A0A087YP19_POEFO Loading...

Potassium voltage-gated channel, Shaw-related subfamily, member 1b

AlphaFold DB , UniProt , Accession A0A087YP19, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 585 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	40.3	Very low	64.9	Low	249 Å²	249	97.7 Å²	97.7	100%	1.227	52%	0.52	S	S	*	.				0	50.3	0	-166.3	167.1	178.5	0	0	109.6
2	G	44.2	Very low	67.4	Low	48 Å²	48	89.6 Å²	89.6	50%	0.495	48%	0.476	S	S	.	.			trans	-157.5	35.2	-166.1	0	0	0	0	0	113.9
3	L	45.2	Very low	69.6	Low	159 Å²	159	83.6 Å²	83.6	83%	0.832	45%	0.445	S	S	*	.	S	Bend	trans	-114.4	-1.3	172	-80.8	166	0	0	0	112.2
4	S	49.4	Very low	71.5	Confident	89 Å²	89	77.6 Å²	77.6	62%	0.622	41%	0.413	S	S	*	.	S	Bend	trans	-93.8	-30.1	174	48.2	0	0	0	0	112.3	K7	S4-K7 PolarHBondContact O-N 3.36Å
5	D	53.9	Low	72.9	Confident	79 Å²	79	75 Å²	75	42%	0.422	41%	0.411	S	S	.	.	S	Bend	trans	-72.6	-40.5	-170.2	-145.7	70.4	0	0	0	112.4	K7 D8 Y22	D5-K7 PolarHBondContact O-N 3.46Å; D5-D8 PolarHBondContact O-N 3.05Å; D5-D8 VanDerWaalsContact O-N 3.14Å; D5-Y22 VanDerWaalsContact OD2-CE1 3.26Å; D5-Y22 WeakPolarHBondContact OD2-CE1 3.29Å; D5-Y22 PolarHBondContact OD2-OH 3.03Å
6	D	58.3	Low	74.1	Confident	99 Å²	99	73.4 Å²	73.4	53%	0.529	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-61.8	-23.4	175.5	-67.7	-43.8	0	0	0	113	R9	D6-R9 WeakPolarHBondContact O-CB 3.47Å; D6-R9 PolarHBondContact O-N 3.31Å
7	K	64.1	Low	75.3	Confident	179 Å²	179	74.4 Å²	74.4	78%	0.778	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-81.3	-15.9	178.1	-68.5	-164.3	173.7	-165.1	0	114.4	S4 D5 R9	S4-K7 PolarHBondContact O-N 3.36Å; D5-K7 PolarHBondContact O-N 3.46Å; K7-R9 VanDerWaalsContact C-N 3.34Å
8	D	82.9	Confident	76.4	Confident	48 Å²	48	78.6 Å²	78.6	26%	0.257	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-89.7	-4.4	169.4	-161.3	64.1	0	0	0	111.6	D5 Y22 R23 S24	D5-D8 PolarHBondContact O-N 3.05Å; D5-D8 VanDerWaalsContact O-N 3.14Å; D8-Y22 HydrophobicContact CB-CD1 4.15Å; D8-Y22 CarbonylContact O-C 3.58Å; D8-Y22 WeakPolarHBondContact O-CA 3.48Å; D8-R23 WeakPolarHBondContact O-CG 3.4Å; D8-R23 PolarHBondContact O-N 2.72Å; D8-S24 PolarHBondContact OD2-N 3.32Å; D8-S24 PolarHBondContact OD2-OG 2.98Å
9	R	89.5	Confident	77.3	Confident	87 Å²	87	76 Å²	76	33%	0.328	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	150.9	175	-64.8	-176.8	175.4	-152.5	3.4	111.6	D6 K7 Q20 T21 Y22	D6-R9 WeakPolarHBondContact O-CB 3.47Å; D6-R9 PolarHBondContact O-N 3.31Å; K7-R9 VanDerWaalsContact C-N 3.34Å; R9-Q20 HydrophobicContact CB-CG 4.43Å; R9-T21 CarbonylContact C-O 3.58Å; R9-T21 VanDerWaalsContact CA-O 3.3Å; R9-T21 WeakPolarHBondContact CA-O 3.48Å; R9-Y22 HydrophobicContact CG-CD1 3.92Å; R9-Y22 HydrophobicContact CG-CE1 3.75Å; R9-Y22 HydrophobicContact CG-CG 4.49Å; R9-Y22 PolarHBondContact NE-OH 3.19Å; R9-Y22 PolarHBondContact NH2-OH 3.3Å
10	I	91.9	Very high	78.1	Confident	6 Å²	6	77.1 Å²	77.1	3%	0.031	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.3	177.7	-174.1	171.7	0	0	0	109.2	I12 Q20 T21 R23 L26 L37 F55	I10-I12 HydrophobicContact CG1-CG1 4.44Å; I10-Q20 WeakPolarHBondContact O-CA 3.26Å; I10-T21 HydrophobicContact CG2-CG2 3.62Å; I10-T21 PolarHBondContact N-O 3.07Å; I10-T21 PolarHBondContact O-N 3.46Å; I10-T21 VanDerWaalsContact O-N 3.11Å; I10-R23 HydrophobicContact CB-CG 4.31Å; I10-R23 HydrophobicContact CG2-CG 4.37Å; I10-L26 HydrophobicContact CD1-CD1 4.15Å; I10-L26 HydrophobicContact CG2-CD1 3.85Å; I10-L37 HydrophobicContact CD1-CB 3.85Å; I10-L37 WeakPolarHBondContact CD1-O 3.35Å; I10-F55 HydrophobicContact CD1-CD2 3.84Å; I10-F55 HydrophobicContact CD1-CE2 3.66Å; I10-F55 HydrophobicContact CG1-CD2 4Å; I10-F55 HydrophobicContact CG1-CE2 4.05Å
11	V	93.8	Very high	78.9	Confident	32 Å²	32	73.8 Å²	73.8	19%	0.194	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.1	176.6	-175.6	0	0	0	0	109	R18 H19 Q20 E54 F55	V11-R18 HydrophobicContact CG1-CG 4.49Å; V11-H19 WeakPolarHBondContact CA-O 3.4Å; V11-Q20 HydrophobicContact CG2-CG 4.42Å; V11-E54 HydrophobicContact CB-CB 3.89Å; V11-E54 HydrophobicContact CG1-CB 3.7Å; V11-E54 WeakPolarHBondContact O-CA 3.41Å; V11-F55 PolarHBondContact O-N 2.89Å
12	I	95.4	Very high	81.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.3	178.8	-49.5	176.5	0	0	0	107.1	I10 V14 H19 L26 L34 L37 F57 F64	I10-I12 HydrophobicContact CG1-CG1 4.44Å; I12-V14 HydrophobicContact CG2-CG2 3.77Å; I12-H19 PolarHBondContact N-O 3.49Å; I12-H19 PolarHBondContact O-N 3.04Å; I12-L26 HydrophobicContact CD1-CD1 4.13Å; I12-L34 HydrophobicContact CD1-CD2 4.05Å; I12-L37 HydrophobicContact CD1-CD1 3.81Å; I12-L37 HydrophobicContact CG1-CD1 4.29Å; I12-F57 HydrophobicContact CG2-CD2 3.75Å; I12-F57 HydrophobicContact CG2-CE2 3.89Å; I12-F64 HydrophobicContact CB-CE1 4.43Å; I12-F64 HydrophobicContact CB-CZ 4.35Å; I12-F64 HydrophobicContact CD1-CZ 4.15Å; I12-F64 HydrophobicContact CG2-CE1 4.23Å; I12-F64 HydrophobicContact CG2-CZ 3.89Å
13	N	95.6	Very high	83.6	Confident	12 Å²	12	65.1 Å²	65.1	6%	0.064	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	109.2	178.8	-178.6	-7.2	0	0	0	108.7	G16 I17 R18 E54 F55 F56 F57	N13-G16 WeakPolarHBondContact OD1-CA 3.3Å; N13-G16 PolarHBondContact OD1-N 3.24Å; N13-I17 CarbonylContact C-O 3.5Å; N13-I17 WeakPolarHBondContact CA-O 3.21Å; N13-I17 PolarHBondContact OD1-N 3.1Å; N13-R18 HydrophobicContact CB-CG 4.39Å; N13-E54 HydrophobicContact CB-CG 4.38Å; N13-E54 PolarHBondContact ND2-OE1 3.37Å; N13-F55 PolarHBondContact N-O 2.81Å; N13-F56 HydrophobicContact CB-CD2 4.19Å; N13-F56 CarbonylContact O-C 3.59Å; N13-F56 WeakPolarHBondContact O-CA 3.49Å; N13-F56 WeakPolarHBondContact O-CD2 3.39Å; N13-F57 PolarHBondContact O-N 2.78Å
14	V	96.4	Very high	85.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	121.3	-177.9	-173.7	0	0	0	0	109	I12 G16 I17 F57 R59 F64 W94	I12-V14 HydrophobicContact CG2-CG2 3.77Å; V14-G16 PolarHBondContact O-N 3.31Å; V14-I17 PolarHBondContact N-O 2.9Å; V14-I17 PolarHBondContact O-N 3.03Å; V14-F57 CarbonylContact C-O 3.57Å; V14-F57 WeakPolarHBondContact CA-O 3.39Å; V14-F57 HydrophobicContact CG1-CB 4.47Å; V14-F57 HydrophobicContact CG2-CB 4.29Å; V14-F57 HydrophobicContact CG2-CD2 4.48Å; V14-R59 HydrophobicContact CG1-CB 3.93Å; V14-R59 WeakPolarHBondContact CG1-O 3.31Å; V14-F64 HydrophobicContact CB-CB 4.27Å; V14-F64 HydrophobicContact CB-CD1 4.06Å; V14-F64 HydrophobicContact CB-CG 4.07Å; V14-F64 HydrophobicContact CG1-CB 3.95Å; V14-F64 HydrophobicContact CG1-CG 4.1Å; V14-F64 HydrophobicContact CG2-CB 4.37Å; V14-F64 HydrophobicContact CG2-CD1 3.51Å; V14-F64 HydrophobicContact CG2-CD2 3.94Å; V14-F64 HydrophobicContact CG2-CE1 3.66Å; V14-F64 HydrophobicContact CG2-CE2 4.06Å; V14-F64 HydrophobicContact CG2-CG 3.65Å; V14-F64 HydrophobicContact CG2-CZ 3.94Å; V14-W94 HydrophobicContact CG1-CZ2 4.37Å; V14-W94 HydrophobicContact CG2-CH2 4.28Å; V14-W94 HydrophobicContact CG2-CZ2 4.49Å
15	G	92.9	Very high	87.9	Confident	38 Å²	38	58 Å²	58	39%	0.392	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	21.2	-178.6	0	0	0	0	0	114.6	F57	G15-F57 PolarHBondContact N-O 3.05Å
16	G	91.2	Very high	89.8	Confident	50 Å²	50	54.2 Å²	54.2	52%	0.515	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	-5.7	-173.7	0	0	0	0	0	115.3	N13 V14	N13-G16 WeakPolarHBondContact OD1-CA 3.3Å; N13-G16 PolarHBondContact OD1-N 3.24Å; V14-G16 PolarHBondContact O-N 3.31Å
17	I	94.7	Very high	91.4	Very high	90 Å²	90	55 Å²	55	46%	0.462	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	126.4	176.1	-57.1	-162	0	0	0	109.9	N13 V14 H19 P61	N13-I17 CarbonylContact C-O 3.5Å; N13-I17 WeakPolarHBondContact CA-O 3.21Å; N13-I17 PolarHBondContact OD1-N 3.1Å; V14-I17 PolarHBondContact N-O 2.9Å; V14-I17 PolarHBondContact O-N 3.03Å; I17-H19 PolarHBondContact O-CD2 2.86Å; I17-H19 VanDerWaalsContact O-CD2 3.23Å; I17-P61 HydrophobicContact CB-CB 4.03Å; I17-P61 HydrophobicContact CD1-CB 3.86Å; I17-P61 HydrophobicContact CD1-CG 4.15Å; I17-P61 HydrophobicContact CG1-CB 3.92Å; I17-P61 HydrophobicContact CG1-CG 4.36Å
18	R	94.8	Very high	92.7	Very high	149 Å²	149	50.1 Å²	50.1	56%	0.562	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.6	179.1	-72.3	178.1	166.8	93.5	20.1	111.6	V11 N13 E54	V11-R18 HydrophobicContact CG1-CG 4.49Å; N13-R18 HydrophobicContact CB-CG 4.39Å; R18-E54 IonicContact CZ-OE1 3.85Å; R18-E54 IonicContact CZ-OE2 3.73Å; R18-E54 VanDerWaalsContact CZ-OE2 3.26Å; R18-E54 IonicContact NE-OE1 3.25Å; R18-E54 IonicContact NE-OE2 2.87Å; R18-E54 PolarHBondContact NE-OE2 2.97Å; R18-E54 VanDerWaalsContact NH2-CD 3.27Å; R18-E54 IonicContact NH2-OE1 3.83Å; R18-E54 PolarHBondContact NH2-OE1 3.19Å; R18-E54 IonicContact NH2-OE2 3.81Å; R18-E54 PolarHBondContact NH2-OE2 2.75Å
19	H	94.9	Very high	93.1	Very high	30 Å²	30	49.5 Å²	49.5	14%	0.139	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.7	171.2	-56.7	-100.7	0	0	0	109.3	V11 I12 I17 F64 L68	V11-H19 WeakPolarHBondContact CA-O 3.4Å; I12-H19 PolarHBondContact N-O 3.49Å; I12-H19 PolarHBondContact O-N 3.04Å; I17-H19 PolarHBondContact O-CD2 2.86Å; I17-H19 VanDerWaalsContact O-CD2 3.23Å; H19-F64 HydrophobicContact CB-CD1 4.45Å; H19-F64 HydrophobicContact CB-CE1 3.98Å; H19-F64 AromaticContact CD2-CD1 3.57Å; H19-F64 AromaticContact CD2-CE1 3.86Å; H19-F64 AromaticContact CE1-CD1 3.89Å; H19-F64 AromaticContact CG-CD1 3.76Å; H19-F64 AromaticContact CG-CE1 3.78Å; H19-F64 AromaticContact ND1-CD1 3.94Å; H19-F64 AromaticContact NE2-CD1 3.69Å; H19-L68 HydrophobicContact CB-CD2 3.73Å
20	Q	93.3	Very high	93	Very high	97 Å²	97	50.5 Å²	50.5	45%	0.453	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.2	172.8	-167.1	176.5	66.8	0	0	110.4	R9 I10 V11 R72	R9-Q20 HydrophobicContact CB-CG 4.43Å; I10-Q20 WeakPolarHBondContact O-CA 3.26Å; V11-Q20 HydrophobicContact CG2-CG 4.42Å; Q20-R72 PolarHBondContact O-NH2 3.21Å; Q20-R72 VanDerWaalsContact O-NH2 3.17Å
21	T	93.7	Very high	92.7	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.055	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	-176.4	174.8	-164.2	0	0	0	0	110.4	R9 I10 T25 L26 L68	R9-T21 CarbonylContact C-O 3.58Å; R9-T21 VanDerWaalsContact CA-O 3.3Å; R9-T21 WeakPolarHBondContact CA-O 3.48Å; I10-T21 HydrophobicContact CG2-CG2 3.62Å; I10-T21 PolarHBondContact N-O 3.07Å; I10-T21 PolarHBondContact O-N 3.46Å; I10-T21 VanDerWaalsContact O-N 3.11Å; T21-T25 WeakPolarHBondContact OG1-CB 3.4Å; T21-L26 HydrophobicContact CG2-CD1 4.26Å; T21-L26 HydrophobicContact CG2-CD2 3.73Å; T21-L26 HydrophobicContact CG2-CG 3.92Å; T21-L68 HydrophobicContact CG2-CD1 3.93Å
22	Y	93.6	Very high	92.7	Very high	66 Å²	66	51.8 Å²	51.8	26%	0.259	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	147.7	175.2	-70.3	-92.8	0	0	0	110.5	D5 D8 R9 S24 T25 L26	D5-Y22 VanDerWaalsContact OD2-CE1 3.26Å; D5-Y22 WeakPolarHBondContact OD2-CE1 3.29Å; D5-Y22 PolarHBondContact OD2-OH 3.03Å; D8-Y22 HydrophobicContact CB-CD1 4.15Å; D8-Y22 CarbonylContact O-C 3.58Å; D8-Y22 WeakPolarHBondContact O-CA 3.48Å; R9-Y22 HydrophobicContact CG-CD1 3.92Å; R9-Y22 HydrophobicContact CG-CE1 3.75Å; R9-Y22 HydrophobicContact CG-CG 4.49Å; R9-Y22 PolarHBondContact NE-OH 3.19Å; R9-Y22 PolarHBondContact NH2-OH 3.3Å; Y22-S24 WeakPolarHBondContact CB-OG 3.39Å; Y22-S24 PolarHBondContact O-N 3.41Å; Y22-T25 WeakPolarHBondContact O-CA 3.26Å; Y22-T25 VanDerWaalsContact O-CB 3.26Å; Y22-T25 WeakPolarHBondContact O-CB 3.45Å; Y22-T25 PolarHBondContact O-N 3.03Å; Y22-L26 PolarHBondContact O-N 3.48Å
23	R	91.3	Very high	92.6	Very high	49 Å²	49	55.5 Å²	55.5	19%	0.185	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-34.9	174.6	-68.3	176.3	172.5	-79.8	-15	111.1	D8 I10 T25 L26 R27 L37 A38	D8-R23 WeakPolarHBondContact O-CG 3.4Å; D8-R23 PolarHBondContact O-N 2.72Å; I10-R23 HydrophobicContact CB-CG 4.31Å; I10-R23 HydrophobicContact CG2-CG 4.37Å; R23-T25 VanDerWaalsContact C-N 3.29Å; R23-T25 PolarHBondContact O-N 3.2Å; R23-L26 PolarHBondContact O-N 3.05Å; R23-R27 WeakPolarHBondContact O-CG 3.26Å; R23-R27 PolarHBondContact O-N 3.38Å; R23-L37 PolarHBondContact NH1-O 3.17Å; R23-A38 HydrophobicContact CB-CB 4.21Å; R23-A38 PolarHBondContact NH1-O 3.09Å
24	S	91.5	Very high	92.4	Very high	70 Å²	70	54.9 Å²	54.9	49%	0.49	30%	0.304	S	S	.	.	H	α-helix	trans	-57	-36.5	168.4	44.5	0	0	0	0	113.7	D8 Y22	D8-S24 PolarHBondContact OD2-N 3.32Å; D8-S24 PolarHBondContact OD2-OG 2.98Å; Y22-S24 WeakPolarHBondContact CB-OG 3.39Å; Y22-S24 PolarHBondContact O-N 3.41Å
25	T	93.1	Very high	92.2	Very high	27 Å²	27	55.4 Å²	55.4	17%	0.166	31%	0.308	C	S	.	.	H	α-helix	trans	-68.4	-38.4	173.3	-51	0	0	0	0	112.2	T21 Y22 R23 R27 T28 R72	T21-T25 WeakPolarHBondContact OG1-CB 3.4Å; Y22-T25 WeakPolarHBondContact O-CA 3.26Å; Y22-T25 VanDerWaalsContact O-CB 3.26Å; Y22-T25 WeakPolarHBondContact O-CB 3.45Å; Y22-T25 PolarHBondContact O-N 3.03Å; R23-T25 VanDerWaalsContact C-N 3.29Å; R23-T25 PolarHBondContact O-N 3.2Å; T25-R27 VanDerWaalsContact C-N 3.26Å; T25-R27 PolarHBondContact O-N 3.49Å; T25-T28 WeakPolarHBondContact O-CG2 3.38Å; T25-T28 PolarHBondContact O-N 3.09Å; T25-T28 PolarHBondContact O-OG1 2.91Å; T25-R72 HydrophobicContact CG2-CG 3.76Å
26	L	92.9	Very high	92.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71.4	-20.8	-179.8	-60.9	-171.6	0	0	0	113.5	I10 I12 T21 Y22 R23 T28 L34 S35 L37 A38 L68 Y71	I10-L26 HydrophobicContact CD1-CD1 4.15Å; I10-L26 HydrophobicContact CG2-CD1 3.85Å; I12-L26 HydrophobicContact CD1-CD1 4.13Å; T21-L26 HydrophobicContact CG2-CD1 4.26Å; T21-L26 HydrophobicContact CG2-CD2 3.73Å; T21-L26 HydrophobicContact CG2-CG 3.92Å; Y22-L26 PolarHBondContact O-N 3.48Å; R23-L26 PolarHBondContact O-N 3.05Å; L26-T28 VanDerWaalsContact C-N 3.33Å; L26-L34 HydrophobicContact CD2-CB 4.13Å; L26-L34 HydrophobicContact CD2-CD1 4.5Å; L26-S35 WeakPolarHBondContact O-CA 3.26Å; L26-S35 WeakPolarHBondContact O-CB 3.42Å; L26-L37 HydrophobicContact CD1-CB 4.08Å; L26-A38 HydrophobicContact CB-CB 4.2Å; L26-L68 HydrophobicContact CD2-CD1 4.21Å; L26-Y71 HydrophobicContact CD2-CD1 4.38Å
27	R	91.7	Very high	92	Very high	115 Å²	115	58.3 Å²	58.3	43%	0.434	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	0.1	176.3	-70.5	-178.7	176	127	1	114.7	R23 T25 L29 A38 E39	R23-R27 WeakPolarHBondContact O-CG 3.26Å; R23-R27 PolarHBondContact O-N 3.38Å; T25-R27 VanDerWaalsContact C-N 3.26Å; T25-R27 PolarHBondContact O-N 3.49Å; R27-L29 VanDerWaalsContact C-N 3.27Å; R27-L29 PolarHBondContact O-N 2.98Å; R27-A38 HydrophobicContact CG-CB 3.67Å; R27-A38 PolarHBondContact NH2-O 2.81Å; R27-E39 IonicContact CZ-OE1 2.66Å; R27-E39 IonicContact NE-OE1 2.77Å; R27-E39 PolarHBondContact NE-OE1 2.99Å; R27-E39 IonicContact NH2-OE1 3.76Å; R27-E39 PolarHBondContact NH2-OE1 2.96Å; R27-E39 IonicContact NH2-OE2 3.5Å
28	T	91.5	Very high	91.7	Very high	77 Å²	77	54.1 Å²	54.1	47%	0.472	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-28	177.5	55.6	0	0	0	0	112.8	T25 L26 P30 Y71	T25-T28 WeakPolarHBondContact O-CG2 3.38Å; T25-T28 PolarHBondContact O-N 3.09Å; T25-T28 PolarHBondContact O-OG1 2.91Å; L26-T28 VanDerWaalsContact C-N 3.33Å; T28-P30 WeakPolarHBondContact O-CD 3.37Å; T28-Y71 PolarHBondContact OG1-O 3.24Å; T28-Y71 VanDerWaalsContact OG1-O 3.07Å
29	L	90.8	Very high	91.4	Very high	35 Å²	35	50.6 Å²	50.6	18%	0.183	26%	0.26	C	S	.	.	S	Bend	trans	-124.3	79.4	-177.3	-62.1	168	0	0	0	109.6	R27 T32 S35 Y70 Y71	R27-L29 VanDerWaalsContact C-N 3.27Å; R27-L29 PolarHBondContact O-N 2.98Å; L29-T32 HydrophobicContact CB-CG2 3.84Å; L29-T32 VanDerWaalsContact O-CG2 3.24Å; L29-T32 WeakPolarHBondContact O-CG2 3.39Å; L29-T32 PolarHBondContact O-OG1 3.36Å; L29-S35 WeakPolarHBondContact O-CB 3.04Å; L29-Y70 HydrophobicContact CD1-CD1 3.44Å; L29-Y70 VanDerWaalsContact CD1-CD1 3.44Å; L29-Y70 HydrophobicContact CD1-CD2 4.46Å; L29-Y70 HydrophobicContact CD1-CE1 3.22Å; L29-Y70 HydrophobicContact CD1-CE2 4.31Å; L29-Y70 HydrophobicContact CD1-CG 4.05Å; L29-Y70 HydrophobicContact CD2-CE1 4.18Å; L29-Y70 WeakPolarHBondContact CD2-OH 3.49Å; L29-Y70 HydrophobicContact CG-CE1 4.32Å; L29-Y71 HydrophobicContact CB-CD1 4.06Å; L29-Y71 HydrophobicContact CB-CE1 3.76Å; L29-Y71 HydrophobicContact CD1-CD1 3.8Å; L29-Y71 HydrophobicContact CD1-CD2 3.95Å; L29-Y71 HydrophobicContact CD1-CE1 3.89Å; L29-Y71 HydrophobicContact CD1-CE2 3.98Å; L29-Y71 HydrophobicContact CD1-CG 3.83Å; L29-Y71 HydrophobicContact CG-CD1 4.21Å; L29-Y71 HydrophobicContact CG-CE1 4.32Å
30	P	88.8	Confident	90.8	Very high	109 Å²	109	54.7 Å²	54.7	71%	0.708	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	144.9	-175.7	28.9	-35.7	0	0	0	112.2	T28 T32	T28-P30 WeakPolarHBondContact O-CD 3.37Å; P30-T32 VanDerWaalsContact C-N 3.35Å
31	G	85.8	Confident	90.5	Very high	54 Å²	54	53.3 Å²	53.3	56%	0.557	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.1	-24.1	-179.4	0	0	0	0	0	113.7	S35 W36	G31-S35 PolarHBondContact N-OG 2.66Å; G31-W36 PolarHBondContact O-NE1 3.14Å
32	T	92.9	Very high	90.1	Very high	11 Å²	11	53 Å²	53	7%	0.067	28%	0.283	C	S	.	.	S	Bend	trans	-64.1	156.8	172.5	64.2	0	0	0	0	112.6	L29 P30 L34 S35 W36 Y71 G95 I96	L29-T32 HydrophobicContact CB-CG2 3.84Å; L29-T32 VanDerWaalsContact O-CG2 3.24Å; L29-T32 WeakPolarHBondContact O-CG2 3.39Å; L29-T32 PolarHBondContact O-OG1 3.36Å; P30-T32 VanDerWaalsContact C-N 3.35Å; T32-L34 PolarHBondContact O-N 2.97Å; T32-S35 PolarHBondContact N-OG 2.81Å; T32-S35 PolarHBondContact O-N 3.13Å; T32-S35 VanDerWaalsContact O-N 3.12Å; T32-S35 PolarHBondContact O-OG 3.26Å; T32-S35 WeakPolarHBondContact OG1-CB 3.43Å; T32-S35 PolarHBondContact OG1-N 2.98Å; T32-S35 VanDerWaalsContact OG1-N 3.11Å; T32-S35 PolarHBondContact OG1-OG 3.27Å; T32-W36 PolarHBondContact O-N 3.38Å; T32-Y71 WeakPolarHBondContact CB-OH 3.35Å; T32-Y71 HydrophobicContact CG2-CE1 4.48Å; T32-Y71 WeakPolarHBondContact CG2-OH 3.09Å; T32-Y71 PolarHBondContact OG1-OH 3.35Å; T32-G95 WeakPolarHBondContact CG2-O 3.43Å; T32-I96 HydrophobicContact CG2-CG1 4.2Å
33	R	92.6	Very high	89.7	Confident	77 Å²	77	52.4 Å²	52.4	29%	0.291	29%	0.288	S	S	.	.	H	α-helix	trans	-58.6	-36.3	176.1	-171.8	-173.7	-60	-90.7	-5.1	112.3	W36 F46 F93 W94	R33-W36 PolarHBondContact O-N 3.31Å; R33-F46 HydrophobicContact CG-CE1 3.7Å; R33-F46 HydrophobicContact CG-CZ 3.97Å; R33-F93 PolarHBondContact NE-O 3.21Å; R33-F93 PolarHBondContact NH2-O 2.9Å; R33-W94 HydrophobicContact CB-CE3 4.49Å; R33-W94 WeakPolarHBondContact CB-O 3.09Å; R33-W94 PolarHBondContact N-O 2.88Å
34	L	92.6	Very high	89.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-73	-31.2	179.1	-65.4	-178.1	0	0	0	112.5	I12 L26 T32 W36 L37 F64 I67 Y71 W94	I12-L34 HydrophobicContact CD1-CD2 4.05Å; L26-L34 HydrophobicContact CD2-CB 4.13Å; L26-L34 HydrophobicContact CD2-CD1 4.5Å; T32-L34 PolarHBondContact O-N 2.97Å; L34-W36 PolarHBondContact O-N 3.24Å; L34-L37 HydrophobicContact CD2-CD1 3.57Å; L34-L37 WeakPolarHBondContact O-CB 3.38Å; L34-L37 PolarHBondContact O-N 3.21Å; L34-L37 VanDerWaalsContact O-N 3.1Å; L34-F64 HydrophobicContact CD1-CE2 3.85Å; L34-F64 HydrophobicContact CD1-CZ 4.14Å; L34-F64 HydrophobicContact CD2-CE2 3.99Å; L34-F64 HydrophobicContact CD2-CZ 4.17Å; L34-F64 HydrophobicContact CG-CE2 4.48Å; L34-I67 HydrophobicContact CD1-CG2 3.96Å; L34-Y71 HydrophobicContact CB-CE1 3.87Å; L34-Y71 HydrophobicContact CB-CE2 4.46Å; L34-Y71 HydrophobicContact CD1-CD2 4.2Å; L34-Y71 HydrophobicContact CD1-CE1 4.46Å; L34-Y71 HydrophobicContact CD1-CE2 3.65Å; L34-W94 HydrophobicContact CD1-CE3 4.44Å; L34-W94 HydrophobicContact CD2-CE3 3.64Å; L34-W94 HydrophobicContact CD2-CH2 4.49Å; L34-W94 HydrophobicContact CD2-CZ3 3.48Å; L34-W94 VanDerWaalsContact CD2-CZ3 3.48Å; L34-W94 HydrophobicContact CG-CE3 3.83Å; L34-W94 HydrophobicContact CG-CZ3 4.21Å
35	S	91.8	Very high	89.1	Confident	11 Å²	11	59.3 Å²	59.3	8%	0.077	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-35.1	172.7	73.9	0	0	0	0	112.1	L26 L29 G31 T32 L37 A38	L26-S35 WeakPolarHBondContact O-CA 3.26Å; L26-S35 WeakPolarHBondContact O-CB 3.42Å; L29-S35 WeakPolarHBondContact O-CB 3.04Å; G31-S35 PolarHBondContact N-OG 2.66Å; T32-S35 PolarHBondContact N-OG 2.81Å; T32-S35 PolarHBondContact O-N 3.13Å; T32-S35 VanDerWaalsContact O-N 3.12Å; T32-S35 PolarHBondContact O-OG 3.26Å; T32-S35 WeakPolarHBondContact OG1-CB 3.43Å; T32-S35 PolarHBondContact OG1-N 2.98Å; T32-S35 VanDerWaalsContact OG1-N 3.11Å; T32-S35 PolarHBondContact OG1-OG 3.27Å; S35-L37 VanDerWaalsContact C-N 3.28Å; S35-L37 PolarHBondContact O-N 2.88Å; S35-A38 VanDerWaalsContact O-CB 3.24Å; S35-A38 WeakPolarHBondContact O-CB 3.43Å; S35-A38 PolarHBondContact O-N 3.35Å
36	W	90.3	Very high	88.9	Confident	148 Å²	148	59.5 Å²	59.5	56%	0.561	32%	0.317	S	S	*	.	H	α-helix	trans	-67.9	-25.2	177.7	-57.1	-1.2	0	0	0	112.7	G31 T32 R33 L34 A38 E39 A42 F46	G31-W36 PolarHBondContact O-NE1 3.14Å; T32-W36 PolarHBondContact O-N 3.38Å; R33-W36 PolarHBondContact O-N 3.31Å; L34-W36 PolarHBondContact O-N 3.24Å; W36-A38 PolarHBondContact O-N 3.02Å; W36-E39 PolarHBondContact O-N 2.86Å; W36-A42 WeakPolarHBondContact O-CB 3.46Å; W36-F46 HydrophobicContact CB-CE2 3.99Å; W36-F46 HydrophobicContact CB-CZ 4.07Å; W36-F46 HydrophobicContact CE3-CZ 4.19Å
37	L	90.4	Very high	88.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-67.9	-21	172.5	-65.2	175.5	0	0	0	113.1	I10 I12 R23 L26 L34 S35 E39 F46 F55 F57	I10-L37 HydrophobicContact CD1-CB 3.85Å; I10-L37 WeakPolarHBondContact CD1-O 3.35Å; I12-L37 HydrophobicContact CD1-CD1 3.81Å; I12-L37 HydrophobicContact CG1-CD1 4.29Å; R23-L37 PolarHBondContact NH1-O 3.17Å; L26-L37 HydrophobicContact CD1-CB 4.08Å; L34-L37 HydrophobicContact CD2-CD1 3.57Å; L34-L37 WeakPolarHBondContact O-CB 3.38Å; L34-L37 PolarHBondContact O-N 3.21Å; L34-L37 VanDerWaalsContact O-N 3.1Å; S35-L37 VanDerWaalsContact C-N 3.28Å; S35-L37 PolarHBondContact O-N 2.88Å; L37-E39 VanDerWaalsContact C-N 3.28Å; L37-F46 HydrophobicContact CD2-CB 4.12Å; L37-F46 HydrophobicContact CD2-CD1 4.2Å; L37-F46 HydrophobicContact CD2-CD2 3.48Å; L37-F46 VanDerWaalsContact CD2-CD2 3.48Å; L37-F46 HydrophobicContact CD2-CE1 4.5Å; L37-F46 HydrophobicContact CD2-CE2 3.83Å; L37-F46 HydrophobicContact CD2-CG 3.67Å; L37-F46 HydrophobicContact CD2-CZ 4.32Å; L37-F46 HydrophobicContact CG-CE2 4.43Å; L37-F55 HydrophobicContact CD2-CB 4.37Å; L37-F55 HydrophobicContact CD2-CD1 3.59Å; L37-F55 HydrophobicContact CD2-CD2 4.22Å; L37-F55 HydrophobicContact CD2-CE1 3.81Å; L37-F55 HydrophobicContact CD2-CE2 4.42Å; L37-F55 HydrophobicContact CD2-CG 3.8Å; L37-F55 HydrophobicContact CD2-CZ 4.22Å; L37-F57 HydrophobicContact CD1-CE2 3.91Å; L37-F57 HydrophobicContact CD1-CZ 4.1Å; L37-F57 HydrophobicContact CD2-CE2 4.48Å; L37-F57 HydrophobicContact CD2-CZ 4.22Å
38	A	87.6	Confident	88.6	Confident	2 Å²	2	62.4 Å²	62.4	2%	0.017	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-20.6	176.5	0	0	0	0	0	112.9	R23 L26 R27 S35 W36	R23-A38 HydrophobicContact CB-CB 4.21Å; R23-A38 PolarHBondContact NH1-O 3.09Å; L26-A38 HydrophobicContact CB-CB 4.2Å; R27-A38 HydrophobicContact CG-CB 3.67Å; R27-A38 PolarHBondContact NH2-O 2.81Å; S35-A38 VanDerWaalsContact O-CB 3.24Å; S35-A38 WeakPolarHBondContact O-CB 3.43Å; S35-A38 PolarHBondContact O-N 3.35Å; W36-A38 PolarHBondContact O-N 3.02Å
39	E	87.8	Confident	88.4	Confident	75 Å²	75	61.7 Å²	61.7	35%	0.35	33%	0.33	S	S	.	.	S	Bend	trans	-79.8	154.7	-175.4	-64.6	-47.5	114.6	0	0	113.4	R27 W36 L37 D41 A42	R27-E39 IonicContact CZ-OE1 2.66Å; R27-E39 IonicContact NE-OE1 2.77Å; R27-E39 PolarHBondContact NE-OE1 2.99Å; R27-E39 IonicContact NH2-OE1 3.76Å; R27-E39 PolarHBondContact NH2-OE1 2.96Å; R27-E39 IonicContact NH2-OE2 3.5Å; W36-E39 PolarHBondContact O-N 2.86Å; L37-E39 VanDerWaalsContact C-N 3.28Å; E39-D41 VanDerWaalsContact C-N 3.3Å; E39-D41 PolarHBondContact O-N 3Å; E39-A42 WeakPolarHBondContact O-CB 3.45Å; E39-A42 PolarHBondContact O-N 3.47Å
40	P	83.9	Confident	88.2	Confident	116 Å²	116	63.6 Å²	63.6	75%	0.753	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16	-168.8	30.2	-36.4	0	0	0	114.2
41	D	86.6	Confident	88.1	Confident	69 Å²	69	67.5 Å²	67.5	37%	0.369	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-7.8	179	66	-34.5	0	0	0	113.5	E39 P43 N44 H45	E39-D41 VanDerWaalsContact C-N 3.3Å; E39-D41 PolarHBondContact O-N 3Å; D41-P43 VanDerWaalsContact C-N 3.3Å; D41-P43 VanDerWaalsContact O-N 3.11Å; D41-N44 WeakPolarHBondContact O-CB 3.45Å; D41-N44 PolarHBondContact O-N 3.35Å; D41-N44 PolarHBondContact O-ND2 3.44Å; D41-H45 IonicContact OD2-CE1 3.09Å; D41-H45 PolarHBondContact OD2-CE1 2.91Å; D41-H45 IonicContact OD2-ND1 3.32Å; D41-H45 PolarHBondContact OD2-ND1 3.04Å
42	A	84.8	Confident	88.2	Confident	1 Å²	1	69.1 Å²	69.1	1%	0.008	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-46.6	-38.6	-179.8	0	0	0	0	0	115.6	W36 E39 N44 H45 F46 F55	W36-A42 WeakPolarHBondContact O-CB 3.46Å; E39-A42 WeakPolarHBondContact O-CB 3.45Å; E39-A42 PolarHBondContact O-N 3.47Å; A42-N44 PolarHBondContact O-N 3.27Å; A42-H45 PolarHBondContact O-N 2.95Å; A42-F46 HydrophobicContact CB-CD2 4.22Å; A42-F46 PolarHBondContact O-N 3.18Å; A42-F46 VanDerWaalsContact O-N 3.14Å; A42-F55 HydrophobicContact CB-CE1 4.17Å; A42-F55 HydrophobicContact CB-CZ 3.98Å
43	P	86.1	Confident	88	Confident	55 Å²	55	75.2 Å²	75.2	36%	0.357	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-61.8	-11.1	176	-24.9	36.8	0	0	0	115.6	D41 Y48 F55	D41-P43 VanDerWaalsContact C-N 3.3Å; D41-P43 VanDerWaalsContact O-N 3.11Å; P43-Y48 HydrophobicContact CB-CD1 3.84Å; P43-Y48 HydrophobicContact CB-CE1 4.38Å; P43-Y48 HydrophobicContact CB-CG 4.19Å; P43-Y48 HydrophobicContact CG-CD1 4.31Å; P43-Y48 HydrophobicContact CG-CE1 4.48Å; P43-F55 HydrophobicContact CG-CZ 4.2Å
44	N	85.3	Confident	88	Confident	134 Å²	134	72.2 Å²	72.2	72%	0.717	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-94.3	-14.8	173.8	-54	-59	0	0	0	113.1	D41 A42	D41-N44 WeakPolarHBondContact O-CB 3.45Å; D41-N44 PolarHBondContact O-N 3.35Å; D41-N44 PolarHBondContact O-ND2 3.44Å; A42-N44 PolarHBondContact O-N 3.27Å
45	H	83.1	Confident	88	Confident	130 Å²	130	72.2 Å²	72.2	60%	0.602	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-13.6	-171.5	-63.7	144.1	0	0	0	113.7	D41 A42	D41-H45 IonicContact OD2-CE1 3.09Å; D41-H45 PolarHBondContact OD2-CE1 2.91Å; D41-H45 IonicContact OD2-ND1 3.32Å; D41-H45 PolarHBondContact OD2-ND1 3.04Å; A42-H45 PolarHBondContact O-N 2.95Å
46	F	88.8	Confident	88.1	Confident	30 Å²	30	75.3 Å²	75.3	13%	0.132	38%	0.381	C	S	.	.	S	Bend	trans	-131.8	159	-179.3	-61.7	-80.5	0	0	0	111	R33 W36 L37 A42 Y48 F55 F57	R33-F46 HydrophobicContact CG-CE1 3.7Å; R33-F46 HydrophobicContact CG-CZ 3.97Å; W36-F46 HydrophobicContact CB-CE2 3.99Å; W36-F46 HydrophobicContact CB-CZ 4.07Å; W36-F46 HydrophobicContact CE3-CZ 4.19Å; L37-F46 HydrophobicContact CD2-CB 4.12Å; L37-F46 HydrophobicContact CD2-CD1 4.2Å; L37-F46 HydrophobicContact CD2-CD2 3.48Å; L37-F46 VanDerWaalsContact CD2-CD2 3.48Å; L37-F46 HydrophobicContact CD2-CE1 4.5Å; L37-F46 HydrophobicContact CD2-CE2 3.83Å; L37-F46 HydrophobicContact CD2-CG 3.67Å; L37-F46 HydrophobicContact CD2-CZ 4.32Å; L37-F46 HydrophobicContact CG-CE2 4.43Å; A42-F46 HydrophobicContact CB-CD2 4.22Å; A42-F46 PolarHBondContact O-N 3.18Å; A42-F46 VanDerWaalsContact O-N 3.14Å; F46-Y48 PolarHBondContact O-N 3.14Å; F46-F55 HydrophobicContact CB-CD1 3.72Å; F46-F55 HydrophobicContact CB-CE1 4Å; F46-F57 AromaticContact CD1-CE1 3.92Å; F46-F57 HydrophobicContact CD1-CE1 3.92Å; F46-F57 AromaticContact CD1-CZ 3.79Å; F46-F57 HydrophobicContact CD1-CZ 3.79Å; F46-F57 HydrophobicContact CE1-CE1 4.32Å; F46-F57 HydrophobicContact CE1-CZ 4.24Å; F46-F57 HydrophobicContact CG-CZ 4.46Å
47	D	87.9	Confident	88.4	Confident	110 Å²	110	69.1 Å²	69.1	59%	0.588	36%	0.358	S	S	*	.			trans	-70.3	111.3	175.8	-165.7	6.2	0	0	0	109.8	F55 F56	D47-F55 CarbonylContact O-C 3.53Å; D47-F55 VanDerWaalsContact O-CA 3.29Å; D47-F55 WeakPolarHBondContact O-CA 3.48Å; D47-F56 PolarHBondContact O-N 3.44Å
48	Y	90.6	Very high	88.6	Confident	66 Å²	66	75.8 Å²	75.8	26%	0.259	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	113.3	-171.5	178.3	-103.8	0	0	0	111	P43 F46 A50 E53 E54 F55	P43-Y48 HydrophobicContact CB-CD1 3.84Å; P43-Y48 HydrophobicContact CB-CE1 4.38Å; P43-Y48 HydrophobicContact CB-CG 4.19Å; P43-Y48 HydrophobicContact CG-CD1 4.31Å; P43-Y48 HydrophobicContact CG-CE1 4.48Å; F46-Y48 PolarHBondContact O-N 3.14Å; Y48-A50 HydrophobicContact CD1-CB 4.18Å; Y48-A50 HydrophobicContact CE1-CB 3.92Å; Y48-A50 PolarHBondContact O-N 2.66Å; Y48-E53 WeakPolarHBondContact OH-CA 3.48Å; Y48-E54 WeakPolarHBondContact CA-O 3.33Å; Y48-E54 WeakPolarHBondContact CD2-O 3.4Å; Y48-F55 AromaticContact CD2-CD1 3.77Å; Y48-F55 HydrophobicContact CD2-CD1 3.77Å; Y48-F55 AromaticContact CD2-CD2 3.68Å; Y48-F55 HydrophobicContact CD2-CD2 3.68Å; Y48-F55 AromaticContact CD2-CE1 3.67Å; Y48-F55 HydrophobicContact CD2-CE1 3.67Å; Y48-F55 AromaticContact CD2-CE2 3.55Å; Y48-F55 HydrophobicContact CD2-CE2 3.55Å; Y48-F55 AromaticContact CD2-CG 3.8Å; Y48-F55 HydrophobicContact CD2-CG 3.8Å; Y48-F55 AromaticContact CD2-CZ 3.56Å; Y48-F55 HydrophobicContact CD2-CZ 3.56Å; Y48-F55 HydrophobicContact CE2-CD2 4.08Å; Y48-F55 AromaticContact CE2-CE2 3.75Å; Y48-F55 HydrophobicContact CE2-CE2 3.75Å; Y48-F55 HydrophobicContact CE2-CZ 4.05Å; Y48-F55 HydrophobicContact CG-CD1 4.23Å; Y48-F55 AromaticContact CG-CE1 3.98Å; Y48-F55 HydrophobicContact CG-CE1 3.98Å; Y48-F55 HydrophobicContact CG-CZ 4.16Å
49	D	88.6	Confident	88.9	Confident	62 Å²	62	78.8 Å²	78.8	33%	0.332	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	97.1	174.2	-169.9	-11.4	0	0	0	110.3	K51 I52 E53 E54	D49-K51 PolarHBondContact O-N 3.11Å; D49-K51 VanDerWaalsContact OD1-CB 3.26Å; D49-K51 WeakPolarHBondContact OD1-CB 3.43Å; D49-K51 WeakPolarHBondContact OD1-CG 3.24Å; D49-K51 PolarHBondContact OD1-N 2.99Å; D49-I52 HydrophobicContact CB-CB 4.37Å; D49-I52 PolarHBondContact O-N 3.09Å; D49-I52 WeakPolarHBondContact OD2-CD1 3.36Å; D49-E53 PolarHBondContact O-N 2.76Å; D49-E54 PolarHBondContact N-O 3.46Å
50	A	86.4	Confident	89.2	Confident	76 Å²	76	78.3 Å²	78.3	63%	0.628	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-1.2	175.8	0	0	0	0	0	115.4	Y48	Y48-A50 HydrophobicContact CD1-CB 4.18Å; Y48-A50 HydrophobicContact CE1-CB 3.92Å; Y48-A50 PolarHBondContact O-N 2.66Å
51	K	86.7	Confident	89.7	Confident	190 Å²	190	74.5 Å²	74.5	83%	0.826	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-24.4	170.1	-56.8	166.6	-173	157.6	0	113.4	D49	D49-K51 PolarHBondContact O-N 3.11Å; D49-K51 VanDerWaalsContact OD1-CB 3.26Å; D49-K51 WeakPolarHBondContact OD1-CB 3.43Å; D49-K51 WeakPolarHBondContact OD1-CG 3.24Å; D49-K51 PolarHBondContact OD1-N 2.99Å
52	I	86.6	Confident	90	Very high	88 Å²	88	72.7 Å²	72.7	45%	0.451	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-15.6	-176.6	-54.8	179.5	0	0	0	110.6	D49 E54	D49-I52 HydrophobicContact CB-CB 4.37Å; D49-I52 PolarHBondContact O-N 3.09Å; D49-I52 WeakPolarHBondContact OD2-CD1 3.36Å; I52-E54 HydrophobicContact CB-CG 4.17Å; I52-E54 HydrophobicContact CG2-CG 3.84Å; I52-E54 WeakPolarHBondContact CG2-OE2 3.49Å
53	E	88.9	Confident	90.4	Very high	140 Å²	140	72.6 Å²	72.6	65%	0.654	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	37.8	-178.4	-56	-170.5	143.2	0	0	113.2	Y48 D49	Y48-E53 WeakPolarHBondContact OH-CA 3.48Å; D49-E53 PolarHBondContact O-N 2.76Å
54	E	92.5	Very high	90.9	Very high	14 Å²	14	70 Å²	70	7%	0.065	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.6	178.9	71.9	-175	-155.7	0	0	113.7	V11 N13 R18 Y48 D49 I52	V11-E54 HydrophobicContact CB-CB 3.89Å; V11-E54 HydrophobicContact CG1-CB 3.7Å; V11-E54 WeakPolarHBondContact O-CA 3.41Å; N13-E54 HydrophobicContact CB-CG 4.38Å; N13-E54 PolarHBondContact ND2-OE1 3.37Å; R18-E54 IonicContact CZ-OE1 3.85Å; R18-E54 IonicContact CZ-OE2 3.73Å; R18-E54 VanDerWaalsContact CZ-OE2 3.26Å; R18-E54 IonicContact NE-OE1 3.25Å; R18-E54 IonicContact NE-OE2 2.87Å; R18-E54 PolarHBondContact NE-OE2 2.97Å; R18-E54 VanDerWaalsContact NH2-CD 3.27Å; R18-E54 IonicContact NH2-OE1 3.83Å; R18-E54 PolarHBondContact NH2-OE1 3.19Å; R18-E54 IonicContact NH2-OE2 3.81Å; R18-E54 PolarHBondContact NH2-OE2 2.75Å; Y48-E54 WeakPolarHBondContact CA-O 3.33Å; Y48-E54 WeakPolarHBondContact CD2-O 3.4Å; D49-E54 PolarHBondContact N-O 3.46Å; I52-E54 HydrophobicContact CB-CG 4.17Å; I52-E54 HydrophobicContact CG2-CG 3.84Å; I52-E54 WeakPolarHBondContact CG2-OE2 3.49Å
55	F	94	Very high	91.3	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	137.6	168.3	-68.9	-87.9	0	0	0	110.4	I10 V11 N13 L37 A42 P43 F46 D47 Y48 F57	I10-F55 HydrophobicContact CD1-CD2 3.84Å; I10-F55 HydrophobicContact CD1-CE2 3.66Å; I10-F55 HydrophobicContact CG1-CD2 4Å; I10-F55 HydrophobicContact CG1-CE2 4.05Å; V11-F55 PolarHBondContact O-N 2.89Å; N13-F55 PolarHBondContact N-O 2.81Å; L37-F55 HydrophobicContact CD2-CB 4.37Å; L37-F55 HydrophobicContact CD2-CD1 3.59Å; L37-F55 HydrophobicContact CD2-CD2 4.22Å; L37-F55 HydrophobicContact CD2-CE1 3.81Å; L37-F55 HydrophobicContact CD2-CE2 4.42Å; L37-F55 HydrophobicContact CD2-CG 3.8Å; L37-F55 HydrophobicContact CD2-CZ 4.22Å; A42-F55 HydrophobicContact CB-CE1 4.17Å; A42-F55 HydrophobicContact CB-CZ 3.98Å; P43-F55 HydrophobicContact CG-CZ 4.2Å; F46-F55 HydrophobicContact CB-CD1 3.72Å; F46-F55 HydrophobicContact CB-CE1 4Å; D47-F55 CarbonylContact O-C 3.53Å; D47-F55 VanDerWaalsContact O-CA 3.29Å; D47-F55 WeakPolarHBondContact O-CA 3.48Å; Y48-F55 AromaticContact CD2-CD1 3.77Å; Y48-F55 HydrophobicContact CD2-CD1 3.77Å; Y48-F55 AromaticContact CD2-CD2 3.68Å; Y48-F55 HydrophobicContact CD2-CD2 3.68Å; Y48-F55 AromaticContact CD2-CE1 3.67Å; Y48-F55 HydrophobicContact CD2-CE1 3.67Å; Y48-F55 AromaticContact CD2-CE2 3.55Å; Y48-F55 HydrophobicContact CD2-CE2 3.55Å; Y48-F55 AromaticContact CD2-CG 3.8Å; Y48-F55 HydrophobicContact CD2-CG 3.8Å; Y48-F55 AromaticContact CD2-CZ 3.56Å; Y48-F55 HydrophobicContact CD2-CZ 3.56Å; Y48-F55 HydrophobicContact CE2-CD2 4.08Å; Y48-F55 AromaticContact CE2-CE2 3.75Å; Y48-F55 HydrophobicContact CE2-CE2 3.75Å; Y48-F55 HydrophobicContact CE2-CZ 4.05Å; Y48-F55 HydrophobicContact CG-CD1 4.23Å; Y48-F55 AromaticContact CG-CE1 3.98Å; Y48-F55 HydrophobicContact CG-CE1 3.98Å; Y48-F55 HydrophobicContact CG-CZ 4.16Å; F55-F57 HydrophobicContact CB-CE2 4.15Å
56	F	94.1	Very high	91.9	Very high	75 Å²	75	62.1 Å²	62.1	33%	0.329	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.4	-179.1	-178.7	-109.6	0	0	0	113.4	N13 D47 D58	N13-F56 HydrophobicContact CB-CD2 4.19Å; N13-F56 CarbonylContact O-C 3.59Å; N13-F56 WeakPolarHBondContact O-CA 3.49Å; N13-F56 WeakPolarHBondContact O-CD2 3.39Å; D47-F56 PolarHBondContact O-N 3.44Å; F56-D58 HydrophobicContact CE1-CB 4.06Å; F56-D58 HydrophobicContact CZ-CB 4.17Å
57	F	95.2	Very high	92.2	Very high	18 Å²	18	60.7 Å²	60.7	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	121	173.9	-64.8	-84.7	0	0	0	111.4	I12 N13 V14 G15 L37 F46 F55 R59 F93 W94	I12-F57 HydrophobicContact CG2-CD2 3.75Å; I12-F57 HydrophobicContact CG2-CE2 3.89Å; N13-F57 PolarHBondContact O-N 2.78Å; V14-F57 CarbonylContact C-O 3.57Å; V14-F57 WeakPolarHBondContact CA-O 3.39Å; V14-F57 HydrophobicContact CG1-CB 4.47Å; V14-F57 HydrophobicContact CG2-CB 4.29Å; V14-F57 HydrophobicContact CG2-CD2 4.48Å; G15-F57 PolarHBondContact N-O 3.05Å; L37-F57 HydrophobicContact CD1-CE2 3.91Å; L37-F57 HydrophobicContact CD1-CZ 4.1Å; L37-F57 HydrophobicContact CD2-CE2 4.48Å; L37-F57 HydrophobicContact CD2-CZ 4.22Å; F46-F57 AromaticContact CD1-CE1 3.92Å; F46-F57 HydrophobicContact CD1-CE1 3.92Å; F46-F57 AromaticContact CD1-CZ 3.79Å; F46-F57 HydrophobicContact CD1-CZ 3.79Å; F46-F57 HydrophobicContact CE1-CE1 4.32Å; F46-F57 HydrophobicContact CE1-CZ 4.24Å; F46-F57 HydrophobicContact CG-CZ 4.46Å; F55-F57 HydrophobicContact CB-CE2 4.15Å; F57-R59 VanDerWaalsContact C-N 3.25Å; F57-R59 HydrophobicContact CB-CG 4.29Å; F57-R59 PolarHBondContact O-N 3.38Å; F57-F93 HydrophobicContact CD1-CE1 4.11Å; F57-F93 AromaticContact CD1-CZ 3.93Å; F57-F93 HydrophobicContact CD1-CZ 3.93Å; F57-F93 HydrophobicContact CE1-CZ 4.3Å; F57-W94 HydrophobicContact CB-CH2 3.94Å; F57-W94 AromaticContact CD1-CH2 3.9Å; F57-W94 HydrophobicContact CD1-CH2 3.9Å; F57-W94 HydrophobicContact CD1-CZ3 4.16Å; F57-W94 AromaticContact CD2-CH2 3.76Å; F57-W94 HydrophobicContact CD2-CH2 3.76Å; F57-W94 HydrophobicContact CD2-CZ3 4.16Å; F57-W94 HydrophobicContact CE1-CH2 4.33Å; F57-W94 HydrophobicContact CE1-CZ3 4.13Å; F57-W94 HydrophobicContact CE2-CH2 4.21Å; F57-W94 HydrophobicContact CE2-CZ3 4.13Å; F57-W94 AromaticContact CG-CH2 3.59Å; F57-W94 HydrophobicContact CG-CH2 3.59Å; F57-W94 HydrophobicContact CG-CZ3 4.17Å; F57-W94 HydrophobicContact CZ-CH2 4.47Å; F57-W94 HydrophobicContact CZ-CZ3 4.11Å
58	D	94.8	Very high	92.6	Very high	140 Å²	140	55.5 Å²	55.5	75%	0.749	29%	0.289	S	S	*	.			trans	-81.3	69.9	174	-162.4	21.9	0	0	0	110.3	F56	F56-D58 HydrophobicContact CE1-CB 4.06Å; F56-D58 HydrophobicContact CZ-CB 4.17Å
59	R	94.9	Very high	92.8	Very high	66 Å²	66	55.8 Å²	55.8	25%	0.249	30%	0.295	C	S	.	.	S	Bend	trans	-137.2	173.3	-173.7	-64.3	-60	-55.8	-142.6	3.1	111.3	V14 F57 P61 E89 E90 F93 W94	V14-R59 HydrophobicContact CG1-CB 3.93Å; V14-R59 WeakPolarHBondContact CG1-O 3.31Å; F57-R59 VanDerWaalsContact C-N 3.25Å; F57-R59 HydrophobicContact CB-CG 4.29Å; F57-R59 PolarHBondContact O-N 3.38Å; R59-P61 VanDerWaalsContact O-CD 3.32Å; R59-P61 WeakPolarHBondContact O-CD 3.19Å; R59-E89 PolarHBondContact NH2-O 2.98Å; R59-E90 IonicContact CZ-OE1 3.46Å; R59-E90 IonicContact NE-OE1 3.35Å; R59-E90 PolarHBondContact NE-OE1 3.43Å; R59-E90 IonicContact NE-OE2 2.95Å; R59-E90 VanDerWaalsContact NH2-CD 3.26Å; R59-E90 IonicContact NH2-OE1 2.75Å; R59-E90 PolarHBondContact NH2-OE1 2.8Å; R59-F93 HydrophobicContact CG-CD1 4.03Å; R59-F93 HydrophobicContact CG-CE1 3.68Å; R59-F93 HydrophobicContact CG-CZ 4.03Å; R59-F93 VanDerWaalsContact NH1-CD2 3.34Å; R59-F93 VanDerWaalsContact NH1-CG 3.31Å; R59-W94 HydrophobicContact CB-CZ2 4.16Å; R59-W94 HydrophobicContact CG-CZ2 4.29Å
60	H	94.1	Very high	93.1	Very high	65 Å²	65	53.5 Å²	53.5	30%	0.301	28%	0.282	S	S	.	.			trans	-74.8	113.1	-170.5	-169.5	-63.6	0	0	0	113.3	G62 V63 F64 E90	H60-G62 PolarHBondContact ND1-N 3.38Å; H60-G62 PolarHBondContact O-N 2.73Å; H60-V63 HydrophobicContact CB-CB 4.34Å; H60-V63 HydrophobicContact CB-CG2 4.31Å; H60-V63 PolarHBondContact ND1-N 2.69Å; H60-F64 PolarHBondContact O-N 3.5Å; H60-F64 VanDerWaalsContact O-N 3.11Å; H60-E90 HydrophobicContact CB-CG 4.37Å; H60-E90 PolarHBondContact N-OE1 3Å; H60-E90 VanDerWaalsContact N-OE1 3.16Å
61	P	93.6	Very high	93.5	Very high	35 Å²	35	50.1 Å²	50.1	23%	0.227	25%	0.253	C	S	.	.	H	α-helix	trans	-69.6	-33.2	-170.5	26.1	-34.3	0	0	0	114.7	I17 R59 F64 A65	I17-P61 HydrophobicContact CB-CB 4.03Å; I17-P61 HydrophobicContact CD1-CB 3.86Å; I17-P61 HydrophobicContact CD1-CG 4.15Å; I17-P61 HydrophobicContact CG1-CB 3.92Å; I17-P61 HydrophobicContact CG1-CG 4.36Å; R59-P61 VanDerWaalsContact O-CD 3.32Å; R59-P61 WeakPolarHBondContact O-CD 3.19Å; P61-F64 PolarHBondContact O-N 3.26Å; P61-A65 PolarHBondContact O-N 3.35Å
62	G	92.1	Very high	93.9	Very high	31 Å²	31	47 Å²	47	32%	0.32	24%	0.235	S	C	.	.	H	α-helix	trans	-61.5	-57.1	177.1	0	0	0	0	0	112.2	H60 F64 A65	H60-G62 PolarHBondContact ND1-N 3.38Å; H60-G62 PolarHBondContact O-N 2.73Å; G62-F64 VanDerWaalsContact C-N 3.26Å; G62-F64 PolarHBondContact O-N 3.46Å; G62-A65 WeakPolarHBondContact O-CB 3.44Å; G62-A65 PolarHBondContact O-N 3.1Å
63	V	94.8	Very high	94.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-50.5	-43.7	171.2	178.5	0	0	0	0	112.2	H60 A65 H66 I67 P79 V82 Y87 E90	H60-V63 HydrophobicContact CB-CB 4.34Å; H60-V63 HydrophobicContact CB-CG2 4.31Å; H60-V63 PolarHBondContact ND1-N 2.69Å; V63-A65 VanDerWaalsContact C-N 3.27Å; V63-A65 PolarHBondContact O-N 3.39Å; V63-H66 WeakPolarHBondContact O-CB 3.24Å; V63-H66 PolarHBondContact O-N 3.46Å; V63-I67 HydrophobicContact CG1-CD1 3.61Å; V63-I67 HydrophobicContact CG1-CG1 4.47Å; V63-I67 PolarHBondContact O-N 3.06Å; V63-I67 VanDerWaalsContact O-N 3.08Å; V63-P79 HydrophobicContact CG2-CG 4.33Å; V63-V82 HydrophobicContact CG2-CB 4.33Å; V63-V82 HydrophobicContact CG2-CG1 3.84Å; V63-V82 HydrophobicContact CG2-CG2 3.76Å; V63-Y87 HydrophobicContact CG1-CD2 3.62Å; V63-Y87 HydrophobicContact CG1-CE2 3.8Å; V63-Y87 HydrophobicContact CG2-CD2 4.31Å; V63-E90 HydrophobicContact CB-CB 4.49Å; V63-E90 HydrophobicContact CB-CG 4.1Å; V63-E90 HydrophobicContact CG1-CB 3.49Å; V63-E90 VanDerWaalsContact CG1-CB 3.49Å; V63-E90 HydrophobicContact CG1-CG 3.62Å; V63-E90 HydrophobicContact CG2-CG 4.42Å
64	F	96.1	Very high	94.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-32.3	178.3	-171.2	-103.4	0	0	0	114.2	I12 V14 H19 L34 H60 P61 G62 H66 I67 L68 W94	I12-F64 HydrophobicContact CB-CE1 4.43Å; I12-F64 HydrophobicContact CB-CZ 4.35Å; I12-F64 HydrophobicContact CD1-CZ 4.15Å; I12-F64 HydrophobicContact CG2-CE1 4.23Å; I12-F64 HydrophobicContact CG2-CZ 3.89Å; V14-F64 HydrophobicContact CB-CB 4.27Å; V14-F64 HydrophobicContact CB-CD1 4.06Å; V14-F64 HydrophobicContact CB-CG 4.07Å; V14-F64 HydrophobicContact CG1-CB 3.95Å; V14-F64 HydrophobicContact CG1-CG 4.1Å; V14-F64 HydrophobicContact CG2-CB 4.37Å; V14-F64 HydrophobicContact CG2-CD1 3.51Å; V14-F64 HydrophobicContact CG2-CD2 3.94Å; V14-F64 HydrophobicContact CG2-CE1 3.66Å; V14-F64 HydrophobicContact CG2-CE2 4.06Å; V14-F64 HydrophobicContact CG2-CG 3.65Å; V14-F64 HydrophobicContact CG2-CZ 3.94Å; H19-F64 HydrophobicContact CB-CD1 4.45Å; H19-F64 HydrophobicContact CB-CE1 3.98Å; H19-F64 AromaticContact CD2-CD1 3.57Å; H19-F64 AromaticContact CD2-CE1 3.86Å; H19-F64 AromaticContact CE1-CD1 3.89Å; H19-F64 AromaticContact CG-CD1 3.76Å; H19-F64 AromaticContact CG-CE1 3.78Å; H19-F64 AromaticContact ND1-CD1 3.94Å; H19-F64 AromaticContact NE2-CD1 3.69Å; L34-F64 HydrophobicContact CD1-CE2 3.85Å; L34-F64 HydrophobicContact CD1-CZ 4.14Å; L34-F64 HydrophobicContact CD2-CE2 3.99Å; L34-F64 HydrophobicContact CD2-CZ 4.17Å; L34-F64 HydrophobicContact CG-CE2 4.48Å; H60-F64 PolarHBondContact O-N 3.5Å; H60-F64 VanDerWaalsContact O-N 3.11Å; P61-F64 PolarHBondContact O-N 3.26Å; G62-F64 VanDerWaalsContact C-N 3.26Å; G62-F64 PolarHBondContact O-N 3.46Å; F64-H66 VanDerWaalsContact C-N 3.29Å; F64-H66 PolarHBondContact O-N 3.12Å; F64-I67 PolarHBondContact O-N 2.82Å; F64-L68 HydrophobicContact CE1-CB 4.27Å; F64-L68 HydrophobicContact CE1-CD2 4.21Å; F64-L68 WeakPolarHBondContact O-CB 3.43Å; F64-L68 PolarHBondContact O-N 3.14Å; F64-W94 HydrophobicContact CD2-CD2 4.27Å; F64-W94 AromaticContact CD2-CE2 3.63Å; F64-W94 AromaticContact CD2-CH2 3.76Å; F64-W94 HydrophobicContact CD2-CH2 3.76Å; F64-W94 AromaticContact CD2-CZ2 3.36Å; F64-W94 HydrophobicContact CD2-CZ2 3.36Å; F64-W94 HydrophobicContact CD2-CZ3 4.38Å; F64-W94 HydrophobicContact CE2-CD2 4.23Å; F64-W94 AromaticContact CE2-CE2 3.98Å; F64-W94 HydrophobicContact CE2-CE3 4.14Å; F64-W94 AromaticContact CE2-CH2 3.53Å; F64-W94 HydrophobicContact CE2-CH2 3.53Å; F64-W94 AromaticContact CE2-CZ2 3.64Å; F64-W94 HydrophobicContact CE2-CZ2 3.64Å; F64-W94 AromaticContact CE2-CZ3 3.81Å; F64-W94 HydrophobicContact CE2-CZ3 3.81Å; F64-W94 HydrophobicContact CG-CZ2 4.37Å; F64-W94 HydrophobicContact CZ-CH2 4.48Å
65	A	94.3	Very high	94.5	Very high	36 Å²	36	46.7 Å²	46.7	30%	0.298	25%	0.251	S	S	.	.	H	α-helix	trans	-64.1	-34.3	174.7	0	0	0	0	0	112.5	P61 G62 V63 N69	P61-A65 PolarHBondContact O-N 3.35Å; G62-A65 WeakPolarHBondContact O-CB 3.44Å; G62-A65 PolarHBondContact O-N 3.1Å; V63-A65 VanDerWaalsContact C-N 3.27Å; V63-A65 PolarHBondContact O-N 3.39Å; A65-N69 WeakPolarHBondContact O-CB 3.35Å; A65-N69 PolarHBondContact O-N 3.31Å; A65-N69 PolarHBondContact O-ND2 3.11Å
66	H	94.6	Very high	94.5	Very high	62 Å²	62	46.7 Å²	46.7	29%	0.287	25%	0.251	S	S	.	.	H	α-helix	trans	-72.5	-44.5	175.7	-74.6	-119	0	0	0	111.4	V63 F64 N69 Y70 H77 P79	V63-H66 WeakPolarHBondContact O-CB 3.24Å; V63-H66 PolarHBondContact O-N 3.46Å; F64-H66 VanDerWaalsContact C-N 3.29Å; F64-H66 PolarHBondContact O-N 3.12Å; H66-N69 PolarHBondContact O-N 3.07Å; H66-N69 VanDerWaalsContact O-N 3.15Å; H66-Y70 PolarHBondContact O-N 3.11Å; H66-Y70 VanDerWaalsContact O-N 3.08Å; H66-H77 PolarHBondContact ND1-O 3.41Å; H66-P79 HydrophobicContact CB-CG 4.44Å
67	I	95.9	Very high	94.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.1	-51.6	173.5	-71.7	151.1	0	0	0	110.7	L34 V63 F64 N69 Y70 Y71 E90 L91 W94 I96	L34-I67 HydrophobicContact CD1-CG2 3.96Å; V63-I67 HydrophobicContact CG1-CD1 3.61Å; V63-I67 HydrophobicContact CG1-CG1 4.47Å; V63-I67 PolarHBondContact O-N 3.06Å; V63-I67 VanDerWaalsContact O-N 3.08Å; F64-I67 PolarHBondContact O-N 2.82Å; I67-N69 PolarHBondContact O-N 2.91Å; I67-Y70 WeakPolarHBondContact O-CB 3.46Å; I67-Y70 PolarHBondContact O-N 3.37Å; I67-Y71 HydrophobicContact CG2-CE2 3.97Å; I67-Y71 VanDerWaalsContact O-CD2 3.26Å; I67-Y71 WeakPolarHBondContact O-CD2 3.3Å; I67-E90 HydrophobicContact CD1-CB 4.34Å; I67-L91 HydrophobicContact CG1-CD2 4.32Å; I67-W94 HydrophobicContact CD1-CG 4.1Å; I67-W94 HydrophobicContact CG2-CG 4.37Å; I67-I96 HydrophobicContact CG1-CD1 4.33Å; I67-I96 HydrophobicContact CG2-CD1 3.67Å
68	L	95.3	Very high	94.2	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-25.2	179.8	-177.2	58.9	0	0	0	112.8	H19 T21 L26 F64 R72	H19-L68 HydrophobicContact CB-CD2 3.73Å; T21-L68 HydrophobicContact CG2-CD1 3.93Å; L26-L68 HydrophobicContact CD2-CD1 4.21Å; F64-L68 HydrophobicContact CE1-CB 4.27Å; F64-L68 HydrophobicContact CE1-CD2 4.21Å; F64-L68 WeakPolarHBondContact O-CB 3.43Å; F64-L68 PolarHBondContact O-N 3.14Å; L68-R72 WeakPolarHBondContact O-CD 3.42Å; L68-R72 WeakPolarHBondContact O-CG 3.31Å
69	N	94.7	Very high	94	Very high	71 Å²	71	40 Å²	40	38%	0.38	22%	0.219	S	C	.	.	H	α-helix	trans	-73.4	-34	171.9	-75.2	-19.8	0	0	0	112.7	A65 H66 I67 Y71 R72 T73	A65-N69 WeakPolarHBondContact O-CB 3.35Å; A65-N69 PolarHBondContact O-N 3.31Å; A65-N69 PolarHBondContact O-ND2 3.11Å; H66-N69 PolarHBondContact O-N 3.07Å; H66-N69 VanDerWaalsContact O-N 3.15Å; I67-N69 PolarHBondContact O-N 2.91Å; N69-Y71 VanDerWaalsContact C-N 3.33Å; N69-Y71 PolarHBondContact O-N 2.87Å; N69-R72 CarbonylContact O-C 3.57Å; N69-R72 WeakPolarHBondContact O-CA 3.27Å; N69-R72 WeakPolarHBondContact O-CB 3.34Å; N69-R72 PolarHBondContact O-N 3.2Å; N69-R72 PolarHBondContact OD1-NH1 3.09Å; N69-T73 PolarHBondContact O-N 2.84Å; N69-T73 PolarHBondContact O-OG1 3.33Å
70	Y	95.9	Very high	93.5	Very high	15 Å²	15	42 Å²	42	6%	0.059	25%	0.25	C	C	.	.	H	α-helix	trans	-56.5	-42.4	174.2	172.6	-132.8	0	0	0	112.3	L29 H66 I67 R72 T73 G74 L76 I96 D100	L29-Y70 HydrophobicContact CD1-CD1 3.44Å; L29-Y70 VanDerWaalsContact CD1-CD1 3.44Å; L29-Y70 HydrophobicContact CD1-CD2 4.46Å; L29-Y70 HydrophobicContact CD1-CE1 3.22Å; L29-Y70 HydrophobicContact CD1-CE2 4.31Å; L29-Y70 HydrophobicContact CD1-CG 4.05Å; L29-Y70 HydrophobicContact CD2-CE1 4.18Å; L29-Y70 WeakPolarHBondContact CD2-OH 3.49Å; L29-Y70 HydrophobicContact CG-CE1 4.32Å; H66-Y70 PolarHBondContact O-N 3.11Å; H66-Y70 VanDerWaalsContact O-N 3.08Å; I67-Y70 WeakPolarHBondContact O-CB 3.46Å; I67-Y70 PolarHBondContact O-N 3.37Å; Y70-R72 PolarHBondContact O-N 3.45Å; Y70-T73 PolarHBondContact O-N 2.73Å; Y70-G74 WeakPolarHBondContact O-CA 3.32Å; Y70-G74 PolarHBondContact O-N 3.26Å; Y70-L76 HydrophobicContact CD1-CB 4.35Å; Y70-L76 HydrophobicContact CD1-CD1 3.98Å; Y70-L76 HydrophobicContact CD2-CB 3.76Å; Y70-L76 HydrophobicContact CE2-CB 4.18Å; Y70-L76 HydrophobicContact CG-CB 3.88Å; Y70-L76 HydrophobicContact CG-CD1 3.89Å; Y70-L76 HydrophobicContact CG-CG 4.43Å; Y70-I96 HydrophobicContact CD1-CD1 4.25Å; Y70-I96 HydrophobicContact CD1-CG2 4.16Å; Y70-I96 HydrophobicContact CE1-CG2 3.74Å; Y70-D100 HydrophobicContact CE1-CB 4.4Å; Y70-D100 HydrophobicContact CE2-CB 4.45Å; Y70-D100 PolarHBondContact OH-OD1 3.03Å; Y70-D100 PolarHBondContact OH-OD2 2.87Å
71	Y	94.8	Very high	93.2	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.02	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-20.6	174.6	-67.5	-107	0	0	0	113.8	L26 T28 L29 T32 L34 I67 N69 I96	L26-Y71 HydrophobicContact CD2-CD1 4.38Å; T28-Y71 PolarHBondContact OG1-O 3.24Å; T28-Y71 VanDerWaalsContact OG1-O 3.07Å; L29-Y71 HydrophobicContact CB-CD1 4.06Å; L29-Y71 HydrophobicContact CB-CE1 3.76Å; L29-Y71 HydrophobicContact CD1-CD1 3.8Å; L29-Y71 HydrophobicContact CD1-CD2 3.95Å; L29-Y71 HydrophobicContact CD1-CE1 3.89Å; L29-Y71 HydrophobicContact CD1-CE2 3.98Å; L29-Y71 HydrophobicContact CD1-CG 3.83Å; L29-Y71 HydrophobicContact CG-CD1 4.21Å; L29-Y71 HydrophobicContact CG-CE1 4.32Å; T32-Y71 WeakPolarHBondContact CB-OH 3.35Å; T32-Y71 HydrophobicContact CG2-CE1 4.48Å; T32-Y71 WeakPolarHBondContact CG2-OH 3.09Å; T32-Y71 PolarHBondContact OG1-OH 3.35Å; L34-Y71 HydrophobicContact CB-CE1 3.87Å; L34-Y71 HydrophobicContact CB-CE2 4.46Å; L34-Y71 HydrophobicContact CD1-CD2 4.2Å; L34-Y71 HydrophobicContact CD1-CE1 4.46Å; L34-Y71 HydrophobicContact CD1-CE2 3.65Å; I67-Y71 HydrophobicContact CG2-CE2 3.97Å; I67-Y71 VanDerWaalsContact O-CD2 3.26Å; I67-Y71 WeakPolarHBondContact O-CD2 3.3Å; N69-Y71 VanDerWaalsContact C-N 3.33Å; N69-Y71 PolarHBondContact O-N 2.87Å; Y71-I96 HydrophobicContact CE2-CD1 4.04Å
72	R	94.4	Very high	92.9	Very high	124 Å²	124	44.4 Å²	44.4	47%	0.468	26%	0.263	S	S	.	.	H	α-helix	trans	-94.6	-31	-179.6	-64.2	165.8	174.9	167	-7.3	112.9	Q20 T25 L68 N69 Y70	Q20-R72 PolarHBondContact O-NH2 3.21Å; Q20-R72 VanDerWaalsContact O-NH2 3.17Å; T25-R72 HydrophobicContact CG2-CG 3.76Å; L68-R72 WeakPolarHBondContact O-CD 3.42Å; L68-R72 WeakPolarHBondContact O-CG 3.31Å; N69-R72 CarbonylContact O-C 3.57Å; N69-R72 WeakPolarHBondContact O-CA 3.27Å; N69-R72 WeakPolarHBondContact O-CB 3.34Å; N69-R72 PolarHBondContact O-N 3.2Å; N69-R72 PolarHBondContact OD1-NH1 3.09Å; Y70-R72 PolarHBondContact O-N 3.45Å
73	T	94.2	Very high	92.7	Very high	88 Å²	88	46.2 Å²	46.2	54%	0.54	27%	0.27	S	S	.	.	H	α-helix	trans	-110.2	-21.7	-172.3	60	0	0	0	0	114	N69 Y70 K75	N69-T73 PolarHBondContact O-N 2.84Å; N69-T73 PolarHBondContact O-OG1 3.33Å; Y70-T73 PolarHBondContact O-N 2.73Å; T73-K75 PolarHBondContact O-N 2.75Å; T73-K75 PolarHBondContact OG1-N 3.46Å; T73-K75 PolarHBondContact OG1-O 2.72Å
74	G	93	Very high	92.3	Very high	54 Å²	54	46.3 Å²	46.3	56%	0.557	27%	0.271	S	S	*	.	S	Bend	trans	69	15.6	-165.1	0	0	0	0	0	113.9	Y70	Y70-G74 WeakPolarHBondContact O-CA 3.32Å; Y70-G74 PolarHBondContact O-N 3.26Å
75	K	93.3	Very high	91.9	Very high	94 Å²	94	48.1 Å²	48.1	41%	0.409	28%	0.283	S	S	.	.			trans	-130.5	119.8	-178.2	-64.8	-169.9	157.6	-72.8	0	112.2	T73 E102	T73-K75 PolarHBondContact O-N 2.75Å; T73-K75 PolarHBondContact OG1-N 3.46Å; T73-K75 PolarHBondContact OG1-O 2.72Å; K75-E102 HydrophobicContact CB-CG 3.99Å; K75-E102 HydrophobicContact CG-CG 4.44Å; K75-E102 WeakPolarHBondContact CG-OE1 3.26Å; K75-E102 IonicContact NZ-OE1 3.84Å; K75-E102 PolarHBondContact NZ-OE1 2.78Å; K75-E102 IonicContact NZ-OE2 3.56Å; K75-E102 PolarHBondContact NZ-OE2 3.22Å
76	L	94.8	Very high	91.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-95.8	116.1	-179	-173.2	65.4	0	0	0	110.4	Y70 Y87 L91 I96 D100 V101 E102	Y70-L76 HydrophobicContact CD1-CB 4.35Å; Y70-L76 HydrophobicContact CD1-CD1 3.98Å; Y70-L76 HydrophobicContact CD2-CB 3.76Å; Y70-L76 HydrophobicContact CE2-CB 4.18Å; Y70-L76 HydrophobicContact CG-CB 3.88Å; Y70-L76 HydrophobicContact CG-CD1 3.89Å; Y70-L76 HydrophobicContact CG-CG 4.43Å; L76-Y87 VanDerWaalsContact CD1-OH 3.26Å; L76-Y87 WeakPolarHBondContact CD1-OH 3.06Å; L76-L91 HydrophobicContact CD1-CD2 4.16Å; L76-L91 HydrophobicContact CD2-CD1 4.13Å; L76-L91 HydrophobicContact CD2-CD2 3.91Å; L76-I96 HydrophobicContact CD2-CG2 3.85Å; L76-D100 HydrophobicContact CB-CB 4.44Å; L76-D100 WeakPolarHBondContact CB-O 3.17Å; L76-D100 HydrophobicContact CD2-CB 3.82Å; L76-V101 HydrophobicContact CD2-CG2 3.7Å; L76-V101 HydrophobicContact CG-CG2 4.22Å; L76-E102 WeakPolarHBondContact O-CB 3.42Å; L76-E102 WeakPolarHBondContact O-CG 3.44Å; L76-E102 PolarHBondContact O-N 3.02Å
77	H	92.8	Very high	91.6	Very high	71 Å²	71	46.2 Å²	46.2	33%	0.329	27%	0.27	S	S	.	.			trans	-119.9	128.6	179.8	-65.7	-62.1	0	0	0	111	H66 Y87 E102 C104	H66-H77 PolarHBondContact ND1-O 3.41Å; H77-Y87 PolarHBondContact O-OH 3.34Å; H77-E102 IonicContact CE1-OE2 2.69Å; H77-C104 VanDerWaalsContact CE1-SG 3.58Å
78	C	90.6	Very high	91.4	Very high	17 Å²	17	49.2 Å²	49.2	12%	0.115	28%	0.284	C	S	.	.			trans	-66.2	139.3	175.3	-170.9	0	0	0	0	111.2	Y87 C105	C78-Y87 HydrophobicContact CB-CD1 4.37Å; C78-Y87 HydrophobicContact CB-CE1 4.14Å; C78-C105 HydrophobicContact CB-CB 3.91Å; C78-C105 PolarHBondContact N-SG 2.89Å; C78-C105 VanDerWaalsContact N-SG 3.36Å
79	P	90.4	Very high	91.2	Very high	4 Å²	4	55.1 Å²	55.1	3%	0.026	31%	0.311	C	S	.	.			trans	-61.7	155.5	165.2	-14.2	26.1	0	0	0	111.5	V63 H66 D81 V82 Y87	V63-P79 HydrophobicContact CG2-CG 4.33Å; H66-P79 HydrophobicContact CB-CG 4.44Å; P79-D81 WeakPolarHBondContact CB-OD1 3.48Å; P79-V82 HydrophobicContact CB-CB 4.04Å; P79-V82 HydrophobicContact CB-CG2 3.88Å; P79-V82 HydrophobicContact CG-CB 4.18Å; P79-V82 HydrophobicContact CG-CG2 4.03Å; P79-Y87 HydrophobicContact CG-CD2 4.3Å; P79-Y87 HydrophobicContact CG-CE2 4.19Å
80	A	85	Confident	91.2	Very high	109 Å²	109	52 Å²	52	90%	0.901	29%	0.294	S	S	*	.	S	Bend	trans	-91.6	-12.9	178.8	0	0	0	0	0	113.4
81	D	87.1	Confident	91.2	Very high	134 Å²	134	51.4 Å²	51.4	72%	0.717	29%	0.292	S	S	*	.	S	Bend	trans	-98.6	-0.8	-179.5	59.5	-43.6	0	0	0	113.4	P79	P79-D81 WeakPolarHBondContact CB-OD1 3.48Å
82	V	87.6	Confident	91.1	Very high	16 Å²	16	54.9 Å²	54.9	10%	0.097	32%	0.322	C	S	.	.	S	Bend	trans	-119.6	136.6	-175	176.2	0	0	0	0	109.7	V63 P79 L86	V63-V82 HydrophobicContact CG2-CB 4.33Å; V63-V82 HydrophobicContact CG2-CG1 3.84Å; V63-V82 HydrophobicContact CG2-CG2 3.76Å; P79-V82 HydrophobicContact CB-CB 4.04Å; P79-V82 HydrophobicContact CB-CG2 3.88Å; P79-V82 HydrophobicContact CG-CB 4.18Å; P79-V82 HydrophobicContact CG-CG2 4.03Å; V82-L86 HydrophobicContact CG1-CB 4.05Å; V82-L86 HydrophobicContact CG1-CD2 4.14Å; V82-L86 HydrophobicContact CG1-CG 4.03Å
83	C	86.4	Confident	91.1	Very high	68 Å²	68	51.1 Å²	51.1	46%	0.459	31%	0.309	S	S	.	.			trans	-80.2	150.6	175.5	61.4	0	0	0	0	112.1	L86 Y87	C83-L86 PolarHBondContact O-N 3.41Å; C83-Y87 PolarHBondContact O-N 2.94Å; C83-Y87 VanDerWaalsContact O-N 3.12Å
84	G	87.9	Confident	91.2	Very high	3 Å²	3	47 Å²	47	3%	0.031	28%	0.283	C	S	.	.	H	α-helix	trans	-44.6	-53.1	-179.7	0	0	0	0	0	114.6	L86 Y87 E88	G84-L86 VanDerWaalsContact C-N 3.34Å; G84-L86 PolarHBondContact O-N 2.89Å; G84-Y87 CarbonylContact O-C 3.57Å; G84-Y87 WeakPolarHBondContact O-CA 3.49Å; G84-Y87 WeakPolarHBondContact O-CB 3.44Å; G84-Y87 PolarHBondContact O-N 3.41Å; G84-E88 WeakPolarHBondContact O-CB 3.38Å; G84-E88 PolarHBondContact O-N 3.35Å
85	P	86.8	Confident	91.1	Very high	37 Å²	37	46.5 Å²	46.5	24%	0.24	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-35.1	-179.6	-27.2	36.3	0	0	0	114.7	Y87 E88 E89	P85-Y87 VanDerWaalsContact C-N 3.33Å; P85-E88 WeakPolarHBondContact O-CB 3.24Å; P85-E88 PolarHBondContact O-N 2.93Å; P85-E89 WeakPolarHBondContact O-CG 3.34Å; P85-E89 PolarHBondContact O-N 2.79Å
86	L	90.3	Very high	91.2	Very high	58 Å²	58	42.5 Å²	42.5	30%	0.304	26%	0.262	S	S	.	.	H	α-helix	trans	-72.9	-28.7	175.6	178.3	58.3	0	0	0	111.8	V82 C83 G84 E90	V82-L86 HydrophobicContact CG1-CB 4.05Å; V82-L86 HydrophobicContact CG1-CD2 4.14Å; V82-L86 HydrophobicContact CG1-CG 4.03Å; C83-L86 PolarHBondContact O-N 3.41Å; G84-L86 VanDerWaalsContact C-N 3.34Å; G84-L86 PolarHBondContact O-N 2.89Å; L86-E90 PolarHBondContact O-N 2.89Å
87	Y	93	Very high	91	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-72.3	-41	171.8	-164.6	-116.3	0	0	0	111.1	V63 L76 H77 C78 P79 C83 G84 P85 E90 L91 V101 Y109	V63-Y87 HydrophobicContact CG1-CD2 3.62Å; V63-Y87 HydrophobicContact CG1-CE2 3.8Å; V63-Y87 HydrophobicContact CG2-CD2 4.31Å; L76-Y87 VanDerWaalsContact CD1-OH 3.26Å; L76-Y87 WeakPolarHBondContact CD1-OH 3.06Å; H77-Y87 PolarHBondContact O-OH 3.34Å; C78-Y87 HydrophobicContact CB-CD1 4.37Å; C78-Y87 HydrophobicContact CB-CE1 4.14Å; P79-Y87 HydrophobicContact CG-CD2 4.3Å; P79-Y87 HydrophobicContact CG-CE2 4.19Å; C83-Y87 PolarHBondContact O-N 2.94Å; C83-Y87 VanDerWaalsContact O-N 3.12Å; G84-Y87 CarbonylContact O-C 3.57Å; G84-Y87 WeakPolarHBondContact O-CA 3.49Å; G84-Y87 WeakPolarHBondContact O-CB 3.44Å; G84-Y87 PolarHBondContact O-N 3.41Å; P85-Y87 VanDerWaalsContact C-N 3.33Å; Y87-E90 PolarHBondContact O-N 3.25Å; Y87-E90 VanDerWaalsContact O-N 3.13Å; Y87-L91 HydrophobicContact CD1-CD1 3.9Å; Y87-L91 HydrophobicContact CD1-CG 4.13Å; Y87-L91 HydrophobicContact CE1-CD1 3.77Å; Y87-L91 HydrophobicContact CE1-CD2 4.1Å; Y87-L91 HydrophobicContact CE1-CG 4.06Å; Y87-L91 WeakPolarHBondContact O-CG 3.35Å; Y87-L91 PolarHBondContact O-N 3.42Å; Y87-V101 HydrophobicContact CE1-CG2 4.13Å; Y87-Y109 AromaticContact CD1-CD2 3.93Å; Y87-Y109 HydrophobicContact CD1-CD2 3.93Å; Y87-Y109 HydrophobicContact CD1-CE2 4.06Å
88	E	90.8	Very high	90.8	Very high	64 Å²	64	45.7 Å²	45.7	30%	0.299	28%	0.279	S	S	.	.	H	α-helix	trans	-59.2	-47.5	174.2	-169.3	170.3	-178.3	0	0	111.8	G84 P85 E90 L91 A92 Y109 R113	G84-E88 WeakPolarHBondContact O-CB 3.38Å; G84-E88 PolarHBondContact O-N 3.35Å; P85-E88 WeakPolarHBondContact O-CB 3.24Å; P85-E88 PolarHBondContact O-N 2.93Å; E88-E90 PolarHBondContact O-N 3.01Å; E88-L91 PolarHBondContact O-N 3.16Å; E88-A92 WeakPolarHBondContact O-CB 3.26Å; E88-A92 PolarHBondContact O-N 2.76Å; E88-Y109 HydrophobicContact CB-CE2 4.1Å; E88-Y109 WeakPolarHBondContact CG-OH 3.45Å; E88-R113 IonicContact OE1-CZ 2.67Å; E88-R113 IonicContact OE1-NH1 3.73Å; E88-R113 PolarHBondContact OE1-NH1 3.16Å; E88-R113 IonicContact OE2-NH1 3.48Å
89	E	92	Very high	90.8	Very high	126 Å²	126	49.7 Å²	49.7	59%	0.589	30%	0.303	S	S	*	.	H	α-helix	trans	-58.7	-26.9	172.9	-79.1	-176.3	-159.4	0	0	113.9	R59 P85 F93	R59-E89 PolarHBondContact NH2-O 2.98Å; P85-E89 WeakPolarHBondContact O-CG 3.34Å; P85-E89 PolarHBondContact O-N 2.79Å; E89-F93 WeakPolarHBondContact O-CB 3.49Å
90	E	95.1	Very high	90.8	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.019	32%	0.319	C	S	.	.	H	α-helix	trans	-84.1	-49.5	173.6	-73.9	-77.5	140.7	0	0	111.3	R59 H60 V63 I67 L86 Y87 E88 A92 F93 W94	R59-E90 IonicContact CZ-OE1 3.46Å; R59-E90 IonicContact NE-OE1 3.35Å; R59-E90 PolarHBondContact NE-OE1 3.43Å; R59-E90 IonicContact NE-OE2 2.95Å; R59-E90 VanDerWaalsContact NH2-CD 3.26Å; R59-E90 IonicContact NH2-OE1 2.75Å; R59-E90 PolarHBondContact NH2-OE1 2.8Å; H60-E90 HydrophobicContact CB-CG 4.37Å; H60-E90 PolarHBondContact N-OE1 3Å; H60-E90 VanDerWaalsContact N-OE1 3.16Å; V63-E90 HydrophobicContact CB-CB 4.49Å; V63-E90 HydrophobicContact CB-CG 4.1Å; V63-E90 HydrophobicContact CG1-CB 3.49Å; V63-E90 VanDerWaalsContact CG1-CB 3.49Å; V63-E90 HydrophobicContact CG1-CG 3.62Å; V63-E90 HydrophobicContact CG2-CG 4.42Å; I67-E90 HydrophobicContact CD1-CB 4.34Å; L86-E90 PolarHBondContact O-N 2.89Å; Y87-E90 PolarHBondContact O-N 3.25Å; Y87-E90 VanDerWaalsContact O-N 3.13Å; E88-E90 PolarHBondContact O-N 3.01Å; E90-A92 VanDerWaalsContact C-N 3.32Å; E90-A92 PolarHBondContact O-N 3.04Å; E90-F93 WeakPolarHBondContact O-CA 3.3Å; E90-F93 WeakPolarHBondContact O-CB 3.49Å; E90-F93 PolarHBondContact O-N 2.97Å; E90-W94 PolarHBondContact O-N 2.87Å; E90-W94 PolarHBondContact OE2-NE1 3.35Å
91	L	94.4	Very high	91.2	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-55	-47.9	178.5	-66.6	-174.5	0	0	0	111.6	I67 L76 Y87 E88 F93 W94 G95 I96 V101	I67-L91 HydrophobicContact CG1-CD2 4.32Å; L76-L91 HydrophobicContact CD1-CD2 4.16Å; L76-L91 HydrophobicContact CD2-CD1 4.13Å; L76-L91 HydrophobicContact CD2-CD2 3.91Å; Y87-L91 HydrophobicContact CD1-CD1 3.9Å; Y87-L91 HydrophobicContact CD1-CG 4.13Å; Y87-L91 HydrophobicContact CE1-CD1 3.77Å; Y87-L91 HydrophobicContact CE1-CD2 4.1Å; Y87-L91 HydrophobicContact CE1-CG 4.06Å; Y87-L91 WeakPolarHBondContact O-CG 3.35Å; Y87-L91 PolarHBondContact O-N 3.42Å; E88-L91 PolarHBondContact O-N 3.16Å; L91-F93 VanDerWaalsContact C-N 3.3Å; L91-F93 PolarHBondContact O-N 3.29Å; L91-W94 PolarHBondContact O-N 3.37Å; L91-G95 PolarHBondContact O-N 3.13Å; L91-I96 HydrophobicContact CD2-CB 4.24Å; L91-I96 HydrophobicContact CD2-CD1 4.49Å; L91-I96 HydrophobicContact CD2-CG2 4.13Å; L91-I96 PolarHBondContact O-N 2.67Å; L91-V101 HydrophobicContact CD1-CG2 4.03Å
92	A	94.1	Very high	91.5	Very high	78 Å²	78	43.4 Å²	43.4	65%	0.645	25%	0.253	S	S	*	.	H	α-helix	trans	-61	-37.1	175.7	0	0	0	0	0	112.3	E88 E90 G95	E88-A92 WeakPolarHBondContact O-CB 3.26Å; E88-A92 PolarHBondContact O-N 2.76Å; E90-A92 VanDerWaalsContact C-N 3.32Å; E90-A92 PolarHBondContact O-N 3.04Å; A92-G95 PolarHBondContact O-N 2.78Å
93	F	94.7	Very high	91.7	Very high	46 Å²	46	47.8 Å²	47.8	20%	0.202	28%	0.282	C	S	.	.	H	α-helix	trans	-66.4	-45.4	174.2	174.5	-96.9	0	0	0	112	R33 F57 R59 E89 E90 L91 G95	R33-F93 PolarHBondContact NE-O 3.21Å; R33-F93 PolarHBondContact NH2-O 2.9Å; F57-F93 HydrophobicContact CD1-CE1 4.11Å; F57-F93 AromaticContact CD1-CZ 3.93Å; F57-F93 HydrophobicContact CD1-CZ 3.93Å; F57-F93 HydrophobicContact CE1-CZ 4.3Å; R59-F93 HydrophobicContact CG-CD1 4.03Å; R59-F93 HydrophobicContact CG-CE1 3.68Å; R59-F93 HydrophobicContact CG-CZ 4.03Å; R59-F93 VanDerWaalsContact NH1-CD2 3.34Å; R59-F93 VanDerWaalsContact NH1-CG 3.31Å; E89-F93 WeakPolarHBondContact O-CB 3.49Å; E90-F93 WeakPolarHBondContact O-CA 3.3Å; E90-F93 WeakPolarHBondContact O-CB 3.49Å; E90-F93 PolarHBondContact O-N 2.97Å; L91-F93 VanDerWaalsContact C-N 3.3Å; L91-F93 PolarHBondContact O-N 3.29Å; F93-G95 PolarHBondContact O-N 3Å
94	W	94.9	Very high	91.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-77.3	-7.9	-179.1	-62.4	105.5	0	0	0	113.7	V14 R33 L34 F57 R59 F64 I67 E90 L91 I96	V14-W94 HydrophobicContact CG1-CZ2 4.37Å; V14-W94 HydrophobicContact CG2-CH2 4.28Å; V14-W94 HydrophobicContact CG2-CZ2 4.49Å; R33-W94 HydrophobicContact CB-CE3 4.49Å; R33-W94 WeakPolarHBondContact CB-O 3.09Å; R33-W94 PolarHBondContact N-O 2.88Å; L34-W94 HydrophobicContact CD1-CE3 4.44Å; L34-W94 HydrophobicContact CD2-CE3 3.64Å; L34-W94 HydrophobicContact CD2-CH2 4.49Å; L34-W94 HydrophobicContact CD2-CZ3 3.48Å; L34-W94 VanDerWaalsContact CD2-CZ3 3.48Å; L34-W94 HydrophobicContact CG-CE3 3.83Å; L34-W94 HydrophobicContact CG-CZ3 4.21Å; F57-W94 HydrophobicContact CB-CH2 3.94Å; F57-W94 AromaticContact CD1-CH2 3.9Å; F57-W94 HydrophobicContact CD1-CH2 3.9Å; F57-W94 HydrophobicContact CD1-CZ3 4.16Å; F57-W94 AromaticContact CD2-CH2 3.76Å; F57-W94 HydrophobicContact CD2-CH2 3.76Å; F57-W94 HydrophobicContact CD2-CZ3 4.16Å; F57-W94 HydrophobicContact CE1-CH2 4.33Å; F57-W94 HydrophobicContact CE1-CZ3 4.13Å; F57-W94 HydrophobicContact CE2-CH2 4.21Å; F57-W94 HydrophobicContact CE2-CZ3 4.13Å; F57-W94 AromaticContact CG-CH2 3.59Å; F57-W94 HydrophobicContact CG-CH2 3.59Å; F57-W94 HydrophobicContact CG-CZ3 4.17Å; F57-W94 HydrophobicContact CZ-CH2 4.47Å; F57-W94 HydrophobicContact CZ-CZ3 4.11Å; R59-W94 HydrophobicContact CB-CZ2 4.16Å; R59-W94 HydrophobicContact CG-CZ2 4.29Å; F64-W94 HydrophobicContact CD2-CD2 4.27Å; F64-W94 AromaticContact CD2-CE2 3.63Å; F64-W94 AromaticContact CD2-CH2 3.76Å; F64-W94 HydrophobicContact CD2-CH2 3.76Å; F64-W94 AromaticContact CD2-CZ2 3.36Å; F64-W94 HydrophobicContact CD2-CZ2 3.36Å; F64-W94 HydrophobicContact CD2-CZ3 4.38Å; F64-W94 HydrophobicContact CE2-CD2 4.23Å; F64-W94 AromaticContact CE2-CE2 3.98Å; F64-W94 HydrophobicContact CE2-CE3 4.14Å; F64-W94 AromaticContact CE2-CH2 3.53Å; F64-W94 HydrophobicContact CE2-CH2 3.53Å; F64-W94 AromaticContact CE2-CZ2 3.64Å; F64-W94 HydrophobicContact CE2-CZ2 3.64Å; F64-W94 AromaticContact CE2-CZ3 3.81Å; F64-W94 HydrophobicContact CE2-CZ3 3.81Å; F64-W94 HydrophobicContact CG-CZ2 4.37Å; F64-W94 HydrophobicContact CZ-CH2 4.48Å; I67-W94 HydrophobicContact CD1-CG 4.1Å; I67-W94 HydrophobicContact CG2-CG 4.37Å; E90-W94 PolarHBondContact O-N 2.87Å; E90-W94 PolarHBondContact OE2-NE1 3.35Å; L91-W94 PolarHBondContact O-N 3.37Å; W94-I96 HydrophobicContact CB-CD1 4.04Å; W94-I96 HydrophobicContact CB-CG1 4.44Å
95	G	92.3	Very high	91.9	Very high	44 Å²	44	49.5 Å²	49.5	45%	0.454	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	43.4	178.3	0	0	0	0	0	112	T32 L91 A92 F93	T32-G95 WeakPolarHBondContact CG2-O 3.43Å; L91-G95 PolarHBondContact O-N 3.13Å; A92-G95 PolarHBondContact O-N 2.78Å; F93-G95 PolarHBondContact O-N 3Å
96	I	94.4	Very high	91.9	Very high	11 Å²	11	51 Å²	51	6%	0.056	29%	0.294	C	S	.	.			trans	-113.7	138.6	177.1	-62.9	163.1	0	0	0	107.3	T32 I67 Y70 Y71 L76 L91 W94 D100	T32-I96 HydrophobicContact CG2-CG1 4.2Å; I67-I96 HydrophobicContact CG1-CD1 4.33Å; I67-I96 HydrophobicContact CG2-CD1 3.67Å; Y70-I96 HydrophobicContact CD1-CD1 4.25Å; Y70-I96 HydrophobicContact CD1-CG2 4.16Å; Y70-I96 HydrophobicContact CE1-CG2 3.74Å; Y71-I96 HydrophobicContact CE2-CD1 4.04Å; L76-I96 HydrophobicContact CD2-CG2 3.85Å; L91-I96 HydrophobicContact CD2-CB 4.24Å; L91-I96 HydrophobicContact CD2-CD1 4.49Å; L91-I96 HydrophobicContact CD2-CG2 4.13Å; L91-I96 PolarHBondContact O-N 2.67Å; W94-I96 HydrophobicContact CB-CD1 4.04Å; W94-I96 HydrophobicContact CB-CG1 4.44Å; I96-D100 HydrophobicContact CG2-CB 4.43Å
97	D	90.8	Very high	91.6	Very high	88 Å²	88	53.8 Å²	53.8	47%	0.471	31%	0.307	S	S	.	.			trans	-75.4	146.4	-178.7	-163.1	-76.3	0	0	0	110.7	T99 D100	D97-T99 PolarHBondContact O-N 2.82Å; D97-T99 VanDerWaalsContact OD1-CB 3.3Å; D97-T99 WeakPolarHBondContact OD1-CB 3.36Å; D97-T99 WeakPolarHBondContact OD1-CG2 3.44Å; D97-T99 PolarHBondContact OD1-N 2.88Å; D97-T99 PolarHBondContact OD1-OG1 3.42Å; D97-D100 PolarHBondContact O-N 2.92Å
98	E	89.1	Confident	91.1	Very high	49 Å²	49	57.7 Å²	57.7	23%	0.229	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-69.2	-25.4	177.4	67.7	157.5	-143.9	0	0	112.8	D100 V101 W106 Y109 R113	E98-D100 PolarHBondContact O-N 3.2Å; E98-V101 WeakPolarHBondContact O-CB 3.38Å; E98-V101 VanDerWaalsContact O-CG2 3.28Å; E98-V101 WeakPolarHBondContact O-CG2 3.45Å; E98-V101 PolarHBondContact O-N 2.83Å; E98-V101 VanDerWaalsContact O-N 3.17Å; E98-W106 WeakPolarHBondContact O-CZ3 3.29Å; E98-Y109 HydrophobicContact CB-CE1 4.04Å; E98-Y109 PolarHBondContact OE2-OH 2.77Å; E98-R113 IonicContact OE1-CZ 3.96Å; E98-R113 IonicContact OE1-NH1 3.93Å; E98-R113 IonicContact OE1-NH2 2.76Å; E98-R113 PolarHBondContact OE1-NH2 3.21Å; E98-R113 IonicContact OE2-CZ 3.04Å; E98-R113 IonicContact OE2-NH1 2.79Å; E98-R113 PolarHBondContact OE2-NH1 3.42Å; E98-R113 IonicContact OE2-NH2 3.21Å; E98-R113 PolarHBondContact OE2-NH2 2.83Å
99	T	89.6	Confident	90.8	Very high	101 Å²	101	54.8 Å²	54.8	62%	0.62	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-72.2	-11.2	-179.2	63.9	0	0	0	0	113.5	D97 V101	D97-T99 PolarHBondContact O-N 2.82Å; D97-T99 VanDerWaalsContact OD1-CB 3.3Å; D97-T99 WeakPolarHBondContact OD1-CB 3.36Å; D97-T99 WeakPolarHBondContact OD1-CG2 3.44Å; D97-T99 PolarHBondContact OD1-N 2.88Å; D97-T99 PolarHBondContact OD1-OG1 3.42Å; T99-V101 PolarHBondContact O-N 3.11Å
100	D	91.4	Very high	90.4	Very high	65 Å²	65	52.3 Å²	52.3	35%	0.348	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-69.6	-15.5	169.6	-80.3	-61.5	0	0	0	113.3	Y70 L76 I96 D97 E98 E102	Y70-D100 HydrophobicContact CE1-CB 4.4Å; Y70-D100 HydrophobicContact CE2-CB 4.45Å; Y70-D100 PolarHBondContact OH-OD1 3.03Å; Y70-D100 PolarHBondContact OH-OD2 2.87Å; L76-D100 HydrophobicContact CB-CB 4.44Å; L76-D100 WeakPolarHBondContact CB-O 3.17Å; L76-D100 HydrophobicContact CD2-CB 3.82Å; I96-D100 HydrophobicContact CG2-CB 4.43Å; D97-D100 PolarHBondContact O-N 2.92Å; E98-D100 PolarHBondContact O-N 3.2Å; D100-E102 PolarHBondContact O-N 2.72Å
101	V	93.4	Very high	89.6	Confident	7 Å²	7	56.5 Å²	56.5	4%	0.042	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-65.6	121.6	-177.3	174.1	0	0	0	0	111.2	L76 Y87 L91 E98 T99 C105 W106	L76-V101 HydrophobicContact CD2-CG2 3.7Å; L76-V101 HydrophobicContact CG-CG2 4.22Å; Y87-V101 HydrophobicContact CE1-CG2 4.13Å; L91-V101 HydrophobicContact CD1-CG2 4.03Å; E98-V101 WeakPolarHBondContact O-CB 3.38Å; E98-V101 VanDerWaalsContact O-CG2 3.28Å; E98-V101 WeakPolarHBondContact O-CG2 3.45Å; E98-V101 PolarHBondContact O-N 2.83Å; E98-V101 VanDerWaalsContact O-N 3.17Å; T99-V101 PolarHBondContact O-N 3.11Å; V101-C105 HydrophobicContact CG1-CB 3.78Å; V101-W106 HydrophobicContact CB-CE3 4.18Å; V101-W106 HydrophobicContact CG1-CE3 4.46Å
102	E	93.4	Very high	88.6	Confident	43 Å²	43	59.6 Å²	59.6	20%	0.201	34%	0.337	C	S	.	.			trans	-59.1	145.1	-175.7	-75.7	-97.7	137	0	0	112.9	K75 L76 H77 D100 C104 C105 W106	K75-E102 HydrophobicContact CB-CG 3.99Å; K75-E102 HydrophobicContact CG-CG 4.44Å; K75-E102 WeakPolarHBondContact CG-OE1 3.26Å; K75-E102 IonicContact NZ-OE1 3.84Å; K75-E102 PolarHBondContact NZ-OE1 2.78Å; K75-E102 IonicContact NZ-OE2 3.56Å; K75-E102 PolarHBondContact NZ-OE2 3.22Å; L76-E102 WeakPolarHBondContact O-CB 3.42Å; L76-E102 WeakPolarHBondContact O-CG 3.44Å; L76-E102 PolarHBondContact O-N 3.02Å; H77-E102 IonicContact CE1-OE2 2.69Å; D100-E102 PolarHBondContact O-N 2.72Å; E102-C104 PolarHBondContact O-N 2.95Å; E102-C105 WeakPolarHBondContact O-CA 3.41Å; E102-C105 PolarHBondContact O-N 3.37Å; E102-W106 PolarHBondContact O-N 3.38Å
103	P	90.1	Very high	87.8	Confident	109 Å²	109	57.8 Å²	57.8	71%	0.708	31%	0.313	S	S	*	.	H	α-helix	trans	-56.3	-24.8	-174.8	-29.1	35.7	0	0	0	116	C105	P103-C105 VanDerWaalsContact C-N 3.3Å
104	C	89.1	Confident	86.8	Confident	90 Å²	90	58.6 Å²	58.6	61%	0.608	32%	0.317	S	S	*	.	H	α-helix	trans	-73.3	-20	175	58.5	0	0	0	0	113.8	H77 E102	H77-C104 VanDerWaalsContact CE1-SG 3.58Å; E102-C104 PolarHBondContact O-N 2.95Å
105	C	89.6	Confident	85.5	Confident	16 Å²	16	58.8 Å²	58.8	11%	0.108	32%	0.319	C	S	.	.	H	α-helix	trans	-102.8	-24.8	176.5	-65.8	0	0	0	0	112.5	C78 V101 E102 P103 M107 T108 Y109	C78-C105 HydrophobicContact CB-CB 3.91Å; C78-C105 PolarHBondContact N-SG 2.89Å; C78-C105 VanDerWaalsContact N-SG 3.36Å; V101-C105 HydrophobicContact CG1-CB 3.78Å; E102-C105 WeakPolarHBondContact O-CA 3.41Å; E102-C105 PolarHBondContact O-N 3.37Å; P103-C105 VanDerWaalsContact C-N 3.3Å; C105-M107 PolarHBondContact O-N 3.35Å; C105-T108 PolarHBondContact O-N 3.45Å; C105-Y109 PolarHBondContact O-N 3.36Å
106	W	88.1	Confident	84.4	Confident	68 Å²	68	60 Å²	60	26%	0.258	31%	0.313	S	S	.	.	H	α-helix	trans	-48.2	-50.3	-175.7	-174.4	-100	0	0	0	113.6	E98 V101 E102 T108 Y109 R110	E98-W106 WeakPolarHBondContact O-CZ3 3.29Å; V101-W106 HydrophobicContact CB-CE3 4.18Å; V101-W106 HydrophobicContact CG1-CE3 4.46Å; E102-W106 PolarHBondContact O-N 3.38Å; W106-T108 PolarHBondContact O-N 3.17Å; W106-Y109 PolarHBondContact O-N 3.34Å; W106-R110 VanDerWaalsContact CZ2-CD 3.46Å; W106-R110 PolarHBondContact O-N 3.36Å
107	M	82.7	Confident	83.2	Confident	117 Å²	117	64.4 Å²	64.4	58%	0.576	33%	0.333	S	S	*	.	H	α-helix	trans	-60.9	-43.5	179.8	-63.3	-52.9	-53.6	0	0	112.3	C105 Q111	C105-M107 PolarHBondContact O-N 3.35Å; M107-Q111 WeakPolarHBondContact O-CB 3.43Å; M107-Q111 PolarHBondContact O-N 2.87Å
108	T	82.4	Confident	81.9	Confident	82 Å²	82	61 Å²	61	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-68.4	-39.1	179.8	-49.3	0	0	0	0	111.8	C105 W106	C105-T108 PolarHBondContact O-N 3.45Å; W106-T108 PolarHBondContact O-N 3.17Å
109	Y	85.3	Confident	80.7	Confident	4 Å²	4	59.5 Å²	59.5	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-52.5	175.8	171.5	-116.5	0	0	0	111.1	Y87 E88 E98 C105 W106	Y87-Y109 AromaticContact CD1-CD2 3.93Å; Y87-Y109 HydrophobicContact CD1-CD2 3.93Å; Y87-Y109 HydrophobicContact CD1-CE2 4.06Å; E88-Y109 HydrophobicContact CB-CE2 4.1Å; E88-Y109 WeakPolarHBondContact CG-OH 3.45Å; E98-Y109 HydrophobicContact CB-CE1 4.04Å; E98-Y109 PolarHBondContact OE2-OH 2.77Å; C105-Y109 PolarHBondContact O-N 3.36Å; W106-Y109 PolarHBondContact O-N 3.34Å
110	R	83.6	Confident	79.5	Confident	74 Å²	74	58.9 Å²	58.9	28%	0.279	30%	0.304	S	S	.	.	H	α-helix	trans	-78.9	-24	-175.5	-122.3	170.5	178.1	-121	6.1	114.8	W106 H112 R113 E114	W106-R110 VanDerWaalsContact CZ2-CD 3.46Å; W106-R110 PolarHBondContact O-N 3.36Å; R110-H112 PolarHBondContact O-N 3.22Å; R110-H112 VanDerWaalsContact O-N 3.09Å; R110-R113 CarbonylContact O-C 3.58Å; R110-R113 WeakPolarHBondContact O-CA 3.49Å; R110-R113 PolarHBondContact O-N 3.2Å; R110-E114 HydrophobicContact CB-CG 4.15Å; R110-E114 WeakPolarHBondContact CD-OE1 3.35Å; R110-E114 HydrophobicContact CG-CG 4.01Å; R110-E114 IonicContact CZ-OE1 3.28Å; R110-E114 IonicContact NH1-OE1 2.87Å; R110-E114 PolarHBondContact NH1-OE1 3.16Å; R110-E114 PolarHBondContact O-N 3.03Å
111	Q	78.8	Confident	77.9	Confident	91 Å²	91	58.9 Å²	58.9	43%	0.425	31%	0.309	S	S	.	.	H	α-helix	trans	-50.1	-38.4	-177.5	171	179.1	98	0	0	114.1	M107 A115 M437	M107-Q111 WeakPolarHBondContact O-CB 3.43Å; M107-Q111 PolarHBondContact O-N 2.87Å; Q111-A115 VanDerWaalsContact O-CB 3.24Å; Q111-A115 WeakPolarHBondContact O-CB 3.43Å; Q111-A115 PolarHBondContact O-N 2.88Å; Q111-M437 HydrophobicContact CG-CE 4.27Å; Q111-M437 HydrophobicContact CG-SD 4.16Å; Q111-M437 PolarHBondContact NE2-SD 3.46Å; Q111-M437 VanDerWaalsContact NE2-SD 3.37Å
112	H	73.4	Confident	76	Confident	69 Å²	69	61.6 Å²	61.6	32%	0.319	32%	0.32	S	S	.	.	H	α-helix	trans	-72.3	-43	175.6	-165.4	-72.2	0	0	0	111.6	R110 E116	R110-H112 PolarHBondContact O-N 3.22Å; R110-H112 VanDerWaalsContact O-N 3.09Å; H112-E116 IonicContact CE1-OE2 2.94Å; H112-E116 PolarHBondContact CE1-OE2 3.2Å; H112-E116 IonicContact ND1-OE2 2.77Å; H112-E116 PolarHBondContact ND1-OE2 3.46Å; H112-E116 WeakPolarHBondContact O-CB 3.24Å; H112-E116 PolarHBondContact O-N 2.92Å
113	R	76.8	Confident	73.7	Confident	40 Å²	40	62.8 Å²	62.8	15%	0.151	34%	0.344	C	S	.	.	H	α-helix	trans	-67	-50.8	-179.8	-177.7	166.8	69.3	-163	0.3	111.9	E88 E98 R110 A115 E116 E117	E88-R113 IonicContact OE1-CZ 2.67Å; E88-R113 IonicContact OE1-NH1 3.73Å; E88-R113 PolarHBondContact OE1-NH1 3.16Å; E88-R113 IonicContact OE2-NH1 3.48Å; E98-R113 IonicContact OE1-CZ 3.96Å; E98-R113 IonicContact OE1-NH1 3.93Å; E98-R113 IonicContact OE1-NH2 2.76Å; E98-R113 PolarHBondContact OE1-NH2 3.21Å; E98-R113 IonicContact OE2-CZ 3.04Å; E98-R113 IonicContact OE2-NH1 2.79Å; E98-R113 PolarHBondContact OE2-NH1 3.42Å; E98-R113 IonicContact OE2-NH2 3.21Å; E98-R113 PolarHBondContact OE2-NH2 2.83Å; R110-R113 CarbonylContact O-C 3.58Å; R110-R113 WeakPolarHBondContact O-CA 3.49Å; R110-R113 PolarHBondContact O-N 3.2Å; R113-A115 PolarHBondContact O-N 2.88Å; R113-E116 CarbonylContact O-C 3.58Å; R113-E116 WeakPolarHBondContact O-CA 3.35Å; R113-E116 WeakPolarHBondContact O-CB 3.17Å; R113-E116 PolarHBondContact O-N 3.26Å; R113-E117 HydrophobicContact CG-CG 4.18Å; R113-E117 VanDerWaalsContact CG-OE1 3.27Å; R113-E117 WeakPolarHBondContact CG-OE1 3.35Å; R113-E117 IonicContact NE-OE1 2.71Å; R113-E117 WeakPolarHBondContact O-CB 3.35Å; R113-E117 VanDerWaalsContact O-CG 3.29Å; R113-E117 WeakPolarHBondContact O-CG 3.45Å; R113-E117 PolarHBondContact O-N 2.9Å
114	E	74.2	Confident	71.1	Confident	62 Å²	62	59.8 Å²	59.8	29%	0.29	33%	0.333	S	S	.	.	H	α-helix	trans	-59.5	-35.8	178.5	-66.2	179.3	162.1	0	0	111.9	R110 A118	R110-E114 HydrophobicContact CB-CG 4.15Å; R110-E114 WeakPolarHBondContact CD-OE1 3.35Å; R110-E114 HydrophobicContact CG-CG 4.01Å; R110-E114 IonicContact CZ-OE1 3.28Å; R110-E114 IonicContact NH1-OE1 2.87Å; R110-E114 PolarHBondContact NH1-OE1 3.16Å; R110-E114 PolarHBondContact O-N 3.03Å; E114-A118 WeakPolarHBondContact O-CB 3.32Å; E114-A118 PolarHBondContact O-N 3.48Å
115	A	67.3	Low	68.6	Low	5 Å²	5	58.6 Å²	58.6	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-79.1	-29.4	174.8	0	0	0	0	0	113.6	Q111 R113 L119 Y438 L441	Q111-A115 VanDerWaalsContact O-CB 3.24Å; Q111-A115 WeakPolarHBondContact O-CB 3.43Å; Q111-A115 PolarHBondContact O-N 2.88Å; R113-A115 PolarHBondContact O-N 2.88Å; A115-L119 VanDerWaalsContact O-CB 3.28Å; A115-L119 WeakPolarHBondContact O-CB 3.29Å; A115-L119 VanDerWaalsContact O-CD1 3.3Å; A115-L119 WeakPolarHBondContact O-CD1 3.48Å; A115-L119 WeakPolarHBondContact O-CG 3.39Å; A115-L119 PolarHBondContact O-N 3.16Å; A115-Y438 HydrophobicContact CB-CD1 4.49Å; A115-Y438 HydrophobicContact CB-CE1 4.29Å; A115-L441 HydrophobicContact CB-CD1 3.35Å
116	E	68.7	Low	66	Low	69 Å²	69	60.9 Å²	60.9	32%	0.322	36%	0.362	S	S	.	.	H	α-helix	trans	-67.7	-50.4	171.9	-176.6	110.9	-113.3	0	0	110.8	H112 R113 A118 L119 D120 K445	H112-E116 IonicContact CE1-OE2 2.94Å; H112-E116 PolarHBondContact CE1-OE2 3.2Å; H112-E116 IonicContact ND1-OE2 2.77Å; H112-E116 PolarHBondContact ND1-OE2 3.46Å; H112-E116 WeakPolarHBondContact O-CB 3.24Å; H112-E116 PolarHBondContact O-N 2.92Å; R113-E116 CarbonylContact O-C 3.58Å; R113-E116 WeakPolarHBondContact O-CA 3.35Å; R113-E116 WeakPolarHBondContact O-CB 3.17Å; R113-E116 PolarHBondContact O-N 3.26Å; E116-A118 VanDerWaalsContact C-N 3.35Å; E116-A118 PolarHBondContact O-N 3.48Å; E116-L119 CarbonylContact O-C 3.57Å; E116-L119 WeakPolarHBondContact O-CB 3.27Å; E116-L119 PolarHBondContact O-N 3.21Å; E116-L119 VanDerWaalsContact O-N 3.13Å; E116-D120 WeakPolarHBondContact O-CB 3.47Å; E116-D120 PolarHBondContact O-N 3.21Å; E116-K445 WeakPolarHBondContact OE1-CE 3.42Å; E116-K445 IonicContact OE1-NZ 2.95Å; E116-K445 PolarHBondContact OE1-NZ 3.45Å
117	E	69.1	Low	63.4	Low	103 Å²	103	61.3 Å²	61.3	48%	0.481	37%	0.369	S	S	.	.	H	α-helix	trans	-54.1	-48.2	171.9	-73.1	169.7	-178	0	0	111.1	R113 D120 S121	R113-E117 HydrophobicContact CG-CG 4.18Å; R113-E117 VanDerWaalsContact CG-OE1 3.27Å; R113-E117 WeakPolarHBondContact CG-OE1 3.35Å; R113-E117 IonicContact NE-OE1 2.71Å; R113-E117 WeakPolarHBondContact O-CB 3.35Å; R113-E117 VanDerWaalsContact O-CG 3.29Å; R113-E117 WeakPolarHBondContact O-CG 3.45Å; R113-E117 PolarHBondContact O-N 2.9Å; E117-D120 PolarHBondContact O-N 3.24Å; E117-S121 WeakPolarHBondContact O-CB 3.37Å; E117-S121 PolarHBondContact O-N 3.24Å
118	A	64.8	Low	61	Low	16 Å²	16	62.1 Å²	62.1	13%	0.132	38%	0.375	C	S	.	.	H	α-helix	trans	-58.1	-53.4	173.5	0	0	0	0	0	110.4	E114 E116 D120 S121 F122 Y438	E114-A118 WeakPolarHBondContact O-CB 3.32Å; E114-A118 PolarHBondContact O-N 3.48Å; E116-A118 VanDerWaalsContact C-N 3.35Å; E116-A118 PolarHBondContact O-N 3.48Å; A118-D120 VanDerWaalsContact C-N 3.26Å; A118-D120 PolarHBondContact O-N 3.22Å; A118-S121 WeakPolarHBondContact O-CB 3.46Å; A118-S121 PolarHBondContact O-N 2.85Å; A118-S121 VanDerWaalsContact O-N 3.15Å; A118-S121 PolarHBondContact O-OG 2.96Å; A118-F122 HydrophobicContact CB-CE1 4.19Å; A118-F122 HydrophobicContact CB-CZ 3.78Å; A118-F122 WeakPolarHBondContact O-CD1 3.38Å; A118-F122 WeakPolarHBondContact O-CE1 3.48Å; A118-F122 VanDerWaalsContact O-CG 3.24Å; A118-F122 WeakPolarHBondContact O-CG 3.41Å; A118-F122 WeakPolarHBondContact O-CZ 3.37Å; A118-F122 PolarHBondContact O-N 3.31Å; A118-F122 VanDerWaalsContact O-N 3.14Å; A118-Y438 HydrophobicContact CB-CD1 4.28Å; A118-Y438 HydrophobicContact CB-CE1 3.61Å
119	L	63.6	Low	58.6	Low	18 Å²	18	64.3 Å²	64.3	9%	0.094	38%	0.384	C	S	.	.	H	α-helix	trans	-58.2	-35.1	-179.9	-76.7	164.3	0	0	0	113.6	A115 E116 F122 G123 L441 A442 K445	A115-L119 VanDerWaalsContact O-CB 3.28Å; A115-L119 WeakPolarHBondContact O-CB 3.29Å; A115-L119 VanDerWaalsContact O-CD1 3.3Å; A115-L119 WeakPolarHBondContact O-CD1 3.48Å; A115-L119 WeakPolarHBondContact O-CG 3.39Å; A115-L119 PolarHBondContact O-N 3.16Å; E116-L119 CarbonylContact O-C 3.57Å; E116-L119 WeakPolarHBondContact O-CB 3.27Å; E116-L119 PolarHBondContact O-N 3.21Å; E116-L119 VanDerWaalsContact O-N 3.13Å; L119-F122 HydrophobicContact CD2-CD2 3.95Å; L119-F122 HydrophobicContact CD2-CE2 3.96Å; L119-F122 HydrophobicContact CG-CE2 4.34Å; L119-F122 WeakPolarHBondContact O-CA 3.46Å; L119-F122 VanDerWaalsContact O-CB 3.32Å; L119-F122 WeakPolarHBondContact O-CB 3.43Å; L119-F122 PolarHBondContact O-N 2.95Å; L119-F122 VanDerWaalsContact O-N 3.17Å; L119-G123 PolarHBondContact O-N 3.49Å; L119-L441 HydrophobicContact CD1-CB 3.63Å; L119-A442 HydrophobicContact CD2-CB 3.78Å; L119-K445 HydrophobicContact CB-CD 4Å; L119-K445 HydrophobicContact CD1-CD 3.92Å; L119-K445 HydrophobicContact CD1-CG 4.34Å; L119-K445 HydrophobicContact CG-CD 4.46Å
120	D	63.1	Low	56.2	Low	88 Å²	88	71.8 Å²	71.8	47%	0.471	42%	0.423	S	S	.	.	H	α-helix	trans	-85.4	-24	-179.3	-67.6	-12	0	0	0	111.9	E116 E117 A118 F122 G123 G124 K445	E116-D120 WeakPolarHBondContact O-CB 3.47Å; E116-D120 PolarHBondContact O-N 3.21Å; E117-D120 PolarHBondContact O-N 3.24Å; A118-D120 VanDerWaalsContact C-N 3.26Å; A118-D120 PolarHBondContact O-N 3.22Å; D120-F122 PolarHBondContact O-N 3.21Å; D120-G123 CarbonylContact O-C 3.59Å; D120-G123 WeakPolarHBondContact O-CA 3.39Å; D120-G123 PolarHBondContact O-N 2.88Å; D120-G124 PolarHBondContact O-N 2.69Å; D120-K445 IonicContact OD1-NZ 3.87Å; D120-K445 PolarHBondContact OD1-NZ 3.07Å; D120-K445 IonicContact OD2-NZ 3.49Å; D120-K445 PolarHBondContact OD2-NZ 3.28Å; D120-K445 VanDerWaalsContact OD2-NZ 3.17Å
121	S	57.5	Low	53.8	Low	65 Å²	65	71.8 Å²	71.8	46%	0.455	45%	0.446	S	S	.	.	H	α-helix	trans	-64.2	-16.7	159.6	86.8	0	0	0	0	113.2	E117 A118	E117-S121 WeakPolarHBondContact O-CB 3.37Å; E117-S121 PolarHBondContact O-N 3.24Å; A118-S121 WeakPolarHBondContact O-CB 3.46Å; A118-S121 PolarHBondContact O-N 2.85Å; A118-S121 VanDerWaalsContact O-N 3.15Å; A118-S121 PolarHBondContact O-OG 2.96Å
122	F	54.4	Low	51.3	Low	64 Å²	64	72 Å²	72	28%	0.281	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-14.7	169.8	-39.4	-24.3	0	0	0	112.1	A118 L119 D120 H332	A118-F122 HydrophobicContact CB-CE1 4.19Å; A118-F122 HydrophobicContact CB-CZ 3.78Å; A118-F122 WeakPolarHBondContact O-CD1 3.38Å; A118-F122 WeakPolarHBondContact O-CE1 3.48Å; A118-F122 VanDerWaalsContact O-CG 3.24Å; A118-F122 WeakPolarHBondContact O-CG 3.41Å; A118-F122 WeakPolarHBondContact O-CZ 3.37Å; A118-F122 PolarHBondContact O-N 3.31Å; A118-F122 VanDerWaalsContact O-N 3.14Å; L119-F122 HydrophobicContact CD2-CD2 3.95Å; L119-F122 HydrophobicContact CD2-CE2 3.96Å; L119-F122 HydrophobicContact CG-CE2 4.34Å; L119-F122 WeakPolarHBondContact O-CA 3.46Å; L119-F122 VanDerWaalsContact O-CB 3.32Å; L119-F122 WeakPolarHBondContact O-CB 3.43Å; L119-F122 PolarHBondContact O-N 2.95Å; L119-F122 VanDerWaalsContact O-N 3.17Å; D120-F122 PolarHBondContact O-N 3.21Å; F122-H332 HydrophobicContact CD1-CB 3.99Å; F122-H332 AromaticContact CD1-CD2 3.74Å; F122-H332 AromaticContact CD1-CE1 3.41Å; F122-H332 VanDerWaalsContact CD1-CE1 3.41Å; F122-H332 WeakPolarHBondContact CD1-CE1 3.28Å; F122-H332 AromaticContact CD1-CG 3.4Å; F122-H332 VanDerWaalsContact CD1-CG 3.4Å; F122-H332 AromaticContact CD1-ND1 3.17Å; F122-H332 WeakPolarHBondContact CD1-ND1 3.4Å; F122-H332 AromaticContact CD1-NE2 3.79Å; F122-H332 HydrophobicContact CD2-CB 4.38Å; F122-H332 HydrophobicContact CE1-CB 3.46Å; F122-H332 VanDerWaalsContact CE1-CB 3.46Å; F122-H332 AromaticContact CE1-CG 3.4Å; F122-H332 VanDerWaalsContact CE1-CG 3.4Å; F122-H332 AromaticContact CE1-ND1 3.34Å; F122-H332 VanDerWaalsContact CE1-ND1 3.34Å; F122-H332 WeakPolarHBondContact CE1-ND1 3.32Å; F122-H332 HydrophobicContact CE2-CB 3.89Å; F122-H332 HydrophobicContact CG-CB 4.46Å; F122-H332 AromaticContact CG-CD2 3.75Å; F122-H332 AromaticContact CG-CE1 3.96Å; F122-H332 AromaticContact CG-CG 3.86Å; F122-H332 AromaticContact CG-ND1 3.98Å; F122-H332 AromaticContact CG-NE2 3.87Å; F122-H332 HydrophobicContact CZ-CB 3.42Å; F122-H332 VanDerWaalsContact CZ-CB 3.42Å; F122-H332 AromaticContact CZ-CG 3.82Å
123	G	45.8	Very low	49.4	Very low	68 Å²	68	78.2 Å²	78.2	70%	0.701	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-39.2	174.4	0	0	0	0	0	113.1	L119 D120	L119-G123 PolarHBondContact O-N 3.49Å; D120-G123 CarbonylContact O-C 3.59Å; D120-G123 WeakPolarHBondContact O-CA 3.39Å; D120-G123 PolarHBondContact O-N 2.88Å
124	G	35.9	Very low	47.1	Very low	46 Å²	46	83.2 Å²	83.2	47%	0.474	52%	0.517	S	S	.	.	S	Bend	trans	-75.2	119.4	171.4	0	0	0	0	0	111.4	D120 G126	D120-G124 PolarHBondContact O-N 2.69Å; G124-G126 PolarHBondContact O-N 3.33Å
125	G	36.6	Very low	45.1	Very low	65 Å²	65	86.3 Å²	86.3	67%	0.67	54%	0.542	S	S	*	.			trans	-75.7	63.9	-179.8	0	0	0	0	0	113.9
126	G	34.3	Very low	43.3	Very low	65 Å²	65	94.6 Å²	94.6	67%	0.67	58%	0.58	S	S	*	*			trans	-143.3	87.6	-176	0	0	0	0	0	113.4	G124	G124-G126 PolarHBondContact O-N 3.33Å
127	L	32.3	Very low	41.4	Very low	76 Å²	76	97.1 Å²	97.1	40%	0.398	60%	0.602	S	S	.	*			trans	-86.1	136.8	166.8	-165.8	76.2	0	0	0	109.4	A273	L127-A273 HydrophobicContact CD2-CB 4.49Å
128	L	32.3	Very low	39.4	Very low	135 Å²	135	101.1 Å²	101.1	71%	0.707	62%	0.621	S	S	*	*			trans	77	71.5	-174.7	-49.2	177.3	0	0	0	114.8
129	D	32.8	Very low	37.9	Very low	128 Å²	128	106.3 Å²	106.3	68%	0.684	65%	0.654	S	S	*	*				-110	129.4	119.6	-169.2	6.8	0	0	0	108.9
130	L	35.4	Very low	36.2	Very low	161 Å²	161	114.2 Å²	114.2	84%	0.843	69%	0.69	S	S	*	*			trans	179.1	61.2	169.3	-152.5	78.5	0	0	0	107.8
131	G	31.7	Very low	34.8	Very low	74 Å²	74	118.8 Å²	118.8	76%	0.763	71%	0.708	S	S	*	*			trans	-160.5	10.9	-166.1	0	0	0	0	0	119.3
132	S	28.2	Very low	33.5	Very low	95 Å²	95	124 Å²	124	66%	0.664	73%	0.725	S	S	*	*			trans	-147.5	113.4	173.1	46.6	0	0	0	0	111.6	D134	S132-D134 PolarHBondContact O-N 3.42Å
133	E	32.7	Very low	32.6	Very low	200 Å²	200	128 Å²	128	94%	0.935	75%	0.749	S	S	*	*			trans	-83.5	89.5	168	-67.7	172.6	96.8	0	0	109.3
134	D	28.9	Very low	32.1	Very low	144 Å²	144	130.8 Å²	130.8	77%	0.77	75%	0.749	S	S	*	*			trans	-152.7	128.5	164.7	-98.9	-44.8	0	0	0	109.6	S132 E136	S132-D134 PolarHBondContact O-N 3.42Å; D134-E136 PolarHBondContact O-N 3.03Å
135	P	31.6	Very low	32.2	Very low	127 Å²	127	131.9 Å²	131.9	83%	0.825	74%	0.743	S	S	*	*			trans	-90.4	91.3	-179	34.2	-32.6	0	0	0	111.9
136	E	30.1	Very low	32.4	Very low	180 Å²	180	133.4 Å²	133.4	84%	0.841	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-86.7	155.7	163.5	-70.4	-154.5	142.8	0	0	111.8	D134	D134-E136 PolarHBondContact O-N 3.03Å
137	P	29	Very low	32.5	Very low	122 Å²	122	134.6 Å²	134.6	79%	0.792	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-73.6	152.9	-168.5	-14.4	30.2	0	0	0	113.6
138	E	27.2	Very low	32.7	Very low	186 Å²	186	134.7 Å²	134.7	87%	0.869	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-61	132.8	176.8	-60.9	-172.8	161.2	0	0	112.2
139	P	31.7	Very low	32.9	Very low	126 Å²	126	135.1 Å²	135.1	82%	0.818	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-76.9	121.9	165.4	30.7	-31	0	0	0	109.9
140	E	29	Very low	33.3	Very low	183 Å²	183	136.9 Å²	136.9	86%	0.855	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-58.1	151.2	177.4	-59.8	178.7	157.8	0	0	112.2	E142	E140-E142 PolarHBondContact O-N 2.86Å
141	H	32.8	Very low	33.5	Very low	185 Å²	185	136 Å²	136	86%	0.856	71%	0.711	S	S	*	*			trans	-55.8	103.7	-174.2	-78.7	-80.8	0	0	0	114.7
142	E	31.7	Very low	33.7	Very low	174 Å²	174	136.4 Å²	136.4	81%	0.813	71%	0.707	S	S	*	*			trans	-85.4	-3.9	171.6	-74.8	-157.1	133.6	0	0	115	E140 D144 D145	E140-E142 PolarHBondContact O-N 2.86Å; E142-D144 VanDerWaalsContact C-N 3.31Å; E142-D144 PolarHBondContact O-N 2.81Å; E142-D145 PolarHBondContact O-N 2.96Å
143	D	34.8	Very low	34	Very low	147 Å²	147	138.9 Å²	138.9	79%	0.786	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-22.6	-172	-100	-40	0	0	0	115	D145	D143-D145 VanDerWaalsContact C-N 3.35Å
144	D	35.9	Very low	34.1	Very low	128 Å²	128	132.4 Å²	132.4	68%	0.684	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-17.1	178.6	-98.9	-23.7	0	0	0	113.6	E142 E146 M147 T148	E142-D144 VanDerWaalsContact C-N 3.31Å; E142-D144 PolarHBondContact O-N 2.81Å; D144-E146 PolarHBondContact O-N 3.26Å; D144-M147 PolarHBondContact O-N 3.15Å; D144-T148 PolarHBondContact O-N 2.83Å; D144-T148 PolarHBondContact O-OG1 3.13Å
145	D	36.8	Very low	34.5	Very low	68 Å²	68	133.9 Å²	133.9	36%	0.364	70%	0.703	S	S	.	*	H	α-helix	trans	-76.3	-26.3	-172.5	-152.9	44.7	0	0	0	112.6	E142 D143 T148 R149	E142-D145 PolarHBondContact O-N 2.96Å; D143-D145 VanDerWaalsContact C-N 3.35Å; D145-T148 PolarHBondContact O-N 3.27Å; D145-R149 WeakPolarHBondContact O-CB 3.3Å; D145-R149 WeakPolarHBondContact O-CG 3.34Å; D145-R149 PolarHBondContact O-N 3.4Å; D145-R149 IonicContact OD2-CZ 3.14Å; D145-R149 IonicContact OD2-NE 3.03Å; D145-R149 PolarHBondContact OD2-NE 3.35Å; D145-R149 IonicContact OD2-NH2 2.72Å; D145-R149 PolarHBondContact OD2-NH2 3.23Å
146	E	41.7	Very low	34.5	Very low	97 Å²	97	132.5 Å²	132.5	45%	0.453	70%	0.696	S	S	.	*	H	α-helix	trans	-72.5	-27.8	171.9	174.8	60.4	-164.2	0	0	112.4	D144 R150	D144-E146 PolarHBondContact O-N 3.26Å; E146-R150 VanDerWaalsContact O-CD 3.3Å; E146-R150 WeakPolarHBondContact O-CD 3.49Å; E146-R150 VanDerWaalsContact O-CG 3.26Å; E146-R150 WeakPolarHBondContact O-CG 3.26Å; E146-R150 IonicContact OE1-CZ 3.09Å; E146-R150 IonicContact OE1-NE 2.81Å; E146-R150 PolarHBondContact OE1-NE 2.87Å; E146-R150 IonicContact OE1-NH2 2.66Å; E146-R150 PolarHBondContact OE1-NH2 3.23Å
147	M	35.4	Very low	35	Very low	91 Å²	91	128.9 Å²	128.9	45%	0.448	69%	0.688	S	S	.	*	H	α-helix	trans	-72.9	-42.8	170.7	-173.6	67	175.8	0	0	110.3	D144 R150	D144-M147 PolarHBondContact O-N 3.15Å; M147-R150 PolarHBondContact O-N 3.11Å
148	T	36.9	Very low	35.4	Very low	78 Å²	78	130 Å²	130	48%	0.479	69%	0.687	S	S	.	*	H	α-helix	trans	-67.2	-42.7	-179.4	-57.9	0	0	0	0	112.2	D144 D145 R150 L151 A152	D144-T148 PolarHBondContact O-N 2.83Å; D144-T148 PolarHBondContact O-OG1 3.13Å; D145-T148 PolarHBondContact O-N 3.27Å; T148-R150 PolarHBondContact O-N 3.38Å; T148-L151 PolarHBondContact O-N 2.74Å; T148-A152 PolarHBondContact O-N 2.95Å
149	R	37.2	Very low	36.1	Very low	144 Å²	144	127.2 Å²	127.2	54%	0.543	68%	0.683	S	S	.	*	H	α-helix	trans	-57.4	-34.2	173.8	-77.1	171.3	-170.2	174.6	5.2	113.4	D145 L151 A152 Q153	D145-R149 WeakPolarHBondContact O-CB 3.3Å; D145-R149 WeakPolarHBondContact O-CG 3.34Å; D145-R149 PolarHBondContact O-N 3.4Å; D145-R149 IonicContact OD2-CZ 3.14Å; D145-R149 IonicContact OD2-NE 3.03Å; D145-R149 PolarHBondContact OD2-NE 3.35Å; D145-R149 IonicContact OD2-NH2 2.72Å; D145-R149 PolarHBondContact OD2-NH2 3.23Å; R149-L151 VanDerWaalsContact C-N 3.3Å; R149-L151 PolarHBondContact O-N 3.06Å; R149-A152 PolarHBondContact O-N 3.31Å; R149-Q153 WeakPolarHBondContact O-CG 3.42Å; R149-Q153 PolarHBondContact O-N 3.41Å
150	R	41.6	Very low	36.8	Very low	164 Å²	164	132.3 Å²	132.3	62%	0.619	69%	0.686	S	S	*	*	H	α-helix	trans	-73.6	-17.8	177.5	-68.8	168.9	-173.2	172	5.2	114	E146 M147 T148	E146-R150 VanDerWaalsContact O-CD 3.3Å; E146-R150 WeakPolarHBondContact O-CD 3.49Å; E146-R150 VanDerWaalsContact O-CG 3.26Å; E146-R150 WeakPolarHBondContact O-CG 3.26Å; E146-R150 IonicContact OE1-CZ 3.09Å; E146-R150 IonicContact OE1-NE 2.81Å; E146-R150 PolarHBondContact OE1-NE 2.87Å; E146-R150 IonicContact OE1-NH2 2.66Å; E146-R150 PolarHBondContact OE1-NH2 3.23Å; M147-R150 PolarHBondContact O-N 3.11Å; T148-R150 PolarHBondContact O-N 3.38Å
151	L	39.5	Very low	37.5	Very low	143 Å²	143	128.5 Å²	128.5	75%	0.749	68%	0.679	S	S	*	*	H	α-helix	trans	-94.1	-29.1	173.6	-65.6	174.3	0	0	0	112.2	T148 R149	T148-L151 PolarHBondContact O-N 2.74Å; R149-L151 VanDerWaalsContact C-N 3.3Å; R149-L151 PolarHBondContact O-N 3.06Å
152	A	35.8	Very low	38.5	Very low	82 Å²	82	121.9 Å²	121.9	68%	0.678	66%	0.661	S	S	*	*	H	α-helix	trans	-72.7	-23.5	175.7	0	0	0	0	0	113.8	T148 R149 G154	T148-A152 PolarHBondContact O-N 2.95Å; R149-A152 PolarHBondContact O-N 3.31Å; A152-G154 VanDerWaalsContact C-N 3.31Å; A152-G154 PolarHBondContact O-N 2.86Å
153	Q	34.8	Very low	40.5	Very low	148 Å²	148	116.8 Å²	116.8	69%	0.692	64%	0.644	S	S	*	*			trans	-84.6	65.1	179.8	-71.8	-175.9	-4.7	0	0	113.2	R149	R149-Q153 WeakPolarHBondContact O-CG 3.42Å; R149-Q153 PolarHBondContact O-N 3.41Å
154	G	34.3	Very low	42.6	Very low	64 Å²	64	115.6 Å²	115.6	66%	0.66	64%	0.637	S	S	*	*			trans	-70.1	128.9	160.4	0	0	0	0	0	111.2	A152 S156	A152-G154 VanDerWaalsContact C-N 3.31Å; A152-G154 PolarHBondContact O-N 2.86Å; G154-S156 PolarHBondContact O-N 3.02Å
155	D	37.8	Very low	44.7	Very low	174 Å²	174	116.2 Å²	116.2	93%	0.93	63%	0.63	S	S	*	*	S	Bend	trans	31.5	78	168.8	-69.4	-27.7	0	0	0	117.9
156	S	30.2	Very low	46.8	Very low	98 Å²	98	115 Å²	115	69%	0.685	63%	0.627	S	S	*	*			trans	-133.7	128.8	157.1	-175.2	0	0	0	0	110.6	G154 D158	G154-S156 PolarHBondContact O-N 3.02Å; S156-D158 PolarHBondContact O-N 2.85Å
157	P	41.5	Very low	48.8	Very low	104 Å²	104	117.2 Å²	117.2	68%	0.675	63%	0.632	S	S	*	*			trans	-82.9	-1.8	-163.3	31.8	-36.5	0	0	0	116.4
158	D	37.3	Very low	51.2	Low	145 Å²	145	120.5 Å²	120.5	78%	0.775	64%	0.639	S	S	*	*			trans	-102.9	36	-160.6	-77.5	-52.4	0	0	0	117	S156	S156-D158 PolarHBondContact O-N 2.85Å
159	V	41.5	Very low	53.7	Low	128 Å²	128	118.6 Å²	118.6	78%	0.776	63%	0.625	S	S	*	*			trans	-115.9	49.2	168.9	-162	0	0	0	0	111.9
160	R	47.3	Very low	55.9	Low	234 Å²	234	119.1 Å²	119.1	88%	0.883	63%	0.631	S	S	*	*			trans	-110.2	47.7	-174.8	-92.1	-168.8	173	-169.6	2.2	115.9
161	S	43.5	Very low	58.1	Low	103 Å²	103	119.4 Å²	119.4	72%	0.72	63%	0.632	S	S	*	*			trans	-163.8	79	149.9	-161	0	0	0	0	115	S163	S161-S163 PolarHBondContact O-N 3.37Å; S161-S163 VanDerWaalsContact O-N 3.1Å
162	G	53.7	Low	60.4	Low	45 Å²	45	113.5 Å²	113.5	46%	0.464	60%	0.602	S	S	.	*			trans	-66.5	103.9	149.7	0	0	0	0	0	108.2	R167	G162-R167 PolarHBondContact O-NE 3.28Å
163	S	72.8	Confident	63	Low	67 Å²	67	112.6 Å²	112.6	47%	0.469	58%	0.581	S	S	.	*			trans	-43.6	141	-171.9	175.3	0	0	0	0	112.6	S161 W165 S166 R167	S161-S163 PolarHBondContact O-N 3.37Å; S161-S163 VanDerWaalsContact O-N 3.1Å; S163-W165 PolarHBondContact O-N 3.23Å; S163-W165 VanDerWaalsContact O-N 3.09Å; S163-W165 PolarHBondContact OG-N 3.04Å; S163-S166 WeakPolarHBondContact O-CB 3.38Å; S163-S166 PolarHBondContact O-N 2.76Å; S163-R167 PolarHBondContact O-N 2.73Å
164	L	80	Confident	65.3	Low	122 Å²	122	107.3 Å²	107.3	64%	0.639	56%	0.562	S	S	*	*	H	α-helix	trans	-50.3	-39.9	178.8	-66.9	176.8	0	0	0	111.1	S166 R167 W168	L164-S166 PolarHBondContact O-N 3.01Å; L164-R167 PolarHBondContact O-N 3.08Å; L164-R167 VanDerWaalsContact O-N 3.13Å; L164-W168 VanDerWaalsContact O-CD1 3.27Å; L164-W168 PolarHBondContact O-N 3.25Å
165	W	80.1	Confident	67.9	Low	142 Å²	142	106.2 Å²	106.2	54%	0.538	54%	0.541	S	S	.	.	H	α-helix	trans	-51.1	-50.8	174	178.9	-101.7	0	0	0	112.8	S163 R167 W168 Q169 F262	S163-W165 PolarHBondContact O-N 3.23Å; S163-W165 VanDerWaalsContact O-N 3.09Å; S163-W165 PolarHBondContact OG-N 3.04Å; W165-R167 VanDerWaalsContact C-N 3.29Å; W165-R167 PolarHBondContact O-N 2.66Å; W165-W168 PolarHBondContact O-N 3.39Å; W165-W168 VanDerWaalsContact O-N 3.14Å; W165-Q169 VanDerWaalsContact O-CB 3.26Å; W165-Q169 WeakPolarHBondContact O-CB 3.26Å; W165-Q169 PolarHBondContact O-N 3.17Å; W165-F262 HydrophobicContact CE3-CE1 4.47Å; W165-F262 AromaticContact CH2-CD1 3.95Å; W165-F262 HydrophobicContact CH2-CD1 3.95Å; W165-F262 AromaticContact CH2-CE1 3.33Å; W165-F262 HydrophobicContact CH2-CE1 3.33Å; W165-F262 HydrophobicContact CH2-CZ 4.03Å; W165-F262 HydrophobicContact CZ2-CD1 4.01Å; W165-F262 AromaticContact CZ2-CE1 3.85Å; W165-F262 HydrophobicContact CZ2-CE1 3.85Å; W165-F262 AromaticContact CZ3-CE1 3.69Å; W165-F262 HydrophobicContact CZ3-CE1 3.69Å; W165-F262 HydrophobicContact CZ3-CZ 4.32Å
166	S	80.6	Confident	70.3	Confident	43 Å²	43	98.6 Å²	98.6	30%	0.301	50%	0.5	S	S	.	.	H	α-helix	trans	-62.9	-34.5	-179.3	-172.5	0	0	0	0	112.6	S163 L164 K170	S163-S166 WeakPolarHBondContact O-CB 3.38Å; S163-S166 PolarHBondContact O-N 2.76Å; L164-S166 PolarHBondContact O-N 3.01Å; S166-K170 WeakPolarHBondContact O-CG 3.47Å; S166-K170 PolarHBondContact O-N 3.44Å; S166-K170 VanDerWaalsContact O-N 3.09Å
167	R	83.4	Confident	72.8	Confident	143 Å²	143	96.1 Å²	96.1	54%	0.54	48%	0.478	S	S	.	.	H	α-helix	trans	-70.1	-37.8	175.2	-62.5	180	179.2	175.5	-2.2	112.3	G162 S163 L164 W165 R171	G162-R167 PolarHBondContact O-NE 3.28Å; S163-R167 PolarHBondContact O-N 2.73Å; L164-R167 PolarHBondContact O-N 3.08Å; L164-R167 VanDerWaalsContact O-N 3.13Å; W165-R167 VanDerWaalsContact C-N 3.29Å; W165-R167 PolarHBondContact O-N 2.66Å; R167-R171 WeakPolarHBondContact O-CD 3.37Å; R167-R171 VanDerWaalsContact O-CG 3.26Å; R167-R171 WeakPolarHBondContact O-CG 3.43Å; R167-R171 PolarHBondContact O-N 2.97Å
168	W	84.9	Confident	74.6	Confident	159 Å²	159	94 Å²	94	60%	0.602	46%	0.461	S	S	*	.	H	α-helix	trans	-71.3	-45.3	174.2	-81.7	92.5	0	0	0	111.2	L164 W165 K170 R171 V172	L164-W168 VanDerWaalsContact O-CD1 3.27Å; L164-W168 PolarHBondContact O-N 3.25Å; W165-W168 PolarHBondContact O-N 3.39Å; W165-W168 VanDerWaalsContact O-N 3.14Å; W168-K170 PolarHBondContact O-N 2.86Å; W168-R171 PolarHBondContact O-N 3.41Å; W168-R171 VanDerWaalsContact O-N 3.09Å; W168-V172 HydrophobicContact CE3-CG2 4.38Å; W168-V172 WeakPolarHBondContact O-CG2 3.42Å; W168-V172 PolarHBondContact O-N 2.63Å
169	Q	88.9	Confident	76.7	Confident	38 Å²	38	88 Å²	88	18%	0.178	43%	0.429	C	S	.	.	H	α-helix	trans	-51.2	-56.2	175.8	-174.6	-176.2	7.5	0	0	111.7	W165 R171 V172 W173 F262 C263	W165-Q169 VanDerWaalsContact O-CB 3.26Å; W165-Q169 WeakPolarHBondContact O-CB 3.26Å; W165-Q169 PolarHBondContact O-N 3.17Å; Q169-R171 VanDerWaalsContact C-N 3.26Å; Q169-R171 PolarHBondContact O-N 3.39Å; Q169-V172 PolarHBondContact O-N 2.99Å; Q169-W173 WeakPolarHBondContact O-CB 3.46Å; Q169-W173 PolarHBondContact O-N 3.18Å; Q169-F262 HydrophobicContact CB-CD1 4.19Å; Q169-F262 HydrophobicContact CG-CB 4.34Å; Q169-F262 HydrophobicContact CG-CD1 4.33Å; Q169-F262 WeakPolarHBondContact CG-O 3.26Å; Q169-C263 PolarHBondContact NE2-O 3.27Å
170	K	85.3	Confident	78.4	Confident	155 Å²	155	88 Å²	88	67%	0.674	42%	0.416	S	S	*	.	H	α-helix	trans	-60.6	-32.3	179.1	-68.7	-176.4	-178.5	-168.1	0	113.3	S166 W168 A174	S166-K170 WeakPolarHBondContact O-CG 3.47Å; S166-K170 PolarHBondContact O-N 3.44Å; S166-K170 VanDerWaalsContact O-N 3.09Å; W168-K170 PolarHBondContact O-N 2.86Å; K170-A174 WeakPolarHBondContact O-CB 3.38Å; K170-A174 PolarHBondContact O-N 2.82Å
171	R	86.5	Confident	80	Confident	171 Å²	171	79.2 Å²	79.2	65%	0.645	39%	0.391	S	S	*	.	H	α-helix	trans	-75.9	-44.9	177.8	-73.9	171.9	177.3	175.1	-2.6	112.8	R167 W168 Q169 L175	R167-R171 WeakPolarHBondContact O-CD 3.37Å; R167-R171 VanDerWaalsContact O-CG 3.26Å; R167-R171 WeakPolarHBondContact O-CG 3.43Å; R167-R171 PolarHBondContact O-N 2.97Å; W168-R171 PolarHBondContact O-N 3.41Å; W168-R171 VanDerWaalsContact O-N 3.09Å; Q169-R171 VanDerWaalsContact C-N 3.26Å; Q169-R171 PolarHBondContact O-N 3.39Å; R171-L175 WeakPolarHBondContact O-CB 3.13Å; R171-L175 PolarHBondContact O-N 3.17Å; R171-L175 VanDerWaalsContact O-N 3.11Å
172	V	88.5	Confident	82.1	Confident	18 Å²	18	76.2 Å²	76.2	11%	0.109	37%	0.37	C	S	.	.	H	α-helix	trans	-73.9	-36.3	-178.7	179.6	0	0	0	0	110.8	W168 Q169 L175 F176 M258 F262	W168-V172 HydrophobicContact CE3-CG2 4.38Å; W168-V172 WeakPolarHBondContact O-CG2 3.42Å; W168-V172 PolarHBondContact O-N 2.63Å; Q169-V172 PolarHBondContact O-N 2.99Å; V172-L175 WeakPolarHBondContact O-CB 3.38Å; V172-L175 PolarHBondContact O-N 2.9Å; V172-F176 HydrophobicContact CG1-CD2 3.99Å; V172-F176 HydrophobicContact CG1-CE2 4.15Å; V172-F176 WeakPolarHBondContact O-CD2 3.46Å; V172-F176 PolarHBondContact O-N 3.21Å; V172-M258 HydrophobicContact CG1-CE 3.57Å; V172-F262 HydrophobicContact CB-CB 4.45Å; V172-F262 HydrophobicContact CB-CD1 4.46Å; V172-F262 HydrophobicContact CB-CD2 3.95Å; V172-F262 HydrophobicContact CB-CE2 4.31Å; V172-F262 HydrophobicContact CB-CG 4.04Å; V172-F262 HydrophobicContact CG1-CB 4.42Å; V172-F262 HydrophobicContact CG1-CD2 3.36Å; V172-F262 HydrophobicContact CG1-CE2 3.71Å; V172-F262 HydrophobicContact CG1-CG 3.93Å; V172-F262 HydrophobicContact CG1-CZ 4.5Å
173	W	89.3	Confident	83.6	Confident	63 Å²	63	82.4 Å²	82.4	24%	0.239	38%	0.384	C	S	.	.	H	α-helix	trans	-56.8	-53.9	170.6	-179.7	-111.4	0	0	0	111.7	Q169 L175 F176 E177 R259 C263 F269	Q169-W173 WeakPolarHBondContact O-CB 3.46Å; Q169-W173 PolarHBondContact O-N 3.18Å; W173-L175 PolarHBondContact O-N 3.35Å; W173-F176 PolarHBondContact O-N 2.69Å; W173-F176 VanDerWaalsContact O-N 3.16Å; W173-E177 HydrophobicContact CD2-CB 4.43Å; W173-E177 HydrophobicContact CH2-CG 4.2Å; W173-E177 HydrophobicContact CZ2-CB 4.22Å; W173-E177 HydrophobicContact CZ2-CG 3.77Å; W173-E177 WeakPolarHBondContact O-CB 3.2Å; W173-E177 PolarHBondContact O-N 3.36Å; W173-R259 HydrophobicContact CZ3-CB 4.05Å; W173-R259 HydrophobicContact CZ3-CG 4.4Å; W173-R259 WeakPolarHBondContact CZ3-O 3.38Å; W173-C263 VanDerWaalsContact CE3-CA 3.46Å; W173-C263 HydrophobicContact CE3-CB 3.87Å; W173-C263 HydrophobicContact CH2-CB 3.92Å; W173-C263 HydrophobicContact CZ3-CB 3.51Å; W173-F269 AromaticContact CH2-CD2 3.77Å; W173-F269 HydrophobicContact CH2-CD2 3.77Å; W173-F269 AromaticContact CH2-CE2 3.94Å; W173-F269 HydrophobicContact CH2-CE2 3.94Å; W173-F269 HydrophobicContact CZ3-CD2 4.04Å; W173-F269 AromaticContact CZ3-CE2 3.98Å; W173-F269 HydrophobicContact CZ3-CE2 3.98Å
174	A	84.5	Confident	84.4	Confident	37 Å²	37	87.7 Å²	87.7	31%	0.306	40%	0.395	S	S	.	.	H	α-helix	trans	-59.6	-31.8	177.4	0	0	0	0	0	113.3	K170 D178 S181	K170-A174 WeakPolarHBondContact O-CB 3.38Å; K170-A174 PolarHBondContact O-N 2.82Å; A174-D178 PolarHBondContact O-N 3.35Å; A174-S181 PolarHBondContact O-OG 2.82Å
175	L	88.3	Confident	84.8	Confident	42 Å²	42	81.9 Å²	81.9	22%	0.22	37%	0.365	C	S	.	.	H	α-helix	trans	-68.1	-32.7	178.6	-173.9	71.6	0	0	0	113.5	R171 V172 W173 A185 I188	R171-L175 WeakPolarHBondContact O-CB 3.13Å; R171-L175 PolarHBondContact O-N 3.17Å; R171-L175 VanDerWaalsContact O-N 3.11Å; V172-L175 WeakPolarHBondContact O-CB 3.38Å; V172-L175 PolarHBondContact O-N 2.9Å; W173-L175 PolarHBondContact O-N 3.35Å; L175-A185 HydrophobicContact CD1-CB 4.1Å; L175-I188 HydrophobicContact CD1-CD1 3.95Å; L175-I188 HydrophobicContact CD2-CD1 3.67Å; L175-I188 HydrophobicContact CG-CD1 3.62Å
176	F	87.3	Confident	85.1	Confident	14 Å²	14	82.4 Å²	82.4	6%	0.061	37%	0.367	C	S	.	.	H	α-helix	trans	-102.4	-17.4	-177.5	-82.4	-90.2	0	0	0	114.5	V172 W173 I188 F254 E255 M258 R259	V172-F176 HydrophobicContact CG1-CD2 3.99Å; V172-F176 HydrophobicContact CG1-CE2 4.15Å; V172-F176 WeakPolarHBondContact O-CD2 3.46Å; V172-F176 PolarHBondContact O-N 3.21Å; W173-F176 PolarHBondContact O-N 2.69Å; W173-F176 VanDerWaalsContact O-N 3.16Å; F176-I188 HydrophobicContact CD1-CG2 4.15Å; F176-I188 HydrophobicContact CE1-CG2 3.95Å; F176-I188 HydrophobicContact CZ-CD1 4.49Å; F176-I188 HydrophobicContact CZ-CG2 4.44Å; F176-F254 HydrophobicContact CE1-CE1 4.05Å; F176-F254 AromaticContact CZ-CE1 3.77Å; F176-F254 HydrophobicContact CZ-CE1 3.77Å; F176-F254 AromaticContact CZ-CZ 3.96Å; F176-F254 HydrophobicContact CZ-CZ 3.96Å; F176-E255 HydrophobicContact CE1-CG 4.5Å; F176-M258 HydrophobicContact CD1-CB 4.33Å; F176-M258 HydrophobicContact CD2-CB 4.2Å; F176-M258 HydrophobicContact CD2-CE 4.4Å; F176-M258 HydrophobicContact CE1-CB 4.18Å; F176-M258 HydrophobicContact CE1-CG 4.41Å; F176-M258 HydrophobicContact CE2-CB 4.05Å; F176-M258 HydrophobicContact CE2-CE 3.57Å; F176-M258 HydrophobicContact CE2-CG 4.21Å; F176-M258 HydrophobicContact CG-CB 4.34Å; F176-M258 HydrophobicContact CZ-CB 4.03Å; F176-M258 HydrophobicContact CZ-CE 4.03Å; F176-M258 HydrophobicContact CZ-CG 3.97Å; F176-R259 HydrophobicContact CB-CG 4.06Å; F176-R259 PolarHBondContact O-NE 2.83Å; F176-R259 VanDerWaalsContact O-NE 3.07Å; F176-R259 PolarHBondContact O-NH2 3.44Å
177	E	84.1	Confident	85.7	Confident	46 Å²	46	89.1 Å²	89.1	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-101.3	-39.6	-178	-159.7	58.6	-137.1	0	0	113.4	W173 P179 R259 R322	W173-E177 HydrophobicContact CD2-CB 4.43Å; W173-E177 HydrophobicContact CH2-CG 4.2Å; W173-E177 HydrophobicContact CZ2-CB 4.22Å; W173-E177 HydrophobicContact CZ2-CG 3.77Å; W173-E177 WeakPolarHBondContact O-CB 3.2Å; W173-E177 PolarHBondContact O-N 3.36Å; E177-P179 WeakPolarHBondContact O-CD 3.43Å; E177-R259 IonicContact OE2-NE 3.17Å; E177-R322 VanDerWaalsContact CD-NH2 3.26Å; E177-R322 IonicContact OE1-CZ 2.78Å; E177-R322 VanDerWaalsContact OE1-CZ 3.25Å; E177-R322 IonicContact OE1-NE 3.51Å; E177-R322 PolarHBondContact OE1-NE 3.07Å; E177-R322 IonicContact OE1-NH2 3.79Å; E177-R322 PolarHBondContact OE1-NH2 3.19Å; E177-R322 IonicContact OE2-CZ 2.76Å; E177-R322 IonicContact OE2-NE 2.68Å; E177-R322 PolarHBondContact OE2-NE 3.18Å; E177-R322 IonicContact OE2-NH2 2.87Å; E177-R322 PolarHBondContact OE2-NH2 3.07Å
178	D	78.9	Confident	86.1	Confident	60 Å²	60	84.1 Å²	84.1	32%	0.321	37%	0.369	S	S	.	.			trans	-111.2	104.7	178.4	172.4	17.9	0	0	0	111.3	A174 Y180 S181 A185	A174-D178 PolarHBondContact O-N 3.35Å; D178-Y180 PolarHBondContact O-N 2.94Å; D178-Y180 VanDerWaalsContact O-N 3.1Å; D178-Y180 WeakPolarHBondContact OD1-CA 3.43Å; D178-Y180 WeakPolarHBondContact OD1-CB 3.48Å; D178-Y180 PolarHBondContact OD1-N 3.28Å; D178-S181 WeakPolarHBondContact O-CB 3.46Å; D178-S181 PolarHBondContact O-N 3.49Å; D178-S181 VanDerWaalsContact O-N 3.17Å; D178-S181 PolarHBondContact O-OG 3.33Å; D178-S181 WeakPolarHBondContact OD2-CA 3.36Å; D178-S181 WeakPolarHBondContact OD2-CB 3.21Å; D178-S181 PolarHBondContact OD2-N 2.57Å; D178-A185 WeakPolarHBondContact O-CB 3.18Å
179	P	80.6	Confident	86.3	Confident	17 Å²	17	77.3 Å²	77.3	11%	0.11	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-24	175.4	-27.7	36.4	0	0	0	115	E177 A185 R186 A189	E177-P179 WeakPolarHBondContact O-CD 3.43Å; P179-A185 CarbonylContact O-C 3.57Å; P179-R186 WeakPolarHBondContact O-CG 3.37Å; P179-R186 PolarHBondContact O-N 3.22Å; P179-A189 HydrophobicContact CB-CB 3.78Å; P179-A189 HydrophobicContact CG-CB 4.1Å
180	Y	78.2	Confident	86.4	Confident	128 Å²	128	80.1 Å²	80.1	50%	0.502	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-10.8	-175.9	-58	-85.5	0	0	0	113.2	D178 S182 V325	D178-Y180 PolarHBondContact O-N 2.94Å; D178-Y180 VanDerWaalsContact O-N 3.1Å; D178-Y180 WeakPolarHBondContact OD1-CA 3.43Å; D178-Y180 WeakPolarHBondContact OD1-CB 3.48Å; D178-Y180 PolarHBondContact OD1-N 3.28Å; Y180-S182 PolarHBondContact O-N 3.46Å; Y180-S182 VanDerWaalsContact O-N 3.16Å; Y180-V325 HydrophobicContact CE2-CG2 4.31Å
181	S	81.2	Confident	86.8	Confident	50 Å²	50	74.1 Å²	74.1	35%	0.35	34%	0.341	S	S	.	.	S	Bend	trans	-57.7	-31.3	-174.8	66.3	0	0	0	0	114.4	A174 D178 A185	A174-S181 PolarHBondContact O-OG 2.82Å; D178-S181 WeakPolarHBondContact O-CB 3.46Å; D178-S181 PolarHBondContact O-N 3.49Å; D178-S181 VanDerWaalsContact O-N 3.17Å; D178-S181 PolarHBondContact O-OG 3.33Å; D178-S181 WeakPolarHBondContact OD2-CA 3.36Å; D178-S181 WeakPolarHBondContact OD2-CB 3.21Å; D178-S181 PolarHBondContact OD2-N 2.57Å; S181-A185 VanDerWaalsContact OG-CB 3.29Å; S181-A185 WeakPolarHBondContact OG-CB 3.16Å
182	S	86.8	Confident	87.1	Confident	40 Å²	40	66 Å²	66	28%	0.28	31%	0.311	S	S	.	.			trans	-159.4	165.1	-178.2	67.7	0	0	0	0	112.6	Y180 Y184 A185 R186	Y180-S182 PolarHBondContact O-N 3.46Å; Y180-S182 VanDerWaalsContact O-N 3.16Å; S182-Y184 PolarHBondContact O-N 3.15Å; S182-Y184 PolarHBondContact OG-N 3.38Å; S182-A185 PolarHBondContact O-N 2.91Å; S182-A185 WeakPolarHBondContact OG-CB 3.49Å; S182-A185 PolarHBondContact OG-N 3.01Å; S182-R186 PolarHBondContact O-N 3.36Å
183	K	86.1	Confident	87.3	Confident	176 Å²	176	67 Å²	67	77%	0.765	32%	0.315	S	S	*	.	H	α-helix	trans	-59	-31.4	171.9	-66.3	-173.2	179.2	-176.2	0	112.5	W187	K183-W187 VanDerWaalsContact O-CD1 3.23Å
184	Y	89.4	Confident	87.6	Confident	177 Å²	177	69.9 Å²	69.9	69%	0.694	33%	0.33	S	S	*	.	H	α-helix	trans	-77.1	-35.6	178	-62	-69.1	0	0	0	112.5	S182 R186 W187 I188	S182-Y184 PolarHBondContact O-N 3.15Å; S182-Y184 PolarHBondContact OG-N 3.38Å; Y184-R186 VanDerWaalsContact C-N 3.27Å; Y184-R186 PolarHBondContact O-N 3.31Å; Y184-W187 PolarHBondContact O-N 3.28Å; Y184-W187 VanDerWaalsContact O-N 3.15Å; Y184-I188 PolarHBondContact O-N 3.25Å
185	A	87.3	Confident	88.1	Confident	1 Å²	1	70 Å²	70	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-38.7	174.4	0	0	0	0	0	111.5	L175 D178 P179 S181 S182 W187 I188 A189	L175-A185 HydrophobicContact CD1-CB 4.1Å; D178-A185 WeakPolarHBondContact O-CB 3.18Å; P179-A185 CarbonylContact O-C 3.57Å; S181-A185 VanDerWaalsContact OG-CB 3.29Å; S181-A185 WeakPolarHBondContact OG-CB 3.16Å; S182-A185 PolarHBondContact O-N 2.91Å; S182-A185 WeakPolarHBondContact OG-CB 3.49Å; S182-A185 PolarHBondContact OG-N 3.01Å; A185-W187 PolarHBondContact O-N 3.45Å; A185-I188 PolarHBondContact O-N 2.91Å; A185-A189 VanDerWaalsContact O-CB 3.26Å; A185-A189 WeakPolarHBondContact O-CB 2.84Å; A185-A189 PolarHBondContact O-N 3.48Å
186	R	87.8	Confident	88.4	Confident	153 Å²	153	68 Å²	68	58%	0.577	31%	0.313	S	S	*	.	H	α-helix	trans	-60.8	-41.4	174.1	-64.1	-178.2	-172.7	-168.2	-0.3	112.8	P179 S182 Y184 L190	P179-R186 WeakPolarHBondContact O-CG 3.37Å; P179-R186 PolarHBondContact O-N 3.22Å; S182-R186 PolarHBondContact O-N 3.36Å; Y184-R186 VanDerWaalsContact C-N 3.27Å; Y184-R186 PolarHBondContact O-N 3.31Å; R186-L190 WeakPolarHBondContact O-CB 3.17Å; R186-L190 PolarHBondContact O-N 2.83Å
187	W	92.1	Very high	88.7	Confident	184 Å²	184	71.8 Å²	71.8	70%	0.697	33%	0.333	S	S	*	.	H	α-helix	trans	-68.6	-40	176.6	-77.3	114.8	0	0	0	112.7	K183 Y184 A185 L190 A191	K183-W187 VanDerWaalsContact O-CD1 3.23Å; Y184-W187 PolarHBondContact O-N 3.28Å; Y184-W187 VanDerWaalsContact O-N 3.15Å; A185-W187 PolarHBondContact O-N 3.45Å; W187-L190 HydrophobicContact CE3-CD2 3.95Å; W187-L190 HydrophobicContact CZ3-CD2 3.83Å; W187-L190 PolarHBondContact O-N 2.77Å; W187-A191 PolarHBondContact O-N 3.35Å
188	I	91.1	Very high	89.2	Confident	38 Å²	38	71.5 Å²	71.5	20%	0.195	34%	0.335	C	S	.	.	H	α-helix	trans	-66.6	-43.3	175.4	-71.2	164.6	0	0	0	110.6	L175 F176 Y184 A185 L190 A191 S192	L175-I188 HydrophobicContact CD1-CD1 3.95Å; L175-I188 HydrophobicContact CD2-CD1 3.67Å; L175-I188 HydrophobicContact CG-CD1 3.62Å; F176-I188 HydrophobicContact CD1-CG2 4.15Å; F176-I188 HydrophobicContact CE1-CG2 3.95Å; F176-I188 HydrophobicContact CZ-CD1 4.49Å; F176-I188 HydrophobicContact CZ-CG2 4.44Å; Y184-I188 PolarHBondContact O-N 3.25Å; A185-I188 PolarHBondContact O-N 2.91Å; I188-L190 VanDerWaalsContact C-N 3.32Å; I188-L190 PolarHBondContact O-N 2.88Å; I188-A191 PolarHBondContact O-N 3.07Å; I188-S192 PolarHBondContact O-N 3.1Å; I188-S192 PolarHBondContact O-OG 2.85Å
189	A	89.7	Confident	89.9	Confident	16 Å²	16	68.6 Å²	68.6	13%	0.132	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-38	175.1	0	0	0	0	0	112.6	P179 A185 L193	P179-A189 HydrophobicContact CB-CB 3.78Å; P179-A189 HydrophobicContact CG-CB 4.1Å; A185-A189 VanDerWaalsContact O-CB 3.26Å; A185-A189 WeakPolarHBondContact O-CB 2.84Å; A185-A189 PolarHBondContact O-N 3.48Å; A189-L193 WeakPolarHBondContact O-CB 3.41Å; A189-L193 PolarHBondContact O-N 3.37Å
190	L	91.7	Very high	90.5	Very high	96 Å²	96	69.7 Å²	69.7	50%	0.503	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-40.2	174	-176.7	63.4	0	0	0	112.1	R186 W187 I188 L193 F194	R186-L190 WeakPolarHBondContact O-CB 3.17Å; R186-L190 PolarHBondContact O-N 2.83Å; W187-L190 HydrophobicContact CE3-CD2 3.95Å; W187-L190 HydrophobicContact CZ3-CD2 3.83Å; W187-L190 PolarHBondContact O-N 2.77Å; I188-L190 VanDerWaalsContact C-N 3.32Å; I188-L190 PolarHBondContact O-N 2.88Å; L190-L193 PolarHBondContact O-N 2.62Å; L190-F194 PolarHBondContact O-N 3.22Å
191	A	93.6	Very high	91.2	Very high	29 Å²	29	67.5 Å²	67.5	24%	0.24	32%	0.324	C	S	.	.	H	α-helix	trans	-64.5	-45.1	174.8	0	0	0	0	0	111.9	W187 I188 L193 F194 F195 W251	W187-A191 PolarHBondContact O-N 3.35Å; I188-A191 PolarHBondContact O-N 3.07Å; A191-L193 PolarHBondContact O-N 3.17Å; A191-F194 WeakPolarHBondContact O-CB 3.49Å; A191-F194 PolarHBondContact O-N 2.93Å; A191-F195 WeakPolarHBondContact O-CD2 3.3Å; A191-F195 PolarHBondContact O-N 2.84Å; A191-W251 HydrophobicContact CB-CH2 4.02Å; A191-W251 HydrophobicContact CB-CZ2 3.72Å
192	S	92.9	Very high	91.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-40.8	175	-64.8	0	0	0	0	112.4	I188 F194 F195 I196 W251 E255	I188-S192 PolarHBondContact O-N 3.1Å; I188-S192 PolarHBondContact O-OG 2.85Å; S192-F194 VanDerWaalsContact C-N 3.34Å; S192-F194 PolarHBondContact O-N 2.75Å; S192-F195 PolarHBondContact O-N 2.77Å; S192-I196 WeakPolarHBondContact O-CD1 3.24Å; S192-I196 WeakPolarHBondContact O-CG1 2.91Å; S192-I196 PolarHBondContact O-N 3.13Å; S192-W251 PolarHBondContact OG-NE1 2.98Å; S192-E255 WeakPolarHBondContact CB-OE1 3.5Å; S192-E255 PolarHBondContact OG-OE1 3.3Å
193	L	92.4	Very high	91.9	Very high	40 Å²	40	65.4 Å²	65.4	21%	0.209	30%	0.304	C	S	.	.	H	α-helix	trans	-58.8	-44.4	172.2	177.5	60.6	0	0	0	111.7	A189 L190 A191 I196 L197 L320 F324	A189-L193 WeakPolarHBondContact O-CB 3.41Å; A189-L193 PolarHBondContact O-N 3.37Å; L190-L193 PolarHBondContact O-N 2.62Å; A191-L193 PolarHBondContact O-N 3.17Å; L193-I196 PolarHBondContact O-N 2.65Å; L193-L197 HydrophobicContact CD1-CD1 4.32Å; L193-L197 HydrophobicContact CD1-CG 4.37Å; L193-L197 HydrophobicContact CG-CD1 4.26Å; L193-L197 WeakPolarHBondContact O-CG 3.32Å; L193-L197 PolarHBondContact O-N 3.05Å; L193-L320 HydrophobicContact CD1-CD2 3.43Å; L193-L320 VanDerWaalsContact CD1-CD2 3.43Å; L193-F324 HydrophobicContact CD1-CE2 4.06Å; L193-F324 HydrophobicContact CD1-CZ 4.48Å
194	F	94.9	Very high	92.2	Very high	123 Å²	123	60.6 Å²	60.6	54%	0.539	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-48.9	175.1	171.2	-97.4	0	0	0	112.1	L190 A191 S192 I196 L197 V198	L190-F194 PolarHBondContact O-N 3.22Å; A191-F194 WeakPolarHBondContact O-CB 3.49Å; A191-F194 PolarHBondContact O-N 2.93Å; S192-F194 VanDerWaalsContact C-N 3.34Å; S192-F194 PolarHBondContact O-N 2.75Å; F194-I196 VanDerWaalsContact C-N 3.33Å; F194-I196 PolarHBondContact O-N 3.38Å; F194-L197 PolarHBondContact O-N 2.87Å; F194-V198 HydrophobicContact CD1-CG2 4.36Å; F194-V198 HydrophobicContact CD2-CG2 4.28Å; F194-V198 HydrophobicContact CE1-CG2 3.93Å; F194-V198 HydrophobicContact CE2-CG2 3.84Å; F194-V198 HydrophobicContact CZ-CG2 3.65Å; F194-V198 WeakPolarHBondContact O-CG2 3.28Å; F194-V198 PolarHBondContact O-N 2.76Å
195	F	95.5	Very high	92.3	Very high	41 Å²	41	54.8 Å²	54.8	18%	0.18	27%	0.272	C	S	.	.	H	α-helix	trans	-64.5	-35.4	177.9	-77.1	-67.6	0	0	0	112.9	A191 S192 S199 V247 W251 F252	A191-F195 WeakPolarHBondContact O-CD2 3.3Å; A191-F195 PolarHBondContact O-N 2.84Å; S192-F195 PolarHBondContact O-N 2.77Å; F195-S199 VanDerWaalsContact O-CB 3.26Å; F195-S199 WeakPolarHBondContact O-CB 3.33Å; F195-S199 PolarHBondContact O-N 2.87Å; F195-S199 PolarHBondContact O-OG 3.17Å; F195-V247 HydrophobicContact CE1-CG1 4.1Å; F195-W251 HydrophobicContact CB-CG 4.22Å; F195-W251 HydrophobicContact CD1-CB 4.3Å; F195-W251 HydrophobicContact CD2-CB 3.94Å; F195-W251 AromaticContact CD2-CD1 3.44Å; F195-W251 VanDerWaalsContact CD2-CD1 3.44Å; F195-W251 AromaticContact CD2-CD2 3.45Å; F195-W251 HydrophobicContact CD2-CD2 3.45Å; F195-W251 VanDerWaalsContact CD2-CD2 3.45Å; F195-W251 AromaticContact CD2-CE2 3.68Å; F195-W251 HydrophobicContact CD2-CE3 4.12Å; F195-W251 AromaticContact CD2-CG 3.31Å; F195-W251 HydrophobicContact CD2-CG 3.31Å; F195-W251 HydrophobicContact CD2-CZ2 4.49Å; F195-W251 AromaticContact CD2-NE1 3.66Å; F195-W251 HydrophobicContact CE2-CB 4.17Å; F195-W251 AromaticContact CE2-CD2 3.47Å; F195-W251 HydrophobicContact CE2-CD2 3.47Å; F195-W251 VanDerWaalsContact CE2-CD2 3.47Å; F195-W251 AromaticContact CE2-CE2 3.98Å; F195-W251 AromaticContact CE2-CE3 3.63Å; F195-W251 HydrophobicContact CE2-CE3 3.63Å; F195-W251 AromaticContact CE2-CG 3.7Å; F195-W251 HydrophobicContact CE2-CG 3.7Å; F195-W251 HydrophobicContact CE2-CZ3 4.25Å; F195-W251 HydrophobicContact CG-CB 4.01Å; F195-W251 AromaticContact CG-CD1 3.8Å; F195-W251 HydrophobicContact CG-CD2 4.37Å; F195-W251 AromaticContact CG-CG 3.77Å; F195-W251 HydrophobicContact CG-CG 3.77Å; F195-W251 HydrophobicContact CZ-CB 4.46Å; F195-W251 HydrophobicContact CZ-CD2 4.41Å; F195-W251 HydrophobicContact CZ-CE3 4.37Å; F195-W251 HydrophobicContact CZ-CG 4.45Å; F195-F252 HydrophobicContact CB-CE1 3.88Å; F195-F252 HydrophobicContact CB-CZ 4.25Å
196	I	94	Very high	92.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-51.8	171.9	-66.8	160.6	0	0	0	109.9	S192 L193 F194 V198 S199 I200 F252 K319 L320	S192-I196 WeakPolarHBondContact O-CD1 3.24Å; S192-I196 WeakPolarHBondContact O-CG1 2.91Å; S192-I196 PolarHBondContact O-N 3.13Å; L193-I196 PolarHBondContact O-N 2.65Å; F194-I196 VanDerWaalsContact C-N 3.33Å; F194-I196 PolarHBondContact O-N 3.38Å; I196-V198 PolarHBondContact O-N 3.12Å; I196-S199 WeakPolarHBondContact CA-OG 3.12Å; I196-S199 PolarHBondContact O-N 3.34Å; I196-S199 PolarHBondContact O-OG 3.29Å; I196-I200 HydrophobicContact CG2-CD1 3.69Å; I196-I200 HydrophobicContact CG2-CG1 4.42Å; I196-I200 WeakPolarHBondContact O-CG1 3.5Å; I196-I200 PolarHBondContact O-N 3.01Å; I196-F252 HydrophobicContact CG1-CE1 3.8Å; I196-F252 HydrophobicContact CG1-CZ 4.03Å; I196-K319 HydrophobicContact CD1-CB 3.6Å; I196-K319 HydrophobicContact CG1-CB 4.12Å; I196-L320 HydrophobicContact CB-CD2 4.2Å; I196-L320 HydrophobicContact CD1-CD2 4.24Å; I196-L320 HydrophobicContact CG2-CD2 3.57Å; I196-L320 HydrophobicContact CG2-CG 3.89Å
197	L	93.9	Very high	92.3	Very high	92 Å²	92	53.4 Å²	53.4	48%	0.482	28%	0.28	S	S	.	.	H	α-helix	trans	-58.4	-48.6	178.9	-69.1	170.8	0	0	0	112.3	L193 F194 S199 I200 T201	L193-L197 HydrophobicContact CD1-CD1 4.32Å; L193-L197 HydrophobicContact CD1-CG 4.37Å; L193-L197 HydrophobicContact CG-CD1 4.26Å; L193-L197 WeakPolarHBondContact O-CG 3.32Å; L193-L197 PolarHBondContact O-N 3.05Å; F194-L197 PolarHBondContact O-N 2.87Å; L197-S199 VanDerWaalsContact C-N 3.31Å; L197-S199 PolarHBondContact O-N 3.13Å; L197-I200 PolarHBondContact O-N 3.33Å; L197-T201 PolarHBondContact O-N 3.4Å; L197-T201 PolarHBondContact O-OG1 2.93Å
198	V	94.9	Very high	92.2	Very high	40 Å²	40	49.1 Å²	49.1	24%	0.242	27%	0.267	C	S	.	.	H	α-helix	trans	-58.4	-42.5	176.5	172.7	0	0	0	0	111.6	F194 I196 I200 T201 T202 I244	F194-V198 HydrophobicContact CD1-CG2 4.36Å; F194-V198 HydrophobicContact CD2-CG2 4.28Å; F194-V198 HydrophobicContact CE1-CG2 3.93Å; F194-V198 HydrophobicContact CE2-CG2 3.84Å; F194-V198 HydrophobicContact CZ-CG2 3.65Å; F194-V198 WeakPolarHBondContact O-CG2 3.28Å; F194-V198 PolarHBondContact O-N 2.76Å; I196-V198 PolarHBondContact O-N 3.12Å; V198-I200 PolarHBondContact O-N 2.68Å; V198-T201 PolarHBondContact O-N 3.17Å; V198-T202 WeakPolarHBondContact O-CB 2.94Å; V198-T202 PolarHBondContact O-N 3.14Å; V198-T202 PolarHBondContact O-OG1 3.23Å; V198-I244 HydrophobicContact CG1-CG2 3.72Å
199	S	93.9	Very high	92	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-71	-28.3	-179.5	68.9	0	0	0	0	113.8	F195 I196 L197 F203 F252 R316	F195-S199 VanDerWaalsContact O-CB 3.26Å; F195-S199 WeakPolarHBondContact O-CB 3.33Å; F195-S199 PolarHBondContact O-N 2.87Å; F195-S199 PolarHBondContact O-OG 3.17Å; I196-S199 WeakPolarHBondContact CA-OG 3.12Å; I196-S199 PolarHBondContact O-N 3.34Å; I196-S199 PolarHBondContact O-OG 3.29Å; L197-S199 VanDerWaalsContact C-N 3.31Å; L197-S199 PolarHBondContact O-N 3.13Å; S199-F203 WeakPolarHBondContact O-CB 3.42Å; S199-F203 PolarHBondContact O-N 2.82Å; S199-F252 WeakPolarHBondContact OG-CZ 3.22Å; S199-R316 VanDerWaalsContact CB-CD 3.49Å; S199-R316 WeakPolarHBondContact OG-CD 3.11Å
200	I	93.3	Very high	91.9	Very high	40 Å²	40	58.1 Å²	58.1	21%	0.205	32%	0.318	C	S	.	.	H	α-helix	trans	-72.4	-45.8	170.7	-65.9	164	0	0	0	109.8	I196 L197 V198 T202 F203 C204 R316 I317	I196-I200 HydrophobicContact CG2-CD1 3.69Å; I196-I200 HydrophobicContact CG2-CG1 4.42Å; I196-I200 WeakPolarHBondContact O-CG1 3.5Å; I196-I200 PolarHBondContact O-N 3.01Å; L197-I200 PolarHBondContact O-N 3.33Å; V198-I200 PolarHBondContact O-N 2.68Å; I200-T202 VanDerWaalsContact C-N 3.32Å; I200-T202 PolarHBondContact O-N 3.14Å; I200-F203 WeakPolarHBondContact O-CB 3.16Å; I200-F203 PolarHBondContact O-N 3.36Å; I200-C204 PolarHBondContact O-N 3.13Å; I200-C204 PolarHBondContact O-SG 3.47Å; I200-R316 HydrophobicContact CG1-CG 4.14Å; I200-I317 HydrophobicContact CD1-CB 4.18Å; I200-I317 HydrophobicContact CD1-CG1 3.95Å
201	T	93.3	Very high	91.6	Very high	82 Å²	82	55.6 Å²	55.6	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-58.8	-43.7	175.1	-58	0	0	0	0	111.4	L197 V198 F203 C204 L205	L197-T201 PolarHBondContact O-N 3.4Å; L197-T201 PolarHBondContact O-OG1 2.93Å; V198-T201 PolarHBondContact O-N 3.17Å; T201-F203 PolarHBondContact O-N 2.96Å; T201-C204 PolarHBondContact O-N 3.33Å; T201-C204 VanDerWaalsContact O-N 3.13Å; T201-L205 HydrophobicContact CG2-CD1 4.11Å; T201-L205 HydrophobicContact CG2-CG 4.38Å; T201-L205 WeakPolarHBondContact O-CG 3.44Å; T201-L205 PolarHBondContact O-N 3.17Å
202	T	92.3	Very high	91.3	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-59.9	-44.5	176.9	-54.9	0	0	0	0	111.3	V198 I200 C204 L205 E206 L241 I244 E245	V198-T202 WeakPolarHBondContact O-CB 2.94Å; V198-T202 PolarHBondContact O-N 3.14Å; V198-T202 PolarHBondContact O-OG1 3.23Å; I200-T202 VanDerWaalsContact C-N 3.32Å; I200-T202 PolarHBondContact O-N 3.14Å; T202-C204 VanDerWaalsContact C-N 3.3Å; T202-C204 PolarHBondContact O-N 2.92Å; T202-L205 PolarHBondContact O-N 2.85Å; T202-L205 VanDerWaalsContact O-N 3.08Å; T202-E206 WeakPolarHBondContact O-CG 3.49Å; T202-E206 PolarHBondContact O-N 3.02Å; T202-L241 HydrophobicContact CG2-CB 4.12Å; T202-L241 HydrophobicContact CG2-CD2 4.35Å; T202-I244 HydrophobicContact CG2-CG2 4.48Å; T202-I244 WeakPolarHBondContact OG1-CG2 3.35Å; T202-E245 HydrophobicContact CG2-CB 4.29Å
203	F	90.6	Very high	90.9	Very high	41 Å²	41	59 Å²	59	18%	0.18	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-34.7	174.8	179	-106.1	0	0	0	113.4	S199 I200 T201 R310 R313 I314	S199-F203 WeakPolarHBondContact O-CB 3.42Å; S199-F203 PolarHBondContact O-N 2.82Å; I200-F203 WeakPolarHBondContact O-CB 3.16Å; I200-F203 PolarHBondContact O-N 3.36Å; T201-F203 PolarHBondContact O-N 2.96Å; F203-R310 WeakPolarHBondContact CE2-O 3.21Å; F203-R313 HydrophobicContact CD2-CB 4.11Å; F203-R313 HydrophobicContact CE2-CB 4.17Å; F203-I314 HydrophobicContact CD1-CG1 4.48Å; F203-I314 HydrophobicContact CE1-CB 3.95Å; F203-I314 HydrophobicContact CE1-CD1 4.05Å; F203-I314 HydrophobicContact CE1-CG1 3.82Å; F203-I314 HydrophobicContact CZ-CB 4.03Å; F203-I314 HydrophobicContact CZ-CG1 4.39Å
204	C	91.2	Very high	90.4	Very high	74 Å²	74	62.3 Å²	62.3	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-76.6	-25.9	173.6	-63.8	0	0	0	0	113.6	I200 T201 T202 T207	I200-C204 PolarHBondContact O-N 3.13Å; I200-C204 PolarHBondContact O-SG 3.47Å; T201-C204 PolarHBondContact O-N 3.33Å; T201-C204 VanDerWaalsContact O-N 3.13Å; T202-C204 VanDerWaalsContact C-N 3.3Å; T202-C204 PolarHBondContact O-N 2.92Å; C204-T207 PolarHBondContact O-OG1 2.65Å
205	L	91.3	Very high	89.7	Confident	55 Å²	55	58.9 Å²	58.9	29%	0.288	33%	0.327	S	S	.	.	H	α-helix	trans	-80.6	-32.1	174	-64.5	176.3	0	0	0	111.7	T201 T202 T207 H208 F211 L241	T201-L205 HydrophobicContact CG2-CD1 4.11Å; T201-L205 HydrophobicContact CG2-CG 4.38Å; T201-L205 WeakPolarHBondContact O-CG 3.44Å; T201-L205 PolarHBondContact O-N 3.17Å; T202-L205 PolarHBondContact O-N 2.85Å; T202-L205 VanDerWaalsContact O-N 3.08Å; L205-T207 PolarHBondContact O-N 3.01Å; L205-T207 VanDerWaalsContact O-N 3.12Å; L205-H208 PolarHBondContact O-N 2.79Å; L205-F211 HydrophobicContact CB-CD2 4.42Å; L205-F211 HydrophobicContact CB-CG 4.43Å; L205-F211 HydrophobicContact CD1-CE1 4.47Å; L205-F211 HydrophobicContact CD1-CZ 4.41Å; L205-F211 HydrophobicContact CD2-CD2 4.36Å; L205-F211 HydrophobicContact CD2-CE2 3.74Å; L205-F211 HydrophobicContact CD2-CZ 3.88Å; L205-F211 WeakPolarHBondContact O-CB 3.38Å; L205-L241 HydrophobicContact CB-CD1 3.94Å; L205-L241 HydrophobicContact CB-CD2 4.1Å; L205-L241 HydrophobicContact CD1-CD2 4.2Å
206	E	87.4	Confident	89	Confident	18 Å²	18	62 Å²	62	8%	0.084	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.9	173.9	-81.9	172.6	-162.1	0	0	113.5	T202 N212 L241 R313	T202-E206 WeakPolarHBondContact O-CG 3.49Å; T202-E206 PolarHBondContact O-N 3.02Å; E206-N212 PolarHBondContact O-ND2 3.12Å; E206-N212 PolarHBondContact O-OD1 2.94Å; E206-L241 HydrophobicContact CG-CD1 4.25Å; E206-R313 IonicContact OE1-NH1 3.16Å; E206-R313 PolarHBondContact OE1-NH1 2.86Å; E206-R313 IonicContact OE2-NH1 3.92Å; E206-R313 PolarHBondContact OE2-NH1 3.02Å
207	T	87.4	Confident	88	Confident	108 Å²	108	67.6 Å²	67.6	66%	0.663	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-10.7	177.3	60	0	0	0	0	114	C204 L205	C204-T207 PolarHBondContact O-OG1 2.65Å; L205-T207 PolarHBondContact O-N 3.01Å; L205-T207 VanDerWaalsContact O-N 3.12Å
208	H	89.8	Confident	87.2	Confident	93 Å²	93	67.5 Å²	67.5	43%	0.431	37%	0.37	S	S	.	.	S	Bend	trans	-84	131.8	-174.2	-176.7	-68.6	0	0	0	111.5	L205 A210 F211	L205-H208 PolarHBondContact O-N 2.79Å; H208-A210 VanDerWaalsContact C-N 3.33Å; H208-A210 PolarHBondContact ND1-N 3.34Å; H208-A210 PolarHBondContact O-N 3.24Å; H208-A210 VanDerWaalsContact O-N 3.16Å; H208-F211 HydrophobicContact CB-CD2 3.92Å; H208-F211 HydrophobicContact CB-CE2 4.47Å; H208-F211 AromaticContact ND1-CD2 3.75Å; H208-F211 AromaticContact ND1-CE2 3.97Å; H208-F211 PolarHBondContact O-N 2.81Å
209	E	87.3	Confident	86	Confident	168 Å²	168	69.2 Å²	69.2	79%	0.785	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-50.2	-44.5	-172.5	53.1	175.4	-159.3	0	0	114.5	F211 N212	E209-F211 PolarHBondContact O-N 2.89Å; E209-N212 PolarHBondContact O-N 3.09Å
210	A	87.4	Confident	84.9	Confident	75 Å²	75	72.9 Å²	72.9	62%	0.62	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-60.5	-12.5	178.7	0	0	0	0	0	115.3	H208	H208-A210 VanDerWaalsContact C-N 3.33Å; H208-A210 PolarHBondContact ND1-N 3.34Å; H208-A210 PolarHBondContact O-N 3.24Å; H208-A210 VanDerWaalsContact O-N 3.16Å
211	F	87	Confident	83.7	Confident	43 Å²	43	75.7 Å²	75.7	19%	0.189	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-109.3	0.5	178.3	-60.6	-94.1	0	0	0	113	L205 H208 E209 P213 A238 Y240 L241	L205-F211 HydrophobicContact CB-CD2 4.42Å; L205-F211 HydrophobicContact CB-CG 4.43Å; L205-F211 HydrophobicContact CD1-CE1 4.47Å; L205-F211 HydrophobicContact CD1-CZ 4.41Å; L205-F211 HydrophobicContact CD2-CD2 4.36Å; L205-F211 HydrophobicContact CD2-CE2 3.74Å; L205-F211 HydrophobicContact CD2-CZ 3.88Å; L205-F211 WeakPolarHBondContact O-CB 3.38Å; H208-F211 HydrophobicContact CB-CD2 3.92Å; H208-F211 HydrophobicContact CB-CE2 4.47Å; H208-F211 AromaticContact ND1-CD2 3.75Å; H208-F211 AromaticContact ND1-CE2 3.97Å; H208-F211 PolarHBondContact O-N 2.81Å; E209-F211 PolarHBondContact O-N 2.89Å; F211-P213 WeakPolarHBondContact O-CD 3.22Å; F211-A238 WeakPolarHBondContact O-CB 3.38Å; F211-A238 PolarHBondContact O-N 3.2Å; F211-Y240 AromaticContact CD1-CE2 3.92Å; F211-Y240 HydrophobicContact CD1-CE2 3.92Å; F211-Y240 AromaticContact CD1-CZ 3.9Å; F211-Y240 WeakPolarHBondContact CD1-OH 3.29Å; F211-Y240 AromaticContact CE1-CE2 4Å; F211-Y240 HydrophobicContact CE1-CE2 4Å; F211-Y240 VanDerWaalsContact CE1-OH 3.32Å; F211-Y240 WeakPolarHBondContact CE1-OH 3.48Å; F211-L241 HydrophobicContact CB-CD1 3.76Å; F211-L241 HydrophobicContact CD1-CD1 3.82Å; F211-L241 HydrophobicContact CD1-CD2 4.22Å; F211-L241 HydrophobicContact CD1-CG 4.19Å; F211-L241 HydrophobicContact CG-CD1 4.02Å
212	N	85.9	Confident	82.4	Confident	32 Å²	32	76.7 Å²	76.7	17%	0.171	42%	0.416	C	S	.	.	S	Bend	trans	-120.8	65.5	-178.9	-74.8	-47.3	0	0	0	111.2	E206 E209 T237	E206-N212 PolarHBondContact O-ND2 3.12Å; E206-N212 PolarHBondContact O-OD1 2.94Å; E209-N212 PolarHBondContact O-N 3.09Å; N212-T237 WeakPolarHBondContact OD1-CA 3.44Å; N212-T237 VanDerWaalsContact OD1-CG2 3.25Å; N212-T237 WeakPolarHBondContact OD1-CG2 3.46Å
213	P	84.5	Confident	81.1	Confident	68 Å²	68	81.9 Å²	81.9	44%	0.442	44%	0.443	S	S	.	.			trans	-57.7	142.5	176.6	26	-36.2	0	0	0	112.3	F211 E236	F211-P213 WeakPolarHBondContact O-CD 3.22Å; P213-E236 VanDerWaalsContact CD-O 3.29Å; P213-E236 WeakPolarHBondContact CD-O 3.38Å; P213-E236 PolarHBondContact O-N 2.88Å
214	I	83.2	Confident	79.4	Confident	111 Å²	111	87.4 Å²	87.4	57%	0.569	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	125.1	173.7	-57.3	172.1	0	0	0	108.8	Q233 T235	I214-Q233 HydrophobicContact CG2-CB 3.83Å; I214-Q233 HydrophobicContact CG2-CG 4.09Å; I214-T235 HydrophobicContact CG1-CG2 3.94Å
215	V	79.9	Confident	78.4	Confident	51 Å²	51	91.8 Å²	91.8	31%	0.309	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.2	178.9	-176.4	0	0	0	0	109.1	R217 E234 E236	V215-R217 PolarHBondContact O-N 2.81Å; V215-E234 PolarHBondContact N-O 3.19Å; V215-E234 PolarHBondContact O-N 2.94Å; V215-E234 VanDerWaalsContact O-N 3.08Å; V215-E236 HydrophobicContact CB-CG 4.43Å; V215-E236 HydrophobicContact CG2-CB 4.11Å; V215-E236 HydrophobicContact CG2-CG 4.23Å
216	N	79.4	Confident	77.2	Confident	107 Å²	107	96.1 Å²	96.1	57%	0.572	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	111.9	173.6	-62	-31.8	0	0	0	109	T231 Q233	N216-T231 HydrophobicContact CB-CG2 4.36Å; N216-Q233 WeakPolarHBondContact OD1-CG 3.46Å; N216-Q233 PolarHBondContact OD1-NE2 3.17Å
217	R	74.1	Confident	76.5	Confident	116 Å²	116	100 Å²	100	44%	0.438	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.3	172.3	-79	-75.5	-176.3	152.2	-2.9	110.1	V215 T231 Y232 E236	V215-R217 PolarHBondContact O-N 2.81Å; R217-T231 CarbonylContact O-C 3.37Å; R217-T231 WeakPolarHBondContact O-CA 3.26Å; R217-Y232 HydrophobicContact CB-CD1 4.15Å; R217-Y232 HydrophobicContact CB-CD2 4.35Å; R217-Y232 HydrophobicContact CB-CE1 3.64Å; R217-Y232 HydrophobicContact CB-CE2 3.91Å; R217-Y232 HydrophobicContact CB-CG 4.45Å; R217-Y232 VanDerWaalsContact CB-CZ 3.5Å; R217-Y232 HydrophobicContact CG-CE2 4.48Å; R217-Y232 PolarHBondContact N-O 3.08Å; R217-Y232 WeakPolarHBondContact O-CD1 3.48Å; R217-Y232 PolarHBondContact O-N 3.48Å; R217-E236 IonicContact CZ-OE1 3.91Å; R217-E236 VanDerWaalsContact CZ-OE1 3.22Å; R217-E236 IonicContact NE-OE1 2.73Å; R217-E236 PolarHBondContact NE-OE1 3.15Å; R217-E236 IonicContact NH2-OE1 2.74Å; R217-E236 PolarHBondContact NH2-OE1 2.87Å
218	T	76	Confident	75.9	Confident	91 Å²	91	98.3 Å²	98.3	56%	0.558	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	114.4	170.8	51.2	0	0	0	0	109.4	V229 S230 T231	T218-V229 HydrophobicContact CG2-CG1 4.22Å; T218-S230 WeakPolarHBondContact CA-O 3.38Å; T218-T231 HydrophobicContact CG2-CG2 4.15Å
219	E	71.6	Confident	75.3	Confident	75 Å²	75	97.9 Å²	97.9	35%	0.35	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	134	167.9	179.6	122.8	-113.6	0	0	108.1	E221 S230 Y232 K300	E219-E221 HydrophobicContact CG-CG 4.28Å; E219-S230 PolarHBondContact N-O 3.02Å; E219-S230 PolarHBondContact O-N 3.25Å; E219-Y232 HydrophobicContact CB-CE1 3.79Å; E219-K300 IonicContact OE1-NZ 2.76Å; E219-K300 PolarHBondContact OE1-NZ 2.77Å; E219-K300 IonicContact OE2-NZ 3.69Å; E219-K300 PolarHBondContact OE2-NZ 3.48Å
220	T	69.4	Low	74.5	Confident	78 Å²	78	92.1 Å²	92.1	48%	0.479	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	99.1	178.2	-53.1	0	0	0	0	108.3	V228 V229	T220-V228 WeakPolarHBondContact CA-O 3.36Å; T220-V229 HydrophobicContact CG2-CG2 4.19Å
221	E	69.6	Low	73.8	Confident	99 Å²	99	93 Å²	93	46%	0.463	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	137.1	173.7	-65.5	-160.6	117.5	0	0	109.7	E219 V228	E219-E221 HydrophobicContact CG-CG 4.28Å; E221-V228 PolarHBondContact N-O 2.9Å; E221-V228 PolarHBondContact O-N 3.16Å
222	V	65.6	Low	73.2	Confident	103 Å²	103	95.1 Å²	95.1	62%	0.624	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	105.4	176.1	-171.8	0	0	0	0	107.7	T227	V222-T227 HydrophobicContact CG2-CG2 4.33Å
223	L	65.4	Low	72.6	Confident	113 Å²	113	100 Å²	100	59%	0.592	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	124.1	174.1	-112.3	75.3	0	0	0	108.5	N225 E226	L223-N225 VanDerWaalsContact C-N 3.31Å; L223-N225 PolarHBondContact O-N 3.4Å; L223-N225 VanDerWaalsContact O-N 3.09Å; L223-E226 PolarHBondContact N-O 2.93Å; L223-E226 VanDerWaalsContact N-O 3.08Å; L223-E226 PolarHBondContact O-N 3.3Å
224	D	53.8	Low	72.2	Confident	158 Å²	158	99.5 Å²	99.5	85%	0.845	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.9	49.7	171	-64.2	-21.4	0	0	0	115.9	E226	D224-E226 VanDerWaalsContact C-N 3.33Å; D224-E226 PolarHBondContact O-N 3.18Å
225	N	70.6	Confident	71.6	Confident	165 Å²	165	98.5 Å²	98.5	88%	0.882	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	-0.8	-178.7	-51	-65.6	0	0	0	117.1	L223	L223-N225 VanDerWaalsContact C-N 3.31Å; L223-N225 PolarHBondContact O-N 3.4Å; L223-N225 VanDerWaalsContact O-N 3.09Å
226	E	66.1	Low	71.5	Confident	146 Å²	146	99.4 Å²	99.4	68%	0.682	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.3	169.8	-64.5	-164.3	164.5	0	0	111.6	L223 D224	L223-E226 PolarHBondContact N-O 2.93Å; L223-E226 VanDerWaalsContact N-O 3.08Å; L223-E226 PolarHBondContact O-N 3.3Å; D224-E226 VanDerWaalsContact C-N 3.33Å; D224-E226 PolarHBondContact O-N 3.18Å
227	T	73.2	Confident	71.5	Confident	100 Å²	100	96 Å²	96	61%	0.613	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	98.2	175.3	53.6	0	0	0	0	109.6	V222	V222-T227 HydrophobicContact CG2-CG2 4.33Å
228	V	74.1	Confident	72.1	Confident	72 Å²	72	91.2 Å²	91.2	44%	0.436	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116	178.8	-176.2	0	0	0	0	109.2	T220 E221 S230	T220-V228 WeakPolarHBondContact CA-O 3.36Å; E221-V228 PolarHBondContact N-O 2.9Å; E221-V228 PolarHBondContact O-N 3.16Å; V228-S230 PolarHBondContact O-N 2.97Å
229	V	76.6	Confident	72.5	Confident	84 Å²	84	89.7 Å²	89.7	51%	0.509	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	92.3	176.9	-176.3	0	0	0	0	109.5	T218 T220 T231	T218-V229 HydrophobicContact CG2-CG1 4.22Å; T220-V229 HydrophobicContact CG2-CG2 4.19Å; V229-T231 PolarHBondContact O-N 2.93Å
230	S	71.8	Confident	73.4	Confident	48 Å²	48	92 Å²	92	34%	0.336	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	114.8	175.9	-70	0	0	0	0	109.9	T218 E219 V228	T218-S230 WeakPolarHBondContact CA-O 3.38Å; E219-S230 PolarHBondContact N-O 3.02Å; E219-S230 PolarHBondContact O-N 3.25Å; V228-S230 PolarHBondContact O-N 2.97Å
231	T	72.2	Confident	74.3	Confident	93 Å²	93	88.5 Å²	88.5	57%	0.571	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.5	173.1	-50.3	0	0	0	0	109.5	N216 R217 T218 V229	N216-T231 HydrophobicContact CB-CG2 4.36Å; R217-T231 CarbonylContact O-C 3.37Å; R217-T231 WeakPolarHBondContact O-CA 3.26Å; T218-T231 HydrophobicContact CG2-CG2 4.15Å; V229-T231 PolarHBondContact O-N 2.93Å
232	Y	74.9	Confident	75.2	Confident	87 Å²	87	86.8 Å²	86.8	34%	0.341	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	159.3	-179.5	65.1	-76	0	0	0	110.5	R217 E219 E234	R217-Y232 HydrophobicContact CB-CD1 4.15Å; R217-Y232 HydrophobicContact CB-CD2 4.35Å; R217-Y232 HydrophobicContact CB-CE1 3.64Å; R217-Y232 HydrophobicContact CB-CE2 3.91Å; R217-Y232 HydrophobicContact CB-CG 4.45Å; R217-Y232 VanDerWaalsContact CB-CZ 3.5Å; R217-Y232 HydrophobicContact CG-CE2 4.48Å; R217-Y232 PolarHBondContact N-O 3.08Å; R217-Y232 WeakPolarHBondContact O-CD1 3.48Å; R217-Y232 PolarHBondContact O-N 3.48Å; E219-Y232 HydrophobicContact CB-CE1 3.79Å; Y232-E234 HydrophobicContact CD2-CG 3.94Å; Y232-E234 HydrophobicContact CE2-CG 3.67Å; Y232-E234 WeakPolarHBondContact CE2-OE2 3.45Å
233	Q	73.1	Confident	76.4	Confident	135 Å²	135	90.5 Å²	90.5	63%	0.631	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.6	-177.1	-69.7	-169.4	-36.1	0	0	110.2	I214 N216	I214-Q233 HydrophobicContact CG2-CB 3.83Å; I214-Q233 HydrophobicContact CG2-CG 4.09Å; N216-Q233 WeakPolarHBondContact OD1-CG 3.46Å; N216-Q233 PolarHBondContact OD1-NE2 3.17Å
234	E	74.9	Confident	77.7	Confident	58 Å²	58	88.4 Å²	88.4	27%	0.271	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.5	169.3	-73.3	-162.2	94.6	0	0	110.2	V215 Y232 R307	V215-E234 PolarHBondContact N-O 3.19Å; V215-E234 PolarHBondContact O-N 2.94Å; V215-E234 VanDerWaalsContact O-N 3.08Å; Y232-E234 HydrophobicContact CD2-CG 3.94Å; Y232-E234 HydrophobicContact CE2-CG 3.67Å; Y232-E234 WeakPolarHBondContact CE2-OE2 3.45Å; E234-R307 IonicContact OE1-NH2 3.16Å; E234-R307 PolarHBondContact OE1-NH2 3.4Å; E234-R307 VanDerWaalsContact OE1-NH2 3.16Å
235	T	71.3	Confident	79.5	Confident	89 Å²	89	81 Å²	81	55%	0.546	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	115.9	166.9	39.7	0	0	0	0	109.4	I214	I214-T235 HydrophobicContact CG1-CG2 3.94Å
236	E	77.4	Confident	80.6	Confident	71 Å²	71	73.8 Å²	73.8	33%	0.332	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-101.3	128.7	174.5	-68	-170.9	179.1	0	0	109.8	P213 V215 R217 A238	P213-E236 VanDerWaalsContact CD-O 3.29Å; P213-E236 WeakPolarHBondContact CD-O 3.38Å; P213-E236 PolarHBondContact O-N 2.88Å; V215-E236 HydrophobicContact CB-CG 4.43Å; V215-E236 HydrophobicContact CG2-CB 4.11Å; V215-E236 HydrophobicContact CG2-CG 4.23Å; R217-E236 IonicContact CZ-OE1 3.91Å; R217-E236 VanDerWaalsContact CZ-OE1 3.22Å; R217-E236 IonicContact NE-OE1 2.73Å; R217-E236 PolarHBondContact NE-OE1 3.15Å; R217-E236 IonicContact NH2-OE1 2.74Å; R217-E236 PolarHBondContact NH2-OE1 2.87Å; E236-A238 PolarHBondContact O-N 2.97Å
237	T	80.9	Confident	82	Confident	34 Å²	34	71.1 Å²	71.1	21%	0.209	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-62.2	129.6	176.1	45.3	0	0	0	0	110.7	N212 A239	N212-T237 WeakPolarHBondContact OD1-CA 3.44Å; N212-T237 VanDerWaalsContact OD1-CG2 3.25Å; N212-T237 WeakPolarHBondContact OD1-CG2 3.46Å; T237-A239 PolarHBondContact O-N 3.42Å
238	A	84.9	Confident	83	Confident	16 Å²	16	66.5 Å²	66.5	13%	0.132	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-56.7	122.4	-176.6	0	0	0	0	0	112.6	F211 E236 Y240 L241	F211-A238 WeakPolarHBondContact O-CB 3.38Å; F211-A238 PolarHBondContact O-N 3.2Å; E236-A238 PolarHBondContact O-N 2.97Å; A238-Y240 HydrophobicContact CB-CD1 4.11Å; A238-Y240 HydrophobicContact CB-CE1 3.61Å; A238-Y240 PolarHBondContact O-N 3.47Å; A238-L241 WeakPolarHBondContact O-CB 3.43Å; A238-L241 PolarHBondContact O-N 3.07Å
239	A	85.3	Confident	84	Confident	59 Å²	59	63.1 Å²	63.1	49%	0.488	34%	0.335	S	S	.	.	H	α-helix	trans	-55.4	-26	-166.3	0	0	0	0	0	115.7	T237 L241 T242 Y243	T237-A239 PolarHBondContact O-N 3.42Å; A239-L241 VanDerWaalsContact C-N 3.33Å; A239-L241 PolarHBondContact O-N 3.39Å; A239-T242 WeakPolarHBondContact O-CB 3.27Å; A239-T242 PolarHBondContact O-N 2.96Å; A239-Y243 HydrophobicContact CB-CE2 4.36Å; A239-Y243 WeakPolarHBondContact O-CD2 3.3Å; A239-Y243 PolarHBondContact O-N 3.33Å
240	Y	89.5	Confident	84.9	Confident	125 Å²	125	63.6 Å²	63.6	49%	0.49	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-30	175.8	59.7	-99.2	0	0	0	113.2	F211 A238 Y243 I244	F211-Y240 AromaticContact CD1-CE2 3.92Å; F211-Y240 HydrophobicContact CD1-CE2 3.92Å; F211-Y240 AromaticContact CD1-CZ 3.9Å; F211-Y240 WeakPolarHBondContact CD1-OH 3.29Å; F211-Y240 AromaticContact CE1-CE2 4Å; F211-Y240 HydrophobicContact CE1-CE2 4Å; F211-Y240 VanDerWaalsContact CE1-OH 3.32Å; F211-Y240 WeakPolarHBondContact CE1-OH 3.48Å; A238-Y240 HydrophobicContact CB-CD1 4.11Å; A238-Y240 HydrophobicContact CB-CE1 3.61Å; A238-Y240 PolarHBondContact O-N 3.47Å; Y240-Y243 PolarHBondContact O-N 3.23Å; Y240-I244 WeakPolarHBondContact O-CD1 3.36Å; Y240-I244 VanDerWaalsContact O-CG1 3.25Å; Y240-I244 WeakPolarHBondContact O-CG1 3.21Å; Y240-I244 PolarHBondContact O-N 3.36Å
241	L	89.9	Confident	86.1	Confident	3 Å²	3	64 Å²	64	2%	0.016	33%	0.332	C	S	.	.	H	α-helix	trans	-65.6	-43.6	170.7	-64.1	-174.7	0	0	0	110.4	T202 L205 E206 F211 A238 A239 Y243 I244 E245	T202-L241 HydrophobicContact CG2-CB 4.12Å; T202-L241 HydrophobicContact CG2-CD2 4.35Å; L205-L241 HydrophobicContact CB-CD1 3.94Å; L205-L241 HydrophobicContact CB-CD2 4.1Å; L205-L241 HydrophobicContact CD1-CD2 4.2Å; E206-L241 HydrophobicContact CG-CD1 4.25Å; F211-L241 HydrophobicContact CB-CD1 3.76Å; F211-L241 HydrophobicContact CD1-CD1 3.82Å; F211-L241 HydrophobicContact CD1-CD2 4.22Å; F211-L241 HydrophobicContact CD1-CG 4.19Å; F211-L241 HydrophobicContact CG-CD1 4.02Å; A238-L241 WeakPolarHBondContact O-CB 3.43Å; A238-L241 PolarHBondContact O-N 3.07Å; A239-L241 VanDerWaalsContact C-N 3.33Å; A239-L241 PolarHBondContact O-N 3.39Å; L241-Y243 VanDerWaalsContact C-N 3.32Å; L241-Y243 PolarHBondContact O-N 3.38Å; L241-I244 PolarHBondContact O-N 3.44Å; L241-I244 VanDerWaalsContact O-N 3.14Å; L241-E245 PolarHBondContact O-N 2.8Å
242	T	86.9	Confident	87.2	Confident	63 Å²	63	59.5 Å²	59.5	39%	0.387	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-38.5	176.3	-40.9	0	0	0	0	112.2	A239 G246	A239-T242 WeakPolarHBondContact O-CB 3.27Å; A239-T242 PolarHBondContact O-N 2.96Å; T242-G246 PolarHBondContact O-N 2.94Å
243	Y	91.4	Very high	88.2	Confident	181 Å²	181	56.2 Å²	56.2	71%	0.71	29%	0.294	S	S	*	.	H	α-helix	trans	-66.6	-41.5	172.8	-72.6	-58.9	0	0	0	112.6	A239 Y240 L241 G246 V247	A239-Y243 HydrophobicContact CB-CE2 4.36Å; A239-Y243 WeakPolarHBondContact O-CD2 3.3Å; A239-Y243 PolarHBondContact O-N 3.33Å; Y240-Y243 PolarHBondContact O-N 3.23Å; L241-Y243 VanDerWaalsContact C-N 3.32Å; L241-Y243 PolarHBondContact O-N 3.38Å; Y243-G246 PolarHBondContact O-N 2.93Å; Y243-V247 WeakPolarHBondContact O-CG2 3.31Å; Y243-V247 PolarHBondContact O-N 2.69Å; Y243-V247 VanDerWaalsContact O-N 3.09Å
244	I	93.6	Very high	89.2	Confident	70 Å²	70	54.2 Å²	54.2	36%	0.359	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-45.2	176.4	-68.8	162.7	0	0	0	110.6	V198 T202 Y240 L241 G246 V247 C248	V198-I244 HydrophobicContact CG1-CG2 3.72Å; T202-I244 HydrophobicContact CG2-CG2 4.48Å; T202-I244 WeakPolarHBondContact OG1-CG2 3.35Å; Y240-I244 WeakPolarHBondContact O-CD1 3.36Å; Y240-I244 VanDerWaalsContact O-CG1 3.25Å; Y240-I244 WeakPolarHBondContact O-CG1 3.21Å; Y240-I244 PolarHBondContact O-N 3.36Å; L241-I244 PolarHBondContact O-N 3.44Å; L241-I244 VanDerWaalsContact O-N 3.14Å; I244-G246 VanDerWaalsContact C-N 3.35Å; I244-G246 PolarHBondContact O-N 3.01Å; I244-V247 PolarHBondContact O-N 3.07Å; I244-C248 PolarHBondContact O-N 2.96Å; I244-C248 VanDerWaalsContact O-N 3.09Å
245	E	91.9	Very high	90.1	Very high	3 Å²	3	51.5 Å²	51.5	1%	0.014	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-44.5	174.3	-179.7	171.5	-123.4	0	0	111.4	T202 L241 V247 C248 V249 F285 R313 R316	T202-E245 HydrophobicContact CG2-CB 4.29Å; L241-E245 PolarHBondContact O-N 2.8Å; E245-V247 VanDerWaalsContact C-N 3.26Å; E245-V247 PolarHBondContact O-N 3.48Å; E245-C248 CarbonylContact O-C 3.55Å; E245-C248 WeakPolarHBondContact O-CA 3.46Å; E245-C248 WeakPolarHBondContact O-CB 3.36Å; E245-C248 PolarHBondContact O-N 3.37Å; E245-V249 HydrophobicContact CG-CG2 3.96Å; E245-V249 WeakPolarHBondContact O-CG2 3.3Å; E245-V249 PolarHBondContact O-N 2.94Å; E245-F285 HydrophobicContact CG-CD2 4.29Å; E245-R313 VanDerWaalsContact CD-NH1 3.29Å; E245-R313 IonicContact OE1-CZ 3.22Å; E245-R313 IonicContact OE1-NE 2.69Å; E245-R313 IonicContact OE1-NH1 3.48Å; E245-R313 PolarHBondContact OE1-NH1 2.96Å; E245-R313 IonicContact OE2-CZ 2.66Å; E245-R313 IonicContact OE2-NE 2.77Å; E245-R313 IonicContact OE2-NH1 3.33Å; E245-R313 PolarHBondContact OE2-NH1 3.48Å; E245-R313 IonicContact OE2-NH2 3.2Å; E245-R313 PolarHBondContact OE2-NH2 3Å; E245-R316 IonicContact OE1-CZ 3.13Å; E245-R316 VanDerWaalsContact OE1-CZ 3.28Å; E245-R316 IonicContact OE1-NH1 3.4Å; E245-R316 PolarHBondContact OE1-NH1 3.21Å; E245-R316 IonicContact OE1-NH2 3.82Å; E245-R316 PolarHBondContact OE1-NH2 2.77Å
246	G	92.1	Very high	91.2	Very high	13 Å²	13	48.6 Å²	48.6	13%	0.134	25%	0.25	C	S	.	.	H	α-helix	trans	-55.4	-40.8	177	0	0	0	0	0	112.8	T242 Y243 I244 V249 V250	T242-G246 PolarHBondContact O-N 2.94Å; Y243-G246 PolarHBondContact O-N 2.93Å; I244-G246 VanDerWaalsContact C-N 3.35Å; I244-G246 PolarHBondContact O-N 3.01Å; G246-V249 PolarHBondContact O-N 3.09Å; G246-V250 WeakPolarHBondContact O-CB 3.36Å; G246-V250 VanDerWaalsContact O-CG2 3.29Å; G246-V250 WeakPolarHBondContact O-CG2 3.41Å; G246-V250 PolarHBondContact O-N 2.79Å
247	V	95.3	Very high	92	Very high	90 Å²	90	49.7 Å²	49.7	55%	0.545	26%	0.258	S	S	.	.	H	α-helix	trans	-65.4	-43.7	174.4	173.9	0	0	0	0	111.7	F195 Y243 I244 E245 V250 W251	F195-V247 HydrophobicContact CE1-CG1 4.1Å; Y243-V247 WeakPolarHBondContact O-CG2 3.31Å; Y243-V247 PolarHBondContact O-N 2.69Å; Y243-V247 VanDerWaalsContact O-N 3.09Å; I244-V247 PolarHBondContact O-N 3.07Å; E245-V247 VanDerWaalsContact C-N 3.26Å; E245-V247 PolarHBondContact O-N 3.48Å; V247-V250 PolarHBondContact O-N 2.84Å; V247-W251 PolarHBondContact O-N 2.91Å
248	C	95.4	Very high	92.6	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.014	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-42.7	174.7	-71.3	0	0	0	0	112.5	I244 E245 W251 F252	I244-C248 PolarHBondContact O-N 2.96Å; I244-C248 VanDerWaalsContact O-N 3.09Å; E245-C248 CarbonylContact O-C 3.55Å; E245-C248 WeakPolarHBondContact O-CA 3.46Å; E245-C248 WeakPolarHBondContact O-CB 3.36Å; E245-C248 PolarHBondContact O-N 3.37Å; C248-W251 PolarHBondContact O-N 3.19Å; C248-F252 HydrophobicContact CB-CE2 4.2Å; C248-F252 HydrophobicContact CB-CZ 4.45Å; C248-F252 VanDerWaalsContact O-CD2 3.31Å; C248-F252 WeakPolarHBondContact O-CD2 3.36Å; C248-F252 VanDerWaalsContact O-CG 3.3Å; C248-F252 WeakPolarHBondContact O-CG 3.4Å; C248-F252 PolarHBondContact O-N 2.67Å
249	V	94.9	Very high	92.9	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-38.2	177.9	172.4	0	0	0	0	111.1	E245 G246 W251 F252 T253 I282 F285 Y286	E245-V249 HydrophobicContact CG-CG2 3.96Å; E245-V249 WeakPolarHBondContact O-CG2 3.3Å; E245-V249 PolarHBondContact O-N 2.94Å; G246-V249 PolarHBondContact O-N 3.09Å; V249-W251 VanDerWaalsContact C-N 3.33Å; V249-W251 PolarHBondContact O-N 2.87Å; V249-F252 PolarHBondContact O-N 3.27Å; V249-T253 VanDerWaalsContact O-CB 3.27Å; V249-T253 WeakPolarHBondContact O-CB 3.15Å; V249-T253 PolarHBondContact O-N 3.49Å; V249-T253 PolarHBondContact O-OG1 3.13Å; V249-I282 HydrophobicContact CG1-CB 4.26Å; V249-I282 HydrophobicContact CG1-CG2 4.26Å; V249-F285 HydrophobicContact CB-CD1 4.27Å; V249-F285 HydrophobicContact CB-CG 4.25Å; V249-F285 HydrophobicContact CG1-CB 4.08Å; V249-F285 HydrophobicContact CG1-CD1 3.76Å; V249-F285 HydrophobicContact CG1-CE1 4.44Å; V249-F285 HydrophobicContact CG1-CG 4.01Å; V249-F285 HydrophobicContact CG2-CB 3.93Å; V249-F285 HydrophobicContact CG2-CD2 4.25Å; V249-F285 HydrophobicContact CG2-CG 3.99Å; V249-Y286 HydrophobicContact CG1-CD2 4.38Å; V249-Y286 HydrophobicContact CG1-CE2 3.75Å
250	V	95.9	Very high	93.2	Very high	95 Å²	95	48.7 Å²	48.7	58%	0.576	24%	0.24	S	C	*	.	H	α-helix	trans	-60.5	-41.7	172	166.3	0	0	0	0	111.2	G246 V247 T253 F254	G246-V250 WeakPolarHBondContact O-CB 3.36Å; G246-V250 VanDerWaalsContact O-CG2 3.29Å; G246-V250 WeakPolarHBondContact O-CG2 3.41Å; G246-V250 PolarHBondContact O-N 2.79Å; V247-V250 PolarHBondContact O-N 2.84Å; V250-T253 PolarHBondContact O-N 3.04Å; V250-F254 WeakPolarHBondContact O-CB 3.42Å; V250-F254 PolarHBondContact O-N 3.03Å
251	W	96.1	Very high	93.3	Very high	55 Å²	55	45.7 Å²	45.7	21%	0.208	23%	0.234	C	C	.	.	H	α-helix	trans	-63.7	-48.1	174.4	-179	-94.7	0	0	0	112.6	A191 S192 F195 V247 C248 V249 T253 F254 E255	A191-W251 HydrophobicContact CB-CH2 4.02Å; A191-W251 HydrophobicContact CB-CZ2 3.72Å; S192-W251 PolarHBondContact OG-NE1 2.98Å; F195-W251 HydrophobicContact CB-CG 4.22Å; F195-W251 HydrophobicContact CD1-CB 4.3Å; F195-W251 HydrophobicContact CD2-CB 3.94Å; F195-W251 AromaticContact CD2-CD1 3.44Å; F195-W251 VanDerWaalsContact CD2-CD1 3.44Å; F195-W251 AromaticContact CD2-CD2 3.45Å; F195-W251 HydrophobicContact CD2-CD2 3.45Å; F195-W251 VanDerWaalsContact CD2-CD2 3.45Å; F195-W251 AromaticContact CD2-CE2 3.68Å; F195-W251 HydrophobicContact CD2-CE3 4.12Å; F195-W251 AromaticContact CD2-CG 3.31Å; F195-W251 HydrophobicContact CD2-CG 3.31Å; F195-W251 HydrophobicContact CD2-CZ2 4.49Å; F195-W251 AromaticContact CD2-NE1 3.66Å; F195-W251 HydrophobicContact CE2-CB 4.17Å; F195-W251 AromaticContact CE2-CD2 3.47Å; F195-W251 HydrophobicContact CE2-CD2 3.47Å; F195-W251 VanDerWaalsContact CE2-CD2 3.47Å; F195-W251 AromaticContact CE2-CE2 3.98Å; F195-W251 AromaticContact CE2-CE3 3.63Å; F195-W251 HydrophobicContact CE2-CE3 3.63Å; F195-W251 AromaticContact CE2-CG 3.7Å; F195-W251 HydrophobicContact CE2-CG 3.7Å; F195-W251 HydrophobicContact CE2-CZ3 4.25Å; F195-W251 HydrophobicContact CG-CB 4.01Å; F195-W251 AromaticContact CG-CD1 3.8Å; F195-W251 HydrophobicContact CG-CD2 4.37Å; F195-W251 AromaticContact CG-CG 3.77Å; F195-W251 HydrophobicContact CG-CG 3.77Å; F195-W251 HydrophobicContact CZ-CB 4.46Å; F195-W251 HydrophobicContact CZ-CD2 4.41Å; F195-W251 HydrophobicContact CZ-CE3 4.37Å; F195-W251 HydrophobicContact CZ-CG 4.45Å; V247-W251 PolarHBondContact O-N 2.91Å; C248-W251 PolarHBondContact O-N 3.19Å; V249-W251 VanDerWaalsContact C-N 3.33Å; V249-W251 PolarHBondContact O-N 2.87Å; W251-T253 VanDerWaalsContact C-N 3.28Å; W251-T253 PolarHBondContact O-N 3.03Å; W251-F254 HydrophobicContact CE3-CD1 4.43Å; W251-F254 HydrophobicContact CZ3-CD1 4.43Å; W251-F254 WeakPolarHBondContact O-CB 3.12Å; W251-F254 PolarHBondContact O-N 2.96Å; W251-E255 PolarHBondContact O-N 3.03Å
252	F	95.1	Very high	93.4	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-33.2	178.2	-58.7	-30.9	0	0	0	112.7	F195 I196 S199 C248 V249 E255 F256 I282 K319	F195-F252 HydrophobicContact CB-CE1 3.88Å; F195-F252 HydrophobicContact CB-CZ 4.25Å; I196-F252 HydrophobicContact CG1-CE1 3.8Å; I196-F252 HydrophobicContact CG1-CZ 4.03Å; S199-F252 WeakPolarHBondContact OG-CZ 3.22Å; C248-F252 HydrophobicContact CB-CE2 4.2Å; C248-F252 HydrophobicContact CB-CZ 4.45Å; C248-F252 VanDerWaalsContact O-CD2 3.31Å; C248-F252 WeakPolarHBondContact O-CD2 3.36Å; C248-F252 VanDerWaalsContact O-CG 3.3Å; C248-F252 WeakPolarHBondContact O-CG 3.4Å; C248-F252 PolarHBondContact O-N 2.67Å; V249-F252 PolarHBondContact O-N 3.27Å; F252-E255 PolarHBondContact O-N 3.02Å; F252-F256 WeakPolarHBondContact O-CB 3.36Å; F252-F256 PolarHBondContact O-N 3.18Å; F252-I282 HydrophobicContact CB-CG2 3.5Å; F252-K319 HydrophobicContact CD1-CD 4.48Å; F252-K319 VanDerWaalsContact CD1-CE 3.47Å
253	T	95.6	Very high	93.5	Very high	18 Å²	18	44 Å²	44	11%	0.11	22%	0.222	C	C	.	.	H	α-helix	trans	-70	-41.3	174.9	-55.1	0	0	0	0	110.8	V249 V250 W251 F256 L257 I282 Y286	V249-T253 VanDerWaalsContact O-CB 3.27Å; V249-T253 WeakPolarHBondContact O-CB 3.15Å; V249-T253 PolarHBondContact O-N 3.49Å; V249-T253 PolarHBondContact O-OG1 3.13Å; V250-T253 PolarHBondContact O-N 3.04Å; W251-T253 VanDerWaalsContact C-N 3.28Å; W251-T253 PolarHBondContact O-N 3.03Å; T253-F256 PolarHBondContact O-N 3.25Å; T253-L257 HydrophobicContact CG2-CD1 3.92Å; T253-L257 HydrophobicContact CG2-CG 4.23Å; T253-L257 VanDerWaalsContact O-CB 3.26Å; T253-L257 WeakPolarHBondContact O-CB 3.46Å; T253-L257 WeakPolarHBondContact O-CG 3.24Å; T253-L257 PolarHBondContact O-N 3.01Å; T253-I282 HydrophobicContact CG2-CD1 4.32Å; T253-Y286 HydrophobicContact CG2-CE2 4.32Å; T253-Y286 WeakPolarHBondContact OG1-CE2 3.02Å; T253-Y286 PolarHBondContact OG1-OH 3.05Å
254	F	95.4	Very high	93.3	Very high	93 Å²	93	39.6 Å²	39.6	41%	0.408	22%	0.215	S	C	.	.	H	α-helix	trans	-59.1	-47.4	171.3	168.6	-106.8	0	0	0	111.7	F176 V250 W251 F256 L257 M258	F176-F254 HydrophobicContact CE1-CE1 4.05Å; F176-F254 AromaticContact CZ-CE1 3.77Å; F176-F254 HydrophobicContact CZ-CE1 3.77Å; F176-F254 AromaticContact CZ-CZ 3.96Å; F176-F254 HydrophobicContact CZ-CZ 3.96Å; V250-F254 WeakPolarHBondContact O-CB 3.42Å; V250-F254 PolarHBondContact O-N 3.03Å; W251-F254 HydrophobicContact CE3-CD1 4.43Å; W251-F254 HydrophobicContact CZ3-CD1 4.43Å; W251-F254 WeakPolarHBondContact O-CB 3.12Å; W251-F254 PolarHBondContact O-N 2.96Å; F254-F256 PolarHBondContact O-N 3.31Å; F254-L257 PolarHBondContact O-N 2.97Å; F254-M258 HydrophobicContact CD2-CG 3.91Å; F254-M258 HydrophobicContact CE1-CG 4.35Å; F254-M258 HydrophobicContact CE2-CE 4.44Å; F254-M258 HydrophobicContact CE2-CG 3.53Å; F254-M258 HydrophobicContact CE2-SD 3.85Å; F254-M258 HydrophobicContact CG-CG 4.46Å; F254-M258 HydrophobicContact CZ-CE 4.32Å; F254-M258 HydrophobicContact CZ-CG 3.78Å; F254-M258 HydrophobicContact CZ-SD 4.27Å; F254-M258 WeakPolarHBondContact O-CB 3.45Å; F254-M258 WeakPolarHBondContact O-CG 3.28Å; F254-M258 PolarHBondContact O-N 3.47Å
255	E	94.3	Very high	93	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-55.5	-52.1	173.5	-75	-160.5	112.1	0	0	112.3	F176 S192 W251 F252 L257 M258 R259 K319	F176-E255 HydrophobicContact CE1-CG 4.5Å; S192-E255 WeakPolarHBondContact CB-OE1 3.5Å; S192-E255 PolarHBondContact OG-OE1 3.3Å; W251-E255 PolarHBondContact O-N 3.03Å; F252-E255 PolarHBondContact O-N 3.02Å; E255-L257 PolarHBondContact O-N 3.45Å; E255-M258 PolarHBondContact O-N 2.86Å; E255-R259 WeakPolarHBondContact O-CG 3.21Å; E255-R259 PolarHBondContact O-N 3.27Å; E255-R259 IonicContact OE1-CZ 2.63Å; E255-R259 IonicContact OE1-NH1 2.69Å; E255-R259 PolarHBondContact OE1-NH1 3.42Å; E255-R259 IonicContact OE1-NH2 3.26Å; E255-R259 PolarHBondContact OE1-NH2 3.32Å; E255-R259 IonicContact OE2-NH1 3.27Å; E255-R259 PolarHBondContact OE2-NH1 3.17Å; E255-K319 IonicContact OE2-NZ 2.73Å; E255-K319 PolarHBondContact OE2-NZ 3.43Å
256	F	93.4	Very high	92.9	Very high	27 Å²	27	45.8 Å²	45.8	12%	0.118	24%	0.244	C	C	.	.	H	α-helix	trans	-63.1	-42.4	-176.8	179.1	-103.4	0	0	0	111.6	F252 T253 F254 R259 I260 F269 D278 F279 I282	F252-F256 WeakPolarHBondContact O-CB 3.36Å; F252-F256 PolarHBondContact O-N 3.18Å; T253-F256 PolarHBondContact O-N 3.25Å; F254-F256 PolarHBondContact O-N 3.31Å; F256-R259 PolarHBondContact O-N 3.31Å; F256-I260 HydrophobicContact CE1-CD1 4.33Å; F256-I260 HydrophobicContact CZ-CD1 4.08Å; F256-I260 WeakPolarHBondContact O-CG2 3.48Å; F256-I260 PolarHBondContact O-N 2.97Å; F256-F269 HydrophobicContact CD2-CE1 4.42Å; F256-F269 HydrophobicContact CD2-CZ 4.39Å; F256-F269 AromaticContact CE2-CE1 3.85Å; F256-F269 HydrophobicContact CE2-CE1 3.85Å; F256-F269 HydrophobicContact CE2-CZ 4.24Å; F256-F269 HydrophobicContact CZ-CE1 4.38Å; F256-D278 HydrophobicContact CD2-CB 3.87Å; F256-F279 HydrophobicContact CE1-CD2 4.07Å; F256-F279 HydrophobicContact CE2-CB 3.85Å; F256-F279 HydrophobicContact CZ-CB 3.94Å; F256-F279 AromaticContact CZ-CD2 3.93Å; F256-F279 HydrophobicContact CZ-CD2 3.93Å; F256-F279 HydrophobicContact CZ-CG 4.33Å; F256-I282 HydrophobicContact CD1-CD1 4.3Å
257	L	93.9	Very high	92.8	Very high	94 Å²	94	51.2 Å²	51.2	49%	0.492	26%	0.264	S	S	.	.	H	α-helix	trans	-62.7	-42.6	174.5	-73.5	174.7	0	0	0	112	T253 F254 E255 T261	T253-L257 HydrophobicContact CG2-CD1 3.92Å; T253-L257 HydrophobicContact CG2-CG 4.23Å; T253-L257 VanDerWaalsContact O-CB 3.26Å; T253-L257 WeakPolarHBondContact O-CB 3.46Å; T253-L257 WeakPolarHBondContact O-CG 3.24Å; T253-L257 PolarHBondContact O-N 3.01Å; F254-L257 PolarHBondContact O-N 2.97Å; E255-L257 PolarHBondContact O-N 3.45Å; L257-T261 WeakPolarHBondContact O-CB 3.33Å; L257-T261 VanDerWaalsContact O-CG2 3.24Å; L257-T261 WeakPolarHBondContact O-CG2 3.34Å; L257-T261 PolarHBondContact O-N 3.01Å; L257-T261 PolarHBondContact O-OG1 3.46Å
258	M	92.9	Very high	92.2	Very high	43 Å²	43	50.2 Å²	50.2	21%	0.212	26%	0.256	C	S	.	.	H	α-helix	trans	-64.6	-40.1	175.9	-69.3	-68.8	-77.3	0	0	111.4	V172 F176 F254 E255 T261 F262	V172-M258 HydrophobicContact CG1-CE 3.57Å; F176-M258 HydrophobicContact CD1-CB 4.33Å; F176-M258 HydrophobicContact CD2-CB 4.2Å; F176-M258 HydrophobicContact CD2-CE 4.4Å; F176-M258 HydrophobicContact CE1-CB 4.18Å; F176-M258 HydrophobicContact CE1-CG 4.41Å; F176-M258 HydrophobicContact CE2-CB 4.05Å; F176-M258 HydrophobicContact CE2-CE 3.57Å; F176-M258 HydrophobicContact CE2-CG 4.21Å; F176-M258 HydrophobicContact CG-CB 4.34Å; F176-M258 HydrophobicContact CZ-CB 4.03Å; F176-M258 HydrophobicContact CZ-CE 4.03Å; F176-M258 HydrophobicContact CZ-CG 3.97Å; F254-M258 HydrophobicContact CD2-CG 3.91Å; F254-M258 HydrophobicContact CE1-CG 4.35Å; F254-M258 HydrophobicContact CE2-CE 4.44Å; F254-M258 HydrophobicContact CE2-CG 3.53Å; F254-M258 HydrophobicContact CE2-SD 3.85Å; F254-M258 HydrophobicContact CG-CG 4.46Å; F254-M258 HydrophobicContact CZ-CE 4.32Å; F254-M258 HydrophobicContact CZ-CG 3.78Å; F254-M258 HydrophobicContact CZ-SD 4.27Å; F254-M258 WeakPolarHBondContact O-CB 3.45Å; F254-M258 WeakPolarHBondContact O-CG 3.28Å; F254-M258 PolarHBondContact O-N 3.47Å; E255-M258 PolarHBondContact O-N 2.86Å; M258-T261 PolarHBondContact O-OG1 3.14Å; M258-F262 HydrophobicContact CE-CD2 4.36Å; M258-F262 HydrophobicContact CE-CE2 3.94Å; M258-F262 VanDerWaalsContact O-CD2 3.31Å; M258-F262 WeakPolarHBondContact O-CD2 3.47Å; M258-F262 PolarHBondContact O-N 2.96Å; M258-F262 HydrophobicContact SD-CD2 4.4Å; M258-F262 HydrophobicContact SD-CE2 3.91Å
259	R	91.4	Very high	91.9	Very high	5 Å²	5	50.6 Å²	50.6	2%	0.019	26%	0.257	C	S	.	.	H	α-helix	trans	-66.5	-50.5	175.5	-71	-176.5	-173.8	108.4	20.6	112	W173 F176 E177 E255 F256 T261 F262 C263 F269 D278	W173-R259 HydrophobicContact CZ3-CB 4.05Å; W173-R259 HydrophobicContact CZ3-CG 4.4Å; W173-R259 WeakPolarHBondContact CZ3-O 3.38Å; F176-R259 HydrophobicContact CB-CG 4.06Å; F176-R259 PolarHBondContact O-NE 2.83Å; F176-R259 VanDerWaalsContact O-NE 3.07Å; F176-R259 PolarHBondContact O-NH2 3.44Å; E177-R259 IonicContact OE2-NE 3.17Å; E255-R259 WeakPolarHBondContact O-CG 3.21Å; E255-R259 PolarHBondContact O-N 3.27Å; E255-R259 IonicContact OE1-CZ 2.63Å; E255-R259 IonicContact OE1-NH1 2.69Å; E255-R259 PolarHBondContact OE1-NH1 3.42Å; E255-R259 IonicContact OE1-NH2 3.26Å; E255-R259 PolarHBondContact OE1-NH2 3.32Å; E255-R259 IonicContact OE2-NH1 3.27Å; E255-R259 PolarHBondContact OE2-NH1 3.17Å; F256-R259 PolarHBondContact O-N 3.31Å; R259-T261 VanDerWaalsContact C-N 3.35Å; R259-T261 PolarHBondContact O-N 3.1Å; R259-F262 PolarHBondContact O-N 3.05Å; R259-C263 VanDerWaalsContact O-CB 3.3Å; R259-C263 WeakPolarHBondContact O-CB 3.24Å; R259-C263 PolarHBondContact O-N 3.3Å; R259-F269 HydrophobicContact CB-CE2 3.65Å; R259-F269 HydrophobicContact CB-CZ 3.66Å; R259-D278 IonicContact CZ-OD2 3Å; R259-D278 IonicContact NH1-OD1 3.67Å; R259-D278 IonicContact NH1-OD2 3.03Å; R259-D278 PolarHBondContact NH1-OD2 2.63Å
260	I	93.1	Very high	91.6	Very high	41 Å²	41	55.4 Å²	55.4	21%	0.21	28%	0.281	C	S	.	.	H	α-helix	trans	-72.8	-22	-177.3	-158.3	170.9	0	0	0	113.7	F256 C263 K266 F269	F256-I260 HydrophobicContact CE1-CD1 4.33Å; F256-I260 HydrophobicContact CZ-CD1 4.08Å; F256-I260 WeakPolarHBondContact O-CG2 3.48Å; F256-I260 PolarHBondContact O-N 2.97Å; I260-C263 PolarHBondContact O-SG 3.42Å; I260-C263 VanDerWaalsContact O-SG 3.41Å; I260-K266 PolarHBondContact O-NZ 3.2Å; I260-F269 HydrophobicContact CB-CD1 4.13Å; I260-F269 HydrophobicContact CB-CE1 3.66Å; I260-F269 HydrophobicContact CB-CZ 4.22Å; I260-F269 HydrophobicContact CD1-CD1 4.19Å; I260-F269 HydrophobicContact CD1-CE1 4.1Å; I260-F269 HydrophobicContact CG1-CD1 3.78Å; I260-F269 HydrophobicContact CG1-CE1 3.78Å
261	T	91.4	Very high	91.1	Very high	61 Å²	61	57.5 Å²	57.5	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-77.2	-43.7	172	51.7	0	0	0	0	111.9	L257 M258 R259 K266	L257-T261 WeakPolarHBondContact O-CB 3.33Å; L257-T261 VanDerWaalsContact O-CG2 3.24Å; L257-T261 WeakPolarHBondContact O-CG2 3.34Å; L257-T261 PolarHBondContact O-N 3.01Å; L257-T261 PolarHBondContact O-OG1 3.46Å; M258-T261 PolarHBondContact O-OG1 3.14Å; R259-T261 VanDerWaalsContact C-N 3.35Å; R259-T261 PolarHBondContact O-N 3.1Å; T261-K266 PolarHBondContact O-NZ 3.08Å
262	F	91.3	Very high	90.6	Very high	30 Å²	30	57.2 Å²	57.2	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-98.4	-2	-173.2	-64.1	-66.8	0	0	0	116	W165 Q169 V172 M258 R259	W165-F262 HydrophobicContact CE3-CE1 4.47Å; W165-F262 AromaticContact CH2-CD1 3.95Å; W165-F262 HydrophobicContact CH2-CD1 3.95Å; W165-F262 AromaticContact CH2-CE1 3.33Å; W165-F262 HydrophobicContact CH2-CE1 3.33Å; W165-F262 HydrophobicContact CH2-CZ 4.03Å; W165-F262 HydrophobicContact CZ2-CD1 4.01Å; W165-F262 AromaticContact CZ2-CE1 3.85Å; W165-F262 HydrophobicContact CZ2-CE1 3.85Å; W165-F262 AromaticContact CZ3-CE1 3.69Å; W165-F262 HydrophobicContact CZ3-CE1 3.69Å; W165-F262 HydrophobicContact CZ3-CZ 4.32Å; Q169-F262 HydrophobicContact CB-CD1 4.19Å; Q169-F262 HydrophobicContact CG-CB 4.34Å; Q169-F262 HydrophobicContact CG-CD1 4.33Å; Q169-F262 WeakPolarHBondContact CG-O 3.26Å; V172-F262 HydrophobicContact CB-CB 4.45Å; V172-F262 HydrophobicContact CB-CD1 4.46Å; V172-F262 HydrophobicContact CB-CD2 3.95Å; V172-F262 HydrophobicContact CB-CE2 4.31Å; V172-F262 HydrophobicContact CB-CG 4.04Å; V172-F262 HydrophobicContact CG1-CB 4.42Å; V172-F262 HydrophobicContact CG1-CD2 3.36Å; V172-F262 HydrophobicContact CG1-CE2 3.71Å; V172-F262 HydrophobicContact CG1-CG 3.93Å; V172-F262 HydrophobicContact CG1-CZ 4.5Å; M258-F262 HydrophobicContact CE-CD2 4.36Å; M258-F262 HydrophobicContact CE-CE2 3.94Å; M258-F262 VanDerWaalsContact O-CD2 3.31Å; M258-F262 WeakPolarHBondContact O-CD2 3.47Å; M258-F262 PolarHBondContact O-N 2.96Å; M258-F262 HydrophobicContact SD-CD2 4.4Å; M258-F262 HydrophobicContact SD-CE2 3.91Å; R259-F262 PolarHBondContact O-N 3.05Å
263	C	89.1	Confident	90.1	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.007	30%	0.299	C	S	.	.			trans	-56.9	151.1	170.9	63.7	0	0	0	0	112.2	Q169 W173 R259 I260 F269	Q169-C263 PolarHBondContact NE2-O 3.27Å; W173-C263 VanDerWaalsContact CE3-CA 3.46Å; W173-C263 HydrophobicContact CE3-CB 3.87Å; W173-C263 HydrophobicContact CH2-CB 3.92Å; W173-C263 HydrophobicContact CZ3-CB 3.51Å; R259-C263 VanDerWaalsContact O-CB 3.3Å; R259-C263 WeakPolarHBondContact O-CB 3.24Å; R259-C263 PolarHBondContact O-N 3.3Å; I260-C263 PolarHBondContact O-SG 3.42Å; I260-C263 VanDerWaalsContact O-SG 3.41Å; C263-F269 HydrophobicContact CB-CB 4.23Å; C263-F269 HydrophobicContact CB-CD2 3.91Å; C263-F269 HydrophobicContact CB-CG 4.19Å
264	P	86.6	Confident	89.6	Confident	88 Å²	88	60.4 Å²	60.4	57%	0.571	30%	0.304	S	S	*	.	S	Bend	trans	-69	-56	175	25.9	-31	0	0	0	111.1
265	N	88.9	Confident	89.3	Confident	93 Å²	93	56.2 Å²	56.2	50%	0.497	29%	0.286	S	S	.	.			trans	-114.3	126.7	-178.9	-67.1	-7.2	0	0	0	109.9	D268 F269	N265-D268 HydrophobicContact CB-CB 4.25Å; N265-D268 WeakPolarHBondContact CB-OD2 3.16Å; N265-D268 PolarHBondContact ND2-OD2 2.93Å; N265-F269 VanDerWaalsContact O-CB 3.31Å; N265-F269 WeakPolarHBondContact O-CB 3.27Å; N265-F269 PolarHBondContact O-N 2.97Å
266	K	89.6	Confident	89.2	Confident	110 Å²	110	60.1 Å²	60.1	48%	0.478	31%	0.306	S	S	.	.	H	α-helix	trans	-79.7	-27.3	-177.6	-59.2	-163.4	-175.9	-53.1	0	113.5	I260 T261 I270	I260-K266 PolarHBondContact O-NZ 3.2Å; T261-K266 PolarHBondContact O-NZ 3.08Å; K266-I270 WeakPolarHBondContact O-CD1 3.5Å; K266-I270 VanDerWaalsContact O-CG1 3.27Å; K266-I270 WeakPolarHBondContact O-CG1 3.43Å; K266-I270 PolarHBondContact O-N 3.29Å; K266-I270 VanDerWaalsContact O-N 3.16Å
267	F	88.6	Confident	89	Confident	128 Å²	128	60.8 Å²	60.8	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-71.5	-52	-179.4	-168.4	-118.2	0	0	0	111.1	F269 I270 R271	F267-F269 VanDerWaalsContact C-N 3.26Å; F267-F269 PolarHBondContact O-N 2.9Å; F267-I270 PolarHBondContact O-N 3.35Å; F267-R271 VanDerWaalsContact CE1-CZ 3.43Å; F267-R271 VanDerWaalsContact CE1-NE 3.31Å; F267-R271 PolarHBondContact O-N 3.08Å
268	D	84.2	Confident	88.9	Confident	69 Å²	69	56.4 Å²	56.4	37%	0.369	29%	0.287	S	S	.	.	H	α-helix	trans	-60.8	-38	175.9	-39.2	-15.7	0	0	0	110.9	N265 I270 R271 N272	N265-D268 HydrophobicContact CB-CB 4.25Å; N265-D268 WeakPolarHBondContact CB-OD2 3.16Å; N265-D268 PolarHBondContact ND2-OD2 2.93Å; D268-I270 VanDerWaalsContact C-N 3.33Å; D268-I270 PolarHBondContact O-N 3.1Å; D268-R271 PolarHBondContact O-N 3.13Å; D268-N272 WeakPolarHBondContact O-CB 3.41Å; D268-N272 PolarHBondContact O-N 2.91Å
269	F	87.8	Confident	88.8	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-57.1	-44.4	172	-177.4	-93.7	0	0	0	112.3	W173 F256 R259 I260 C263 N265 F267 N275	W173-F269 AromaticContact CH2-CD2 3.77Å; W173-F269 HydrophobicContact CH2-CD2 3.77Å; W173-F269 AromaticContact CH2-CE2 3.94Å; W173-F269 HydrophobicContact CH2-CE2 3.94Å; W173-F269 HydrophobicContact CZ3-CD2 4.04Å; W173-F269 AromaticContact CZ3-CE2 3.98Å; W173-F269 HydrophobicContact CZ3-CE2 3.98Å; F256-F269 HydrophobicContact CD2-CE1 4.42Å; F256-F269 HydrophobicContact CD2-CZ 4.39Å; F256-F269 AromaticContact CE2-CE1 3.85Å; F256-F269 HydrophobicContact CE2-CE1 3.85Å; F256-F269 HydrophobicContact CE2-CZ 4.24Å; F256-F269 HydrophobicContact CZ-CE1 4.38Å; R259-F269 HydrophobicContact CB-CE2 3.65Å; R259-F269 HydrophobicContact CB-CZ 3.66Å; I260-F269 HydrophobicContact CB-CD1 4.13Å; I260-F269 HydrophobicContact CB-CE1 3.66Å; I260-F269 HydrophobicContact CB-CZ 4.22Å; I260-F269 HydrophobicContact CD1-CD1 4.19Å; I260-F269 HydrophobicContact CD1-CE1 4.1Å; I260-F269 HydrophobicContact CG1-CD1 3.78Å; I260-F269 HydrophobicContact CG1-CE1 3.78Å; C263-F269 HydrophobicContact CB-CB 4.23Å; C263-F269 HydrophobicContact CB-CD2 3.91Å; C263-F269 HydrophobicContact CB-CG 4.19Å; N265-F269 VanDerWaalsContact O-CB 3.31Å; N265-F269 WeakPolarHBondContact O-CB 3.27Å; N265-F269 PolarHBondContact O-N 2.97Å; F267-F269 VanDerWaalsContact C-N 3.26Å; F267-F269 PolarHBondContact O-N 2.9Å; F269-N275 HydrophobicContact CD1-CB 4.4Å; F269-N275 HydrophobicContact CD2-CB 4.48Å; F269-N275 WeakPolarHBondContact CD2-ND2 3.46Å; F269-N275 HydrophobicContact CE1-CB 4.01Å; F269-N275 HydrophobicContact CE2-CB 4.06Å; F269-N275 WeakPolarHBondContact CE2-ND2 3.43Å; F269-N275 WeakPolarHBondContact CE2-OD1 3.11Å; F269-N275 HydrophobicContact CZ-CB 3.82Å; F269-N275 WeakPolarHBondContact O-CB 3.45Å; F269-N275 PolarHBondContact O-ND2 3.05Å
270	I	88.5	Confident	88.8	Confident	102 Å²	102	60.3 Å²	60.3	52%	0.523	31%	0.306	S	S	.	.	H	α-helix	trans	-74.5	-32.7	179.9	-69.1	165.5	0	0	0	112	K266 F267 D268 I276	K266-I270 WeakPolarHBondContact O-CD1 3.5Å; K266-I270 VanDerWaalsContact O-CG1 3.27Å; K266-I270 WeakPolarHBondContact O-CG1 3.43Å; K266-I270 PolarHBondContact O-N 3.29Å; K266-I270 VanDerWaalsContact O-N 3.16Å; F267-I270 PolarHBondContact O-N 3.35Å; D268-I270 VanDerWaalsContact C-N 3.33Å; D268-I270 PolarHBondContact O-N 3.1Å; I270-I276 WeakPolarHBondContact O-CG1 3.32Å
271	R	86.3	Confident	88.7	Confident	139 Å²	139	58.5 Å²	58.5	53%	0.525	30%	0.297	S	S	.	.	H	α-helix	trans	-71.5	-26.9	175.8	-76.4	-176	166.4	-163.9	-4.1	113.6	F267 D268 A273	F267-R271 VanDerWaalsContact CE1-CZ 3.43Å; F267-R271 VanDerWaalsContact CE1-NE 3.31Å; F267-R271 PolarHBondContact O-N 3.08Å; D268-R271 PolarHBondContact O-N 3.13Å; R271-A273 PolarHBondContact O-N 3.26Å
272	N	84.4	Confident	88.7	Confident	49 Å²	49	56 Å²	56	26%	0.262	28%	0.282	S	S	.	.	S	Bend	trans	-68.9	119.8	-178.6	178.9	-21	0	0	0	112.1	D268 L274 N275 I276	D268-N272 WeakPolarHBondContact O-CB 3.41Å; D268-N272 PolarHBondContact O-N 2.91Å; N272-L274 VanDerWaalsContact C-N 3.25Å; N272-L274 PolarHBondContact O-N 3.19Å; N272-L274 VanDerWaalsContact O-N 3.13Å; N272-L274 PolarHBondContact OD1-N 3.32Å; N272-N275 WeakPolarHBondContact O-CB 3.49Å; N272-N275 PolarHBondContact O-N 2.94Å; N272-I276 PolarHBondContact O-N 2.82Å; N272-I276 VanDerWaalsContact O-N 3.14Å
273	A	85.8	Confident	88.6	Confident	43 Å²	43	57.5 Å²	57.5	36%	0.355	29%	0.291	S	S	.	.	H	α-helix	trans	-53.2	-33.9	-178.2	0	0	0	0	0	114.8	L127 R271 N275 I276 I277	L127-A273 HydrophobicContact CD2-CB 4.49Å; R271-A273 PolarHBondContact O-N 3.26Å; A273-N275 VanDerWaalsContact C-N 3.28Å; A273-N275 PolarHBondContact O-N 3.06Å; A273-I276 PolarHBondContact O-N 2.98Å; A273-I277 WeakPolarHBondContact O-CD1 3.5Å; A273-I277 WeakPolarHBondContact O-CG1 3.43Å; A273-I277 PolarHBondContact O-N 2.71Å
274	L	84.9	Confident	88.5	Confident	42 Å²	42	57.7 Å²	57.7	22%	0.22	29%	0.292	C	S	.	.	H	α-helix	trans	-67.2	-30	177.8	-61.4	-179.6	0	0	0	112.4	N272 D278 T321	N272-L274 VanDerWaalsContact C-N 3.25Å; N272-L274 PolarHBondContact O-N 3.19Å; N272-L274 VanDerWaalsContact O-N 3.13Å; N272-L274 PolarHBondContact OD1-N 3.32Å; L274-D278 PolarHBondContact O-N 3.42Å; L274-D278 VanDerWaalsContact O-N 3.12Å; L274-T321 HydrophobicContact CD2-CG2 3.84Å
275	N	90.1	Very high	88.6	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.032	27%	0.273	C	S	.	.	H	α-helix	trans	-84.3	-29.8	177	-59.6	-35.8	0	0	0	111.9	F269 N272 A273 I277 D278 F279 R322	F269-N275 HydrophobicContact CD1-CB 4.4Å; F269-N275 HydrophobicContact CD2-CB 4.48Å; F269-N275 WeakPolarHBondContact CD2-ND2 3.46Å; F269-N275 HydrophobicContact CE1-CB 4.01Å; F269-N275 HydrophobicContact CE2-CB 4.06Å; F269-N275 WeakPolarHBondContact CE2-ND2 3.43Å; F269-N275 WeakPolarHBondContact CE2-OD1 3.11Å; F269-N275 HydrophobicContact CZ-CB 3.82Å; F269-N275 WeakPolarHBondContact O-CB 3.45Å; F269-N275 PolarHBondContact O-ND2 3.05Å; N272-N275 WeakPolarHBondContact O-CB 3.49Å; N272-N275 PolarHBondContact O-N 2.94Å; A273-N275 VanDerWaalsContact C-N 3.28Å; A273-N275 PolarHBondContact O-N 3.06Å; N275-I277 VanDerWaalsContact C-N 3.3Å; N275-D278 PolarHBondContact O-N 3.36Å; N275-F279 PolarHBondContact O-N 3.13Å; N275-R322 PolarHBondContact OD1-NH2 3.47Å
276	I	90.6	Very high	88.6	Confident	82 Å²	82	55.2 Å²	55.2	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-61.2	-43	167.6	-60.7	174.7	0	0	0	109.5	I270 N272 A273 F279 V280	I270-I276 WeakPolarHBondContact O-CG1 3.32Å; N272-I276 PolarHBondContact O-N 2.82Å; N272-I276 VanDerWaalsContact O-N 3.14Å; A273-I276 PolarHBondContact O-N 2.98Å; I276-F279 PolarHBondContact O-N 3.36Å; I276-V280 HydrophobicContact CG2-CG2 4.15Å; I276-V280 WeakPolarHBondContact O-CB 3.41Å; I276-V280 VanDerWaalsContact O-CG2 3.28Å; I276-V280 WeakPolarHBondContact O-CG2 3.42Å; I276-V280 PolarHBondContact O-N 3.08Å
277	I	90.1	Very high	88.4	Confident	41 Å²	41	52.8 Å²	52.8	21%	0.21	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-44.7	173.7	-70.1	160.6	0	0	0	111.6	A273 N275 F279 V280 A281 F318 K319	A273-I277 WeakPolarHBondContact O-CD1 3.5Å; A273-I277 WeakPolarHBondContact O-CG1 3.43Å; A273-I277 PolarHBondContact O-N 2.71Å; N275-I277 VanDerWaalsContact C-N 3.3Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 3.36Å; I277-V280 PolarHBondContact O-N 3.33Å; I277-A281 VanDerWaalsContact O-CB 3.24Å; I277-A281 WeakPolarHBondContact O-CB 3.26Å; I277-A281 PolarHBondContact O-N 3.09Å; I277-F318 HydrophobicContact CD1-CB 4Å; I277-F318 HydrophobicContact CG2-CB 3.93Å; I277-K319 HydrophobicContact CG2-CG 4.13Å
278	D	90.8	Very high	88.1	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.011	24%	0.241	C	C	.	.	H	α-helix	trans	-56.3	-43	174.5	-89.4	-13.4	0	0	0	112.2	F256 R259 L274 N275 K319 R322	F256-D278 HydrophobicContact CD2-CB 3.87Å; R259-D278 IonicContact CZ-OD2 3Å; R259-D278 IonicContact NH1-OD1 3.67Å; R259-D278 IonicContact NH1-OD2 3.03Å; R259-D278 PolarHBondContact NH1-OD2 2.63Å; L274-D278 PolarHBondContact O-N 3.42Å; L274-D278 VanDerWaalsContact O-N 3.12Å; N275-D278 PolarHBondContact O-N 3.36Å; D278-K319 IonicContact OD1-NZ 3.73Å; D278-K319 PolarHBondContact OD1-NZ 2.88Å; D278-R322 IonicContact OD1-NH1 2.67Å; D278-R322 IonicContact OD2-CZ 3.94Å; D278-R322 IonicContact OD2-NH1 3Å; D278-R322 PolarHBondContact OD2-NH1 3Å
279	F	92.4	Very high	88.1	Confident	95 Å²	95	49.2 Å²	49.2	42%	0.417	25%	0.246	S	C	.	.	H	α-helix	trans	-70.7	-48	178.9	175.1	-105.5	0	0	0	112.8	F256 N275 I276 I277 A281 I282 L283	F256-F279 HydrophobicContact CE1-CD2 4.07Å; F256-F279 HydrophobicContact CE2-CB 3.85Å; F256-F279 HydrophobicContact CZ-CB 3.94Å; F256-F279 AromaticContact CZ-CD2 3.93Å; F256-F279 HydrophobicContact CZ-CD2 3.93Å; F256-F279 HydrophobicContact CZ-CG 4.33Å; N275-F279 PolarHBondContact O-N 3.13Å; I276-F279 PolarHBondContact O-N 3.36Å; I277-F279 VanDerWaalsContact C-N 3.31Å; I277-F279 PolarHBondContact O-N 3.36Å; F279-A281 PolarHBondContact O-N 3.32Å; F279-I282 WeakPolarHBondContact O-CG1 3.49Å; F279-I282 PolarHBondContact O-N 3.21Å; F279-L283 HydrophobicContact CE1-CD2 4.24Å; F279-L283 HydrophobicContact CZ-CD1 4.29Å; F279-L283 PolarHBondContact O-N 2.97Å; F279-L283 VanDerWaalsContact O-N 3.17Å
280	V	90.8	Very high	87.9	Confident	35 Å²	35	52.6 Å²	52.6	21%	0.212	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-28.1	-179.2	172.7	0	0	0	0	111.5	I276 I277 I282 P284 V312 L315	I276-V280 HydrophobicContact CG2-CG2 4.15Å; I276-V280 WeakPolarHBondContact O-CB 3.41Å; I276-V280 VanDerWaalsContact O-CG2 3.28Å; I276-V280 WeakPolarHBondContact O-CG2 3.42Å; I276-V280 PolarHBondContact O-N 3.08Å; I277-V280 PolarHBondContact O-N 3.33Å; V280-I282 VanDerWaalsContact C-N 3.33Å; V280-I282 PolarHBondContact O-N 3.46Å; V280-P284 VanDerWaalsContact O-CD 3.22Å; V280-P284 WeakPolarHBondContact O-CD 3.44Å; V280-V312 HydrophobicContact CG1-CG1 3.4Å; V280-L315 HydrophobicContact CG1-CD1 3.83Å
281	A	89.9	Confident	87.5	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-68.4	-24	175.6	0	0	0	0	0	114.5	I277 F279 R316 K319	I277-A281 VanDerWaalsContact O-CB 3.24Å; I277-A281 WeakPolarHBondContact O-CB 3.26Å; I277-A281 PolarHBondContact O-N 3.09Å; F279-A281 PolarHBondContact O-N 3.32Å; A281-R316 HydrophobicContact CB-CB 4.05Å; A281-K319 HydrophobicContact CB-CD 4.07Å
282	I	91.7	Very high	87	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.051	26%	0.257	C	S	.	.	H	α-helix	trans	-98	-23.9	176.6	60.7	170.6	0	0	0	113.4	V249 F252 T253 F256 F279 V280 F285 Y286	V249-I282 HydrophobicContact CG1-CB 4.26Å; V249-I282 HydrophobicContact CG1-CG2 4.26Å; F252-I282 HydrophobicContact CB-CG2 3.5Å; T253-I282 HydrophobicContact CG2-CD1 4.32Å; F256-I282 HydrophobicContact CD1-CD1 4.3Å; F279-I282 WeakPolarHBondContact O-CG1 3.49Å; F279-I282 PolarHBondContact O-N 3.21Å; V280-I282 VanDerWaalsContact C-N 3.33Å; V280-I282 PolarHBondContact O-N 3.46Å; I282-F285 PolarHBondContact O-N 2.94Å; I282-Y286 HydrophobicContact CB-CD2 4.35Å; I282-Y286 HydrophobicContact CB-CE2 4.26Å; I282-Y286 HydrophobicContact CD1-CE2 4.37Å; I282-Y286 WeakPolarHBondContact O-CD2 3.2Å
283	L	89.5	Confident	86.4	Confident	60 Å²	60	47.6 Å²	47.6	31%	0.314	28%	0.278	S	S	.	.	H	α-helix	trans	-55.1	-44.7	-173	-179.6	64.4	0	0	0	115.1	F279 F285 Y286 L287	F279-L283 HydrophobicContact CE1-CD2 4.24Å; F279-L283 HydrophobicContact CZ-CD1 4.29Å; F279-L283 PolarHBondContact O-N 2.97Å; F279-L283 VanDerWaalsContact O-N 3.17Å; L283-F285 VanDerWaalsContact C-N 3.34Å; L283-F285 PolarHBondContact O-N 3.49Å; L283-Y286 PolarHBondContact O-N 3.47Å; L283-L287 HydrophobicContact CD1-CD1 4.01Å; L283-L287 HydrophobicContact CD1-CD2 4.23Å; L283-L287 HydrophobicContact CD1-CG 3.87Å; L283-L287 HydrophobicContact CD2-CD1 4.39Å; L283-L287 HydrophobicContact CG-CD1 3.82Å; L283-L287 HydrophobicContact CG-CG 4.14Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 3.09Å
284	P	87.4	Confident	86	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.032	29%	0.286	C	S	.	.	H	α-helix	trans	-57.8	-41.6	-176.8	-27.4	35.7	0	0	0	113.9	V280 L287 E288 V309 V312 R313	V280-P284 VanDerWaalsContact O-CD 3.22Å; V280-P284 WeakPolarHBondContact O-CD 3.44Å; P284-L287 PolarHBondContact O-N 3.28Å; P284-E288 WeakPolarHBondContact O-CB 3.35Å; P284-E288 PolarHBondContact O-N 3.27Å; P284-V309 HydrophobicContact CB-CG1 4.24Å; P284-V309 HydrophobicContact CG-CG1 4.2Å; P284-V312 HydrophobicContact CG-CB 4.22Å; P284-V312 HydrophobicContact CG-CG1 4.42Å; P284-R313 HydrophobicContact CB-CG 3.9Å; P284-R313 HydrophobicContact CG-CG 4.05Å
285	F	87.9	Confident	85.2	Confident	40 Å²	40	54.8 Å²	54.8	18%	0.175	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-44.2	-179.6	-178.4	-88	0	0	0	111.4	E245 V249 I282 L283 E288 V289	E245-F285 HydrophobicContact CG-CD2 4.29Å; V249-F285 HydrophobicContact CB-CD1 4.27Å; V249-F285 HydrophobicContact CB-CG 4.25Å; V249-F285 HydrophobicContact CG1-CB 4.08Å; V249-F285 HydrophobicContact CG1-CD1 3.76Å; V249-F285 HydrophobicContact CG1-CE1 4.44Å; V249-F285 HydrophobicContact CG1-CG 4.01Å; V249-F285 HydrophobicContact CG2-CB 3.93Å; V249-F285 HydrophobicContact CG2-CD2 4.25Å; V249-F285 HydrophobicContact CG2-CG 3.99Å; I282-F285 PolarHBondContact O-N 2.94Å; L283-F285 VanDerWaalsContact C-N 3.34Å; L283-F285 PolarHBondContact O-N 3.49Å; F285-E288 PolarHBondContact O-N 3.45Å; F285-V289 HydrophobicContact CD1-CG2 4.16Å; F285-V289 HydrophobicContact CE1-CG2 3.84Å; F285-V289 HydrophobicContact CZ-CG2 4.05Å; F285-V289 WeakPolarHBondContact O-CG2 3.48Å; F285-V289 PolarHBondContact O-N 2.94Å
286	Y	89.4	Confident	84.6	Confident	90 Å²	90	57.3 Å²	57.3	35%	0.353	34%	0.338	S	S	.	.	H	α-helix	trans	-67.8	-35.5	178	-75.7	-68.9	0	0	0	113.1	V249 T253 I282 L283 S290	V249-Y286 HydrophobicContact CG1-CD2 4.38Å; V249-Y286 HydrophobicContact CG1-CE2 3.75Å; T253-Y286 HydrophobicContact CG2-CE2 4.32Å; T253-Y286 WeakPolarHBondContact OG1-CE2 3.02Å; T253-Y286 PolarHBondContact OG1-OH 3.05Å; I282-Y286 HydrophobicContact CB-CD2 4.35Å; I282-Y286 HydrophobicContact CB-CE2 4.26Å; I282-Y286 HydrophobicContact CD1-CE2 4.37Å; I282-Y286 WeakPolarHBondContact O-CD2 3.2Å; L283-Y286 PolarHBondContact O-N 3.47Å; Y286-S290 WeakPolarHBondContact O-CB 3.22Å; Y286-S290 PolarHBondContact O-N 3.37Å; Y286-S290 PolarHBondContact O-OG 3.32Å
287	L	86.2	Confident	83.9	Confident	59 Å²	59	61 Å²	61	31%	0.309	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-47.2	172.8	-69.4	175.7	0	0	0	111.3	L283 P284 S290 L291 L306	L283-L287 HydrophobicContact CD1-CD1 4.01Å; L283-L287 HydrophobicContact CD1-CD2 4.23Å; L283-L287 HydrophobicContact CD1-CG 3.87Å; L283-L287 HydrophobicContact CD2-CD1 4.39Å; L283-L287 HydrophobicContact CG-CD1 3.82Å; L283-L287 HydrophobicContact CG-CG 4.14Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 3.09Å; P284-L287 PolarHBondContact O-N 3.28Å; L287-S290 PolarHBondContact O-N 2.89Å; L287-L291 WeakPolarHBondContact O-CB 3.13Å; L287-L291 PolarHBondContact O-N 3.23Å; L287-L306 HydrophobicContact CB-CD1 3.9Å; L287-L306 HydrophobicContact CB-CD2 4.16Å; L287-L306 HydrophobicContact CD1-CD2 4.13Å
288	E	81.3	Confident	83.1	Confident	44 Å²	44	62 Å²	62	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-45	-179.2	-171.6	165.3	-175.8	0	0	112.3	P284 F285 S292 R310 R313	P284-E288 WeakPolarHBondContact O-CB 3.35Å; P284-E288 PolarHBondContact O-N 3.27Å; F285-E288 PolarHBondContact O-N 3.45Å; E288-S292 WeakPolarHBondContact O-CB 3.18Å; E288-S292 PolarHBondContact O-N 2.92Å; E288-S292 PolarHBondContact O-OG 2.98Å; E288-S292 VanDerWaalsContact O-OG 3.07Å; E288-R310 IonicContact OE1-CZ 2.87Å; E288-R310 IonicContact OE1-NE 2.91Å; E288-R310 PolarHBondContact OE1-NE 2.85Å; E288-R310 IonicContact OE1-NH2 3.23Å; E288-R310 PolarHBondContact OE1-NH2 2.96Å; E288-R310 IonicContact OE2-NE 2.91Å; E288-R310 PolarHBondContact OE2-NE 3.03Å; E288-R313 IonicContact OE2-CZ 2.59Å; E288-R313 IonicContact OE2-NH2 3.71Å; E288-R313 PolarHBondContact OE2-NH2 3.45Å
289	V	84.4	Confident	82.3	Confident	78 Å²	78	62.2 Å²	62.2	47%	0.473	37%	0.368	S	S	.	.	H	α-helix	trans	-65.6	-41.3	174.1	173.7	0	0	0	0	111.8	F285 L291 S292	F285-V289 HydrophobicContact CD1-CG2 4.16Å; F285-V289 HydrophobicContact CE1-CG2 3.84Å; F285-V289 HydrophobicContact CZ-CG2 4.05Å; F285-V289 WeakPolarHBondContact O-CG2 3.48Å; F285-V289 PolarHBondContact O-N 2.94Å; V289-L291 PolarHBondContact O-N 3.42Å; V289-S292 PolarHBondContact O-OG 2.69Å
290	S	83.1	Confident	81.4	Confident	79 Å²	79	62.8 Å²	62.8	55%	0.552	37%	0.37	S	S	*	.	H	α-helix	trans	-68.7	-35	-178.7	-58.5	0	0	0	0	112.9	Y286 L287	Y286-S290 WeakPolarHBondContact O-CB 3.22Å; Y286-S290 PolarHBondContact O-N 3.37Å; Y286-S290 PolarHBondContact O-OG 3.32Å; L287-S290 PolarHBondContact O-N 2.89Å
291	L	79.9	Confident	80.7	Confident	36 Å²	36	66.2 Å²	66.2	19%	0.188	39%	0.387	C	S	.	.	H	α-helix	trans	-86	-27.3	-179	-81.4	149	0	0	0	113.3	L287 V289 G293 L294 A299 V302 L303 L306	L287-L291 WeakPolarHBondContact O-CB 3.13Å; L287-L291 PolarHBondContact O-N 3.23Å; V289-L291 PolarHBondContact O-N 3.42Å; L291-G293 PolarHBondContact O-N 3.03Å; L291-L294 HydrophobicContact CD2-CD1 4Å; L291-L294 PolarHBondContact O-N 2.87Å; L291-A299 HydrophobicContact CD2-CB 4.37Å; L291-V302 HydrophobicContact CD1-CG1 3.84Å; L291-V302 HydrophobicContact CD2-CG1 4.18Å; L291-L303 HydrophobicContact CB-CD2 3.86Å; L291-L303 HydrophobicContact CB-CG 4.12Å; L291-L306 HydrophobicContact CB-CD1 4.42Å; L291-L306 HydrophobicContact CD1-CD1 3.62Å
292	S	75.7	Confident	80.1	Confident	82 Å²	82	69.1 Å²	69.1	57%	0.573	41%	0.405	S	S	*	.	H	α-helix	trans	-63.8	-22.5	173.5	58.9	0	0	0	0	113.9	E288 V289 L294	E288-S292 WeakPolarHBondContact O-CB 3.18Å; E288-S292 PolarHBondContact O-N 2.92Å; E288-S292 PolarHBondContact O-OG 2.98Å; E288-S292 VanDerWaalsContact O-OG 3.07Å; V289-S292 PolarHBondContact O-OG 2.69Å; S292-L294 VanDerWaalsContact C-N 3.3Å; S292-L294 PolarHBondContact O-N 2.73Å
293	G	71.9	Confident	79.2	Confident	68 Å²	68	71.1 Å²	71.1	70%	0.701	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-7.2	171.4	0	0	0	0	0	115.4	L291	L291-G293 PolarHBondContact O-N 3.03Å
294	L	78	Confident	78.4	Confident	100 Å²	100	70.1 Å²	70.1	52%	0.524	42%	0.42	S	S	.	.			trans	-102.2	105.3	-176.7	-72.8	166.1	0	0	0	110.9	L291 S292 S296 A299	L291-L294 HydrophobicContact CD2-CD1 4Å; L291-L294 PolarHBondContact O-N 2.87Å; S292-L294 VanDerWaalsContact C-N 3.3Å; S292-L294 PolarHBondContact O-N 2.73Å; L294-S296 PolarHBondContact O-N 3.27Å; L294-A299 HydrophobicContact CB-CB 3.72Å; L294-A299 WeakPolarHBondContact O-CB 3.26Å
295	S	67.8	Low	77.8	Confident	135 Å²	135	76.6 Å²	76.6	94%	0.944	45%	0.447	S	S	*	.			trans	-76.4	23.9	-176.1	-170.7	0	0	0	0	115.3
296	S	79	Confident	77	Confident	59 Å²	59	75.4 Å²	75.4	41%	0.413	44%	0.443	S	S	.	.	S	Bend	trans	-92.2	152.9	-178.2	77.4	0	0	0	0	112.2	L294 A298 A299 K300	L294-S296 PolarHBondContact O-N 3.27Å; S296-A298 VanDerWaalsContact C-N 3.31Å; S296-A298 PolarHBondContact O-N 3.26Å; S296-A299 WeakPolarHBondContact O-CB 3.45Å; S296-A299 PolarHBondContact O-N 2.92Å; S296-A299 WeakPolarHBondContact OG-CB 3.45Å; S296-A299 PolarHBondContact OG-N 3.29Å; S296-A299 VanDerWaalsContact OG-N 3.14Å; S296-K300 PolarHBondContact O-N 3.16Å; S296-K300 VanDerWaalsContact O-N 3.13Å
297	K	74.8	Confident	76.1	Confident	160 Å²	160	78.2 Å²	78.2	70%	0.696	45%	0.453	S	S	*	.	H	α-helix	trans	-58.6	-43.5	177.1	-172.6	163.6	-177.6	163.4	0	111.6	A299 K300 D301	K297-A299 VanDerWaalsContact C-N 3.28Å; K297-A299 PolarHBondContact O-N 3.09Å; K297-K300 WeakPolarHBondContact O-CB 3.33Å; K297-K300 PolarHBondContact O-N 3.31Å; K297-K300 VanDerWaalsContact O-N 3.1Å; K297-D301 PolarHBondContact O-N 3.42Å; K297-D301 VanDerWaalsContact O-N 3.07Å
298	A	74.3	Confident	75.6	Confident	63 Å²	63	79.2 Å²	79.2	52%	0.521	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-32.4	174.6	0	0	0	0	0	113.5	S296 D301 V302	S296-A298 VanDerWaalsContact C-N 3.31Å; S296-A298 PolarHBondContact O-N 3.26Å; A298-D301 PolarHBondContact O-N 3.17Å; A298-V302 WeakPolarHBondContact O-CB 3.14Å; A298-V302 VanDerWaalsContact O-CG2 3.27Å; A298-V302 WeakPolarHBondContact O-CG2 3.19Å; A298-V302 PolarHBondContact O-N 3.21Å
299	A	73	Confident	75.5	Confident	5 Å²	5	78.5 Å²	78.5	4%	0.041	46%	0.46	C	S	.	.	H	α-helix	trans	-70.6	-37.3	174.3	0	0	0	0	0	112.1	L291 L294 S296 K297 V302 L303	L291-A299 HydrophobicContact CD2-CB 4.37Å; L294-A299 HydrophobicContact CB-CB 3.72Å; L294-A299 WeakPolarHBondContact O-CB 3.26Å; S296-A299 WeakPolarHBondContact O-CB 3.45Å; S296-A299 PolarHBondContact O-N 2.92Å; S296-A299 WeakPolarHBondContact OG-CB 3.45Å; S296-A299 PolarHBondContact OG-N 3.29Å; S296-A299 VanDerWaalsContact OG-N 3.14Å; K297-A299 VanDerWaalsContact C-N 3.28Å; K297-A299 PolarHBondContact O-N 3.09Å; A299-V302 PolarHBondContact O-N 3.48Å; A299-L303 WeakPolarHBondContact O-CB 3.11Å; A299-L303 WeakPolarHBondContact O-CD1 3.38Å; A299-L303 VanDerWaalsContact O-CG 3.23Å; A299-L303 WeakPolarHBondContact O-CG 3.3Å; A299-L303 PolarHBondContact O-N 3.02Å
300	K	73.7	Confident	75.2	Confident	107 Å²	107	77.9 Å²	77.9	47%	0.465	45%	0.449	S	S	.	.	H	α-helix	trans	-58.4	-47.3	169.9	-69	-171.6	173.6	-171.4	0	111.5	E219 S296 K297 V302 L303 G304	E219-K300 IonicContact OE1-NZ 2.76Å; E219-K300 PolarHBondContact OE1-NZ 2.77Å; E219-K300 IonicContact OE2-NZ 3.69Å; E219-K300 PolarHBondContact OE2-NZ 3.48Å; S296-K300 PolarHBondContact O-N 3.16Å; S296-K300 VanDerWaalsContact O-N 3.13Å; K297-K300 WeakPolarHBondContact O-CB 3.33Å; K297-K300 PolarHBondContact O-N 3.31Å; K297-K300 VanDerWaalsContact O-N 3.1Å; K300-V302 PolarHBondContact O-N 2.66Å; K300-L303 PolarHBondContact O-N 3.24Å; K300-G304 PolarHBondContact O-N 3.2Å
301	D	76.9	Confident	75.2	Confident	107 Å²	107	80.3 Å²	80.3	57%	0.572	45%	0.45	S	S	*	.	H	α-helix	trans	-61.9	-42.8	179.8	-58.7	-33.1	0	0	0	111.4	K297 A298 G304 F305	K297-D301 PolarHBondContact O-N 3.42Å; K297-D301 VanDerWaalsContact O-N 3.07Å; A298-D301 PolarHBondContact O-N 3.17Å; D301-G304 PolarHBondContact O-N 2.94Å; D301-F305 PolarHBondContact O-N 3.13Å
302	V	77.1	Confident	75.5	Confident	65 Å²	65	80 Å²	80	39%	0.394	45%	0.449	S	S	.	.	H	α-helix	trans	-68.1	-36.1	176	171.8	0	0	0	0	112.4	L291 A298 A299 K300 G304 F305 L306	L291-V302 HydrophobicContact CD1-CG1 3.84Å; L291-V302 HydrophobicContact CD2-CG1 4.18Å; A298-V302 WeakPolarHBondContact O-CB 3.14Å; A298-V302 VanDerWaalsContact O-CG2 3.27Å; A298-V302 WeakPolarHBondContact O-CG2 3.19Å; A298-V302 PolarHBondContact O-N 3.21Å; A299-V302 PolarHBondContact O-N 3.48Å; K300-V302 PolarHBondContact O-N 2.66Å; V302-G304 VanDerWaalsContact C-N 3.27Å; V302-G304 PolarHBondContact O-N 3Å; V302-F305 CarbonylContact O-C 3.57Å; V302-F305 WeakPolarHBondContact O-CB 3.18Å; V302-F305 PolarHBondContact O-N 3.28Å; V302-F305 VanDerWaalsContact O-N 3.11Å; V302-L306 PolarHBondContact O-N 3.11Å
303	L	72.6	Confident	76	Confident	51 Å²	51	76.5 Å²	76.5	27%	0.267	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-35.6	171.9	-75.5	162.1	0	0	0	111.6	L291 A299 K300 F305 L306 R307	L291-L303 HydrophobicContact CB-CD2 3.86Å; L291-L303 HydrophobicContact CB-CG 4.12Å; A299-L303 WeakPolarHBondContact O-CB 3.11Å; A299-L303 WeakPolarHBondContact O-CD1 3.38Å; A299-L303 VanDerWaalsContact O-CG 3.23Å; A299-L303 WeakPolarHBondContact O-CG 3.3Å; A299-L303 PolarHBondContact O-N 3.02Å; K300-L303 PolarHBondContact O-N 3.24Å; L303-F305 VanDerWaalsContact C-N 3.35Å; L303-L306 HydrophobicContact CD2-CD1 4.36Å; L303-L306 PolarHBondContact O-N 2.97Å; L303-R307 PolarHBondContact O-N 3.05Å
304	G	71.9	Confident	76.8	Confident	40 Å²	40	77.5 Å²	77.5	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-57.7	-44.8	169.2	0	0	0	0	0	112.5	K300 D301 V302 R307	K300-G304 PolarHBondContact O-N 3.2Å; D301-G304 PolarHBondContact O-N 2.94Å; V302-G304 VanDerWaalsContact C-N 3.27Å; V302-G304 PolarHBondContact O-N 3Å; G304-R307 WeakPolarHBondContact O-CB 3.23Å; G304-R307 PolarHBondContact O-N 3.26Å
305	F	74.1	Confident	77.2	Confident	140 Å²	140	75.5 Å²	75.5	61%	0.614	40%	0.401	S	S	*	.	H	α-helix	trans	-68.6	-36.4	174.5	-176.3	-99.6	0	0	0	113.1	D301 V302 L303 R307 V308 V309	D301-F305 PolarHBondContact O-N 3.13Å; V302-F305 CarbonylContact O-C 3.57Å; V302-F305 WeakPolarHBondContact O-CB 3.18Å; V302-F305 PolarHBondContact O-N 3.28Å; V302-F305 VanDerWaalsContact O-N 3.11Å; L303-F305 VanDerWaalsContact C-N 3.35Å; F305-R307 PolarHBondContact O-N 2.98Å; F305-V308 VanDerWaalsContact O-CB 3.3Å; F305-V308 WeakPolarHBondContact O-CB 3.4Å; F305-V308 PolarHBondContact O-N 2.88Å; F305-V309 HydrophobicContact CD1-CG2 4.39Å; F305-V309 HydrophobicContact CE1-CG2 4.17Å; F305-V309 PolarHBondContact O-N 3.17Å
306	L	71.1	Confident	78.2	Confident	15 Å²	15	69.1 Å²	69.1	8%	0.079	36%	0.357	C	S	.	.	H	α-helix	trans	-62.9	-22	174.9	-72.3	-173.5	0	0	0	113.4	L287 L291 V302 L303 V308 V309 R310	L287-L306 HydrophobicContact CB-CD1 3.9Å; L287-L306 HydrophobicContact CB-CD2 4.16Å; L287-L306 HydrophobicContact CD1-CD2 4.13Å; L291-L306 HydrophobicContact CB-CD1 4.42Å; L291-L306 HydrophobicContact CD1-CD1 3.62Å; V302-L306 PolarHBondContact O-N 3.11Å; L303-L306 HydrophobicContact CD2-CD1 4.36Å; L303-L306 PolarHBondContact O-N 2.97Å; L306-V308 PolarHBondContact O-N 3.13Å; L306-V309 HydrophobicContact CD2-CB 4Å; L306-V309 HydrophobicContact CD2-CG1 4.35Å; L306-V309 HydrophobicContact CD2-CG2 3.86Å; L306-V309 CarbonylContact O-C 3.57Å; L306-V309 WeakPolarHBondContact O-CA 3.46Å; L306-V309 WeakPolarHBondContact O-CB 3.43Å; L306-V309 PolarHBondContact O-N 3.11Å; L306-R310 PolarHBondContact O-N 3.01Å
307	R	72.1	Confident	78.8	Confident	150 Å²	150	69.8 Å²	69.8	57%	0.566	36%	0.355	S	S	*	.	H	α-helix	trans	-57.2	-32.8	169.4	-160.8	-179.9	-71	-174.6	-2.8	111.6	E234 L303 G304 F305 R310	E234-R307 IonicContact OE1-NH2 3.16Å; E234-R307 PolarHBondContact OE1-NH2 3.4Å; E234-R307 VanDerWaalsContact OE1-NH2 3.16Å; L303-R307 PolarHBondContact O-N 3.05Å; G304-R307 WeakPolarHBondContact O-CB 3.23Å; G304-R307 PolarHBondContact O-N 3.26Å; F305-R307 PolarHBondContact O-N 2.98Å; R307-R310 WeakPolarHBondContact O-CB 3.44Å
308	V	75.8	Confident	79.4	Confident	80 Å²	80	67.1 Å²	67.1	49%	0.485	34%	0.343	S	S	.	.	H	α-helix	trans	-71.8	-44.4	170.6	-177.2	0	0	0	0	110.6	F305 L306 R310 F311	F305-V308 VanDerWaalsContact O-CB 3.3Å; F305-V308 WeakPolarHBondContact O-CB 3.4Å; F305-V308 PolarHBondContact O-N 2.88Å; L306-V308 PolarHBondContact O-N 3.13Å; V308-R310 PolarHBondContact O-N 3.13Å; V308-F311 HydrophobicContact CG1-CD1 3.83Å; V308-F311 HydrophobicContact CG1-CE1 3.82Å; V308-F311 WeakPolarHBondContact O-CD1 3.5Å; V308-F311 PolarHBondContact O-N 3.04Å
309	V	78.4	Confident	80.1	Confident	29 Å²	29	64.5 Å²	64.5	18%	0.176	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-18.1	178	-178	0	0	0	0	112.6	P284 F305 L306 F311 V312	P284-V309 HydrophobicContact CB-CG1 4.24Å; P284-V309 HydrophobicContact CG-CG1 4.2Å; F305-V309 HydrophobicContact CD1-CG2 4.39Å; F305-V309 HydrophobicContact CE1-CG2 4.17Å; F305-V309 PolarHBondContact O-N 3.17Å; L306-V309 HydrophobicContact CD2-CB 4Å; L306-V309 HydrophobicContact CD2-CG1 4.35Å; L306-V309 HydrophobicContact CD2-CG2 3.86Å; L306-V309 CarbonylContact O-C 3.57Å; L306-V309 WeakPolarHBondContact O-CA 3.46Å; L306-V309 WeakPolarHBondContact O-CB 3.43Å; L306-V309 PolarHBondContact O-N 3.11Å; V309-F311 PolarHBondContact O-N 3.25Å; V309-V312 HydrophobicContact CG1-CB 4.43Å; V309-V312 HydrophobicContact CG1-CG2 4.15Å; V309-V312 WeakPolarHBondContact O-CB 3.31Å; V309-V312 WeakPolarHBondContact O-CG2 3.23Å; V309-V312 PolarHBondContact O-N 2.98Å
310	R	78.7	Confident	80.7	Confident	64 Å²	64	65.5 Å²	65.5	24%	0.242	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-57	-26.9	167.3	-63.8	-167.8	179.6	171	-0.1	113.6	F203 E288 L306 R307 V308 V312 R313	F203-R310 WeakPolarHBondContact CE2-O 3.21Å; E288-R310 IonicContact OE1-CZ 2.87Å; E288-R310 IonicContact OE1-NE 2.91Å; E288-R310 PolarHBondContact OE1-NE 2.85Å; E288-R310 IonicContact OE1-NH2 3.23Å; E288-R310 PolarHBondContact OE1-NH2 2.96Å; E288-R310 IonicContact OE2-NE 2.91Å; E288-R310 PolarHBondContact OE2-NE 3.03Å; L306-R310 PolarHBondContact O-N 3.01Å; R307-R310 WeakPolarHBondContact O-CB 3.44Å; V308-R310 PolarHBondContact O-N 3.13Å; R310-V312 PolarHBondContact O-N 3.1Å; R310-R313 WeakPolarHBondContact O-CB 3.44Å; R310-R313 VanDerWaalsContact O-CD 3.32Å; R310-R313 WeakPolarHBondContact O-CD 3.46Å; R310-R313 WeakPolarHBondContact O-CG 3.13Å; R310-R313 PolarHBondContact O-N 3.39Å; R310-R313 VanDerWaalsContact O-N 3.17Å
311	F	82.7	Confident	81.2	Confident	131 Å²	131	61.5 Å²	61.5	58%	0.575	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-63.5	-31.1	173.6	86.6	-113.2	0	0	0	112	V308 V309 R313 I314	V308-F311 HydrophobicContact CG1-CD1 3.83Å; V308-F311 HydrophobicContact CG1-CE1 3.82Å; V308-F311 WeakPolarHBondContact O-CD1 3.5Å; V308-F311 PolarHBondContact O-N 3.04Å; V309-F311 PolarHBondContact O-N 3.25Å; F311-R313 PolarHBondContact O-N 3.25Å; F311-R313 VanDerWaalsContact O-N 3.13Å; F311-I314 WeakPolarHBondContact O-CB 3.47Å; F311-I314 WeakPolarHBondContact O-CG2 3.35Å; F311-I314 PolarHBondContact O-N 3.41Å
312	V	85.6	Confident	81.4	Confident	29 Å²	29	57 Å²	57	18%	0.176	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-61.1	-24.5	179.3	-176	0	0	0	0	111	V280 P284 V309 R310 I314 L315	V280-V312 HydrophobicContact CG1-CG1 3.4Å; P284-V312 HydrophobicContact CG-CB 4.22Å; P284-V312 HydrophobicContact CG-CG1 4.42Å; V309-V312 HydrophobicContact CG1-CB 4.43Å; V309-V312 HydrophobicContact CG1-CG2 4.15Å; V309-V312 WeakPolarHBondContact O-CB 3.31Å; V309-V312 WeakPolarHBondContact O-CG2 3.23Å; V309-V312 PolarHBondContact O-N 2.98Å; R310-V312 PolarHBondContact O-N 3.1Å; V312-I314 PolarHBondContact O-N 2.84Å; V312-I314 VanDerWaalsContact O-N 3.13Å; V312-L315 HydrophobicContact CG1-CD1 3.89Å; V312-L315 HydrophobicContact CG1-CG 4.48Å; V312-L315 VanDerWaalsContact O-CB 3.31Å; V312-L315 WeakPolarHBondContact O-CB 3.22Å; V312-L315 WeakPolarHBondContact O-CG 3.24Å; V312-L315 PolarHBondContact O-N 3.27Å
313	R	86.4	Confident	81.6	Confident	9 Å²	9	55 Å²	55	3%	0.034	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-56.2	-25.1	170.9	-57.9	170.2	177.4	-148.2	-16.7	112.7	F203 E206 E245 P284 E288 R310 F311 L315 R316	F203-R313 HydrophobicContact CD2-CB 4.11Å; F203-R313 HydrophobicContact CE2-CB 4.17Å; E206-R313 IonicContact OE1-NH1 3.16Å; E206-R313 PolarHBondContact OE1-NH1 2.86Å; E206-R313 IonicContact OE2-NH1 3.92Å; E206-R313 PolarHBondContact OE2-NH1 3.02Å; E245-R313 VanDerWaalsContact CD-NH1 3.29Å; E245-R313 IonicContact OE1-CZ 3.22Å; E245-R313 IonicContact OE1-NE 2.69Å; E245-R313 IonicContact OE1-NH1 3.48Å; E245-R313 PolarHBondContact OE1-NH1 2.96Å; E245-R313 IonicContact OE2-CZ 2.66Å; E245-R313 IonicContact OE2-NE 2.77Å; E245-R313 IonicContact OE2-NH1 3.33Å; E245-R313 PolarHBondContact OE2-NH1 3.48Å; E245-R313 IonicContact OE2-NH2 3.2Å; E245-R313 PolarHBondContact OE2-NH2 3Å; P284-R313 HydrophobicContact CB-CG 3.9Å; P284-R313 HydrophobicContact CG-CG 4.05Å; E288-R313 IonicContact OE2-CZ 2.59Å; E288-R313 IonicContact OE2-NH2 3.71Å; E288-R313 PolarHBondContact OE2-NH2 3.45Å; R310-R313 WeakPolarHBondContact O-CB 3.44Å; R310-R313 VanDerWaalsContact O-CD 3.32Å; R310-R313 WeakPolarHBondContact O-CD 3.46Å; R310-R313 WeakPolarHBondContact O-CG 3.13Å; R310-R313 PolarHBondContact O-N 3.39Å; R310-R313 VanDerWaalsContact O-N 3.17Å; F311-R313 PolarHBondContact O-N 3.25Å; F311-R313 VanDerWaalsContact O-N 3.13Å; R313-L315 PolarHBondContact O-N 3.11Å; R313-R316 WeakPolarHBondContact O-CB 3.46Å; R313-R316 WeakPolarHBondContact O-CG 3.15Å; R313-R316 PolarHBondContact O-N 3.44Å; R313-R316 PolarHBondContact O-NE 2.99Å
314	I	88.4	Confident	82.1	Confident	88 Å²	88	57.6 Å²	57.6	45%	0.451	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-62.2	-28.7	176.2	-153.8	174	0	0	0	112.1	F203 F311 V312 R316 I317	F203-I314 HydrophobicContact CD1-CG1 4.48Å; F203-I314 HydrophobicContact CE1-CB 3.95Å; F203-I314 HydrophobicContact CE1-CD1 4.05Å; F203-I314 HydrophobicContact CE1-CG1 3.82Å; F203-I314 HydrophobicContact CZ-CB 4.03Å; F203-I314 HydrophobicContact CZ-CG1 4.39Å; F311-I314 WeakPolarHBondContact O-CB 3.47Å; F311-I314 WeakPolarHBondContact O-CG2 3.35Å; F311-I314 PolarHBondContact O-N 3.41Å; V312-I314 PolarHBondContact O-N 2.84Å; V312-I314 VanDerWaalsContact O-N 3.13Å; I314-R316 PolarHBondContact O-N 3.05Å; I314-I317 WeakPolarHBondContact O-CB 3.41Å; I314-I317 WeakPolarHBondContact O-CG2 3.27Å; I314-I317 PolarHBondContact O-N 3.46Å
315	L	87.6	Confident	82.2	Confident	58 Å²	58	56.4 Å²	56.4	30%	0.304	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-62	-14.8	179.4	-57.5	-177.2	0	0	0	112.8	V280 V312 R313 I317 F318	V280-L315 HydrophobicContact CG1-CD1 3.83Å; V312-L315 HydrophobicContact CG1-CD1 3.89Å; V312-L315 HydrophobicContact CG1-CG 4.48Å; V312-L315 VanDerWaalsContact O-CB 3.31Å; V312-L315 WeakPolarHBondContact O-CB 3.22Å; V312-L315 WeakPolarHBondContact O-CG 3.24Å; V312-L315 PolarHBondContact O-N 3.27Å; R313-L315 PolarHBondContact O-N 3.11Å; L315-I317 PolarHBondContact O-N 3.09Å; L315-I317 VanDerWaalsContact O-N 3.11Å; L315-F318 HydrophobicContact CB-CD2 4.33Å; L315-F318 HydrophobicContact CD2-CD2 3.89Å; L315-F318 HydrophobicContact CD2-CE2 3.68Å; L315-F318 PolarHBondContact O-N 3.21Å
316	R	89	Confident	82.2	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.008	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-56.2	-22.8	169.5	83.2	-178.3	98.3	-157.8	29.2	112.8	S199 I200 E245 A281 R313 I314 F318 K319	S199-R316 VanDerWaalsContact CB-CD 3.49Å; S199-R316 WeakPolarHBondContact OG-CD 3.11Å; I200-R316 HydrophobicContact CG1-CG 4.14Å; E245-R316 IonicContact OE1-CZ 3.13Å; E245-R316 VanDerWaalsContact OE1-CZ 3.28Å; E245-R316 IonicContact OE1-NH1 3.4Å; E245-R316 PolarHBondContact OE1-NH1 3.21Å; E245-R316 IonicContact OE1-NH2 3.82Å; E245-R316 PolarHBondContact OE1-NH2 2.77Å; A281-R316 HydrophobicContact CB-CB 4.05Å; R313-R316 WeakPolarHBondContact O-CB 3.46Å; R313-R316 WeakPolarHBondContact O-CG 3.15Å; R313-R316 PolarHBondContact O-N 3.44Å; R313-R316 PolarHBondContact O-NE 2.99Å; I314-R316 PolarHBondContact O-N 3.05Å; R316-F318 VanDerWaalsContact C-N 3.29Å; R316-F318 PolarHBondContact O-N 2.99Å; R316-K319 WeakPolarHBondContact O-CB 3.44Å; R316-K319 PolarHBondContact O-N 3.27Å
317	I	90.6	Very high	82.6	Confident	72 Å²	72	53.7 Å²	53.7	37%	0.369	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-61.7	-33.9	171.8	-160	168.9	0	0	0	112.8	I200 I314 L315 K319 L320	I200-I317 HydrophobicContact CD1-CB 4.18Å; I200-I317 HydrophobicContact CD1-CG1 3.95Å; I314-I317 WeakPolarHBondContact O-CB 3.41Å; I314-I317 WeakPolarHBondContact O-CG2 3.27Å; I314-I317 PolarHBondContact O-N 3.46Å; L315-I317 PolarHBondContact O-N 3.09Å; L315-I317 VanDerWaalsContact O-N 3.11Å; I317-K319 PolarHBondContact O-N 2.82Å; I317-L320 HydrophobicContact CG1-CD1 3.95Å; I317-L320 VanDerWaalsContact O-CB 3.22Å; I317-L320 WeakPolarHBondContact O-CB 3.25Å; I317-L320 WeakPolarHBondContact O-CG 3.4Å; I317-L320 PolarHBondContact O-N 3.28Å; I317-L320 VanDerWaalsContact O-N 3.09Å
318	F	88.1	Confident	82.9	Confident	104 Å²	104	49.9 Å²	49.9	46%	0.456	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-73.6	-9.9	-179.7	-62.5	-66.6	0	0	0	113.1	I277 L315 R316 L320 T321	I277-F318 HydrophobicContact CD1-CB 4Å; I277-F318 HydrophobicContact CG2-CB 3.93Å; L315-F318 HydrophobicContact CB-CD2 4.33Å; L315-F318 HydrophobicContact CD2-CD2 3.89Å; L315-F318 HydrophobicContact CD2-CE2 3.68Å; L315-F318 PolarHBondContact O-N 3.21Å; R316-F318 VanDerWaalsContact C-N 3.29Å; R316-F318 PolarHBondContact O-N 2.99Å; F318-L320 PolarHBondContact O-N 3.48Å; F318-T321 WeakPolarHBondContact O-CB 3.42Å; F318-T321 PolarHBondContact O-N 3.39Å; F318-T321 VanDerWaalsContact O-N 3.11Å; F318-T321 PolarHBondContact O-OG1 3.45Å; F318-T321 VanDerWaalsContact O-OG1 3.13Å
319	K	87.6	Confident	82.9	Confident	8 Å²	8	46.4 Å²	46.4	4%	0.035	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-62.3	-24.5	166.5	-70.7	175.8	55.5	89	0	112.3	I196 F252 E255 I277 D278 A281 R316 I317 T321 R322	I196-K319 HydrophobicContact CD1-CB 3.6Å; I196-K319 HydrophobicContact CG1-CB 4.12Å; F252-K319 HydrophobicContact CD1-CD 4.48Å; F252-K319 VanDerWaalsContact CD1-CE 3.47Å; E255-K319 IonicContact OE2-NZ 2.73Å; E255-K319 PolarHBondContact OE2-NZ 3.43Å; I277-K319 HydrophobicContact CG2-CG 4.13Å; D278-K319 IonicContact OD1-NZ 3.73Å; D278-K319 PolarHBondContact OD1-NZ 2.88Å; A281-K319 HydrophobicContact CB-CD 4.07Å; R316-K319 WeakPolarHBondContact O-CB 3.44Å; R316-K319 PolarHBondContact O-N 3.27Å; I317-K319 PolarHBondContact O-N 2.82Å; K319-T321 PolarHBondContact O-N 2.83Å; K319-T321 VanDerWaalsContact O-N 3.13Å; K319-R322 PolarHBondContact O-N 3.27Å; K319-R322 VanDerWaalsContact O-N 3.09Å
320	L	85.8	Confident	82.9	Confident	26 Å²	26	48.4 Å²	48.4	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-56.4	-27.2	172.9	-63.5	177.4	0	0	0	112.3	L193 I196 I317 F318 R322 H323 F324 L327	L193-L320 HydrophobicContact CD1-CD2 3.43Å; L193-L320 VanDerWaalsContact CD1-CD2 3.43Å; I196-L320 HydrophobicContact CB-CD2 4.2Å; I196-L320 HydrophobicContact CD1-CD2 4.24Å; I196-L320 HydrophobicContact CG2-CD2 3.57Å; I196-L320 HydrophobicContact CG2-CG 3.89Å; I317-L320 HydrophobicContact CG1-CD1 3.95Å; I317-L320 VanDerWaalsContact O-CB 3.22Å; I317-L320 WeakPolarHBondContact O-CB 3.25Å; I317-L320 WeakPolarHBondContact O-CG 3.4Å; I317-L320 PolarHBondContact O-N 3.28Å; I317-L320 VanDerWaalsContact O-N 3.09Å; F318-L320 PolarHBondContact O-N 3.48Å; L320-R322 VanDerWaalsContact C-N 3.26Å; L320-R322 PolarHBondContact O-N 3.03Å; L320-H323 PolarHBondContact O-N 3.18Å; L320-F324 HydrophobicContact CB-CD2 4.19Å; L320-F324 HydrophobicContact CD2-CE2 4.3Å; L320-F324 WeakPolarHBondContact O-CD2 3.4Å; L320-F324 PolarHBondContact O-N 3.06Å; L320-L327 HydrophobicContact CB-CD1 3.93Å
321	T	84.1	Confident	83	Confident	23 Å²	23	47.1 Å²	47.1	14%	0.141	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-27.1	177	-56.6	0	0	0	0	113.4	L274 F318 K319 L327 R328	L274-T321 HydrophobicContact CD2-CG2 3.84Å; F318-T321 WeakPolarHBondContact O-CB 3.42Å; F318-T321 PolarHBondContact O-N 3.39Å; F318-T321 VanDerWaalsContact O-N 3.11Å; F318-T321 PolarHBondContact O-OG1 3.45Å; F318-T321 VanDerWaalsContact O-OG1 3.13Å; K319-T321 PolarHBondContact O-N 2.83Å; K319-T321 VanDerWaalsContact O-N 3.13Å; T321-L327 HydrophobicContact CG2-CB 4.24Å; T321-R328 HydrophobicContact CG2-CG 3.69Å; T321-R328 WeakPolarHBondContact O-CG 3.46Å; T321-R328 PolarHBondContact O-NH1 2.94Å
322	R	81.9	Confident	82.5	Confident	12 Å²	12	43.6 Å²	43.6	5%	0.045	23%	0.229	C	C	.	.	H	α-helix	trans	-72.1	-30.3	171	-176.7	172.6	-86.2	125.1	-13.1	112.1	E177 N275 D278 K319 L320 R328	E177-R322 VanDerWaalsContact CD-NH2 3.26Å; E177-R322 IonicContact OE1-CZ 2.78Å; E177-R322 VanDerWaalsContact OE1-CZ 3.25Å; E177-R322 IonicContact OE1-NE 3.51Å; E177-R322 PolarHBondContact OE1-NE 3.07Å; E177-R322 IonicContact OE1-NH2 3.79Å; E177-R322 PolarHBondContact OE1-NH2 3.19Å; E177-R322 IonicContact OE2-CZ 2.76Å; E177-R322 IonicContact OE2-NE 2.68Å; E177-R322 PolarHBondContact OE2-NE 3.18Å; E177-R322 IonicContact OE2-NH2 2.87Å; E177-R322 PolarHBondContact OE2-NH2 3.07Å; N275-R322 PolarHBondContact OD1-NH2 3.47Å; D278-R322 IonicContact OD1-NH1 2.67Å; D278-R322 IonicContact OD2-CZ 3.94Å; D278-R322 IonicContact OD2-NH1 3Å; D278-R322 PolarHBondContact OD2-NH1 3Å; K319-R322 PolarHBondContact O-N 3.27Å; K319-R322 VanDerWaalsContact O-N 3.09Å; L320-R322 VanDerWaalsContact C-N 3.26Å; L320-R322 PolarHBondContact O-N 3.03Å; R322-R328 VanDerWaalsContact C-NH1 3.3Å; R322-R328 PolarHBondContact O-NH1 3.03Å
323	H	81.3	Confident	82	Confident	25 Å²	25	42.3 Å²	42.3	12%	0.116	22%	0.221	C	C	.	.	H	α-helix	trans	-86.3	-39.7	-177.6	-59.3	-66.8	0	0	0	113.3	L320	L320-H323 PolarHBondContact O-N 3.18Å
324	F	82.8	Confident	81.7	Confident	105 Å²	105	45.4 Å²	45.4	46%	0.461	24%	0.238	S	C	.	.			trans	-98.8	114.2	-179.5	-65.7	-81.1	0	0	0	112	L193 L320 G326 L327 R328	L193-F324 HydrophobicContact CD1-CE2 4.06Å; L193-F324 HydrophobicContact CD1-CZ 4.48Å; L320-F324 HydrophobicContact CB-CD2 4.19Å; L320-F324 HydrophobicContact CD2-CE2 4.3Å; L320-F324 WeakPolarHBondContact O-CD2 3.4Å; L320-F324 PolarHBondContact O-N 3.06Å; F324-G326 VanDerWaalsContact C-N 3.25Å; F324-G326 PolarHBondContact O-N 3.29Å; F324-L327 HydrophobicContact CB-CB 4.26Å; F324-L327 HydrophobicContact CB-CD1 4.14Å; F324-L327 HydrophobicContact CB-CG 4.2Å; F324-L327 HydrophobicContact CD2-CD1 4.3Å; F324-L327 PolarHBondContact O-N 2.89Å; F324-L327 VanDerWaalsContact O-N 3.16Å; F324-R328 PolarHBondContact O-N 3.37Å
325	V	74.1	Confident	81.3	Confident	14 Å²	14	47 Å²	47	9%	0.085	24%	0.239	C	C	.	.	H	α-helix	trans	-52.8	-44.5	172.7	175.3	0	0	0	0	111.2	Y180 L327 R328 V329 M443 Q446	Y180-V325 HydrophobicContact CE2-CG2 4.31Å; V325-L327 VanDerWaalsContact C-N 3.27Å; V325-L327 PolarHBondContact O-N 3.23Å; V325-R328 WeakPolarHBondContact O-CB 3.35Å; V325-R328 PolarHBondContact O-N 2.93Å; V325-V329 HydrophobicContact CG1-CG2 4.11Å; V325-V329 PolarHBondContact O-N 3.14Å; V325-M443 HydrophobicContact CG1-CE 3.79Å; V325-Q446 VanDerWaalsContact CG1-NE2 3.28Å
326	G	73.9	Confident	80.8	Confident	30 Å²	30	46.4 Å²	46.4	31%	0.309	24%	0.242	S	C	.	.	H	α-helix	trans	-58.9	-33	-179.4	0	0	0	0	0	114.1	F324 L330	F324-G326 VanDerWaalsContact C-N 3.25Å; F324-G326 PolarHBondContact O-N 3.29Å; G326-L330 WeakPolarHBondContact O-CB 3.45Å; G326-L330 PolarHBondContact O-N 3.03Å
327	L	79.4	Confident	80.4	Confident	69 Å²	69	46.3 Å²	46.3	36%	0.361	24%	0.242	S	C	.	.	H	α-helix	trans	-72	-31.7	174.9	-78.7	175.7	0	0	0	112.5	L320 T321 F324 V325 L330 G331	L320-L327 HydrophobicContact CB-CD1 3.93Å; T321-L327 HydrophobicContact CG2-CB 4.24Å; F324-L327 HydrophobicContact CB-CB 4.26Å; F324-L327 HydrophobicContact CB-CD1 4.14Å; F324-L327 HydrophobicContact CB-CG 4.2Å; F324-L327 HydrophobicContact CD2-CD1 4.3Å; F324-L327 PolarHBondContact O-N 2.89Å; F324-L327 VanDerWaalsContact O-N 3.16Å; V325-L327 VanDerWaalsContact C-N 3.27Å; V325-L327 PolarHBondContact O-N 3.23Å; L327-L330 HydrophobicContact CD2-CD2 4.48Å; L327-G331 PolarHBondContact O-N 3.22Å
328	R	78.6	Confident	80.1	Confident	69 Å²	69	46.2 Å²	46.2	26%	0.26	25%	0.245	S	C	.	.	H	α-helix	trans	-67.7	-53.3	171.5	-63.4	-165.3	-72.1	-84.3	19.4	110.6	T321 R322 F324 V325 L330 G331 H332	T321-R328 HydrophobicContact CG2-CG 3.69Å; T321-R328 WeakPolarHBondContact O-CG 3.46Å; T321-R328 PolarHBondContact O-NH1 2.94Å; R322-R328 VanDerWaalsContact C-NH1 3.3Å; R322-R328 PolarHBondContact O-NH1 3.03Å; F324-R328 PolarHBondContact O-N 3.37Å; V325-R328 WeakPolarHBondContact O-CB 3.35Å; V325-R328 PolarHBondContact O-N 2.93Å; R328-L330 VanDerWaalsContact C-N 3.29Å; R328-L330 PolarHBondContact O-N 2.94Å; R328-G331 PolarHBondContact O-N 2.63Å; R328-G331 VanDerWaalsContact O-N 3.08Å; R328-H332 PolarHBondContact O-CD2 2.83Å; R328-H332 PolarHBondContact O-N 3.23Å
329	V	75.3	Confident	80	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-55.7	-46.8	179.2	176.6	0	0	0	0	110.2	V325 G331 H332 T333 F435 Y439 A442	V325-V329 HydrophobicContact CG1-CG2 4.11Å; V325-V329 PolarHBondContact O-N 3.14Å; V329-G331 PolarHBondContact O-N 2.99Å; V329-H332 PolarHBondContact O-N 3.47Å; V329-T333 PolarHBondContact O-N 2.8Å; V329-T333 PolarHBondContact O-OG1 3.35Å; V329-T333 VanDerWaalsContact O-OG1 3.09Å; V329-F435 HydrophobicContact CG1-CE2 4.35Å; V329-Y439 HydrophobicContact CG1-CD2 4.35Å; V329-A442 HydrophobicContact CG2-CB 3.75Å
330	L	79.8	Confident	80	Confident	71 Å²	71	48.3 Å²	48.3	37%	0.372	26%	0.26	S	S	.	.	H	α-helix	trans	-55.9	-51.4	174.1	-179.8	62.9	0	0	0	111.8	G326 L327 R328 H332 T333 L334 F435	G326-L330 WeakPolarHBondContact O-CB 3.45Å; G326-L330 PolarHBondContact O-N 3.03Å; L327-L330 HydrophobicContact CD2-CD2 4.48Å; R328-L330 VanDerWaalsContact C-N 3.29Å; R328-L330 PolarHBondContact O-N 2.94Å; L330-H332 VanDerWaalsContact C-N 3.27Å; L330-H332 PolarHBondContact O-N 3.39Å; L330-T333 PolarHBondContact O-N 3.36Å; L330-L334 HydrophobicContact CD1-CD1 4.37Å; L330-L334 HydrophobicContact CD1-CD2 4.43Å; L330-L334 HydrophobicContact CD1-CG 4.14Å; L330-L334 HydrophobicContact CG-CD1 4.13Å; L330-L334 HydrophobicContact CG-CG 4.32Å; L330-L334 WeakPolarHBondContact O-CB 3.48Å; L330-L334 VanDerWaalsContact O-CG 3.23Å; L330-L334 WeakPolarHBondContact O-CG 3.46Å; L330-L334 PolarHBondContact O-N 3.45Å; L330-F435 HydrophobicContact CB-CE2 4.11Å; L330-F435 HydrophobicContact CD1-CD2 4.16Å; L330-F435 HydrophobicContact CD1-CE2 4.05Å
331	G	79.8	Confident	80	Confident	38 Å²	38	50.1 Å²	50.1	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-57.9	-36.9	178	0	0	0	0	0	113.7	L327 R328 V329 R335	L327-G331 PolarHBondContact O-N 3.22Å; R328-G331 PolarHBondContact O-N 2.63Å; R328-G331 VanDerWaalsContact O-N 3.08Å; V329-G331 PolarHBondContact O-N 2.99Å; G331-R335 PolarHBondContact O-N 3.5Å
332	H	73.1	Confident	80.3	Confident	56 Å²	56	53.5 Å²	53.5	26%	0.259	28%	0.283	S	S	.	.	H	α-helix	trans	-74.4	-40	175.5	-71.4	-71.2	0	0	0	113.1	F122 R328 V329 L330 R335 A336	F122-H332 HydrophobicContact CD1-CB 3.99Å; F122-H332 AromaticContact CD1-CD2 3.74Å; F122-H332 AromaticContact CD1-CE1 3.41Å; F122-H332 VanDerWaalsContact CD1-CE1 3.41Å; F122-H332 WeakPolarHBondContact CD1-CE1 3.28Å; F122-H332 AromaticContact CD1-CG 3.4Å; F122-H332 VanDerWaalsContact CD1-CG 3.4Å; F122-H332 AromaticContact CD1-ND1 3.17Å; F122-H332 WeakPolarHBondContact CD1-ND1 3.4Å; F122-H332 AromaticContact CD1-NE2 3.79Å; F122-H332 HydrophobicContact CD2-CB 4.38Å; F122-H332 HydrophobicContact CE1-CB 3.46Å; F122-H332 VanDerWaalsContact CE1-CB 3.46Å; F122-H332 AromaticContact CE1-CG 3.4Å; F122-H332 VanDerWaalsContact CE1-CG 3.4Å; F122-H332 AromaticContact CE1-ND1 3.34Å; F122-H332 VanDerWaalsContact CE1-ND1 3.34Å; F122-H332 WeakPolarHBondContact CE1-ND1 3.32Å; F122-H332 HydrophobicContact CE2-CB 3.89Å; F122-H332 HydrophobicContact CG-CB 4.46Å; F122-H332 AromaticContact CG-CD2 3.75Å; F122-H332 AromaticContact CG-CE1 3.96Å; F122-H332 AromaticContact CG-CG 3.86Å; F122-H332 AromaticContact CG-ND1 3.98Å; F122-H332 AromaticContact CG-NE2 3.87Å; F122-H332 HydrophobicContact CZ-CB 3.42Å; F122-H332 VanDerWaalsContact CZ-CB 3.42Å; F122-H332 AromaticContact CZ-CG 3.82Å; R328-H332 PolarHBondContact O-CD2 2.83Å; R328-H332 PolarHBondContact O-N 3.23Å; V329-H332 PolarHBondContact O-N 3.47Å; L330-H332 VanDerWaalsContact C-N 3.27Å; L330-H332 PolarHBondContact O-N 3.39Å; H332-R335 WeakPolarHBondContact O-CB 3.47Å; H332-R335 PolarHBondContact O-N 2.9Å; H332-R335 VanDerWaalsContact O-N 3.13Å; H332-A336 PolarHBondContact O-N 3.17Å
333	T	75.4	Confident	80.7	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.012	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-42.5	171.8	-58	0	0	0	0	111.5	V329 L330 R335 A336 S337 F435 Y438	V329-T333 PolarHBondContact O-N 2.8Å; V329-T333 PolarHBondContact O-OG1 3.35Å; V329-T333 VanDerWaalsContact O-OG1 3.09Å; L330-T333 PolarHBondContact O-N 3.36Å; T333-R335 PolarHBondContact O-N 2.85Å; T333-A336 PolarHBondContact O-N 2.94Å; T333-A336 VanDerWaalsContact O-N 3.1Å; T333-S337 PolarHBondContact O-N 3.2Å; T333-F435 HydrophobicContact CG2-CB 3.89Å; T333-F435 HydrophobicContact CG2-CD2 4.18Å; T333-Y438 HydrophobicContact CG2-CD2 4.13Å
334	L	79.6	Confident	81.1	Confident	75 Å²	75	56.6 Å²	56.6	39%	0.393	30%	0.301	S	S	.	.	H	α-helix	trans	-59.6	-32.8	174.2	-68.8	177.4	0	0	0	111.5	L330 T338 F341	L330-L334 HydrophobicContact CD1-CD1 4.37Å; L330-L334 HydrophobicContact CD1-CD2 4.43Å; L330-L334 HydrophobicContact CD1-CG 4.14Å; L330-L334 HydrophobicContact CG-CD1 4.13Å; L330-L334 HydrophobicContact CG-CG 4.32Å; L330-L334 WeakPolarHBondContact O-CB 3.48Å; L330-L334 VanDerWaalsContact O-CG 3.23Å; L330-L334 WeakPolarHBondContact O-CG 3.46Å; L330-L334 PolarHBondContact O-N 3.45Å; L334-T338 WeakPolarHBondContact O-CG2 3.12Å; L334-F341 HydrophobicContact CD2-CD2 4.28Å; L334-F341 HydrophobicContact CD2-CE1 4.31Å; L334-F341 HydrophobicContact CD2-CE2 3.32Å; L334-F341 HydrophobicContact CD2-CZ 3.32Å
335	R	79.4	Confident	81.6	Confident	122 Å²	122	56.6 Å²	56.6	46%	0.46	31%	0.305	S	S	.	.	H	α-helix	trans	-73.5	-37.6	172.7	-172.6	-178.9	178	-140.8	-4.3	112.7	G331 H332 T333 T338	G331-R335 PolarHBondContact O-N 3.5Å; H332-R335 WeakPolarHBondContact O-CB 3.47Å; H332-R335 PolarHBondContact O-N 2.9Å; H332-R335 VanDerWaalsContact O-N 3.13Å; T333-R335 PolarHBondContact O-N 2.85Å; R335-T338 WeakPolarHBondContact O-CG2 3.19Å; R335-T338 PolarHBondContact O-OG1 3.46Å
336	A	76.4	Confident	82.6	Confident	44 Å²	44	60.2 Å²	60.2	36%	0.364	32%	0.323	S	S	.	.	H	α-helix	trans	-70.6	-38.8	179	0	0	0	0	0	112.3	H332 T333 Y438	H332-A336 PolarHBondContact O-N 3.17Å; T333-A336 PolarHBondContact O-N 2.94Å; T333-A336 VanDerWaalsContact O-N 3.1Å; A336-Y438 HydrophobicContact CB-CE2 3.79Å
337	S	82	Confident	83.5	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.007	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	24.4	179.5	-77.9	0	0	0	0	114.4	T333 N339 E340 F341 N434	T333-S337 PolarHBondContact O-N 3.2Å; S337-N339 PolarHBondContact O-N 3.22Å; S337-E340 VanDerWaalsContact C-OE2 3.3Å; S337-E340 WeakPolarHBondContact CA-OE1 3.44Å; S337-E340 VanDerWaalsContact CA-OE2 3.24Å; S337-E340 WeakPolarHBondContact CA-OE2 3.32Å; S337-E340 WeakPolarHBondContact CB-OE1 3.21Å; S337-E340 PolarHBondContact O-N 2.96Å; S337-E340 PolarHBondContact OG-OE1 3.23Å; S337-F341 VanDerWaalsContact O-CD2 3.27Å; S337-F341 WeakPolarHBondContact O-CD2 2.98Å; S337-F341 PolarHBondContact O-N 2.77Å; S337-N434 PolarHBondContact OG-ND2 3.47Å
338	T	84.6	Confident	84.3	Confident	70 Å²	70	61.5 Å²	61.5	43%	0.429	32%	0.319	S	S	.	.	H	α-helix	trans	-57.6	-32.3	179.4	40.9	0	0	0	0	112.9	L334 R335 L342	L334-T338 WeakPolarHBondContact O-CG2 3.12Å; R335-T338 WeakPolarHBondContact O-CG2 3.19Å; R335-T338 PolarHBondContact O-OG1 3.46Å; T338-L342 WeakPolarHBondContact O-CB 3.15Å; T338-L342 PolarHBondContact O-N 2.69Å
339	N	84.4	Confident	85.1	Confident	116 Å²	116	61 Å²	61	62%	0.62	33%	0.33	S	S	*	.	H	α-helix	trans	-68.8	-42.3	-179.6	-63.2	-40.7	0	0	0	111.2	S337 L342 L343	S337-N339 PolarHBondContact O-N 3.22Å; N339-L342 PolarHBondContact O-N 2.98Å; N339-L343 WeakPolarHBondContact O-CB 3.48Å; N339-L343 PolarHBondContact O-N 2.9Å
340	E	88.3	Confident	86.2	Confident	40 Å²	40	65.1 Å²	65.1	19%	0.187	35%	0.351	C	S	.	.	H	α-helix	trans	-69.7	-39	177	-53.9	93.8	105.5	0	0	111.6	S337 L343 L344 V430 I431 N434	S337-E340 VanDerWaalsContact C-OE2 3.3Å; S337-E340 WeakPolarHBondContact CA-OE1 3.44Å; S337-E340 VanDerWaalsContact CA-OE2 3.24Å; S337-E340 WeakPolarHBondContact CA-OE2 3.32Å; S337-E340 WeakPolarHBondContact CB-OE1 3.21Å; S337-E340 PolarHBondContact O-N 2.96Å; S337-E340 PolarHBondContact OG-OE1 3.23Å; E340-L343 PolarHBondContact O-N 2.91Å; E340-L344 WeakPolarHBondContact O-CB 3.47Å; E340-L344 PolarHBondContact O-N 2.87Å; E340-V430 HydrophobicContact CG-CG1 4.14Å; E340-I431 HydrophobicContact CB-CD1 4.38Å; E340-I431 HydrophobicContact CB-CG1 4.05Å; E340-N434 PolarHBondContact OE1-ND2 3.21Å
341	F	86.8	Confident	87	Confident	63 Å²	63	62.2 Å²	62.2	28%	0.276	34%	0.338	S	S	.	.	H	α-helix	trans	-65.1	-42.2	171.3	-84.5	-72.6	0	0	0	112.3	L334 S337 L344 I345 I431	L334-F341 HydrophobicContact CD2-CD2 4.28Å; L334-F341 HydrophobicContact CD2-CE1 4.31Å; L334-F341 HydrophobicContact CD2-CE2 3.32Å; L334-F341 HydrophobicContact CD2-CZ 3.32Å; S337-F341 VanDerWaalsContact O-CD2 3.27Å; S337-F341 WeakPolarHBondContact O-CD2 2.98Å; S337-F341 PolarHBondContact O-N 2.77Å; F341-L344 PolarHBondContact O-N 3.23Å; F341-I345 VanDerWaalsContact O-CG1 3.27Å; F341-I345 WeakPolarHBondContact O-CG1 3.48Å; F341-I345 PolarHBondContact O-N 3.17Å; F341-I431 HydrophobicContact CD1-CD1 4.04Å; F341-I431 HydrophobicContact CD2-CD1 4.11Å; F341-I431 HydrophobicContact CD2-CG1 4.37Å; F341-I431 HydrophobicContact CE1-CD1 3.89Å; F341-I431 HydrophobicContact CE2-CB 4.49Å; F341-I431 HydrophobicContact CE2-CD1 3.92Å; F341-I431 HydrophobicContact CE2-CG1 4.03Å; F341-I431 HydrophobicContact CE2-CG2 3.63Å; F341-I431 HydrophobicContact CG-CD1 4.16Å; F341-I431 HydrophobicContact CZ-CD1 3.83Å; F341-I431 HydrophobicContact CZ-CG1 4.29Å; F341-I431 HydrophobicContact CZ-CG2 3.55Å
342	L	90	Very high	87.8	Confident	94 Å²	94	61 Å²	61	49%	0.492	32%	0.323	S	S	.	.	H	α-helix	trans	-64	-41.6	176.4	179.5	60	0	0	0	111.1	T338 N339 I345 I346	T338-L342 WeakPolarHBondContact O-CB 3.15Å; T338-L342 PolarHBondContact O-N 2.69Å; N339-L342 PolarHBondContact O-N 2.98Å; L342-I345 PolarHBondContact O-N 3.32Å; L342-I346 HydrophobicContact CD1-CD1 4.01Å; L342-I346 HydrophobicContact CD1-CG1 4.28Å; L342-I346 HydrophobicContact CG-CD1 3.85Å; L342-I346 WeakPolarHBondContact O-CB 3.3Å; L342-I346 VanDerWaalsContact O-CG1 3.25Å; L342-I346 WeakPolarHBondContact O-CG1 3.35Å; L342-I346 PolarHBondContact O-N 3.13Å
343	L	89.2	Confident	89	Confident	75 Å²	75	62.4 Å²	62.4	39%	0.393	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-46.6	174.6	-172	72.3	0	0	0	111.8	N339 E340 I345 I346 F347	N339-L343 WeakPolarHBondContact O-CB 3.48Å; N339-L343 PolarHBondContact O-N 2.9Å; E340-L343 PolarHBondContact O-N 2.91Å; L343-I345 PolarHBondContact O-N 3.34Å; L343-I346 PolarHBondContact O-N 3.01Å; L343-F347 HydrophobicContact CD1-CD2 4.43Å; L343-F347 HydrophobicContact CD1-CE1 4.24Å; L343-F347 HydrophobicContact CD1-CE2 3.74Å; L343-F347 HydrophobicContact CD1-CZ 3.63Å; L343-F347 HydrophobicContact CD2-CE2 3.92Å; L343-F347 HydrophobicContact CD2-CZ 4.48Å; L343-F347 HydrophobicContact CG-CD2 4.02Å; L343-F347 HydrophobicContact CG-CE2 3.56Å; L343-F347 HydrophobicContact CG-CZ 4.02Å; L343-F347 WeakPolarHBondContact O-CG 3.49Å; L343-F347 PolarHBondContact O-N 2.59Å
344	L	90.7	Very high	90.1	Very high	27 Å²	27	65.9 Å²	65.9	14%	0.141	35%	0.35	C	S	.	.	H	α-helix	trans	-59.4	-44.3	175	176.2	60.1	0	0	0	111.8	E340 F341 L348 T423 I424 P427	E340-L344 WeakPolarHBondContact O-CB 3.47Å; E340-L344 PolarHBondContact O-N 2.87Å; F341-L344 PolarHBondContact O-N 3.23Å; L344-L348 VanDerWaalsContact O-CB 3.28Å; L344-L348 WeakPolarHBondContact O-CB 3.45Å; L344-L348 PolarHBondContact O-N 3.23Å; L344-T423 HydrophobicContact CD1-CG2 4.46Å; L344-I424 HydrophobicContact CD1-CG1 4.46Å; L344-P427 HydrophobicContact CB-CB 4.09Å; L344-P427 HydrophobicContact CB-CG 3.99Å; L344-P427 HydrophobicContact CD1-CG 4Å; L344-P427 HydrophobicContact CG-CG 4.48Å
345	I	93.1	Very high	91	Very high	106 Å²	106	63.4 Å²	63.4	54%	0.544	34%	0.336	S	S	.	.	H	α-helix	trans	-64.7	-41.3	177.8	-70	165	0	0	0	111.1	F341 L342 L343 L348 A349	F341-I345 VanDerWaalsContact O-CG1 3.27Å; F341-I345 WeakPolarHBondContact O-CG1 3.48Å; F341-I345 PolarHBondContact O-N 3.17Å; L342-I345 PolarHBondContact O-N 3.32Å; L343-I345 PolarHBondContact O-N 3.34Å; I345-L348 PolarHBondContact O-N 3.2Å; I345-A349 VanDerWaalsContact O-CB 3.25Å; I345-A349 WeakPolarHBondContact O-CB 3.25Å; I345-A349 PolarHBondContact O-N 3.2Å
346	I	94.3	Very high	91.9	Very high	90 Å²	90	57.6 Å²	57.6	46%	0.462	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-47.6	177.6	-72.6	166.6	0	0	0	111	L342 L343 A349 L350	L342-I346 HydrophobicContact CD1-CD1 4.01Å; L342-I346 HydrophobicContact CD1-CG1 4.28Å; L342-I346 HydrophobicContact CG-CD1 3.85Å; L342-I346 WeakPolarHBondContact O-CB 3.3Å; L342-I346 VanDerWaalsContact O-CG1 3.25Å; L342-I346 WeakPolarHBondContact O-CG1 3.35Å; L342-I346 PolarHBondContact O-N 3.13Å; L343-I346 PolarHBondContact O-N 3.01Å; I346-A349 PolarHBondContact O-N 3.46Å; I346-L350 VanDerWaalsContact O-CB 3.31Å; I346-L350 WeakPolarHBondContact O-CB 3.27Å; I346-L350 PolarHBondContact O-N 2.89Å
347	F	94.3	Very high	92.9	Very high	84 Å²	84	57.5 Å²	57.5	37%	0.368	31%	0.309	S	S	.	.	H	α-helix	trans	-66.1	-39.3	177.9	-67.9	-30.3	0	0	0	112.4	L343 G351 T423	L343-F347 HydrophobicContact CD1-CD2 4.43Å; L343-F347 HydrophobicContact CD1-CE1 4.24Å; L343-F347 HydrophobicContact CD1-CE2 3.74Å; L343-F347 HydrophobicContact CD1-CZ 3.63Å; L343-F347 HydrophobicContact CD2-CE2 3.92Å; L343-F347 HydrophobicContact CD2-CZ 4.48Å; L343-F347 HydrophobicContact CG-CD2 4.02Å; L343-F347 HydrophobicContact CG-CE2 3.56Å; L343-F347 HydrophobicContact CG-CZ 4.02Å; L343-F347 WeakPolarHBondContact O-CG 3.49Å; L343-F347 PolarHBondContact O-N 2.59Å; F347-G351 PolarHBondContact O-N 3.42Å; F347-T423 HydrophobicContact CB-CG2 3.72Å
348	L	94.9	Very high	93.6	Very high	42 Å²	42	61 Å²	61	22%	0.22	33%	0.326	C	S	.	.	H	α-helix	trans	-63.8	-46.1	174.4	-177.3	62	0	0	0	111.3	L344 I345 L350 G351 V352 M394	L344-L348 VanDerWaalsContact O-CB 3.28Å; L344-L348 WeakPolarHBondContact O-CB 3.45Å; L344-L348 PolarHBondContact O-N 3.23Å; I345-L348 PolarHBondContact O-N 3.2Å; L348-L350 PolarHBondContact O-N 2.95Å; L348-G351 PolarHBondContact O-N 3.09Å; L348-V352 HydrophobicContact CD1-CG2 4.19Å; L348-V352 HydrophobicContact CG-CG2 4.39Å; L348-V352 VanDerWaalsContact O-CB 3.3Å; L348-V352 WeakPolarHBondContact O-CB 3.46Å; L348-V352 WeakPolarHBondContact O-CG2 3.36Å; L348-V352 PolarHBondContact O-N 2.94Å; L348-M394 HydrophobicContact CD1-CB 3.99Å; L348-M394 HydrophobicContact CD1-CE 4.01Å; L348-M394 HydrophobicContact CD1-SD 4.2Å
349	A	96.5	Very high	94.1	Very high	59 Å²	59	57.7 Å²	57.7	49%	0.488	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-40.6	178.4	0	0	0	0	0	112.6	I345 I346 L353	I345-A349 VanDerWaalsContact O-CB 3.25Å; I345-A349 WeakPolarHBondContact O-CB 3.25Å; I345-A349 PolarHBondContact O-N 3.2Å; I346-A349 PolarHBondContact O-N 3.46Å; A349-L353 WeakPolarHBondContact O-CB 3.33Å; A349-L353 PolarHBondContact O-N 2.97Å
350	L	96.9	Very high	94.6	Very high	93 Å²	93	54.1 Å²	54.1	49%	0.487	28%	0.284	S	S	.	.	H	α-helix	trans	-65.1	-46	175.2	179.8	61.2	0	0	0	111.5	I346 L348 L353 I354	I346-L350 VanDerWaalsContact O-CB 3.31Å; I346-L350 WeakPolarHBondContact O-CB 3.27Å; I346-L350 PolarHBondContact O-N 2.89Å; L348-L350 PolarHBondContact O-N 2.95Å; L350-L353 PolarHBondContact O-N 3.4Å; L350-I354 HydrophobicContact CD1-CD1 3.92Å; L350-I354 HydrophobicContact CD1-CG1 4.39Å; L350-I354 HydrophobicContact CG-CD1 3.91Å; L350-I354 VanDerWaalsContact O-CG1 3.31Å; L350-I354 WeakPolarHBondContact O-CG1 3.49Å; L350-I354 PolarHBondContact O-N 3.07Å
351	G	96.9	Very high	94.8	Very high	10 Å²	10	59.4 Å²	59.4	10%	0.103	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-44.4	175.8	0	0	0	0	0	112.3	F347 L348 L353 I354 F355	F347-G351 PolarHBondContact O-N 3.42Å; L348-G351 PolarHBondContact O-N 3.09Å; G351-L353 VanDerWaalsContact C-N 3.33Å; G351-L353 PolarHBondContact O-N 3.5Å; G351-I354 PolarHBondContact O-N 3.48Å; G351-F355 WeakPolarHBondContact O-CD2 3.45Å; G351-F355 PolarHBondContact O-N 3.41Å
352	V	98.1	Very high	95.2	Very high	13 Å²	13	56.8 Å²	56.8	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-58.4	-43.9	175.3	164.3	0	0	0	0	111.2	L348 A356 F387 A390 V391 M394	L348-V352 HydrophobicContact CD1-CG2 4.19Å; L348-V352 HydrophobicContact CG-CG2 4.39Å; L348-V352 VanDerWaalsContact O-CB 3.3Å; L348-V352 WeakPolarHBondContact O-CB 3.46Å; L348-V352 WeakPolarHBondContact O-CG2 3.36Å; L348-V352 PolarHBondContact O-N 2.94Å; V352-A356 WeakPolarHBondContact O-CB 3.4Å; V352-A356 PolarHBondContact O-N 3.31Å; V352-F387 HydrophobicContact CG1-CB 3.82Å; V352-F387 HydrophobicContact CG1-CD1 3.71Å; V352-F387 HydrophobicContact CG1-CG 3.96Å; V352-A390 HydrophobicContact CB-CB 4.42Å; V352-A390 HydrophobicContact CG1-CB 4.23Å; V352-A390 HydrophobicContact CG2-CB 4.36Å; V352-V391 HydrophobicContact CG1-CG2 4.1Å; V352-V391 HydrophobicContact CG2-CB 4.46Å; V352-V391 HydrophobicContact CG2-CG2 3.57Å; V352-M394 HydrophobicContact CG2-SD 4.06Å
353	L	98.1	Very high	95.2	Very high	85 Å²	85	52.3 Å²	52.3	45%	0.445	27%	0.269	S	S	.	.	H	α-helix	trans	-64.2	-44.5	176.1	179.7	60.5	0	0	0	112.4	A349 L350 G351 T357 F387	A349-L353 WeakPolarHBondContact O-CB 3.33Å; A349-L353 PolarHBondContact O-N 2.97Å; L350-L353 PolarHBondContact O-N 3.4Å; G351-L353 VanDerWaalsContact C-N 3.33Å; G351-L353 PolarHBondContact O-N 3.5Å; L353-T357 HydrophobicContact CD1-CG2 4.32Å; L353-T357 WeakPolarHBondContact O-CB 3.46Å; L353-T357 WeakPolarHBondContact O-CG2 3.49Å; L353-T357 PolarHBondContact O-N 3.15Å; L353-T357 VanDerWaalsContact O-N 3.09Å; L353-T357 PolarHBondContact O-OG1 2.87Å; L353-F387 HydrophobicContact CD1-CE1 3.93Å; L353-F387 HydrophobicContact CD1-CZ 4.09Å
354	I	98.1	Very high	95.2	Very high	75 Å²	75	52 Å²	52	39%	0.385	26%	0.263	S	S	.	.	H	α-helix	trans	-65.8	-52.1	179.5	-69.8	168.6	0	0	0	110.7	L350 G351 T357 M358	L350-I354 HydrophobicContact CD1-CD1 3.92Å; L350-I354 HydrophobicContact CD1-CG1 4.39Å; L350-I354 HydrophobicContact CG-CD1 3.91Å; L350-I354 VanDerWaalsContact O-CG1 3.31Å; L350-I354 WeakPolarHBondContact O-CG1 3.49Å; L350-I354 PolarHBondContact O-N 3.07Å; G351-I354 PolarHBondContact O-N 3.48Å; I354-T357 PolarHBondContact O-N 3.26Å; I354-T357 PolarHBondContact O-OG1 3.29Å; I354-M358 HydrophobicContact CG2-CG 4.41Å; I354-M358 HydrophobicContact CG2-SD 3.63Å; I354-M358 WeakPolarHBondContact O-CB 3.35Å; I354-M358 VanDerWaalsContact O-CG 3.27Å; I354-M358 WeakPolarHBondContact O-CG 3.25Å; I354-M358 PolarHBondContact O-N 2.96Å
355	F	98.1	Very high	94.9	Very high	22 Å²	22	55.6 Å²	55.6	10%	0.096	28%	0.281	C	S	.	.	H	α-helix	trans	-71.3	-34	-177.7	-69.5	-64.2	0	0	0	112.8	G351 T357 M358 I359 W389 A390 M394 V412 L415 C416 A419	G351-F355 WeakPolarHBondContact O-CD2 3.45Å; G351-F355 PolarHBondContact O-N 3.41Å; F355-T357 VanDerWaalsContact C-N 3.35Å; F355-M358 HydrophobicContact CD1-SD 4.33Å; F355-M358 HydrophobicContact CE1-SD 4.45Å; F355-M358 PolarHBondContact O-N 2.93Å; F355-I359 VanDerWaalsContact O-CB 3.29Å; F355-I359 WeakPolarHBondContact O-CB 3.43Å; F355-I359 VanDerWaalsContact O-CG2 3.28Å; F355-I359 WeakPolarHBondContact O-CG2 3.31Å; F355-I359 PolarHBondContact O-N 3.45Å; F355-W389 HydrophobicContact CB-CZ3 4.41Å; F355-A390 HydrophobicContact CB-CB 4.43Å; F355-M394 HydrophobicContact CD2-CG 4.46Å; F355-M394 HydrophobicContact CD2-SD 3.95Å; F355-V412 HydrophobicContact CD1-CG1 4.19Å; F355-L415 HydrophobicContact CE1-CB 4.12Å; F355-C416 HydrophobicContact CB-CB 4.1Å; F355-C416 HydrophobicContact CD1-CB 3.62Å; F355-C416 HydrophobicContact CD2-CB 4.12Å; F355-C416 HydrophobicContact CE1-CB 4.06Å; F355-C416 HydrophobicContact CG-CB 3.67Å; F355-C416 HydrophobicContact CZ-CB 4.5Å; F355-A419 HydrophobicContact CE2-CB 3.55Å; F355-A419 HydrophobicContact CZ-CB 3.58Å
356	A	97.8	Very high	93.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-68	-31.3	173.5	0	0	0	0	0	113.3	V352 Y360 I383 G386 F387 A390	V352-A356 WeakPolarHBondContact O-CB 3.4Å; V352-A356 PolarHBondContact O-N 3.31Å; A356-Y360 WeakPolarHBondContact O-CB 3.25Å; A356-Y360 PolarHBondContact O-N 3.4Å; A356-I383 HydrophobicContact CB-CG2 4.28Å; A356-G386 VanDerWaalsContact CB-C 3.46Å; A356-F387 HydrophobicContact CB-CD1 3.49Å; A356-F387 VanDerWaalsContact CB-CD1 3.49Å; A356-F387 HydrophobicContact CB-CE1 3.97Å; A356-A390 HydrophobicContact CB-CB 4.19Å
357	T	97.3	Very high	93	Very high	42 Å²	42	50.7 Å²	50.7	26%	0.258	28%	0.277	S	S	.	.	H	α-helix	trans	-76.5	-43.1	172.5	49.7	0	0	0	0	111.5	L353 I354 F355 Y360 Y361 I383	L353-T357 HydrophobicContact CD1-CG2 4.32Å; L353-T357 WeakPolarHBondContact O-CB 3.46Å; L353-T357 WeakPolarHBondContact O-CG2 3.49Å; L353-T357 PolarHBondContact O-N 3.15Å; L353-T357 VanDerWaalsContact O-N 3.09Å; L353-T357 PolarHBondContact O-OG1 2.87Å; I354-T357 PolarHBondContact O-N 3.26Å; I354-T357 PolarHBondContact O-OG1 3.29Å; F355-T357 VanDerWaalsContact C-N 3.35Å; T357-Y360 PolarHBondContact O-N 2.96Å; T357-Y361 VanDerWaalsContact O-CD2 3.22Å; T357-Y361 WeakPolarHBondContact O-CD2 3.5Å; T357-Y361 PolarHBondContact O-N 2.9Å; T357-I383 HydrophobicContact CG2-CD1 3.95Å; T357-I383 HydrophobicContact CG2-CG1 4.12Å; T357-I383 HydrophobicContact CG2-CG2 3.74Å
358	M	96.6	Very high	92.1	Very high	76 Å²	76	51.8 Å²	51.8	37%	0.374	29%	0.286	S	S	.	.	H	α-helix	trans	-60.4	-46.6	176.2	-72.7	175	64.5	0	0	112.6	I354 F355 Y361 A362 V412	I354-M358 HydrophobicContact CG2-CG 4.41Å; I354-M358 HydrophobicContact CG2-SD 3.63Å; I354-M358 WeakPolarHBondContact O-CB 3.35Å; I354-M358 VanDerWaalsContact O-CG 3.27Å; I354-M358 WeakPolarHBondContact O-CG 3.25Å; I354-M358 PolarHBondContact O-N 2.96Å; F355-M358 HydrophobicContact CD1-SD 4.33Å; F355-M358 HydrophobicContact CE1-SD 4.45Å; F355-M358 PolarHBondContact O-N 2.93Å; M358-Y361 PolarHBondContact O-N 3.49Å; M358-A362 VanDerWaalsContact O-CB 3.26Å; M358-A362 WeakPolarHBondContact O-CB 3.28Å; M358-A362 PolarHBondContact O-N 3.22Å; M358-V412 HydrophobicContact CB-CG1 3.73Å; M358-V412 HydrophobicContact CB-CG2 4.34Å; M358-V412 HydrophobicContact CE-CG1 4.37Å; M358-V412 HydrophobicContact CE-CG2 4.1Å
359	I	95.8	Very high	91.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.5	-40.2	-178.5	-157.5	64.2	0	0	0	111.5	F355 Y361 A362 E363 F380 W389 P404 G409 V412	F355-I359 VanDerWaalsContact O-CB 3.29Å; F355-I359 WeakPolarHBondContact O-CB 3.43Å; F355-I359 VanDerWaalsContact O-CG2 3.28Å; F355-I359 WeakPolarHBondContact O-CG2 3.31Å; F355-I359 PolarHBondContact O-N 3.45Å; I359-Y361 VanDerWaalsContact C-N 3.32Å; I359-Y361 PolarHBondContact O-N 2.88Å; I359-A362 PolarHBondContact O-N 2.88Å; I359-E363 HydrophobicContact CD1-CG 4.37Å; I359-E363 HydrophobicContact CG1-CG 4.23Å; I359-E363 WeakPolarHBondContact O-CB 3.1Å; I359-E363 WeakPolarHBondContact O-CG 3.31Å; I359-E363 PolarHBondContact O-N 3.4Å; I359-F380 HydrophobicContact CB-CE1 4.31Å; I359-F380 HydrophobicContact CG1-CD1 4.22Å; I359-F380 HydrophobicContact CG1-CD2 4.39Å; I359-F380 HydrophobicContact CG1-CE1 3.76Å; I359-F380 HydrophobicContact CG1-CE2 3.97Å; I359-F380 HydrophobicContact CG1-CZ 3.63Å; I359-F380 HydrophobicContact CG2-CD1 3.53Å; I359-F380 HydrophobicContact CG2-CE1 3.51Å; I359-F380 HydrophobicContact CG2-CG 4.3Å; I359-F380 HydrophobicContact CG2-CZ 4.27Å; I359-W389 HydrophobicContact CB-CE3 4.14Å; I359-W389 HydrophobicContact CB-CH2 4.06Å; I359-W389 HydrophobicContact CB-CZ3 3.62Å; I359-W389 HydrophobicContact CD1-CH2 3.64Å; I359-W389 HydrophobicContact CD1-CZ2 4.02Å; I359-W389 HydrophobicContact CD1-CZ3 4.11Å; I359-W389 HydrophobicContact CG1-CD2 4.45Å; I359-W389 HydrophobicContact CG1-CE3 4.04Å; I359-W389 HydrophobicContact CG1-CH2 3.69Å; I359-W389 HydrophobicContact CG1-CZ2 4.13Å; I359-W389 HydrophobicContact CG1-CZ3 3.65Å; I359-W389 HydrophobicContact CG2-CE3 3.78Å; I359-W389 HydrophobicContact CG2-CZ3 3.73Å; I359-P404 HydrophobicContact CD1-CB 3.84Å; I359-P404 HydrophobicContact CD1-CG 4.21Å; I359-G409 WeakPolarHBondContact CD1-O 3.49Å; I359-V412 HydrophobicContact CB-CG1 4.23Å; I359-V412 HydrophobicContact CD1-CB 3.98Å; I359-V412 HydrophobicContact CD1-CG1 3.93Å
360	Y	94.4	Very high	90.3	Very high	41 Å²	41	60 Å²	60	16%	0.161	33%	0.329	C	S	.	.	H	α-helix	trans	-61.8	-36.3	178.4	167.2	-100	0	0	0	112.9	A356 T357 R364 F380 I383	A356-Y360 WeakPolarHBondContact O-CB 3.25Å; A356-Y360 PolarHBondContact O-N 3.4Å; T357-Y360 PolarHBondContact O-N 2.96Å; Y360-R364 VanDerWaalsContact CE2-NH1 3.33Å; Y360-R364 WeakPolarHBondContact O-CD 3.04Å; Y360-R364 WeakPolarHBondContact O-CG 3.29Å; Y360-R364 PolarHBondContact OH-NH1 3.37Å; Y360-F380 WeakPolarHBondContact CD2-O 3.25Å; Y360-I383 HydrophobicContact CD1-CD1 3.98Å; Y360-I383 HydrophobicContact CD1-CG1 3.58Å; Y360-I383 HydrophobicContact CD2-CG1 4.17Å; Y360-I383 HydrophobicContact CE1-CD1 3.94Å; Y360-I383 HydrophobicContact CE1-CG1 3.9Å; Y360-I383 HydrophobicContact CE2-CG1 4.46Å; Y360-I383 HydrophobicContact CG-CG1 3.71Å
361	Y	93.6	Very high	89.6	Confident	151 Å²	151	57 Å²	57	59%	0.592	31%	0.313	S	S	*	.	H	α-helix	trans	-80.5	-42.1	172.4	-74.4	-65.5	0	0	0	112.4	T357 M358 I359 E363 R364 I365	T357-Y361 VanDerWaalsContact O-CD2 3.22Å; T357-Y361 WeakPolarHBondContact O-CD2 3.5Å; T357-Y361 PolarHBondContact O-N 2.9Å; M358-Y361 PolarHBondContact O-N 3.49Å; I359-Y361 VanDerWaalsContact C-N 3.32Å; I359-Y361 PolarHBondContact O-N 2.88Å; Y361-E363 PolarHBondContact O-N 2.94Å; Y361-R364 PolarHBondContact O-N 2.91Å; Y361-R364 VanDerWaalsContact O-N 3.16Å; Y361-I365 PolarHBondContact O-N 3.01Å
362	A	93.8	Very high	88.4	Confident	7 Å²	7	62.6 Å²	62.6	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-45.7	-179	0	0	0	0	0	112.6	M358 I359 R364 I365 T406 F408 V412	M358-A362 VanDerWaalsContact O-CB 3.26Å; M358-A362 WeakPolarHBondContact O-CB 3.28Å; M358-A362 PolarHBondContact O-N 3.22Å; I359-A362 PolarHBondContact O-N 2.88Å; A362-R364 PolarHBondContact O-N 3.19Å; A362-R364 VanDerWaalsContact O-N 3.1Å; A362-I365 WeakPolarHBondContact O-CB 3.49Å; A362-I365 PolarHBondContact O-N 3.44Å; A362-T406 PolarHBondContact O-OG1 3.35Å; A362-F408 HydrophobicContact CB-CB 4.11Å; A362-V412 HydrophobicContact CB-CG2 4.13Å
363	E	91.6	Very high	87.2	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-3.1	179.6	-71	-72	107.4	0	0	114.5	I359 Y361 H377 T378 F380 P404 Q405 T406	I359-E363 HydrophobicContact CD1-CG 4.37Å; I359-E363 HydrophobicContact CG1-CG 4.23Å; I359-E363 WeakPolarHBondContact O-CB 3.1Å; I359-E363 WeakPolarHBondContact O-CG 3.31Å; I359-E363 PolarHBondContact O-N 3.4Å; Y361-E363 PolarHBondContact O-N 2.94Å; E363-H377 PolarHBondContact O-ND1 2.88Å; E363-T378 HydrophobicContact CB-CG2 4.3Å; E363-T378 PolarHBondContact OE2-OG1 3.16Å; E363-F380 HydrophobicContact CB-CD2 4.25Å; E363-F380 HydrophobicContact CG-CD2 3.74Å; E363-F380 HydrophobicContact CG-CE2 4.09Å; E363-P404 HydrophobicContact CG-CB 4.27Å; E363-P404 WeakPolarHBondContact OE1-CB 3.47Å; E363-P404 WeakPolarHBondContact OE2-CA 3.32Å; E363-Q405 VanDerWaalsContact CD-N 3.32Å; E363-Q405 PolarHBondContact OE1-N 3.1Å; E363-Q405 VanDerWaalsContact OE1-N 3.13Å; E363-Q405 PolarHBondContact OE2-N 3.44Å; E363-T406 VanDerWaalsContact OE1-CB 3.31Å; E363-T406 WeakPolarHBondContact OE1-CB 3.32Å; E363-T406 WeakPolarHBondContact OE1-CG2 3.15Å; E363-T406 PolarHBondContact OE1-N 3.45Å; E363-T406 PolarHBondContact OE1-OG1 3.13Å
364	R	89.2	Confident	86.1	Confident	70 Å²	70	67.6 Å²	67.6	26%	0.264	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-6.3	173.1	-67.6	-179	172.1	-175.4	-1	113.2	Y360 Y361 A362 G366 A367 R373 A374 K381	Y360-R364 VanDerWaalsContact CE2-NH1 3.33Å; Y360-R364 WeakPolarHBondContact O-CD 3.04Å; Y360-R364 WeakPolarHBondContact O-CG 3.29Å; Y360-R364 PolarHBondContact OH-NH1 3.37Å; Y361-R364 PolarHBondContact O-N 2.91Å; Y361-R364 VanDerWaalsContact O-N 3.16Å; A362-R364 PolarHBondContact O-N 3.19Å; A362-R364 VanDerWaalsContact O-N 3.1Å; R364-G366 PolarHBondContact O-N 3.46Å; R364-A367 PolarHBondContact O-N 3.12Å; R364-R373 PolarHBondContact NH2-O 3.05Å; R364-A374 HydrophobicContact CG-CB 3.98Å; R364-K381 PolarHBondContact NH2-O 3.48Å; R364-K381 VanDerWaalsContact NH2-O 3.09Å
365	I	83	Confident	85	Confident	101 Å²	101	65.9 Å²	65.9	52%	0.518	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	93.4	170.9	-58.5	174.3	0	0	0	107.8	Y361 A362 F408	Y361-I365 PolarHBondContact O-N 3.01Å; A362-I365 WeakPolarHBondContact O-CB 3.49Å; A362-I365 PolarHBondContact O-N 3.44Å; I365-F408 HydrophobicContact CB-CD2 4.41Å; I365-F408 HydrophobicContact CD1-CD2 4.4Å; I365-F408 HydrophobicContact CD1-CG 4.49Å; I365-F408 HydrophobicContact CG2-CD2 4.05Å; I365-F408 HydrophobicContact CG2-CE2 4.12Å
366	G	72.2	Confident	83.9	Confident	67 Å²	67	73.2 Å²	73.2	69%	0.691	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.3	2.9	-177.1	0	0	0	0	0	115.3	R364	R364-G366 PolarHBondContact O-N 3.46Å
367	A	76	Confident	83	Confident	27 Å²	27	76.3 Å²	76.3	22%	0.223	40%	0.404	C	S	.	.			trans	-61.7	143.8	173.3	0	0	0	0	0	111.7	R364 A374 H377	R364-A367 PolarHBondContact O-N 3.12Å; A367-A374 HydrophobicContact CB-CB 3.8Å; A367-H377 HydrophobicContact CB-CB 4.41Å
368	D	74.6	Confident	82.5	Confident	107 Å²	107	74.6 Å²	74.6	57%	0.572	39%	0.393	S	S	*	.			trans	-60.3	134.3	-174.8	-103.3	-51.1	0	0	0	112.7	N370 D371	D368-N370 PolarHBondContact O-N 2.82Å; D368-D371 PolarHBondContact O-N 2.84Å
369	P	75.7	Confident	82.2	Confident	121 Å²	121	74.1 Å²	74.1	79%	0.786	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-19	176.9	-25.9	34.9	0	0	0	114.8
370	N	79.1	Confident	82	Confident	152 Å²	152	74.1 Å²	74.1	81%	0.813	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.1	178.5	-63.6	-29.5	0	0	0	113.5	D368 P372	D368-N370 PolarHBondContact O-N 2.82Å; N370-P372 VanDerWaalsContact C-CD 3.48Å; N370-P372 VanDerWaalsContact O-CD 3.25Å; N370-P372 WeakPolarHBondContact O-CD 3.48Å
371	D	80.8	Confident	81.8	Confident	30 Å²	30	77.5 Å²	77.5	16%	0.16	41%	0.405	C	S	.	.			trans	-112	82.2	171	-177.6	0.2	0	0	0	110.4	D368 R373 A374 S375 E376	D368-D371 PolarHBondContact O-N 2.84Å; D371-R373 PolarHBondContact O-N 3.35Å; D371-R373 WeakPolarHBondContact OD1-CA 3.41Å; D371-R373 PolarHBondContact OD1-N 3.08Å; D371-A374 VanDerWaalsContact CG-N 3.3Å; D371-A374 PolarHBondContact O-N 2.9Å; D371-A374 PolarHBondContact OD1-N 2.99Å; D371-A374 VanDerWaalsContact OD2-CA 3.3Å; D371-A374 WeakPolarHBondContact OD2-CA 3.34Å; D371-A374 PolarHBondContact OD2-N 3.16Å; D371-S375 PolarHBondContact OD1-N 2.85Å; D371-S375 PolarHBondContact OD1-OG 3.34Å; D371-S375 PolarHBondContact OD2-N 3.08Å; D371-E376 PolarHBondContact OD2-N 2.95Å
372	P	73.5	Confident	81.7	Confident	127 Å²	127	73.4 Å²	73.4	83%	0.825	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	1.6	178.1	29.5	-36.7	0	0	0	114.1	N370	N370-P372 VanDerWaalsContact C-CD 3.48Å; N370-P372 VanDerWaalsContact O-CD 3.25Å; N370-P372 WeakPolarHBondContact O-CD 3.48Å
373	R	72.8	Confident	81.8	Confident	200 Å²	200	75.2 Å²	75.2	76%	0.755	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-13.5	171.2	-78.1	-178.1	156.6	157.8	-4.3	113.2	R364 D371 S375	R364-R373 PolarHBondContact NH2-O 3.05Å; D371-R373 PolarHBondContact O-N 3.35Å; D371-R373 WeakPolarHBondContact OD1-CA 3.41Å; D371-R373 PolarHBondContact OD1-N 3.08Å; R373-S375 PolarHBondContact O-N 3.44Å
374	A	73.6	Confident	82.1	Confident	4 Å²	4	79.3 Å²	79.3	3%	0.033	43%	0.429	C	S	.	.			trans	49.2	31.8	-168.5	0	0	0	0	0	112.9	R364 A367 D371 T378	R364-A374 HydrophobicContact CG-CB 3.98Å; A367-A374 HydrophobicContact CB-CB 3.8Å; D371-A374 VanDerWaalsContact CG-N 3.3Å; D371-A374 PolarHBondContact O-N 2.9Å; D371-A374 PolarHBondContact OD1-N 2.99Å; D371-A374 VanDerWaalsContact OD2-CA 3.3Å; D371-A374 WeakPolarHBondContact OD2-CA 3.34Å; D371-A374 PolarHBondContact OD2-N 3.16Å; A374-T378 HydrophobicContact CB-CG2 4.23Å; A374-T378 WeakPolarHBondContact O-CG2 3.49Å; A374-T378 PolarHBondContact O-N 3.34Å
375	S	75	Confident	82.4	Confident	39 Å²	39	79.2 Å²	79.2	27%	0.273	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-25.4	-176.5	31.1	0	0	0	0	114.6	D371 R373 K381	D371-S375 PolarHBondContact OD1-N 2.85Å; D371-S375 PolarHBondContact OD1-OG 3.34Å; D371-S375 PolarHBondContact OD2-N 3.08Å; R373-S375 PolarHBondContact O-N 3.44Å; S375-K381 WeakPolarHBondContact O-CE 3.15Å; S375-K381 PolarHBondContact O-NZ 2.92Å
376	E	76.3	Confident	83	Confident	176 Å²	176	74.4 Å²	74.4	82%	0.822	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-37.5	172.8	-61.3	-60.7	113.9	0	0	111.2	D371	D371-E376 PolarHBondContact OD2-N 2.95Å
377	H	79.1	Confident	84.2	Confident	65 Å²	65	74.7 Å²	74.7	30%	0.301	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-30.1	-176.3	-175.2	-94	0	0	0	113.9	E363 A367	E363-H377 PolarHBondContact O-ND1 2.88Å; A367-H377 HydrophobicContact CB-CB 4.41Å
378	T	86.6	Confident	85.2	Confident	5 Å²	5	79.3 Å²	79.3	3%	0.031	40%	0.402	C	S	.	.			trans	-148.5	148.8	-175.8	-170.2	0	0	0	0	115.1	E363 A374 F380	E363-T378 HydrophobicContact CB-CG2 4.3Å; E363-T378 PolarHBondContact OE2-OG1 3.16Å; A374-T378 HydrophobicContact CB-CG2 4.23Å; A374-T378 WeakPolarHBondContact O-CG2 3.49Å; A374-T378 PolarHBondContact O-N 3.34Å; T378-F380 HydrophobicContact CG2-CB 4.41Å; T378-F380 PolarHBondContact O-N 3.3Å; T378-F380 WeakPolarHBondContact OG1-CD2 3.29Å; T378-F380 PolarHBondContact OG1-N 3.5Å
379	Q	89.1	Confident	86.3	Confident	67 Å²	67	74.7 Å²	74.7	31%	0.313	38%	0.377	S	S	.	.	S	Bend	trans	-71.9	-20	174.3	-57.9	176.3	-66.4	0	0	112.2	K381 D401 M402	Q379-K381 PolarHBondContact O-N 2.87Å; Q379-D401 PolarHBondContact NE2-O 2.89Å; Q379-M402 HydrophobicContact CB-CE 3.94Å; Q379-M402 HydrophobicContact CB-CG 4.42Å
380	F	91.9	Very high	87.4	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.339	C	S	.	.			trans	-78.4	62.1	-178.5	-65	-84.2	0	0	0	112.4	I359 Y360 E363 T378 N382 W389 M402	I359-F380 HydrophobicContact CB-CE1 4.31Å; I359-F380 HydrophobicContact CG1-CD1 4.22Å; I359-F380 HydrophobicContact CG1-CD2 4.39Å; I359-F380 HydrophobicContact CG1-CE1 3.76Å; I359-F380 HydrophobicContact CG1-CE2 3.97Å; I359-F380 HydrophobicContact CG1-CZ 3.63Å; I359-F380 HydrophobicContact CG2-CD1 3.53Å; I359-F380 HydrophobicContact CG2-CE1 3.51Å; I359-F380 HydrophobicContact CG2-CG 4.3Å; I359-F380 HydrophobicContact CG2-CZ 4.27Å; Y360-F380 WeakPolarHBondContact CD2-O 3.25Å; E363-F380 HydrophobicContact CB-CD2 4.25Å; E363-F380 HydrophobicContact CG-CD2 3.74Å; E363-F380 HydrophobicContact CG-CE2 4.09Å; T378-F380 HydrophobicContact CG2-CB 4.41Å; T378-F380 PolarHBondContact O-N 3.3Å; T378-F380 WeakPolarHBondContact OG1-CD2 3.29Å; T378-F380 PolarHBondContact OG1-N 3.5Å; F380-N382 VanDerWaalsContact C-N 3.35Å; F380-N382 PolarHBondContact O-N 2.95Å; F380-W389 HydrophobicContact CE1-CB 3.66Å; F380-W389 AromaticContact CE1-CD2 3.61Å; F380-W389 HydrophobicContact CE1-CD2 3.61Å; F380-W389 AromaticContact CE1-CE3 3.83Å; F380-W389 HydrophobicContact CE1-CE3 3.83Å; F380-W389 AromaticContact CE1-CG 3.53Å; F380-W389 HydrophobicContact CE1-CG 3.53Å; F380-W389 HydrophobicContact CZ-CB 4.09Å; F380-W389 AromaticContact CZ-CD1 3.82Å; F380-W389 AromaticContact CZ-CD2 3.63Å; F380-W389 HydrophobicContact CZ-CD2 3.63Å; F380-W389 AromaticContact CZ-CE2 3.95Å; F380-W389 HydrophobicContact CZ-CE3 4.19Å; F380-W389 AromaticContact CZ-CG 3.54Å; F380-W389 HydrophobicContact CZ-CG 3.54Å; F380-M402 HydrophobicContact CD1-CE 3.61Å; F380-M402 HydrophobicContact CD2-CE 4.34Å; F380-M402 HydrophobicContact CE1-CE 3.62Å; F380-M402 HydrophobicContact CE2-CE 4.34Å; F380-M402 HydrophobicContact CG-CE 4.01Å; F380-M402 HydrophobicContact CZ-CE 4Å
381	K	90.6	Very high	88.2	Confident	111 Å²	111	64.3 Å²	64.3	48%	0.483	32%	0.317	S	S	.	.			trans	-67	-31	-172.1	-63.3	-175.9	-178.7	-169	0	113.5	R364 S375 Q379 I385	R364-K381 PolarHBondContact NH2-O 3.48Å; R364-K381 VanDerWaalsContact NH2-O 3.09Å; S375-K381 WeakPolarHBondContact O-CE 3.15Å; S375-K381 PolarHBondContact O-NZ 2.92Å; Q379-K381 PolarHBondContact O-N 2.87Å; K381-I385 HydrophobicContact CB-CD1 4.21Å
382	N	92.4	Very high	89	Confident	66 Å²	66	63.1 Å²	63.1	35%	0.353	31%	0.31	S	S	.	.	S	Bend	trans	-153	165.2	171.1	63.6	50.1	0	0	0	111.4	F380 P384 I385 G386	F380-N382 VanDerWaalsContact C-N 3.35Å; F380-N382 PolarHBondContact O-N 2.95Å; N382-P384 VanDerWaalsContact OD1-CD 3.29Å; N382-P384 WeakPolarHBondContact OD1-CD 3.17Å; N382-I385 WeakPolarHBondContact ND2-CD1 3.29Å; N382-I385 PolarHBondContact O-N 2.98Å; N382-I385 VanDerWaalsContact OD1-CG1 3.31Å; N382-I385 WeakPolarHBondContact OD1-CG1 3.47Å; N382-I385 PolarHBondContact OD1-N 3.42Å; N382-G386 PolarHBondContact O-N 2.92Å
383	I	95.6	Very high	90.2	Very high	44 Å²	44	58.1 Å²	58.1	23%	0.226	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-42.8	-177.7	-63.6	154.1	0	0	0	112.4	A356 T357 Y360 I385 G386 F387	A356-I383 HydrophobicContact CB-CG2 4.28Å; T357-I383 HydrophobicContact CG2-CD1 3.95Å; T357-I383 HydrophobicContact CG2-CG1 4.12Å; T357-I383 HydrophobicContact CG2-CG2 3.74Å; Y360-I383 HydrophobicContact CD1-CD1 3.98Å; Y360-I383 HydrophobicContact CD1-CG1 3.58Å; Y360-I383 HydrophobicContact CD2-CG1 4.17Å; Y360-I383 HydrophobicContact CE1-CD1 3.94Å; Y360-I383 HydrophobicContact CE1-CG1 3.9Å; Y360-I383 HydrophobicContact CE2-CG1 4.46Å; Y360-I383 HydrophobicContact CG-CG1 3.71Å; I383-I385 VanDerWaalsContact C-N 3.35Å; I383-I385 PolarHBondContact O-N 2.83Å; I383-G386 CarbonylContact O-C 3.45Å; I383-G386 VanDerWaalsContact O-CA 3.25Å; I383-G386 WeakPolarHBondContact O-CA 3.29Å; I383-G386 PolarHBondContact O-N 3.41Å; I383-F387 HydrophobicContact CG2-CD1 4.41Å; I383-F387 HydrophobicContact CG2-CE1 3.67Å; I383-F387 HydrophobicContact CG2-CZ 4.07Å; I383-F387 PolarHBondContact O-N 2.82Å
384	P	96.9	Very high	91.3	Very high	86 Å²	86	48.7 Å²	48.7	56%	0.558	24%	0.242	S	C	*	.	H	α-helix	trans	-58.3	-37.3	173.4	-29.5	36.5	0	0	0	115.4	N382 G386 F387	N382-P384 VanDerWaalsContact OD1-CD 3.29Å; N382-P384 WeakPolarHBondContact OD1-CD 3.17Å; P384-G386 VanDerWaalsContact C-N 3.3Å; P384-F387 HydrophobicContact CB-CD2 4.32Å; P384-F387 HydrophobicContact CB-CE2 4.38Å; P384-F387 HydrophobicContact CG-CE2 4.49Å; P384-F387 VanDerWaalsContact O-CB 3.32Å; P384-F387 WeakPolarHBondContact O-CB 3.3Å; P384-F387 PolarHBondContact O-N 2.93Å
385	I	94.8	Very high	92.4	Very high	69 Å²	69	50.2 Å²	50.2	35%	0.354	25%	0.251	S	S	.	.	H	α-helix	trans	-66.3	-37.3	171.2	-69.2	167.2	0	0	0	110	K381 N382 I383 F387 W388 M402	K381-I385 HydrophobicContact CB-CD1 4.21Å; N382-I385 WeakPolarHBondContact ND2-CD1 3.29Å; N382-I385 PolarHBondContact O-N 2.98Å; N382-I385 VanDerWaalsContact OD1-CG1 3.31Å; N382-I385 WeakPolarHBondContact OD1-CG1 3.47Å; N382-I385 PolarHBondContact OD1-N 3.42Å; I383-I385 VanDerWaalsContact C-N 3.35Å; I383-I385 PolarHBondContact O-N 2.83Å; I385-F387 PolarHBondContact O-N 3.08Å; I385-W388 WeakPolarHBondContact O-CB 3.43Å; I385-W388 PolarHBondContact O-N 3.06Å; I385-M402 HydrophobicContact CG2-CE 3.89Å; I385-M402 HydrophobicContact CG2-SD 3.86Å
386	G	96.1	Very high	93.4	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-25.4	170.6	0	0	0	0	0	114.6	A356 N382 I383 P384 W388 W389 A390	A356-G386 VanDerWaalsContact CB-C 3.46Å; N382-G386 PolarHBondContact O-N 2.92Å; I383-G386 CarbonylContact O-C 3.45Å; I383-G386 VanDerWaalsContact O-CA 3.25Å; I383-G386 WeakPolarHBondContact O-CA 3.29Å; I383-G386 PolarHBondContact O-N 3.41Å; P384-G386 VanDerWaalsContact C-N 3.3Å; G386-W388 VanDerWaalsContact C-N 3.32Å; G386-W388 PolarHBondContact O-N 3.17Å; G386-W389 PolarHBondContact O-N 3.29Å; G386-A390 VanDerWaalsContact O-CB 3.31Å; G386-A390 WeakPolarHBondContact O-CB 3.48Å; G386-A390 PolarHBondContact O-N 3.41Å
387	F	97.9	Very high	94.3	Very high	73 Å²	73	49.1 Å²	49.1	32%	0.32	25%	0.251	S	S	.	.	H	α-helix	trans	-63.3	-37	174.9	-61.6	-25	0	0	0	112.2	V352 L353 A356 I383 P384 I385 A390 V391	V352-F387 HydrophobicContact CG1-CB 3.82Å; V352-F387 HydrophobicContact CG1-CD1 3.71Å; V352-F387 HydrophobicContact CG1-CG 3.96Å; L353-F387 HydrophobicContact CD1-CE1 3.93Å; L353-F387 HydrophobicContact CD1-CZ 4.09Å; A356-F387 HydrophobicContact CB-CD1 3.49Å; A356-F387 VanDerWaalsContact CB-CD1 3.49Å; A356-F387 HydrophobicContact CB-CE1 3.97Å; I383-F387 HydrophobicContact CG2-CD1 4.41Å; I383-F387 HydrophobicContact CG2-CE1 3.67Å; I383-F387 HydrophobicContact CG2-CZ 4.07Å; I383-F387 PolarHBondContact O-N 2.82Å; P384-F387 HydrophobicContact CB-CD2 4.32Å; P384-F387 HydrophobicContact CB-CE2 4.38Å; P384-F387 HydrophobicContact CG-CE2 4.49Å; P384-F387 VanDerWaalsContact O-CB 3.32Å; P384-F387 WeakPolarHBondContact O-CB 3.3Å; P384-F387 PolarHBondContact O-N 2.93Å; I385-F387 PolarHBondContact O-N 3.08Å; F387-A390 PolarHBondContact O-N 2.98Å; F387-V391 WeakPolarHBondContact O-CB 3.31Å; F387-V391 VanDerWaalsContact O-CG2 3.29Å; F387-V391 WeakPolarHBondContact O-CG2 3.25Å; F387-V391 PolarHBondContact O-N 3.16Å
388	W	97.6	Very high	95.1	Very high	124 Å²	124	48.6 Å²	48.6	47%	0.47	26%	0.263	S	S	.	.	H	α-helix	trans	-60.2	-54.1	177.2	169.5	-111.9	0	0	0	110.9	I385 G386 A390 V391 V392 Y399 D401	I385-W388 WeakPolarHBondContact O-CB 3.43Å; I385-W388 PolarHBondContact O-N 3.06Å; G386-W388 VanDerWaalsContact C-N 3.32Å; G386-W388 PolarHBondContact O-N 3.17Å; W388-A390 VanDerWaalsContact C-N 3.33Å; W388-A390 PolarHBondContact O-N 3.45Å; W388-V391 PolarHBondContact O-N 2.88Å; W388-V392 HydrophobicContact CD2-CG2 3.99Å; W388-V392 HydrophobicContact CE3-CG2 4.11Å; W388-V392 HydrophobicContact CH2-CG2 4.06Å; W388-V392 HydrophobicContact CZ2-CG2 3.91Å; W388-V392 HydrophobicContact CZ3-CG2 4.15Å; W388-V392 WeakPolarHBondContact O-CB 3.49Å; W388-V392 VanDerWaalsContact O-CG2 3.27Å; W388-V392 WeakPolarHBondContact O-CG2 3.45Å; W388-V392 PolarHBondContact O-N 2.65Å; W388-Y399 HydrophobicContact CH2-CD2 4.11Å; W388-Y399 AromaticContact CH2-CE2 3.68Å; W388-Y399 HydrophobicContact CH2-CE2 3.68Å; W388-Y399 AromaticContact CZ2-CD2 3.7Å; W388-Y399 HydrophobicContact CZ2-CD2 3.7Å; W388-Y399 AromaticContact CZ2-CE2 3.78Å; W388-Y399 HydrophobicContact CZ2-CE2 3.78Å; W388-D401 PolarHBondContact NE1-OD2 3.44Å
389	W	97.4	Very high	95.5	Very high	10 Å²	10	55.2 Å²	55.2	4%	0.038	29%	0.288	C	S	.	.	H	α-helix	trans	-57.8	-43.1	175	171.8	80.8	0	0	0	112.6	F355 I359 F380 G386 V392 T393 M402 P404 C416	F355-W389 HydrophobicContact CB-CZ3 4.41Å; I359-W389 HydrophobicContact CB-CE3 4.14Å; I359-W389 HydrophobicContact CB-CH2 4.06Å; I359-W389 HydrophobicContact CB-CZ3 3.62Å; I359-W389 HydrophobicContact CD1-CH2 3.64Å; I359-W389 HydrophobicContact CD1-CZ2 4.02Å; I359-W389 HydrophobicContact CD1-CZ3 4.11Å; I359-W389 HydrophobicContact CG1-CD2 4.45Å; I359-W389 HydrophobicContact CG1-CE3 4.04Å; I359-W389 HydrophobicContact CG1-CH2 3.69Å; I359-W389 HydrophobicContact CG1-CZ2 4.13Å; I359-W389 HydrophobicContact CG1-CZ3 3.65Å; I359-W389 HydrophobicContact CG2-CE3 3.78Å; I359-W389 HydrophobicContact CG2-CZ3 3.73Å; F380-W389 HydrophobicContact CE1-CB 3.66Å; F380-W389 AromaticContact CE1-CD2 3.61Å; F380-W389 HydrophobicContact CE1-CD2 3.61Å; F380-W389 AromaticContact CE1-CE3 3.83Å; F380-W389 HydrophobicContact CE1-CE3 3.83Å; F380-W389 AromaticContact CE1-CG 3.53Å; F380-W389 HydrophobicContact CE1-CG 3.53Å; F380-W389 HydrophobicContact CZ-CB 4.09Å; F380-W389 AromaticContact CZ-CD1 3.82Å; F380-W389 AromaticContact CZ-CD2 3.63Å; F380-W389 HydrophobicContact CZ-CD2 3.63Å; F380-W389 AromaticContact CZ-CE2 3.95Å; F380-W389 HydrophobicContact CZ-CE3 4.19Å; F380-W389 AromaticContact CZ-CG 3.54Å; F380-W389 HydrophobicContact CZ-CG 3.54Å; G386-W389 PolarHBondContact O-N 3.29Å; W389-V392 PolarHBondContact O-N 3.01Å; W389-T393 HydrophobicContact CZ2-CG2 4.28Å; W389-T393 PolarHBondContact NE1-OG1 2.89Å; W389-T393 VanDerWaalsContact O-CB 3.24Å; W389-T393 WeakPolarHBondContact O-CB 3.37Å; W389-T393 PolarHBondContact O-N 3.41Å; W389-T393 PolarHBondContact O-OG1 3.37Å; W389-M402 HydrophobicContact CB-CB 4.14Å; W389-M402 HydrophobicContact CB-CE 4.31Å; W389-M402 HydrophobicContact CB-SD 4.38Å; W389-M402 VanDerWaalsContact CD1-O 3.26Å; W389-M402 HydrophobicContact CG-CB 4.42Å; W389-P404 HydrophobicContact CZ2-CG 4.47Å; W389-C416 HydrophobicContact CH2-CB 4.02Å
390	A	97.6	Very high	95.8	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67	-40.9	-178.4	0	0	0	0	0	111.9	V352 F355 A356 G386 F387 W388 T393 M394	V352-A390 HydrophobicContact CB-CB 4.42Å; V352-A390 HydrophobicContact CG1-CB 4.23Å; V352-A390 HydrophobicContact CG2-CB 4.36Å; F355-A390 HydrophobicContact CB-CB 4.43Å; A356-A390 HydrophobicContact CB-CB 4.19Å; G386-A390 VanDerWaalsContact O-CB 3.31Å; G386-A390 WeakPolarHBondContact O-CB 3.48Å; G386-A390 PolarHBondContact O-N 3.41Å; F387-A390 PolarHBondContact O-N 2.98Å; W388-A390 VanDerWaalsContact C-N 3.33Å; W388-A390 PolarHBondContact O-N 3.45Å; A390-T393 PolarHBondContact O-N 3.32Å; A390-M394 VanDerWaalsContact O-CB 3.27Å; A390-M394 WeakPolarHBondContact O-CB 3.4Å; A390-M394 VanDerWaalsContact O-CG 3.3Å; A390-M394 WeakPolarHBondContact O-CG 3.27Å; A390-M394 PolarHBondContact O-N 2.9Å
391	V	97.6	Very high	95.8	Very high	55 Å²	55	57.8 Å²	57.8	33%	0.333	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-55.3	171.5	169.6	0	0	0	0	109.9	V352 F387 W388 T393 M394 T395	V352-V391 HydrophobicContact CG1-CG2 4.1Å; V352-V391 HydrophobicContact CG2-CB 4.46Å; V352-V391 HydrophobicContact CG2-CG2 3.57Å; F387-V391 WeakPolarHBondContact O-CB 3.31Å; F387-V391 VanDerWaalsContact O-CG2 3.29Å; F387-V391 WeakPolarHBondContact O-CG2 3.25Å; F387-V391 PolarHBondContact O-N 3.16Å; W388-V391 PolarHBondContact O-N 2.88Å; V391-T393 PolarHBondContact O-N 3.49Å; V391-M394 PolarHBondContact O-N 3.01Å; V391-T395 HydrophobicContact CG1-CG2 4.36Å; V391-T395 WeakPolarHBondContact O-CB 3.43Å; V391-T395 WeakPolarHBondContact O-CG2 3.5Å; V391-T395 PolarHBondContact O-N 3.48Å; V391-T395 PolarHBondContact O-OG1 2.83Å
392	V	97.5	Very high	96	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-32.6	-177.8	169.2	0	0	0	0	112.7	W388 W389 L397 G398 Y399	W388-V392 HydrophobicContact CD2-CG2 3.99Å; W388-V392 HydrophobicContact CE3-CG2 4.11Å; W388-V392 HydrophobicContact CH2-CG2 4.06Å; W388-V392 HydrophobicContact CZ2-CG2 3.91Å; W388-V392 HydrophobicContact CZ3-CG2 4.15Å; W388-V392 WeakPolarHBondContact O-CB 3.49Å; W388-V392 VanDerWaalsContact O-CG2 3.27Å; W388-V392 WeakPolarHBondContact O-CG2 3.45Å; W388-V392 PolarHBondContact O-N 2.65Å; W389-V392 PolarHBondContact O-N 3.01Å; V392-L397 HydrophobicContact CG1-CB 4.15Å; V392-L397 PolarHBondContact O-N 2.99Å; V392-G398 PolarHBondContact O-N 3.41Å; V392-G398 VanDerWaalsContact O-N 3.09Å; V392-Y399 HydrophobicContact CB-CD2 4.34Å; V392-Y399 HydrophobicContact CG1-CD2 3.64Å; V392-Y399 HydrophobicContact CG1-CE2 4.32Å; V392-Y399 HydrophobicContact CG1-CG 4.17Å; V392-Y399 HydrophobicContact CG2-CD2 3.65Å; V392-Y399 HydrophobicContact CG2-CE2 3.78Å
393	T	97.2	Very high	96.1	Very high	23 Å²	23	56.3 Å²	56.3	14%	0.141	30%	0.304	C	S	.	.	H	α-helix	trans	-80.1	-46.9	177	-55.7	0	0	0	0	111.9	W389 A390 V391 T395 T396 C416 A417	W389-T393 HydrophobicContact CZ2-CG2 4.28Å; W389-T393 PolarHBondContact NE1-OG1 2.89Å; W389-T393 VanDerWaalsContact O-CB 3.24Å; W389-T393 WeakPolarHBondContact O-CB 3.37Å; W389-T393 PolarHBondContact O-N 3.41Å; W389-T393 PolarHBondContact O-OG1 3.37Å; A390-T393 PolarHBondContact O-N 3.32Å; V391-T393 PolarHBondContact O-N 3.49Å; T393-T395 VanDerWaalsContact C-N 3.33Å; T393-T395 PolarHBondContact O-N 3.49Å; T393-T396 PolarHBondContact O-N 2.97Å; T393-T396 VanDerWaalsContact O-N 3.1Å; T393-C416 HydrophobicContact CG2-CB 4.08Å; T393-A417 HydrophobicContact CG2-CB 4.12Å
394	M	96.3	Very high	96	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-66.8	-33	179.9	-74.6	-172.7	70.6	0	0	112.8	L348 V352 F355 A390 V391 T396 G420 T423	L348-M394 HydrophobicContact CD1-CB 3.99Å; L348-M394 HydrophobicContact CD1-CE 4.01Å; L348-M394 HydrophobicContact CD1-SD 4.2Å; V352-M394 HydrophobicContact CG2-SD 4.06Å; F355-M394 HydrophobicContact CD2-CG 4.46Å; F355-M394 HydrophobicContact CD2-SD 3.95Å; A390-M394 VanDerWaalsContact O-CB 3.27Å; A390-M394 WeakPolarHBondContact O-CB 3.4Å; A390-M394 VanDerWaalsContact O-CG 3.3Å; A390-M394 WeakPolarHBondContact O-CG 3.27Å; A390-M394 PolarHBondContact O-N 2.9Å; V391-M394 PolarHBondContact O-N 3.01Å; M394-T396 PolarHBondContact O-N 3.25Å; M394-G420 CarbonylContact O-C 3.6Å; M394-G420 VanDerWaalsContact O-CA 3.25Å; M394-G420 WeakPolarHBondContact O-CA 3.3Å; M394-T423 HydrophobicContact CE-CG2 4.46Å
395	T	95.9	Very high	95.7	Very high	36 Å²	36	55.8 Å²	55.8	22%	0.221	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	11	173.9	66.6	0	0	0	0	113.4	V391 T393 L397 I424	V391-T395 HydrophobicContact CG1-CG2 4.36Å; V391-T395 WeakPolarHBondContact O-CB 3.43Å; V391-T395 WeakPolarHBondContact O-CG2 3.5Å; V391-T395 PolarHBondContact O-N 3.48Å; V391-T395 PolarHBondContact O-OG1 2.83Å; T393-T395 VanDerWaalsContact C-N 3.33Å; T393-T395 PolarHBondContact O-N 3.49Å; T395-L397 PolarHBondContact O-N 2.94Å; T395-L397 WeakPolarHBondContact OG1-CD1 3.36Å; T395-L397 WeakPolarHBondContact OG1-CG 3.27Å; T395-I424 HydrophobicContact CG2-CD1 4.35Å
396	T	95.9	Very high	95.5	Very high	97 Å²	97	53.4 Å²	53.4	60%	0.595	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	21.7	179	64.3	0	0	0	0	116.3	T393 M394 V421	T393-T396 PolarHBondContact O-N 2.97Å; T393-T396 VanDerWaalsContact O-N 3.1Å; M394-T396 PolarHBondContact O-N 3.25Å; T396-V421 HydrophobicContact CG2-CG2 3.55Å
397	L	96.8	Very high	95.3	Very high	96 Å²	96	59.1 Å²	59.1	50%	0.503	32%	0.318	S	S	.	.			trans	-73.4	-41.7	178.7	-70.1	172.9	0	0	0	112.4	V392 T395 Y399	V392-L397 HydrophobicContact CG1-CB 4.15Å; V392-L397 PolarHBondContact O-N 2.99Å; T395-L397 PolarHBondContact O-N 2.94Å; T395-L397 WeakPolarHBondContact OG1-CD1 3.36Å; T395-L397 WeakPolarHBondContact OG1-CG 3.27Å; L397-Y399 HydrophobicContact CD1-CE2 4.33Å; L397-Y399 PolarHBondContact O-N 3.2Å
398	G	95.3	Very high	95	Very high	54 Å²	54	61.4 Å²	61.4	56%	0.557	33%	0.328	S	S	*	.			trans	55.7	45.4	168.3	0	0	0	0	0	116.5	V392 G400	V392-G398 PolarHBondContact O-N 3.41Å; V392-G398 VanDerWaalsContact O-N 3.09Å; G398-G400 PolarHBondContact O-N 2.96Å
399	Y	95.4	Very high	94.9	Very high	144 Å²	144	55.5 Å²	55.5	57%	0.565	31%	0.306	S	S	*	.			trans	-54.9	-24.6	-176.6	-64.5	-54.4	0	0	0	115.4	W388 V392 L397 D401	W388-Y399 HydrophobicContact CH2-CD2 4.11Å; W388-Y399 AromaticContact CH2-CE2 3.68Å; W388-Y399 HydrophobicContact CH2-CE2 3.68Å; W388-Y399 AromaticContact CZ2-CD2 3.7Å; W388-Y399 HydrophobicContact CZ2-CD2 3.7Å; W388-Y399 AromaticContact CZ2-CE2 3.78Å; W388-Y399 HydrophobicContact CZ2-CE2 3.78Å; V392-Y399 HydrophobicContact CB-CD2 4.34Å; V392-Y399 HydrophobicContact CG1-CD2 3.64Å; V392-Y399 HydrophobicContact CG1-CE2 4.32Å; V392-Y399 HydrophobicContact CG1-CG 4.17Å; V392-Y399 HydrophobicContact CG2-CD2 3.65Å; V392-Y399 HydrophobicContact CG2-CE2 3.78Å; L397-Y399 HydrophobicContact CD1-CE2 4.33Å; L397-Y399 PolarHBondContact O-N 3.2Å; Y399-D401 VanDerWaalsContact C-N 3.26Å; Y399-D401 PolarHBondContact O-N 3.24Å
400	G	94.1	Very high	94.8	Very high	47 Å²	47	60.1 Å²	60.1	49%	0.485	33%	0.329	S	S	.	.	S	Bend	trans	77.9	4.3	177.3	0	0	0	0	0	115.1	G398 M402	G398-G400 PolarHBondContact O-N 2.96Å; G400-M402 VanDerWaalsContact C-N 3.33Å
401	D	93.9	Very high	94.8	Very high	74 Å²	74	65.2 Å²	65.2	40%	0.396	36%	0.356	S	S	.	.	S	Bend	trans	-68.5	-32.6	172.1	66.9	-46.3	0	0	0	112.2	Q379 W388 Y399	Q379-D401 PolarHBondContact NE2-O 2.89Å; W388-D401 PolarHBondContact NE1-OD2 3.44Å; Y399-D401 VanDerWaalsContact C-N 3.26Å; Y399-D401 PolarHBondContact O-N 3.24Å
402	M	93.7	Very high	94.7	Very high	20 Å²	20	63.2 Å²	63.2	10%	0.099	34%	0.344	C	S	.	.	S	Bend	trans	-125.4	135.4	169.5	-71	-168.8	63.7	0	0	111.3	Q379 F380 I385 W389 G400	Q379-M402 HydrophobicContact CB-CE 3.94Å; Q379-M402 HydrophobicContact CB-CG 4.42Å; F380-M402 HydrophobicContact CD1-CE 3.61Å; F380-M402 HydrophobicContact CD2-CE 4.34Å; F380-M402 HydrophobicContact CE1-CE 3.62Å; F380-M402 HydrophobicContact CE2-CE 4.34Å; F380-M402 HydrophobicContact CG-CE 4.01Å; F380-M402 HydrophobicContact CZ-CE 4Å; I385-M402 HydrophobicContact CG2-CE 3.89Å; I385-M402 HydrophobicContact CG2-SD 3.86Å; W389-M402 HydrophobicContact CB-CB 4.14Å; W389-M402 HydrophobicContact CB-CE 4.31Å; W389-M402 HydrophobicContact CB-SD 4.38Å; W389-M402 VanDerWaalsContact CD1-O 3.26Å; W389-M402 HydrophobicContact CG-CB 4.42Å; G400-M402 VanDerWaalsContact C-N 3.33Å
403	Y	93.7	Very high	94.7	Very high	126 Å²	126	63.6 Å²	63.6	49%	0.494	35%	0.348	S	S	.	.			trans	-155.2	152.3	174.4	59.1	-89.1	0	0	0	112.2	Q405	Y403-Q405 HydrophobicContact CD2-CG 4.24Å; Y403-Q405 HydrophobicContact CE2-CG 3.94Å
404	P	93.7	Very high	94.7	Very high	18 Å²	18	65.4 Å²	65.4	12%	0.117	37%	0.366	C	S	.	.			trans	-72.4	141.5	174.4	26.8	-32.3	0	0	0	113	I359 E363 W389 G409	I359-P404 HydrophobicContact CD1-CB 3.84Å; I359-P404 HydrophobicContact CD1-CG 4.21Å; E363-P404 HydrophobicContact CG-CB 4.27Å; E363-P404 WeakPolarHBondContact OE1-CB 3.47Å; E363-P404 WeakPolarHBondContact OE2-CA 3.32Å; W389-P404 HydrophobicContact CZ2-CG 4.47Å; P404-G409 WeakPolarHBondContact CG-O 3.32Å
405	Q	90.4	Very high	94.8	Very high	101 Å²	101	69.4 Å²	69.4	47%	0.472	39%	0.386	S	S	.	.			trans	-108.9	-21.4	-180	-54	-169.2	14.7	0	0	112.8	E363 Y403	E363-Q405 VanDerWaalsContact CD-N 3.32Å; E363-Q405 PolarHBondContact OE1-N 3.1Å; E363-Q405 VanDerWaalsContact OE1-N 3.13Å; E363-Q405 PolarHBondContact OE2-N 3.44Å; Y403-Q405 HydrophobicContact CD2-CG 4.24Å; Y403-Q405 HydrophobicContact CE2-CG 3.94Å
406	T	91.8	Very high	94.8	Very high	18 Å²	18	67.7 Å²	67.7	11%	0.11	38%	0.376	C	S	.	.	S	Bend	trans	-85.8	150.9	177.5	70.1	0	0	0	0	111.9	A362 E363 F408 G409 M410	A362-T406 PolarHBondContact O-OG1 3.35Å; E363-T406 VanDerWaalsContact OE1-CB 3.31Å; E363-T406 WeakPolarHBondContact OE1-CB 3.32Å; E363-T406 WeakPolarHBondContact OE1-CG2 3.15Å; E363-T406 PolarHBondContact OE1-N 3.45Å; E363-T406 PolarHBondContact OE1-OG1 3.13Å; T406-F408 PolarHBondContact O-N 3.47Å; T406-G409 PolarHBondContact O-N 3.38Å; T406-G409 VanDerWaalsContact O-N 3.08Å; T406-G409 PolarHBondContact OG1-N 3.2Å; T406-M410 WeakPolarHBondContact O-CG 3.31Å; T406-M410 PolarHBondContact O-N 3.38Å
407	T	91.7	Very high	94.9	Very high	120 Å²	120	64.8 Å²	64.8	74%	0.736	36%	0.362	S	S	*	.	H	α-helix	trans	-58.1	-35.3	175.9	-42.6	0	0	0	0	112.6	L411	T407-L411 PolarHBondContact O-N 2.87Å
408	F	92.6	Very high	94.9	Very high	122 Å²	122	65.2 Å²	65.2	54%	0.535	36%	0.364	S	S	.	.	H	α-helix	trans	-70.6	-42.2	174.9	-69	-69.6	0	0	0	111.6	A362 I365 T406 M410 L411 V412	A362-F408 HydrophobicContact CB-CB 4.11Å; I365-F408 HydrophobicContact CB-CD2 4.41Å; I365-F408 HydrophobicContact CD1-CD2 4.4Å; I365-F408 HydrophobicContact CD1-CG 4.49Å; I365-F408 HydrophobicContact CG2-CD2 4.05Å; I365-F408 HydrophobicContact CG2-CE2 4.12Å; T406-F408 PolarHBondContact O-N 3.47Å; F408-M410 VanDerWaalsContact C-N 3.34Å; F408-M410 PolarHBondContact O-N 3.35Å; F408-L411 WeakPolarHBondContact O-CB 3.29Å; F408-L411 PolarHBondContact O-N 2.86Å; F408-V412 WeakPolarHBondContact O-CG2 3.25Å; F408-V412 PolarHBondContact O-N 2.88Å
409	G	94.5	Very high	95	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63	-38.6	174.7	0	0	0	0	0	112.7	I359 P404 T406 L411 V412 G413	I359-G409 WeakPolarHBondContact CD1-O 3.49Å; P404-G409 WeakPolarHBondContact CG-O 3.32Å; T406-G409 PolarHBondContact O-N 3.38Å; T406-G409 VanDerWaalsContact O-N 3.08Å; T406-G409 PolarHBondContact OG1-N 3.2Å; G409-L411 PolarHBondContact O-N 3.46Å; G409-V412 PolarHBondContact O-N 3.49Å; G409-G413 PolarHBondContact O-N 3.41Å
410	M	95.2	Very high	95	Very high	107 Å²	107	57.1 Å²	57.1	53%	0.527	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-41.2	173.4	-69	176.4	-173.9	0	0	112	T406 F408 G413 A414	T406-M410 WeakPolarHBondContact O-CG 3.31Å; T406-M410 PolarHBondContact O-N 3.38Å; F408-M410 VanDerWaalsContact C-N 3.34Å; F408-M410 PolarHBondContact O-N 3.35Å; M410-G413 PolarHBondContact O-N 3.49Å; M410-A414 PolarHBondContact O-N 3.45Å
411	L	96.7	Very high	95.1	Very high	106 Å²	106	58.4 Å²	58.4	56%	0.555	32%	0.32	S	S	*	.	H	α-helix	trans	-63.8	-43.5	173.9	179.3	63.1	0	0	0	111.7	T407 F408 G409 G413 A414 L415	T407-L411 PolarHBondContact O-N 2.87Å; F408-L411 WeakPolarHBondContact O-CB 3.29Å; F408-L411 PolarHBondContact O-N 2.86Å; G409-L411 PolarHBondContact O-N 3.46Å; L411-G413 VanDerWaalsContact C-N 3.33Å; L411-G413 PolarHBondContact O-N 3.35Å; L411-A414 PolarHBondContact O-N 3.16Å; L411-L415 HydrophobicContact CG-CD1 4.4Å; L411-L415 WeakPolarHBondContact O-CG 3.31Å; L411-L415 PolarHBondContact O-N 3.18Å; L411-L415 VanDerWaalsContact O-N 3.08Å
412	V	97.2	Very high	95.1	Very high	14 Å²	14	60.2 Å²	60.2	9%	0.085	33%	0.329	C	S	.	.	H	α-helix	trans	-63.1	-39	174.5	174.8	0	0	0	0	111.2	F355 M358 I359 A362 F408 G409 L415 C416	F355-V412 HydrophobicContact CD1-CG1 4.19Å; M358-V412 HydrophobicContact CB-CG1 3.73Å; M358-V412 HydrophobicContact CB-CG2 4.34Å; M358-V412 HydrophobicContact CE-CG1 4.37Å; M358-V412 HydrophobicContact CE-CG2 4.1Å; I359-V412 HydrophobicContact CB-CG1 4.23Å; I359-V412 HydrophobicContact CD1-CB 3.98Å; I359-V412 HydrophobicContact CD1-CG1 3.93Å; A362-V412 HydrophobicContact CB-CG2 4.13Å; F408-V412 WeakPolarHBondContact O-CG2 3.25Å; F408-V412 PolarHBondContact O-N 2.88Å; G409-V412 PolarHBondContact O-N 3.49Å; V412-L415 PolarHBondContact O-N 3.1Å; V412-C416 WeakPolarHBondContact O-CB 3.21Å; V412-C416 PolarHBondContact O-N 2.89Å
413	G	96.7	Very high	95.1	Very high	11 Å²	11	60.7 Å²	60.7	11%	0.113	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-43.2	175.1	0	0	0	0	0	113.3	G409 M410 L411 C416 A417	G409-G413 PolarHBondContact O-N 3.41Å; M410-G413 PolarHBondContact O-N 3.49Å; L411-G413 VanDerWaalsContact C-N 3.33Å; L411-G413 PolarHBondContact O-N 3.35Å; G413-C416 WeakPolarHBondContact O-CB 3.01Å; G413-C416 PolarHBondContact O-N 2.88Å; G413-A417 PolarHBondContact O-N 3.38Å
414	A	97.3	Very high	95	Very high	62 Å²	62	57.2 Å²	57.2	51%	0.512	32%	0.323	S	S	.	.	H	α-helix	trans	-62.9	-41.9	175.1	0	0	0	0	0	112.2	M410 L411 L418	M410-A414 PolarHBondContact O-N 3.45Å; L411-A414 PolarHBondContact O-N 3.16Å; A414-L418 WeakPolarHBondContact O-CB 3.24Å; A414-L418 PolarHBondContact O-N 3.18Å
415	L	97.4	Very high	94.9	Very high	84 Å²	84	59.1 Å²	59.1	44%	0.44	34%	0.34	S	S	.	.	H	α-helix	trans	-66.9	-39.2	174.7	-67.8	170.9	0	0	0	112.2	F355 L411 V412 L418 A419	F355-L415 HydrophobicContact CE1-CB 4.12Å; L411-L415 HydrophobicContact CG-CD1 4.4Å; L411-L415 WeakPolarHBondContact O-CG 3.31Å; L411-L415 PolarHBondContact O-N 3.18Å; L411-L415 VanDerWaalsContact O-N 3.08Å; V412-L415 PolarHBondContact O-N 3.1Å; L415-L418 PolarHBondContact O-N 3.03Å; L415-A419 VanDerWaalsContact O-CB 3.24Å; L415-A419 WeakPolarHBondContact O-CB 3.34Å; L415-A419 PolarHBondContact O-N 2.96Å
416	C	97.9	Very high	94.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-61.1	-48.8	176.7	-177.5	0	0	0	0	111.8	F355 W389 T393 V412 G413 A419 G420	F355-C416 HydrophobicContact CB-CB 4.1Å; F355-C416 HydrophobicContact CD1-CB 3.62Å; F355-C416 HydrophobicContact CD2-CB 4.12Å; F355-C416 HydrophobicContact CE1-CB 4.06Å; F355-C416 HydrophobicContact CG-CB 3.67Å; F355-C416 HydrophobicContact CZ-CB 4.5Å; W389-C416 HydrophobicContact CH2-CB 4.02Å; T393-C416 HydrophobicContact CG2-CB 4.08Å; V412-C416 WeakPolarHBondContact O-CB 3.21Å; V412-C416 PolarHBondContact O-N 2.89Å; G413-C416 WeakPolarHBondContact O-CB 3.01Å; G413-C416 PolarHBondContact O-N 2.88Å; C416-A419 PolarHBondContact O-N 3.26Å; C416-G420 PolarHBondContact O-N 2.81Å
417	A	97.2	Very high	94.5	Very high	36 Å²	36	60.2 Å²	60.2	30%	0.298	35%	0.346	S	S	.	.	H	α-helix	trans	-62.4	-45.3	177.8	0	0	0	0	0	112.1	T393 G413 G420 V421	T393-A417 HydrophobicContact CG2-CB 4.12Å; G413-A417 PolarHBondContact O-N 3.38Å; A417-G420 PolarHBondContact O-N 3.23Å; A417-V421 WeakPolarHBondContact O-CG2 3.45Å; A417-V421 PolarHBondContact O-N 3.32Å; A417-V421 VanDerWaalsContact O-N 3.1Å
418	L	96.8	Very high	94.4	Very high	106 Å²	106	57.4 Å²	57.4	56%	0.555	33%	0.329	S	S	*	.	H	α-helix	trans	-62.7	-45.9	177.4	178.8	60.8	0	0	0	112	A414 L415 G420 V421 L422	A414-L418 WeakPolarHBondContact O-CB 3.24Å; A414-L418 PolarHBondContact O-N 3.18Å; L415-L418 PolarHBondContact O-N 3.03Å; L418-G420 VanDerWaalsContact C-N 3.34Å; L418-G420 PolarHBondContact O-N 2.91Å; L418-V421 PolarHBondContact O-N 3.09Å; L418-L422 HydrophobicContact CD1-CD1 4.22Å; L418-L422 HydrophobicContact CG-CD1 4.19Å; L418-L422 WeakPolarHBondContact O-CG 3.42Å; L418-L422 PolarHBondContact O-N 3.04Å; L418-L422 VanDerWaalsContact O-N 3.16Å
419	A	96.7	Very high	94.2	Very high	27 Å²	27	55.2 Å²	55.2	22%	0.223	33%	0.327	C	S	.	.	H	α-helix	trans	-65.1	-36.8	177.5	0	0	0	0	0	112.1	F355 L415 C416 L422 T423	F355-A419 HydrophobicContact CE2-CB 3.55Å; F355-A419 HydrophobicContact CZ-CB 3.58Å; L415-A419 VanDerWaalsContact O-CB 3.24Å; L415-A419 WeakPolarHBondContact O-CB 3.34Å; L415-A419 PolarHBondContact O-N 2.96Å; C416-A419 PolarHBondContact O-N 3.26Å; A419-L422 PolarHBondContact O-N 2.93Å; A419-T423 VanDerWaalsContact O-CB 3.29Å; A419-T423 WeakPolarHBondContact O-CB 3.27Å; A419-T423 PolarHBondContact O-N 2.95Å; A419-T423 PolarHBondContact O-OG1 3.09Å
420	G	96.2	Very high	93.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.6	-49.2	175.6	0	0	0	0	0	113	M394 C416 A417 L418 L422 T423 I424	M394-G420 CarbonylContact O-C 3.6Å; M394-G420 VanDerWaalsContact O-CA 3.25Å; M394-G420 WeakPolarHBondContact O-CA 3.3Å; C416-G420 PolarHBondContact O-N 2.81Å; A417-G420 PolarHBondContact O-N 3.23Å; L418-G420 VanDerWaalsContact C-N 3.34Å; L418-G420 PolarHBondContact O-N 2.91Å; G420-L422 PolarHBondContact O-N 2.79Å; G420-T423 WeakPolarHBondContact O-CB 3.41Å; G420-T423 PolarHBondContact O-N 2.75Å; G420-I424 WeakPolarHBondContact O-CG1 3.24Å; G420-I424 PolarHBondContact O-N 2.85Å
421	V	95.6	Very high	93.2	Very high	74 Å²	74	54.4 Å²	54.4	45%	0.448	33%	0.326	S	S	.	.	H	α-helix	trans	-56.1	-48.9	175.4	171.8	0	0	0	0	111.2	T396 A417 L418 T423 I424 A425	T396-V421 HydrophobicContact CG2-CG2 3.55Å; A417-V421 WeakPolarHBondContact O-CG2 3.45Å; A417-V421 PolarHBondContact O-N 3.32Å; A417-V421 VanDerWaalsContact O-N 3.1Å; L418-V421 PolarHBondContact O-N 3.09Å; V421-T423 VanDerWaalsContact C-N 3.35Å; V421-T423 PolarHBondContact O-N 2.89Å; V421-I424 PolarHBondContact O-N 3.36Å; V421-A425 WeakPolarHBondContact O-CB 3.48Å; V421-A425 PolarHBondContact O-N 3.27Å
422	L	93.8	Very high	92.8	Very high	112 Å²	112	53.7 Å²	53.7	59%	0.586	33%	0.326	S	S	*	.	H	α-helix	trans	-64	-38.8	178.7	-67.3	168.8	0	0	0	112.4	L418 A419 G420 I424 A425 M426	L418-L422 HydrophobicContact CD1-CD1 4.22Å; L418-L422 HydrophobicContact CG-CD1 4.19Å; L418-L422 WeakPolarHBondContact O-CG 3.42Å; L418-L422 PolarHBondContact O-N 3.04Å; L418-L422 VanDerWaalsContact O-N 3.16Å; A419-L422 PolarHBondContact O-N 2.93Å; G420-L422 PolarHBondContact O-N 2.79Å; L422-I424 PolarHBondContact O-N 3.5Å; L422-A425 PolarHBondContact O-N 2.75Å; L422-M426 PolarHBondContact O-N 3.28Å
423	T	93.3	Very high	92.2	Very high	30 Å²	30	57.7 Å²	57.7	18%	0.184	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-40.3	178.2	-59.6	0	0	0	0	112	L344 F347 M394 A419 G420 V421 P427	L344-T423 HydrophobicContact CD1-CG2 4.46Å; F347-T423 HydrophobicContact CB-CG2 3.72Å; M394-T423 HydrophobicContact CE-CG2 4.46Å; A419-T423 VanDerWaalsContact O-CB 3.29Å; A419-T423 WeakPolarHBondContact O-CB 3.27Å; A419-T423 PolarHBondContact O-N 2.95Å; A419-T423 PolarHBondContact O-OG1 3.09Å; G420-T423 WeakPolarHBondContact O-CB 3.41Å; G420-T423 PolarHBondContact O-N 2.75Å; V421-T423 VanDerWaalsContact C-N 3.35Å; V421-T423 PolarHBondContact O-N 2.89Å; T423-P427 WeakPolarHBondContact O-CD 3.28Å
424	I	92.6	Very high	91.4	Very high	54 Å²	54	58.7 Å²	58.7	28%	0.277	35%	0.35	S	S	.	.	H	α-helix	trans	-80.9	-37	-179.9	-64.7	170.5	0	0	0	111.1	L344 T395 G420 V421 L422 M426 P427 V428	L344-I424 HydrophobicContact CD1-CG1 4.46Å; T395-I424 HydrophobicContact CG2-CD1 4.35Å; G420-I424 WeakPolarHBondContact O-CG1 3.24Å; G420-I424 PolarHBondContact O-N 2.85Å; V421-I424 PolarHBondContact O-N 3.36Å; L422-I424 PolarHBondContact O-N 3.5Å; I424-M426 VanDerWaalsContact C-N 3.28Å; I424-M426 PolarHBondContact O-N 3.49Å; I424-P427 WeakPolarHBondContact O-CD 3.45Å; I424-V428 HydrophobicContact CG2-CG2 3.99Å; I424-V428 WeakPolarHBondContact O-CB 3.29Å; I424-V428 VanDerWaalsContact O-CG2 3.25Å; I424-V428 WeakPolarHBondContact O-CG2 3.21Å
425	A	91.3	Very high	90.6	Very high	58 Å²	58	59 Å²	59	48%	0.479	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-21.9	-176.2	0	0	0	0	0	114.5	V421 L422 P429	V421-A425 WeakPolarHBondContact O-CB 3.48Å; V421-A425 PolarHBondContact O-N 3.27Å; L422-A425 PolarHBondContact O-N 2.75Å; A425-P429 WeakPolarHBondContact O-CD 3.14Å; A425-P429 VanDerWaalsContact O-CG 3.29Å; A425-P429 WeakPolarHBondContact O-CG 3.44Å
426	M	86.7	Confident	89.9	Confident	135 Å²	135	56.8 Å²	56.8	67%	0.665	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-49.8	-179.1	177.2	179.9	178.8	0	0	114	L422 I424	L422-M426 PolarHBondContact O-N 3.28Å; I424-M426 VanDerWaalsContact C-N 3.28Å; I424-M426 PolarHBondContact O-N 3.49Å
427	P	86.8	Confident	89	Confident	7 Å²	7	59.2 Å²	59.2	5%	0.045	35%	0.349	C	S	.	.	H	α-helix	trans	-81.4	-29.7	-176.7	-18.4	36	0	0	0	113.9	L344 T423 I424 V430 I431	L344-P427 HydrophobicContact CB-CB 4.09Å; L344-P427 HydrophobicContact CB-CG 3.99Å; L344-P427 HydrophobicContact CD1-CG 4Å; L344-P427 HydrophobicContact CG-CG 4.48Å; T423-P427 WeakPolarHBondContact O-CD 3.28Å; I424-P427 WeakPolarHBondContact O-CD 3.45Å; P427-V430 WeakPolarHBondContact O-CB 3.22Å; P427-V430 PolarHBondContact O-N 2.97Å; P427-V430 VanDerWaalsContact O-N 3.16Å; P427-I431 HydrophobicContact CB-CD1 4.42Å; P427-I431 WeakPolarHBondContact O-CG1 3.44Å; P427-I431 PolarHBondContact O-N 2.91Å; P427-I431 VanDerWaalsContact O-N 3.15Å
428	V	89.4	Confident	88	Confident	61 Å²	61	59.3 Å²	59.3	37%	0.37	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-44.2	-174.9	169.9	0	0	0	0	113.2	I424 V430 I431 V432	I424-V428 HydrophobicContact CG2-CG2 3.99Å; I424-V428 WeakPolarHBondContact O-CB 3.29Å; I424-V428 VanDerWaalsContact O-CG2 3.25Å; I424-V428 WeakPolarHBondContact O-CG2 3.21Å; V428-V430 VanDerWaalsContact C-N 3.3Å; V428-V430 PolarHBondContact O-N 2.93Å; V428-I431 PolarHBondContact O-N 3.17Å; V428-V432 HydrophobicContact CG1-CG2 4.21Å; V428-V432 VanDerWaalsContact O-CG2 3.31Å; V428-V432 WeakPolarHBondContact O-CG2 3.45Å; V428-V432 PolarHBondContact O-N 3.49Å
429	P	89.8	Confident	87.2	Confident	76 Å²	76	59 Å²	59	49%	0.494	33%	0.334	S	S	.	.	H	α-helix	trans	-60.5	-35	175.8	-26.2	36.3	0	0	0	113.9	A425 V432 N433	A425-P429 WeakPolarHBondContact O-CD 3.14Å; A425-P429 VanDerWaalsContact O-CG 3.29Å; A425-P429 WeakPolarHBondContact O-CG 3.44Å; P429-V432 PolarHBondContact O-N 3.06Å; P429-N433 WeakPolarHBondContact O-CB 3.34Å; P429-N433 PolarHBondContact O-N 2.88Å
430	V	84.8	Confident	86.3	Confident	68 Å²	68	60.9 Å²	60.9	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-66.2	-47.8	177.5	-175.8	0	0	0	0	110.2	E340 P427 V428 V432 N433 N434	E340-V430 HydrophobicContact CG-CG1 4.14Å; P427-V430 WeakPolarHBondContact O-CB 3.22Å; P427-V430 PolarHBondContact O-N 2.97Å; P427-V430 VanDerWaalsContact O-N 3.16Å; V428-V430 VanDerWaalsContact C-N 3.3Å; V428-V430 PolarHBondContact O-N 2.93Å; V430-V432 VanDerWaalsContact C-N 3.33Å; V430-V432 PolarHBondContact O-N 3.38Å; V430-N433 PolarHBondContact O-N 3.44Å; V430-N434 VanDerWaalsContact O-CG 3.26Å; V430-N434 PolarHBondContact O-N 3.46Å
431	I	84.4	Confident	85.3	Confident	21 Å²	21	63 Å²	63	11%	0.108	36%	0.356	C	S	.	.	H	α-helix	trans	-59.6	-42.8	176.3	-66.9	160.8	0	0	0	111.1	E340 F341 P427 V428 N434 F435	E340-I431 HydrophobicContact CB-CD1 4.38Å; E340-I431 HydrophobicContact CB-CG1 4.05Å; F341-I431 HydrophobicContact CD1-CD1 4.04Å; F341-I431 HydrophobicContact CD2-CD1 4.11Å; F341-I431 HydrophobicContact CD2-CG1 4.37Å; F341-I431 HydrophobicContact CE1-CD1 3.89Å; F341-I431 HydrophobicContact CE2-CB 4.49Å; F341-I431 HydrophobicContact CE2-CD1 3.92Å; F341-I431 HydrophobicContact CE2-CG1 4.03Å; F341-I431 HydrophobicContact CE2-CG2 3.63Å; F341-I431 HydrophobicContact CG-CD1 4.16Å; F341-I431 HydrophobicContact CZ-CD1 3.83Å; F341-I431 HydrophobicContact CZ-CG1 4.29Å; F341-I431 HydrophobicContact CZ-CG2 3.55Å; P427-I431 HydrophobicContact CB-CD1 4.42Å; P427-I431 WeakPolarHBondContact O-CG1 3.44Å; P427-I431 PolarHBondContact O-N 2.91Å; P427-I431 VanDerWaalsContact O-N 3.15Å; V428-I431 PolarHBondContact O-N 3.17Å; I431-N434 PolarHBondContact O-N 2.84Å; I431-F435 WeakPolarHBondContact O-CB 3.37Å; I431-F435 PolarHBondContact O-N 2.95Å
432	V	87.1	Confident	84.2	Confident	91 Å²	91	59.8 Å²	59.8	55%	0.552	34%	0.338	S	S	*	.	H	α-helix	trans	-67	-40.6	178.1	169.9	0	0	0	0	111.7	V428 P429 V430 F435 G436	V428-V432 HydrophobicContact CG1-CG2 4.21Å; V428-V432 VanDerWaalsContact O-CG2 3.31Å; V428-V432 WeakPolarHBondContact O-CG2 3.45Å; V428-V432 PolarHBondContact O-N 3.49Å; P429-V432 PolarHBondContact O-N 3.06Å; V430-V432 VanDerWaalsContact C-N 3.33Å; V430-V432 PolarHBondContact O-N 3.38Å; V432-F435 PolarHBondContact O-N 2.87Å; V432-G436 PolarHBondContact O-N 2.78Å
433	N	84.8	Confident	83.4	Confident	99 Å²	99	56.4 Å²	56.4	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-61.9	-48.8	175.1	-177.6	75.7	0	0	0	111.3	P429 V430 F435 G436 M437	P429-N433 WeakPolarHBondContact O-CB 3.34Å; P429-N433 PolarHBondContact O-N 2.88Å; V430-N433 PolarHBondContact O-N 3.44Å; N433-F435 VanDerWaalsContact C-N 3.33Å; N433-F435 PolarHBondContact O-N 3.36Å; N433-G436 WeakPolarHBondContact O-CA 3.33Å; N433-G436 PolarHBondContact O-N 3.3Å; N433-M437 WeakPolarHBondContact O-CG 3.37Å; N433-M437 PolarHBondContact O-N 3.41Å
434	N	80.8	Confident	82.6	Confident	32 Å²	32	57 Å²	57	17%	0.171	33%	0.328	C	S	.	.	H	α-helix	trans	-59.5	-43.5	177.8	-67.8	-8.7	0	0	0	111.4	S337 E340 V430 I431 G436 M437 Y438	S337-N434 PolarHBondContact OG-ND2 3.47Å; E340-N434 PolarHBondContact OE1-ND2 3.21Å; V430-N434 VanDerWaalsContact O-CG 3.26Å; V430-N434 PolarHBondContact O-N 3.46Å; I431-N434 PolarHBondContact O-N 2.84Å; N434-G436 VanDerWaalsContact C-N 3.35Å; N434-G436 PolarHBondContact O-N 3.09Å; N434-M437 PolarHBondContact O-N 3.39Å; N434-Y438 WeakPolarHBondContact O-CD2 3.43Å; N434-Y438 PolarHBondContact O-N 3.36Å
435	F	80.1	Confident	81.5	Confident	69 Å²	69	57.7 Å²	57.7	30%	0.303	33%	0.329	S	S	.	.	H	α-helix	trans	-58.2	-44.7	172.4	-178.2	-103.4	0	0	0	112.4	V329 L330 T333 I431 V432 N433 M437 Y438 Y439	V329-F435 HydrophobicContact CG1-CE2 4.35Å; L330-F435 HydrophobicContact CB-CE2 4.11Å; L330-F435 HydrophobicContact CD1-CD2 4.16Å; L330-F435 HydrophobicContact CD1-CE2 4.05Å; T333-F435 HydrophobicContact CG2-CB 3.89Å; T333-F435 HydrophobicContact CG2-CD2 4.18Å; I431-F435 WeakPolarHBondContact O-CB 3.37Å; I431-F435 PolarHBondContact O-N 2.95Å; V432-F435 PolarHBondContact O-N 2.87Å; N433-F435 VanDerWaalsContact C-N 3.33Å; N433-F435 PolarHBondContact O-N 3.36Å; F435-M437 VanDerWaalsContact C-N 3.31Å; F435-M437 PolarHBondContact O-N 3.03Å; F435-Y438 PolarHBondContact O-N 3.46Å; F435-Y439 HydrophobicContact CE1-CG 4.47Å; F435-Y439 HydrophobicContact CZ-CD2 4.17Å; F435-Y439 HydrophobicContact CZ-CG 4.39Å; F435-Y439 WeakPolarHBondContact O-CB 3.43Å; F435-Y439 PolarHBondContact O-N 3.38Å
436	G	81.3	Confident	80.3	Confident	36 Å²	36	60.1 Å²	60.1	37%	0.371	33%	0.33	S	S	.	.	H	α-helix	trans	-57.5	-41.3	176.6	0	0	0	0	0	113.1	V432 N433 N434 S440	V432-G436 PolarHBondContact O-N 2.78Å; N433-G436 WeakPolarHBondContact O-CA 3.33Å; N433-G436 PolarHBondContact O-N 3.3Å; N434-G436 VanDerWaalsContact C-N 3.35Å; N434-G436 PolarHBondContact O-N 3.09Å; G436-S440 VanDerWaalsContact O-CB 3.3Å; G436-S440 WeakPolarHBondContact O-CB 3.42Å; G436-S440 PolarHBondContact O-N 3.49Å; G436-S440 PolarHBondContact O-OG 3.32Å
437	M	79.8	Confident	79.7	Confident	51 Å²	51	62.1 Å²	62.1	25%	0.251	34%	0.335	S	S	.	.	H	α-helix	trans	-68.1	-55	177.2	-58.4	-155.4	-51.1	0	0	112.1	Q111 N433 N434 F435 Y439 S440 L441	Q111-M437 HydrophobicContact CG-CE 4.27Å; Q111-M437 HydrophobicContact CG-SD 4.16Å; Q111-M437 PolarHBondContact NE2-SD 3.46Å; Q111-M437 VanDerWaalsContact NE2-SD 3.37Å; N433-M437 WeakPolarHBondContact O-CG 3.37Å; N433-M437 PolarHBondContact O-N 3.41Å; N434-M437 PolarHBondContact O-N 3.39Å; F435-M437 VanDerWaalsContact C-N 3.31Å; F435-M437 PolarHBondContact O-N 3.03Å; M437-Y439 VanDerWaalsContact C-N 3.27Å; M437-Y439 PolarHBondContact O-N 2.95Å; M437-S440 PolarHBondContact O-N 2.79Å; M437-S440 PolarHBondContact O-OG 3.39Å; M437-L441 WeakPolarHBondContact O-CG 3.35Å; M437-L441 PolarHBondContact O-N 3.26Å; M437-L441 VanDerWaalsContact O-N 3.1Å
438	Y	75.9	Confident	78.8	Confident	39 Å²	39	67.6 Å²	67.6	15%	0.153	36%	0.363	C	S	.	.	H	α-helix	trans	-60.9	-36.4	-180	-71.4	-63.4	0	0	0	112.3	A115 A118 T333 A336 N434 F435 A442	A115-Y438 HydrophobicContact CB-CD1 4.49Å; A115-Y438 HydrophobicContact CB-CE1 4.29Å; A118-Y438 HydrophobicContact CB-CD1 4.28Å; A118-Y438 HydrophobicContact CB-CE1 3.61Å; T333-Y438 HydrophobicContact CG2-CD2 4.13Å; A336-Y438 HydrophobicContact CB-CE2 3.79Å; N434-Y438 WeakPolarHBondContact O-CD2 3.43Å; N434-Y438 PolarHBondContact O-N 3.36Å; F435-Y438 PolarHBondContact O-N 3.46Å; Y438-A442 WeakPolarHBondContact O-CB 3.41Å; Y438-A442 PolarHBondContact O-N 3.08Å
439	Y	79.3	Confident	77.2	Confident	99 Å²	99	70.1 Å²	70.1	39%	0.388	38%	0.381	S	S	.	.	H	α-helix	trans	-69.6	-44.8	176.4	-176.2	-99.1	0	0	0	112.8	V329 F435 M437 L441 A442 M443	V329-Y439 HydrophobicContact CG1-CD2 4.35Å; F435-Y439 HydrophobicContact CE1-CG 4.47Å; F435-Y439 HydrophobicContact CZ-CD2 4.17Å; F435-Y439 HydrophobicContact CZ-CG 4.39Å; F435-Y439 WeakPolarHBondContact O-CB 3.43Å; F435-Y439 PolarHBondContact O-N 3.38Å; M437-Y439 VanDerWaalsContact C-N 3.27Å; M437-Y439 PolarHBondContact O-N 2.95Å; Y439-L441 PolarHBondContact O-N 2.97Å; Y439-A442 PolarHBondContact O-N 3.49Å; Y439-M443 HydrophobicContact CD1-CG 4.21Å; Y439-M443 HydrophobicContact CE1-CG 3.83Å; Y439-M443 HydrophobicContact CE2-CE 4.33Å; Y439-M443 HydrophobicContact CE2-CG 4.2Å; Y439-M443 HydrophobicContact CE2-SD 4.41Å; Y439-M443 WeakPolarHBondContact O-CB 3.26Å; Y439-M443 VanDerWaalsContact O-CG 3.26Å; Y439-M443 WeakPolarHBondContact O-CG 3.39Å; Y439-M443 PolarHBondContact O-N 3.33Å
440	S	79.7	Confident	75.5	Confident	66 Å²	66	75.7 Å²	75.7	46%	0.462	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-41.6	-179.9	69.1	0	0	0	0	111.8	G436 M437 M443 A444	G436-S440 VanDerWaalsContact O-CB 3.3Å; G436-S440 WeakPolarHBondContact O-CB 3.42Å; G436-S440 PolarHBondContact O-N 3.49Å; G436-S440 PolarHBondContact O-OG 3.32Å; M437-S440 PolarHBondContact O-N 2.79Å; M437-S440 PolarHBondContact O-OG 3.39Å; S440-M443 PolarHBondContact O-N 3.21Å; S440-A444 PolarHBondContact O-N 3.39Å
441	L	75.1	Confident	73.8	Confident	44 Å²	44	81.7 Å²	81.7	23%	0.23	42%	0.418	C	S	.	.	H	α-helix	trans	-72.5	-36.9	178.5	-64.2	169.1	0	0	0	112.5	A115 L119 M437 Y439 M443 A444 K445	A115-L441 HydrophobicContact CB-CD1 3.35Å; L119-L441 HydrophobicContact CD1-CB 3.63Å; M437-L441 WeakPolarHBondContact O-CG 3.35Å; M437-L441 PolarHBondContact O-N 3.26Å; M437-L441 VanDerWaalsContact O-N 3.1Å; Y439-L441 PolarHBondContact O-N 2.97Å; L441-M443 VanDerWaalsContact C-N 3.32Å; L441-M443 PolarHBondContact O-N 3.3Å; L441-A444 WeakPolarHBondContact O-CB 3.49Å; L441-A444 PolarHBondContact O-N 3.41Å; L441-K445 PolarHBondContact O-N 2.93Å
442	A	71	Confident	71.9	Confident	7 Å²	7	89.2 Å²	89.2	6%	0.058	45%	0.45	C	S	.	.	H	α-helix	trans	-60.2	-41.3	169.5	0	0	0	0	0	112.1	L119 V329 Y438 Y439 Q446	L119-A442 HydrophobicContact CD2-CB 3.78Å; V329-A442 HydrophobicContact CG2-CB 3.75Å; Y438-A442 WeakPolarHBondContact O-CB 3.41Å; Y438-A442 PolarHBondContact O-N 3.08Å; Y439-A442 PolarHBondContact O-N 3.49Å; A442-Q446 WeakPolarHBondContact O-CG 3.36Å; A442-Q446 PolarHBondContact O-N 2.9Å
443	M	76.8	Confident	69.8	Low	42 Å²	42	91.3 Å²	91.3	21%	0.207	46%	0.458	C	S	.	.	H	α-helix	trans	-69.2	-32.9	175	-69.2	-63.2	100.7	0	0	112.3	V325 Y439 S440 L441 K447	V325-M443 HydrophobicContact CG1-CE 3.79Å; Y439-M443 HydrophobicContact CD1-CG 4.21Å; Y439-M443 HydrophobicContact CE1-CG 3.83Å; Y439-M443 HydrophobicContact CE2-CE 4.33Å; Y439-M443 HydrophobicContact CE2-CG 4.2Å; Y439-M443 HydrophobicContact CE2-SD 4.41Å; Y439-M443 WeakPolarHBondContact O-CB 3.26Å; Y439-M443 VanDerWaalsContact O-CG 3.26Å; Y439-M443 WeakPolarHBondContact O-CG 3.39Å; Y439-M443 PolarHBondContact O-N 3.33Å; S440-M443 PolarHBondContact O-N 3.21Å; L441-M443 VanDerWaalsContact C-N 3.32Å; L441-M443 PolarHBondContact O-N 3.3Å; M443-K447 WeakPolarHBondContact O-CB 3.37Å; M443-K447 VanDerWaalsContact O-CG 3.3Å; M443-K447 WeakPolarHBondContact O-CG 3.31Å; M443-K447 PolarHBondContact O-N 3.43Å
444	A	76.5	Confident	67.8	Low	43 Å²	43	96.5 Å²	96.5	36%	0.355	47%	0.47	S	S	.	.	H	α-helix	trans	-66.1	-53.6	173.6	0	0	0	0	0	111.6	S440 L441 Q446 K447 L448	S440-A444 PolarHBondContact O-N 3.39Å; L441-A444 WeakPolarHBondContact O-CB 3.49Å; L441-A444 PolarHBondContact O-N 3.41Å; A444-Q446 PolarHBondContact O-N 2.98Å; A444-Q446 VanDerWaalsContact O-N 3.13Å; A444-K447 PolarHBondContact O-N 2.93Å; A444-L448 WeakPolarHBondContact O-CG 3.49Å; A444-L448 PolarHBondContact O-N 3.21Å
445	K	69.8	Low	65.9	Low	68 Å²	68	103.4 Å²	103.4	30%	0.296	50%	0.501	S	S	.	.	H	α-helix	trans	-55.6	-31.1	175.7	-75.8	-163.5	177.8	-172.2	0	112.5	E116 L119 D120 L441	E116-K445 WeakPolarHBondContact OE1-CE 3.42Å; E116-K445 IonicContact OE1-NZ 2.95Å; E116-K445 PolarHBondContact OE1-NZ 3.45Å; L119-K445 HydrophobicContact CB-CD 4Å; L119-K445 HydrophobicContact CD1-CD 3.92Å; L119-K445 HydrophobicContact CD1-CG 4.34Å; L119-K445 HydrophobicContact CG-CD 4.46Å; D120-K445 IonicContact OD1-NZ 3.87Å; D120-K445 PolarHBondContact OD1-NZ 3.07Å; D120-K445 IonicContact OD2-NZ 3.49Å; D120-K445 PolarHBondContact OD2-NZ 3.28Å; D120-K445 VanDerWaalsContact OD2-NZ 3.17Å; L441-K445 PolarHBondContact O-N 2.93Å
446	Q	67.1	Low	64.5	Low	108 Å²	108	107.3 Å²	107.3	51%	0.505	52%	0.523	S	S	.	.	H	α-helix	trans	-80.9	-28.8	175.9	-73.3	-175.1	8.2	0	0	115.3	V325 A442 A444	V325-Q446 VanDerWaalsContact CG1-NE2 3.28Å; A442-Q446 WeakPolarHBondContact O-CG 3.36Å; A442-Q446 PolarHBondContact O-N 2.9Å; A444-Q446 PolarHBondContact O-N 2.98Å; A444-Q446 VanDerWaalsContact O-N 3.13Å
447	K	72.9	Confident	62.8	Low	177 Å²	177	111 Å²	111	77%	0.77	54%	0.541	S	S	*	.	H	α-helix	trans	-80	-26.1	176.4	-76.1	174.3	-179.7	-179.4	0	112.8	M443 A444	M443-K447 WeakPolarHBondContact O-CB 3.37Å; M443-K447 VanDerWaalsContact O-CG 3.3Å; M443-K447 WeakPolarHBondContact O-CG 3.31Å; M443-K447 PolarHBondContact O-N 3.43Å; A444-K447 PolarHBondContact O-N 2.93Å
448	L	67.7	Low	60.7	Low	122 Å²	122	118 Å²	118	64%	0.639	56%	0.564	S	S	*	*	S	Bend	trans	-62.4	127.1	177.3	-75	171.2	0	0	0	111.2	A444 K450	A444-L448 WeakPolarHBondContact O-CG 3.49Å; A444-L448 PolarHBondContact O-N 3.21Å; L448-K450 PolarHBondContact O-N 2.86Å
449	P	56	Low	59.1	Low	115 Å²	115	119.9 Å²	119.9	75%	0.747	59%	0.588	S	S	*	*			trans	-66.8	122.1	175.3	27.5	-32.9	0	0	0	109.2	K451	P449-K451 PolarHBondContact O-N 3.08Å; P449-K451 VanDerWaalsContact O-N 3.07Å
450	K	55.1	Low	57.2	Low	192 Å²	192	121.2 Å²	121.2	84%	0.835	61%	0.609	S	S	*	*			trans	-45.6	119.1	-179.8	-68	-168.9	176.5	-171.8	0	110.3	L448 K452	L448-K450 PolarHBondContact O-N 2.86Å; K450-K452 VanDerWaalsContact C-N 3.33Å; K450-K452 PolarHBondContact O-N 2.86Å
451	K	48	Very low	55.1	Low	194 Å²	194	124.8 Å²	124.8	84%	0.843	62%	0.618	S	S	*	*			trans	-56.3	88.8	-171.9	-131.8	179.2	-172.8	177.5	0	110.2	P449 N453	P449-K451 PolarHBondContact O-N 3.08Å; P449-K451 VanDerWaalsContact O-N 3.07Å; K451-N453 PolarHBondContact O-N 2.85Å; K451-N453 PolarHBondContact O-OD1 3.24Å
452	K	45.2	Very low	53.3	Low	180 Å²	180	128.9 Å²	128.9	78%	0.783	65%	0.648	S	S	*	*			trans	-82.6	100.1	178.3	-173	175.8	-174.7	177	0	106.6	K450 R454	K450-K452 VanDerWaalsContact C-N 3.33Å; K450-K452 PolarHBondContact O-N 2.86Å; K452-R454 PolarHBondContact O-N 3.13Å
453	N	42.3	Very low	51.5	Low	135 Å²	135	132 Å²	132	72%	0.722	68%	0.68	S	S	*	*			trans	-62.6	68.4	-176.7	-70.1	-4	0	0	0	113.1	K451	K451-N453 PolarHBondContact O-N 2.85Å; K451-N453 PolarHBondContact O-OD1 3.24Å
454	R	42.9	Very low	49.4	Very low	207 Å²	207	135 Å²	135	78%	0.781	71%	0.705	S	S	*	*			trans	-78.9	109.3	153.5	-60.8	-177.1	80.9	176.7	4.6	105	K452 I456	K452-R454 PolarHBondContact O-N 3.13Å; R454-I456 PolarHBondContact O-N 2.6Å
455	H	42.3	Very low	47.5	Very low	177 Å²	177	139.2 Å²	139.2	82%	0.819	73%	0.729	S	S	*	*			trans	-50.3	113.2	159	-109	59.4	0	0	0	107.4	P457	H455-P457 WeakPolarHBondContact O-CD 3.3Å
456	I	48.9	Very low	45.8	Very low	151 Å²	151	143.2 Å²	143.2	77%	0.774	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-72	119.7	163.7	-60.4	177.3	0	0	0	104.2	R454 R458	R454-I456 PolarHBondContact O-N 2.6Å; I456-R458 PolarHBondContact O-N 3.18Å
457	P	45.9	Very low	44.1	Very low	113 Å²	113	148.7 Å²	148.7	73%	0.734	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-56.3	127.6	179.3	-24.7	34.9	0	0	0	109.4	H455 A459	H455-P457 WeakPolarHBondContact O-CD 3.3Å; P457-A459 PolarHBondContact O-N 3.24Å; P457-A459 VanDerWaalsContact O-N 3.11Å
458	R	37.2	Very low	42	Very low	199 Å²	199	146 Å²	146	75%	0.751	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-51.2	121.6	176	-177.2	174.7	179.8	135.2	-2.3	107.9	I456 Q461	I456-R458 PolarHBondContact O-N 3.18Å; R458-Q461 VanDerWaalsContact NH2-NE2 3.1Å
459	A	42	Very low	40.1	Very low	78 Å²	78	149.6 Å²	149.6	65%	0.645	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-53.9	135.2	-179.4	0	0	0	0	0	109.2	P457 Q461	P457-A459 PolarHBondContact O-N 3.24Å; P457-A459 VanDerWaalsContact O-N 3.11Å; A459-Q461 PolarHBondContact O-N 3.48Å
460	P	37.8	Very low	38.9	Very low	128 Å²	128	149.7 Å²	149.7	83%	0.831	79%	0.788	S	S	*	*			trans	-56	113.7	-180	-25.7	34.5	0	0	0	109.9	P462	P460-P462 WeakPolarHBondContact O-CD 3.44Å
461	Q	37.5	Very low	37.5	Very low	140 Å²	140	146.3 Å²	146.3	65%	0.654	79%	0.788	S	S	*	*			trans	-63.9	128.3	175.7	-75	-177.2	-37.9	0	0	108.4	R458 A459 G463	R458-Q461 VanDerWaalsContact NH2-NE2 3.1Å; A459-Q461 PolarHBondContact O-N 3.48Å; Q461-G463 PolarHBondContact O-N 2.76Å
462	P	37	Very low	36.6	Very low	131 Å²	131	144.6 Å²	144.6	85%	0.851	79%	0.787	S	S	*	*			trans	-61.2	107.2	170.4	-21.2	33.5	0	0	0	108.7	P460 S464	P460-P462 WeakPolarHBondContact O-CD 3.44Å; P462-S464 PolarHBondContact O-N 3.43Å
463	G	32.3	Very low	35.7	Very low	72 Å²	72	141.3 Å²	141.3	74%	0.742	79%	0.786	S	S	*	*			trans	-65.9	125.7	-176.1	0	0	0	0	0	111.5	Q461	Q461-G463 PolarHBondContact O-N 2.76Å
464	S	32.9	Very low	35	Very low	105 Å²	105	139.4 Å²	139.4	73%	0.734	78%	0.783	S	S	*	*			trans	-56.8	139.5	173.2	-67.3	0	0	0	0	111.1	P462 N466	P462-S464 PolarHBondContact O-N 3.43Å; S464-N466 PolarHBondContact O-N 3.5Å
465	P	37.3	Very low	34.2	Very low	131 Å²	131	137.5 Å²	137.5	85%	0.851	78%	0.783	S	S	*	*			trans	-76.4	87.2	-165.4	30	-36.6	0	0	0	112.9	Y467	P465-Y467 PolarHBondContact O-N 2.93Å
466	N	33.4	Very low	33.6	Very low	153 Å²	153	136.6 Å²	136.6	82%	0.818	78%	0.779	S	S	*	*			trans	-76.8	112.9	176	-91	-21.3	0	0	0	112.7	S464 C468	S464-N466 PolarHBondContact O-N 3.5Å; N466-C468 PolarHBondContact O-N 3Å
467	Y	30.9	Very low	32.9	Very low	222 Å²	222	134.9 Å²	134.9	87%	0.871	78%	0.778	S	S	*	*			trans	-43.7	103.9	-179.7	-153.5	-90.9	0	0	0	114.8	P465	P465-Y467 PolarHBondContact O-N 2.93Å
468	C	29.7	Very low	32	Very low	122 Å²	122	134.8 Å²	134.8	82%	0.824	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-88.3	124.5	174.2	-72.8	0	0	0	0	111.7	N466	N466-C468 PolarHBondContact O-N 3Å
469	K	27.9	Very low	32	Very low	196 Å²	196	130.9 Å²	130.9	85%	0.852	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-73.2	142.3	172.4	-73.6	179.6	177.1	175	0	111
470	S	29.8	Very low	31.3	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-84.4	142.7	176	46.2	0	0	0	0	113
471	S	26.4	Very low	30.7	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	78%	0.779	S	S	*	*			trans	-149.5	160.2	158.8	56.4	0	0	0	0	108.8
472	I	28.9	Very low	30.3	Very low	158 Å²	158	134.8 Å²	134.8	81%	0.81	79%	0.79	S	S	*	*			trans	-131.5	160.8	-156.2	-70.1	173.4	0	0	0	111.3
473	S	25.8	Very low	29.8	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	79%	0.789	S	S	*	*			trans	85.3	141	173.9	-80.4	0	0	0	0	117
474	S	28.2	Very low	29.6	Very low	94 Å²	94	139.4 Å²	139.4	66%	0.657	79%	0.791	S	S	*	*			cis	-162.6	143.8	-2.2	47.6	0	0	0	0	113.5
475	Q	26.6	Very low	29.4	Very low	168 Å²	168	141 Å²	141	79%	0.785	80%	0.796	S	S	*	*			trans	43.3	146.8	136	-63.8	178.8	-17	0	0	120.4
476	H	28.1	Very low	28.9	Very low	158 Å²	158	143.3 Å²	143.3	73%	0.731	79%	0.793	S	S	*	*			cis	-173.1	-178.5	2.6	-111.5	-47.4	0	0	0	106.7
477	P	35.7	Very low	28.5	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	79%	0.789	S	S	*	*			cis	-127.5	-178.1	-34.3	39.4	-22.9	0	0	0	113.2
478	S	27	Very low	28.4	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	79%	0.787	S	S	*	*			trans	-86.1	179	-178.2	-39.7	0	0	0	0	114.5
479	P	36.3	Very low	28.1	Very low	116 Å²	116	143.3 Å²	143.3	75%	0.753	78%	0.784	S	S	*	*				-149.7	139.9	87	36.3	-16.8	0	0	0	119.3
480	I	27.3	Very low	28.1	Very low	157 Å²	157	142.8 Å²	142.8	81%	0.805	78%	0.783	S	S	*	*			trans	70.1	100.4	134.6	-56.9	171.3	0	0	0	120.7
481	A	26.6	Very low	27.9	Very low	78 Å²	78	145.7 Å²	145.7	65%	0.645	78%	0.783	S	S	*	*				38.7	136.3	127.6	0	0	0	0	0	123.5
482	H	27.8	Very low	27.9	Very low	194 Å²	194	146.8 Å²	146.8	90%	0.898	78%	0.78	S	S	*	*				-147.2	142.7	111.9	-110.5	-83.4	0	0	0	109.9
483	D	27.3	Very low	28.1	Very low	152 Å²	152	144.7 Å²	144.7	81%	0.813	78%	0.779	S	S	*	*			trans	-78.4	144	170.3	-68.6	-68.4	0	0	0	110.9
484	D	27.6	Very low	28.4	Very low	148 Å²	148	148.2 Å²	148.2	79%	0.791	78%	0.78	S	S	*	*			trans	-153.8	132.5	152.2	-118.7	-30.8	0	0	0	110.9
485	V	29.3	Very low	28.7	Very low	137 Å²	137	150.7 Å²	150.7	83%	0.83	79%	0.785	S	S	*	*			trans	-95.6	115.8	-176	174.8	0	0	0	0	109.8
486	F	26.4	Very low	29	Very low	181 Å²	181	149.5 Å²	149.5	79%	0.794	78%	0.784	S	S	*	*			trans	-103.8	106.1	173.2	-93.6	-88.3	0	0	0	112.9	I488	F486-I488 PolarHBondContact O-N 3.25Å
487	E	24	Very low	29.4	Very low	158 Å²	158	144.1 Å²	144.1	74%	0.738	77%	0.771	S	S	*	*			trans	-71.8	113.8	176.9	-177.6	-176.5	-121.9	0	0	111.2	K489	E487-K489 PolarHBondContact O-N 2.99Å
488	I	29.8	Very low	29.4	Very low	163 Å²	163	146 Å²	146	84%	0.836	77%	0.77	S	S	*	*			trans	-78.4	102.3	175.2	-60.1	178.1	0	0	0	109	F486 F490	F486-I488 PolarHBondContact O-N 3.25Å; I488-F490 PolarHBondContact O-N 3.16Å
489	K	23.1	Very low	29.8	Very low	175 Å²	175	144.4 Å²	144.4	76%	0.761	76%	0.763	S	S	*	*			trans	-64	116	172	-79	-177.4	174.3	175.2	0	111.2	E487	E487-K489 PolarHBondContact O-N 2.99Å
490	F	27.5	Very low	29.7	Very low	186 Å²	186	141.4 Å²	141.4	82%	0.816	75%	0.748	S	S	*	*			trans	-65.2	133.2	164.1	-150.7	-91	0	0	0	108.9	I488	I488-F490 PolarHBondContact O-N 3.16Å
491	Q	27.1	Very low	30.1	Very low	179 Å²	179	139.3 Å²	139.3	84%	0.836	74%	0.739	S	S	*	*			trans	-123.8	138.8	-178.6	-162.3	167	12.1	0	0	111.1
492	D	25.9	Very low	30.7	Very low	144 Å²	144	139.4 Å²	139.4	77%	0.77	74%	0.74	S	S	*	*			trans	-53.7	128.1	-150.6	-63.6	-78	0	0	0	118.5	K494	D492-K494 VanDerWaalsContact C-N 3.34Å; D492-K494 PolarHBondContact O-N 3.1Å
493	S	33.2	Very low	31.1	Very low	113 Å²	113	134.1 Å²	134.1	79%	0.79	73%	0.73	S	S	*	*			trans	-70.3	79.9	164.4	-61.7	0	0	0	0	111.8
494	K	32.1	Very low	31.5	Very low	186 Å²	186	133.9 Å²	133.9	81%	0.809	73%	0.727	S	S	*	*			trans	-130.1	17.1	-178.4	-138.4	174.7	-174.9	176.1	0	117.2	D492	D492-K494 VanDerWaalsContact C-N 3.34Å; D492-K494 PolarHBondContact O-N 3.1Å
495	L	33.8	Very low	31.9	Very low	145 Å²	145	130 Å²	130	76%	0.759	72%	0.716	S	S	*	*	S	Bend	trans	-107.6	-6.1	178.5	-89.4	162.9	0	0	0	115.6
496	N	33.9	Very low	32.1	Very low	144 Å²	144	131 Å²	131	77%	0.77	72%	0.717	S	S	*	*	S	Bend	trans	-91.9	-10.2	-177.9	-69.8	6	0	0	0	114.3
497	G	35.8	Very low	32.5	Very low	44 Å²	44	131.8 Å²	131.8	45%	0.454	72%	0.723	S	S	.	*	H	α-helix	trans	-73.4	-35.8	-174.5	0	0	0	0	0	114.6	A500 N501	G497-A500 PolarHBondContact O-N 2.93Å; G497-N501 PolarHBondContact O-N 3.45Å
498	E	34.7	Very low	32.9	Very low	155 Å²	155	132 Å²	132	72%	0.724	73%	0.729	S	S	*	*	H	α-helix	trans	-71.3	-34.4	-176	-62	-176.4	139.8	0	0	112.2	A502	E498-A502 WeakPolarHBondContact O-CB 3.25Å; E498-A502 PolarHBondContact O-N 3.05Å; E498-A502 VanDerWaalsContact O-N 3.13Å
499	A	35.9	Very low	32.9	Very low	77 Å²	77	130.1 Å²	130.1	64%	0.636	73%	0.729	S	S	*	*	H	α-helix	trans	-67.5	-33.4	176.3	0	0	0	0	0	112.9
500	A	34.8	Very low	33.3	Very low	53 Å²	53	127.3 Å²	127.3	44%	0.438	73%	0.729	S	S	.	*	H	α-helix	trans	-73.4	-44.7	176.4	0	0	0	0	0	111.8	G497 A502 A503	G497-A500 PolarHBondContact O-N 2.93Å; A500-A502 VanDerWaalsContact C-N 3.29Å; A500-A502 PolarHBondContact O-N 2.98Å; A500-A503 WeakPolarHBondContact O-CB 3.43Å; A500-A503 PolarHBondContact O-N 3.25Å; A500-A503 VanDerWaalsContact O-N 3.08Å
501	N	34.8	Very low	33.3	Very low	113 Å²	113	127.4 Å²	127.4	60%	0.604	73%	0.731	S	S	*	*	H	α-helix	trans	-66.3	-30.6	-179.9	-70.7	-10.1	0	0	0	112.7	G497 A503 L504	G497-N501 PolarHBondContact O-N 3.45Å; N501-A503 PolarHBondContact O-N 2.98Å; N501-L504 PolarHBondContact O-N 2.95Å
502	A	38.9	Very low	33.5	Very low	80 Å²	80	126.4 Å²	126.4	66%	0.661	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-16	174.1	0	0	0	0	0	114.1	E498 A500	E498-A502 WeakPolarHBondContact O-CB 3.25Å; E498-A502 PolarHBondContact O-N 3.05Å; E498-A502 VanDerWaalsContact O-N 3.13Å; A500-A502 VanDerWaalsContact C-N 3.29Å; A500-A502 PolarHBondContact O-N 2.98Å
503	A	36.5	Very low	33.7	Very low	84 Å²	84	127.2 Å²	127.2	69%	0.694	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-15.2	177.2	0	0	0	0	0	113.8	A500 N501	A500-A503 WeakPolarHBondContact O-CB 3.43Å; A500-A503 PolarHBondContact O-N 3.25Å; A500-A503 VanDerWaalsContact O-N 3.08Å; N501-A503 PolarHBondContact O-N 2.98Å
504	L	36.8	Very low	33.5	Very low	146 Å²	146	131 Å²	131	76%	0.764	74%	0.739	S	S	*	*	S	Bend	trans	-103.4	8.4	-176.1	-69.6	171.4	0	0	0	113.8	N501	N501-L504 PolarHBondContact O-N 2.95Å
505	A	34.8	Very low	33.3	Very low	66 Å²	66	127 Å²	127	55%	0.545	74%	0.742	S	S	.	*	S	Bend	trans	-126.2	64.2	-175.5	0	0	0	0	0	111.7
506	N	33.6	Very low	32.9	Very low	160 Å²	160	128 Å²	128	86%	0.856	75%	0.746	S	S	*	*			trans	-172.9	59.7	160.8	-90.1	-41.4	0	0	0	110.8
507	E	35.7	Very low	32.4	Very low	196 Å²	196	126.5 Å²	126.5	92%	0.916	75%	0.747	S	S	*	*			trans	-92.4	95.6	161.1	-73.4	-163.6	131.2	0	0	108.9
508	D	31.9	Very low	32.3	Very low	164 Å²	164	129 Å²	129	88%	0.877	76%	0.755	S	S	*	*			trans	-156.7	82.7	171.2	-112.8	-34.7	0	0	0	109.6
509	C	29.9	Very low	32	Very low	122 Å²	122	129.9 Å²	129.9	82%	0.824	76%	0.759	S	S	*	*			trans	-155.9	140.2	169.7	-142.8	0	0	0	0	108.7
510	P	31.7	Very low	31.6	Very low	117 Å²	117	133.7 Å²	133.7	76%	0.76	76%	0.764	S	S	*	*			trans	-78.1	145.9	-163.3	29.9	-35.7	0	0	0	113.9
511	H	28.4	Very low	31.2	Very low	187 Å²	187	138.7 Å²	138.7	87%	0.866	78%	0.782	S	S	*	*			trans	-63.4	144.1	167.4	-79.6	-94	0	0	0	111.8
512	I	30	Very low	30.7	Very low	159 Å²	159	141.3 Å²	141.3	82%	0.815	79%	0.788	S	S	*	*			trans	-121	130.6	156.7	-65.5	178.1	0	0	0	105.9
513	D	29.4	Very low	29.9	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	80%	0.797	S	S	*	*			trans	-66.5	141.6	-173.1	-63.3	-64.2	0	0	0	112.8
514	Q	29.9	Very low	29.5	Very low	192 Å²	192	144.9 Å²	144.9	90%	0.897	80%	0.8	S	S	*	*			trans	-118.2	127.7	171.3	-151.9	170.2	26.4	0	0	109.4
515	A	27.3	Very low	28.8	Very low	104 Å²	104	143.3 Å²	143.3	86%	0.86	80%	0.801	S	S	*	*			trans	-75.8	145.4	-167.3	0	0	0	0	0	113.5
516	I	27	Very low	28.4	Very low	165 Å²	165	148.8 Å²	148.8	85%	0.846	82%	0.815	S	S	*	*			trans	-95.3	143.4	177.2	-67.9	160.6	0	0	0	110.4
517	S	23.1	Very low	28	Very low	113 Å²	113	151.3 Å²	151.3	79%	0.79	81%	0.813	S	S	*	*			trans	-120.1	149.3	163.8	-159.9	0	0	0	0	109.3
518	P	33.4	Very low	27.5	Very low	97 Å²	97	148.9 Å²	148.9	63%	0.63	80%	0.802	S	S	*	*			trans	-113	-170.7	-153.1	42.2	-34.1	0	0	0	115.7
519	E	28.5	Very low	27.1	Very low	172 Å²	172	152.5 Å²	152.5	80%	0.804	80%	0.803	S	S	*	*			trans	81.5	135	165.5	-67.8	173.7	-156.2	0	0	117.2
520	E	26.4	Very low	27.3	Very low	157 Å²	157	152.2 Å²	152.2	73%	0.734	80%	0.8	S	S	*	*			cis	-162.9	-169.6	-13.7	-137.8	-161.8	-170.7	0	0	113.1
521	I	27.7	Very low	27	Very low	159 Å²	159	152.8 Å²	152.8	82%	0.815	81%	0.805	S	S	*	*			trans	108.2	135.7	163.2	-56.7	179.4	0	0	0	117.1
522	F	22.9	Very low	26.7	Very low	168 Å²	168	153.2 Å²	153.2	74%	0.737	81%	0.805	S	S	*	*			trans	-105.1	157.7	-158.5	-92.2	-108.6	0	0	0	116
523	S	22.8	Very low	26.5	Very low	122 Å²	122	153.1 Å²	153.1	85%	0.853	81%	0.805	S	S	*	*				-155.1	152.6	128.2	-82.4	0	0	0	0	111.5
524	P	27.5	Very low	26.2	Very low	116 Å²	116	151.2 Å²	151.2	75%	0.753	80%	0.799	S	S	*	*			trans	-121.8	152.8	-154.7	39.5	-27.1	0	0	0	116.6
525	S	23.3	Very low	26	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	80%	0.796	S	S	*	*			trans	-158.9	159.9	140.3	-155.6	0	0	0	0	112.4
526	E	25.8	Very low	25.8	Very low	181 Å²	181	149.8 Å²	149.8	85%	0.846	79%	0.793	S	S	*	*			trans	60.1	89.8	165.3	-47.3	-142	129.3	0	0	119.4
527	R	25.1	Very low	25.7	Very low	213 Å²	213	146.4 Å²	146.4	80%	0.804	79%	0.79	S	S	*	*			trans	-7.1	157.2	136.7	-62.5	-176.1	146.1	121.7	1.7	118.3
528	E	24.7	Very low	25.7	Very low	146 Å²	146	150 Å²	150	68%	0.682	79%	0.794	S	S	*	*			cis	-170.6	126.4	-8.4	-100.4	151.8	-168	0	0	102.2
529	R	24.6	Very low	25.4	Very low	240 Å²	240	153.9 Å²	153.9	91%	0.906	80%	0.804	S	S	*	*				52.8	147.3	57.2	-78.5	-163.6	179	-165.6	2.9	115
530	P	34.4	Very low	25.8	Very low	115 Å²	115	150.3 Å²	150.3	75%	0.747	80%	0.795	S	S	*	*			cis	-138.1	-165.3	-42.5	40.8	-24.1	0	0	0	110.9
531	C	25	Very low	25.9	Very low	130 Å²	130	148.9 Å²	148.9	88%	0.878	79%	0.793	S	S	*	*			trans	-163.1	137.7	137.5	-124.9	0	0	0	0	113.7
532	F	22.3	Very low	25.9	Very low	195 Å²	195	148.7 Å²	148.7	86%	0.855	79%	0.788	S	S	*	*			trans	-116.3	150.9	167.4	-107.6	-94.6	0	0	0	107.6
533	L	25.2	Very low	26.1	Very low	157 Å²	157	147 Å²	147	82%	0.822	79%	0.792	S	S	*	*			trans	-175.1	152.8	131.3	-105.5	164.9	0	0	0	112.7
534	V	24.4	Very low	26.3	Very low	121 Å²	121	144.8 Å²	144.8	73%	0.733	79%	0.788	S	S	*	*			trans	-125.5	130.7	170	171.9	0	0	0	0	107.6
535	T	24.2	Very low	26.3	Very low	137 Å²	137	143.3 Å²	143.3	84%	0.84	79%	0.794	S	S	*	*			trans	-154	167.2	161.6	29.9	0	0	0	0	110.7
536	T	24.3	Very low	26.5	Very low	128 Å²	128	149.8 Å²	149.8	79%	0.785	80%	0.801	S	S	*	*			trans	-125.4	151.4	-160	50.9	0	0	0	0	114.2
537	A	24.4	Very low	26.6	Very low	95 Å²	95	148.6 Å²	148.6	79%	0.785	81%	0.806	S	S	*	*			trans	67	160	164.6	0	0	0	0	0	115.6
538	E	23.7	Very low	26.6	Very low	187 Å²	187	148.2 Å²	148.2	87%	0.874	80%	0.804	S	S	*	*			cis	-138.7	-171.3	20.2	-66.4	-174.9	114	0	0	113.9
539	H	25.4	Very low	26.7	Very low	180 Å²	180	150 Å²	150	83%	0.833	81%	0.805	S	S	*	*			trans	-84.7	-173.7	169.3	-96	56	0	0	0	111
540	P	38.4	Very low	26.7	Very low	96 Å²	96	144.9 Å²	144.9	62%	0.623	79%	0.791	S	S	*	*			cis	-148.3	-179.7	18.6	46.1	-26.7	0	0	0	119.2
541	N	26.9	Very low	26.4	Very low	127 Å²	127	144.5 Å²	144.5	68%	0.679	78%	0.783	S	S	*	*			trans	60.5	150.9	148.6	-66.3	-18.9	0	0	0	119.5
542	H	28.6	Very low	26.5	Very low	155 Å²	155	145.2 Å²	145.2	72%	0.718	77%	0.773	S	S	*	*			cis	-157.9	173.1	-3.4	-104.3	-3.7	0	0	0	106
543	T	28.1	Very low	26.8	Very low	133 Å²	133	147.9 Å²	147.9	82%	0.816	78%	0.778	S	S	*	*			cis	-148.5	-165.3	7.2	-6.1	0	0	0	0	106.7
544	G	26.7	Very low	26.9	Very low	76 Å²	76	148.3 Å²	148.3	78%	0.784	78%	0.776	S	S	*	*			cis	138.9	119.7	-2.2	0	0	0	0	0	113
545	G	26.3	Very low	27	Very low	85 Å²	85	151.9 Å²	151.9	88%	0.876	78%	0.784	S	S	*	*			trans	139.3	128.1	173.8	0	0	0	0	0	115.9
546	R	28.1	Very low	27.2	Very low	249 Å²	249	156.5 Å²	156.5	94%	0.94	79%	0.786	S	S	*	*			trans	-103.1	153.7	169.5	-72.6	174	168.2	166.2	-5	110.3
547	V	28	Very low	27.4	Very low	156 Å²	156	154.7 Å²	154.7	95%	0.945	78%	0.778	S	S	*	*			trans	-163.7	175.4	139.9	131.4	0	0	0	0	109.9
548	R	25.9	Very low	27.5	Very low	204 Å²	204	161.9 Å²	161.9	77%	0.77	79%	0.785	S	S	*	*			trans	-138.9	155.7	-156.7	-176.7	-167.8	166.7	160.1	-2.2	111.7
549	R	26.4	Very low	27.6	Very low	185 Å²	185	161.7 Å²	161.7	70%	0.698	78%	0.784	S	S	*	*			trans	104.2	124.9	138.5	-139.1	171	176.2	172.9	-6.1	120.3
550	E	24.9	Very low	28.9	Very low	131 Å²	131	157.8 Å²	157.8	61%	0.612	78%	0.775	S	S	*	*			trans	61.5	154.7	148.2	-77.6	175	87	0	0	119.5
551	N	26.8	Very low	28.4	Very low	107 Å²	107	159 Å²	159	57%	0.572	78%	0.781	S	S	*	*			cis	-153.9	159.7	2.5	-130	-26.6	0	0	0	114.7
552	Q	28.5	Very low	28.3	Very low	145 Å²	145	161.6 Å²	161.6	68%	0.678	79%	0.789	S	S	*	*			trans	40.9	132.8	148.5	-74.4	167.7	39.7	0	0	123.1
553	R	26.7	Very low	28.1	Very low	251 Å²	251	159 Å²	159	95%	0.947	79%	0.788	S	S	*	*				-153.8	160.4	99.8	-106.2	173.2	-171	-162.5	1.8	112.3
554	Q	28.6	Very low	28	Very low	167 Å²	167	159 Å²	159	78%	0.78	79%	0.788	S	S	*	*			trans	-105.9	159.8	-168.8	-61	171	-25.2	0	0	112
555	H	27.1	Very low	27.8	Very low	196 Å²	196	161 Å²	161	91%	0.907	79%	0.788	S	S	*	*				-146.3	156.3	121.7	-121.7	-88.4	0	0	0	112.6
556	R	28.5	Very low	27.8	Very low	233 Å²	233	163.5 Å²	163.5	88%	0.879	79%	0.786	S	S	*	*			trans	-97	164.2	-173.9	-128.4	173.7	177.9	179	-1.8	108.7
557	S	27.4	Very low	27.8	Very low	90 Å²	90	159.6 Å²	159.6	63%	0.629	78%	0.781	S	S	*	*			cis	-174.4	169.6	25.2	57.3	0	0	0	0	114.5
558	R	26.8	Very low	27.8	Very low	246 Å²	246	157.9 Å²	157.9	93%	0.928	77%	0.766	S	S	*	*			trans	92.8	146.3	155.5	-68	179.3	178.6	-175.5	-1.4	119
559	Q	26	Very low	28	Very low	183 Å²	183	156.3 Å²	156.3	86%	0.855	77%	0.767	S	S	*	*			trans	-148.2	177.1	-168.1	-97.3	-176.5	-30.5	0	0	105.9
560	P	51.8	Low	28.1	Very low	98 Å²	98	150.2 Å²	150.2	64%	0.636	76%	0.762	S	S	*	*			cis	-133.9	-143.8	-33.8	37.2	-16.5	0	0	0	110.4
561	T	27.8	Very low	28.3	Very low	121 Å²	121	150.4 Å²	150.4	74%	0.742	77%	0.772	S	S	*	*			trans	75.4	148.1	173.1	73.7	0	0	0	0	115.9
562	E	26.1	Very low	28.7	Very low	183 Å²	183	151.2 Å²	151.2	86%	0.855	78%	0.783	S	S	*	*			cis	-143.8	-162.3	-2.2	-141	158.1	-139.4	0	0	112.8
563	S	24.4	Very low	28.9	Very low	101 Å²	101	151 Å²	151	71%	0.706	79%	0.792	S	S	*	*			trans	-102.4	172.3	-165.2	58.3	0	0	0	0	115.1
564	V	25.2	Very low	29.1	Very low	133 Å²	133	145.6 Å²	145.6	81%	0.806	79%	0.787	S	S	*	*			trans	-176.5	147.9	132.4	142.2	0	0	0	0	110.9
565	C	23	Very low	29.1	Very low	116 Å²	116	145.8 Å²	145.8	78%	0.784	79%	0.79	S	S	*	*			trans	-116.2	162.7	175.2	-59	0	0	0	0	111.5
566	V	24.9	Very low	29	Very low	139 Å²	139	142.5 Å²	142.5	84%	0.842	79%	0.788	S	S	*	*			trans	-136.4	140.5	165.9	179.1	0	0	0	0	111.2
567	M	28.2	Very low	29	Very low	166 Å²	166	139.7 Å²	139.7	82%	0.818	79%	0.787	S	S	*	*			trans	-135.6	167.8	173.3	-60.1	-179.5	179.8	0	0	107.8
568	N	28.7	Very low	29.1	Very low	120 Å²	120	141.5 Å²	141.5	64%	0.642	79%	0.794	S	S	*	*			cis	-140.6	-154	3.3	-140	-26.6	0	0	0	107
569	H	30.5	Very low	29.3	Very low	172 Å²	172	137.8 Å²	137.8	80%	0.796	79%	0.787	S	S	*	*			cis	-156.6	175.9	3.3	-119.6	-34.7	0	0	0	106.5
570	G	27.8	Very low	29.5	Very low	57 Å²	57	136.2 Å²	136.2	59%	0.588	78%	0.784	S	S	*	*			cis	178.6	161.8	-0.4	0	0	0	0	0	110.3
571	V	29	Very low	28.5	Very low	135 Å²	135	138.2 Å²	138.2	82%	0.818	79%	0.789	S	S	*	*			trans	-136	139.4	-176.2	177.1	0	0	0	0	108.7
572	P	36.7	Very low	29.6	Very low	124 Å²	124	138 Å²	138	81%	0.805	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.7	136.3	175.3	31.3	-33.8	0	0	0	112
573	T	32.2	Very low	29.9	Very low	140 Å²	140	134.7 Å²	134.7	86%	0.859	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-97.9	137	178.3	8.4	0	0	0	0	112.2
574	T	30.4	Very low	31.3	Very low	138 Å²	138	135.9 Å²	135.9	85%	0.847	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.4	139.9	166.5	-40.9	0	0	0	0	109.8
575	M	28.1	Very low	32.3	Very low	170 Å²	170	139.8 Å²	139.8	84%	0.837	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-81.1	139.7	178.3	-61.5	-175.2	-175.4	0	0	111.8
576	C	26.6	Very low	32.7	Very low	128 Å²	128	141 Å²	141	87%	0.865	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-94.1	122.4	158.5	-64.4	0	0	0	0	109.1
577	M	28.3	Very low	33.2	Very low	174 Å²	174	141.1 Å²	141.1	86%	0.857	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-90.7	130.6	166.9	-76.6	-170.6	170.1	0	0	110.2
578	T	28.6	Very low	33.4	Very low	128 Å²	128	139.7 Å²	139.7	79%	0.785	82%	0.817	S	S	*	*			trans	-92.9	113.6	171.5	50.8	0	0	0	0	109.9
579	H	30	Very low	33.7	Very low	167 Å²	167	140.8 Å²	140.8	77%	0.773	83%	0.828	S	S	*	*			trans	-82.2	130.7	167.7	-113.4	-103.3	0	0	0	110.2
580	N	31	Very low	33.9	Very low	150 Å²	150	138.9 Å²	138.9	80%	0.802	83%	0.83	S	S	*	*			trans	-108.1	119.5	166.3	-78.3	-21	0	0	0	107.7
581	D	31.4	Very low	34.3	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-99.8	137.9	169.5	-71.7	-35.5	0	0	0	110.8
582	P	50.2	Low	34.7	Very low	118 Å²	118	145 Å²	145	77%	0.766	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-86	142.3	177.5	33.9	-33.5	0	0	0	112.3
583	S	32.5	Very low	34.5	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-70.4	132.5	173.1	54.6	0	0	0	0	112.5
584	P	54.5	Low	34.7	Very low	125 Å²	125	147.2 Å²	147.2	81%	0.812	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-77.8	157.2	164.7	33.5	-33.8	0	0	0	111.8
585	T	45.3	Very low	35.1	Very low	215 Å²	215	148 Å²	148	100%	1.319	85%	0.851	S	S	*	*			trans	-89.3	0	169.9	53.9	0	0	0	0	111.9

Retrieved 585 of 585 residues in 190.5 ms (Link to these results)

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