 3.34Å; D626-K628 PolarHBondContact O-N 3.04Å; D626-R629 WeakPolarHBondContact O-CA 3.49Å; D626-R629 WeakPolarHBondContact O-CB 3.4Å; D626-R629 PolarHBondContact O-N 3.07Å; D626-R629 IonicContact OD1-NH2 2.94Å; D626-R629 PolarHBondContact OD1-NH2 2.88Å; D626-G630 PolarHBondContact O-N 2.84Å
627	M	80.3	Confident	78.2	Confident	49 Å²	49	47.1 Å²	47.1	24%	0.241	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-35.6	177.4	-70.7	-177.5	156.5	0	0	113.5	L507 L510 F520 M623 H625 R629 G630 K631	L507-M627 HydrophobicContact CD2-SD 4.01Å; L510-M627 HydrophobicContact CD1-CE 3.67Å; L510-M627 HydrophobicContact CD1-SD 3.55Å; L510-M627 VanDerWaalsContact CD1-SD 3.55Å; F520-M627 HydrophobicContact CE1-CE 4.17Å; F520-M627 HydrophobicContact CZ-CE 4.11Å; M623-M627 HydrophobicContact CE-CE 3.21Å; M623-M627 HydrophobicContact CE-SD 3.93Å; M623-M627 HydrophobicContact CG-CE 4.16Å; M623-M627 HydrophobicContact CG-CG 4.44Å; M623-M627 HydrophobicContact CG-SD 3.94Å; M623-M627 WeakPolarHBondContact O-CB 3.35Å; M623-M627 VanDerWaalsContact O-CG 3.32Å; M623-M627 WeakPolarHBondContact O-CG 3.23Å; M623-M627 PolarHBondContact O-N 2.9Å; H625-M627 PolarHBondContact O-N 3.18Å; M627-R629 VanDerWaalsContact C-N 3.26Å; M627-G630 PolarHBondContact O-N 3.13Å; M627-K631 WeakPolarHBondContact O-CG 3.33Å; M627-K631 PolarHBondContact O-N 3.49Å
628	K	72.1	Confident	77.4	Confident	104 Å²	104	50 Å²	50	45%	0.452	24%	0.242	S	C	.	.	H	α-helix	trans	-68.6	-29	173.7	-83.2	176.8	174.6	171.6	0	112.2	V506 G624 H625 D626 R632	V506-K628 HydrophobicContact CG1-CD 4.33Å; G624-K628 WeakPolarHBondContact O-CB 3.32Å; G624-K628 VanDerWaalsContact O-CG 3.28Å; G624-K628 WeakPolarHBondContact O-CG 3.44Å; G624-K628 PolarHBondContact O-N 2.66Å; H625-K628 PolarHBondContact O-N 3.36Å; D626-K628 VanDerWaalsContact C-N 3.34Å; D626-K628 PolarHBondContact O-N 3.04Å; K628-R632 WeakPolarHBondContact O-CD 3.42Å; K628-R632 VanDerWaalsContact O-CG 3.23Å; K628-R632 WeakPolarHBondContact O-CG 3.42Å; K628-R632 PolarHBondContact O-N 3.32Å
629	R	66.5	Low	76.2	Confident	118 Å²	118	53.6 Å²	53.6	45%	0.445	26%	0.259	S	S	.	.	H	α-helix	trans	-74.4	-39.5	174.6	-164	-177.7	66.5	-170.1	-7.7	111.4	I559 H625 D626 M627 K631 R632	I559-R629 PolarHBondContact O-NH1 2.86Å; I559-R629 PolarHBondContact O-NH2 3.33Å; H625-R629 PolarHBondContact O-N 3.42Å; H625-R629 VanDerWaalsContact O-N 3.11Å; D626-R629 WeakPolarHBondContact O-CA 3.49Å; D626-R629 WeakPolarHBondContact O-CB 3.4Å; D626-R629 PolarHBondContact O-N 3.07Å; D626-R629 IonicContact OD1-NH2 2.94Å; D626-R629 PolarHBondContact OD1-NH2 2.88Å; M627-R629 VanDerWaalsContact C-N 3.26Å; R629-K631 VanDerWaalsContact C-N 3.3Å; R629-K631 PolarHBondContact O-N 3.25Å; R629-R632 PolarHBondContact O-N 2.8Å
630	G	56.1	Low	74.8	Confident	68 Å²	68	57.7 Å²	57.7	70%	0.701	28%	0.279	S	S	*	.	H	α-helix	trans	-73.6	-14.3	177.2	0	0	0	0	0	115.6	D626 M627	D626-G630 PolarHBondContact O-N 2.84Å; M627-G630 PolarHBondContact O-N 3.13Å
631	K	44.5	Very low	73.5	Confident	123 Å²	123	62.5 Å²	62.5	54%	0.535	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-11.4	172.3	-74.7	-173.2	178.7	-171.9	0	113.6	D509 M627 R629	D509-K631 IonicContact OD2-NZ 3.06Å; D509-K631 PolarHBondContact OD2-NZ 3.26Å; M627-K631 WeakPolarHBondContact O-CG 3.33Å; M627-K631 PolarHBondContact O-N 3.49Å; R629-K631 VanDerWaalsContact C-N 3.3Å; R629-K631 PolarHBondContact O-N 3.25Å
632	R	34.2	Very low	72	Confident	189 Å²	189	66.2 Å²	66.2	71%	0.713	32%	0.316	S	S	*	.			trans	-95.1	0	173.1	-77.2	173.7	177.8	-171.2	-4	108	K628 R629	K628-R632 WeakPolarHBondContact O-CD 3.42Å; K628-R632 VanDerWaalsContact O-CG 3.23Å; K628-R632 WeakPolarHBondContact O-CG 3.42Å; K628-R632 PolarHBondContact O-N 3.32Å; R629-R632 PolarHBondContact O-N 2.8Å

Retrieved 632 of 632 residues in 274.3 ms (Link to these results)

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