A0A087YJQ9_POEFO Loading...

Cell division cycle protein 27 homolog

AlphaFold DB , UniProt , Accession A0A087YJQ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 803 aa.

						>A0A087YJQ9_POEFO|A0A087YJQ9
MTVLQEPVQAAVWQALNHYAYLDAVFLAERLYAEVRSEEALYLLATCYYRSGKPYKAYRLLKAHSCSTPQVRFLLAKCCVELSKLAEGEQVLIGGVLNKQKSQDDIITEFGDSASFTLSLLGHIYCKTDRAAKGAECFQRSLTLNPFLWSPFQNLCHLGEKPDPDQVFRLSALQNSSLAPPPPHISPAQNPSHRLDTALMETPQDTLELNRLNLESSNGKLTSDLSISYIDSSLISPETGSLLGNTVSMASAGTLLAKQNKPKSGRSLLGGPAGLSPLTPSFGILPLEPSPGDPTYLQNYSATMETQTTAPSKKAVSRISQSKSVFSQSGNSRDVLPIPFNQSQTSAPHTSGSPQVLSPSMSGPPNVQPRRSSRLFTSASSTAKENSKKLKMKFPTKIPNRKTKCKSAKTANSSNLNESLDILRLDPSLNLPDARMPQYQRAAADSVMALLRELGRGYQALCSYSCREAINILTSLPPQHYNTGWVLTHVGRAYFELAEYMQAERLFSEVRRIESYRVEGMEIYSTTLWHLQKDVALSALAKDLTDMDKNCPEAWCVAGNCFSLQREHDIAIKFFQRAIQVDPGFAYAYTLLGHEFVLTEELDRALACFRNAIRVNNRHYNAWYGLGMIYYKQEKFNLAEIHFKKALSINPQSSVLLCHIGVVQHALKKSDAALETLNRAIGIDPKNPLCKFHRASILFANDKYKAALQELEELKQIVPKESLVYFLIGKVYKKLGQTHLALMNFSWAMDLDPKGANNQIKEAIDKRYLPEDEVAEVDDSQDSSFMTDADDTQLHTPDSDDVL
					

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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	52	Low	76.9	Confident	201 Å²	201	88.6 Å²	88.6	99%	0.99	50%	0.502	S	S	*	.				0	-47.6	0	-76.8	175.8	168.2	0	0	112	V3 L4	M1-V3 PolarHBondContact O-N 3.45Å; M1-L4 PolarHBondContact O-N 2.79Å
2	T	54.6	Low	78.4	Confident	100 Å²	100	81.3 Å²	81.3	61%	0.613	46%	0.46	S	S	*	.	H	α-helix	trans	-35.7	-43.1	174.5	45.8	0	0	0	0	116	L4 Q5	T2-L4 PolarHBondContact O-N 2.95Å; T2-Q5 WeakPolarHBondContact O-CB 3.38Å; T2-Q5 PolarHBondContact O-N 2.63Å
3	V	58.8	Low	79.8	Confident	121 Å²	121	82 Å²	82	73%	0.733	45%	0.451	S	S	*	.	H	α-helix	trans	-54.4	-22.9	178.3	-172.8	0	0	0	0	114.5	M1 P7	M1-V3 PolarHBondContact O-N 3.45Å; V3-P7 VanDerWaalsContact O-CD 3.3Å; V3-P7 WeakPolarHBondContact O-CD 3.22Å; V3-P7 WeakPolarHBondContact O-CG 3.41Å
4	L	63.3	Low	81	Confident	131 Å²	131	85.1 Å²	85.1	69%	0.686	46%	0.461	S	S	*	.	H	α-helix	trans	-94.9	-15.2	174.4	-75.6	168	0	0	0	113.8	M1 T2 V8	M1-L4 PolarHBondContact O-N 2.79Å; T2-L4 PolarHBondContact O-N 2.95Å; L4-V8 VanDerWaalsContact O-CG2 3.25Å; L4-V8 WeakPolarHBondContact O-CG2 3.34Å
5	Q	78.1	Confident	82	Confident	33 Å²	33	80.4 Å²	80.4	15%	0.154	44%	0.438	C	S	.	.	H	α-helix	trans	-73.7	-51.5	-177.9	177.2	175.5	-20.1	0	0	111.2	T2 V8 Q9 L31 E39	T2-Q5 WeakPolarHBondContact O-CB 3.38Å; T2-Q5 PolarHBondContact O-N 2.63Å; Q5-V8 PolarHBondContact O-N 3.13Å; Q5-Q9 HydrophobicContact CG-CG 4.23Å; Q5-Q9 WeakPolarHBondContact O-CB 3.36Å; Q5-Q9 WeakPolarHBondContact O-CG 3.43Å; Q5-Q9 PolarHBondContact O-N 2.94Å; Q5-L31 HydrophobicContact CG-CD1 4.4Å; Q5-E39 PolarHBondContact NE2-OE2 3.37Å
6	E	82.4	Confident	82.8	Confident	141 Å²	141	75.4 Å²	75.4	66%	0.659	41%	0.411	S	S	*	.	H	α-helix	trans	-55.6	-51.3	-179.6	-66	177.9	-179.6	0	0	114.1	V8 Q9 A10	E6-V8 VanDerWaalsContact C-N 3.29Å; E6-V8 PolarHBondContact O-N 2.64Å; E6-Q9 PolarHBondContact O-N 3.29Å; E6-A10 WeakPolarHBondContact O-CB 3.4Å; E6-A10 PolarHBondContact O-N 3.45Å
7	P	89.4	Confident	83.6	Confident	71 Å²	71	76.5 Å²	76.5	46%	0.461	42%	0.417	S	S	.	.	H	α-helix	trans	-65.9	-30.1	179.6	25.2	-34.9	0	0	0	113	V3 A11	V3-P7 VanDerWaalsContact O-CD 3.3Å; V3-P7 WeakPolarHBondContact O-CD 3.22Å; V3-P7 WeakPolarHBondContact O-CG 3.41Å; P7-A11 WeakPolarHBondContact O-CB 3.36Å; P7-A11 PolarHBondContact O-N 3.36Å
8	V	90.1	Very high	84.3	Confident	45 Å²	45	79.7 Å²	79.7	27%	0.273	43%	0.428	S	S	.	.	H	α-helix	trans	-75.6	-41.2	175.9	176.5	0	0	0	0	111.1	L4 Q5 E6 A10 A11 V12 L31	L4-V8 VanDerWaalsContact O-CG2 3.25Å; L4-V8 WeakPolarHBondContact O-CG2 3.34Å; Q5-V8 PolarHBondContact O-N 3.13Å; E6-V8 VanDerWaalsContact C-N 3.29Å; E6-V8 PolarHBondContact O-N 2.64Å; V8-A10 VanDerWaalsContact C-N 3.32Å; V8-A10 PolarHBondContact O-N 3.44Å; V8-A11 PolarHBondContact O-N 3.04Å; V8-V12 WeakPolarHBondContact O-CG2 3.39Å; V8-V12 PolarHBondContact O-N 3.22Å; V8-L31 HydrophobicContact CB-CD1 4.28Å; V8-L31 HydrophobicContact CG1-CB 4.11Å; V8-L31 HydrophobicContact CG1-CD1 4.05Å; V8-L31 HydrophobicContact CG1-CD2 4.29Å; V8-L31 HydrophobicContact CG1-CG 4.37Å
9	Q	90.8	Very high	84.9	Confident	38 Å²	38	84.4 Å²	84.4	18%	0.178	44%	0.44	C	S	.	.	H	α-helix	trans	-58.7	-44.6	171.1	-74.1	178.7	-22.9	0	0	110.9	Q5 E6 V12 W13 L31 E39 L43	Q5-Q9 HydrophobicContact CG-CG 4.23Å; Q5-Q9 WeakPolarHBondContact O-CB 3.36Å; Q5-Q9 WeakPolarHBondContact O-CG 3.43Å; Q5-Q9 PolarHBondContact O-N 2.94Å; E6-Q9 PolarHBondContact O-N 3.29Å; Q9-V12 PolarHBondContact O-N 2.83Å; Q9-W13 VanDerWaalsContact O-CD1 3.24Å; Q9-W13 PolarHBondContact O-N 2.87Å; Q9-L31 HydrophobicContact CG-CD2 3.65Å; Q9-E39 PolarHBondContact NE2-OE2 3.26Å; Q9-L43 HydrophobicContact CB-CD2 4.21Å; Q9-L43 HydrophobicContact CG-CD2 3.95Å
10	A	92.7	Very high	85.5	Confident	58 Å²	58	81.8 Å²	81.8	48%	0.479	43%	0.432	S	S	.	.	H	α-helix	trans	-62.8	-43.4	176.5	0	0	0	0	0	112.4	E6 V8 V12 W13 Q14	E6-A10 WeakPolarHBondContact O-CB 3.4Å; E6-A10 PolarHBondContact O-N 3.45Å; V8-A10 VanDerWaalsContact C-N 3.32Å; V8-A10 PolarHBondContact O-N 3.44Å; A10-V12 PolarHBondContact O-N 2.7Å; A10-W13 PolarHBondContact O-N 3.49Å; A10-Q14 WeakPolarHBondContact O-CB 3.4Å; A10-Q14 PolarHBondContact O-N 3.04Å
11	A	94.4	Very high	86	Confident	36 Å²	36	81.7 Å²	81.7	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-63.3	-39.3	175.5	0	0	0	0	0	112.5	P7 V8 Q14 A15	P7-A11 WeakPolarHBondContact O-CB 3.36Å; P7-A11 PolarHBondContact O-N 3.36Å; V8-A11 PolarHBondContact O-N 3.04Å; A11-Q14 PolarHBondContact O-N 3Å; A11-A15 WeakPolarHBondContact O-CB 3.37Å; A11-A15 PolarHBondContact O-N 2.84Å
12	V	94.9	Very high	88.2	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-63.1	-46	172.9	172	0	0	0	0	110.9	V8 Q9 A10 Q14 A15 L16 A24 L27 A28 L43 C47	V8-V12 WeakPolarHBondContact O-CG2 3.39Å; V8-V12 PolarHBondContact O-N 3.22Å; Q9-V12 PolarHBondContact O-N 2.83Å; A10-V12 PolarHBondContact O-N 2.7Å; V12-Q14 PolarHBondContact O-N 2.87Å; V12-A15 PolarHBondContact O-N 3.17Å; V12-L16 HydrophobicContact CG1-CD1 4.26Å; V12-L16 HydrophobicContact CG1-CG 4.39Å; V12-L16 WeakPolarHBondContact O-CG 3.01Å; V12-L16 PolarHBondContact O-N 2.67Å; V12-A24 HydrophobicContact CG1-CB 4.38Å; V12-L27 HydrophobicContact CG2-CB 3.54Å; V12-L27 HydrophobicContact CG2-CD1 4.5Å; V12-A28 HydrophobicContact CG1-CB 4.27Å; V12-A28 HydrophobicContact CG2-CB 4.35Å; V12-L43 HydrophobicContact CB-CD2 4.06Å; V12-L43 HydrophobicContact CG1-CD1 3.8Å; V12-L43 HydrophobicContact CG1-CD2 3.9Å; V12-L43 HydrophobicContact CG1-CG 3.79Å; V12-C47 WeakPolarHBondContact CG1-SG 3.37Å
13	W	95.6	Very high	90.1	Very high	91 Å²	91	78.8 Å²	78.8	35%	0.345	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-40	176.2	-82	116.6	0	0	0	112.6	Q9 A10 L16 N17 L43 T46	Q9-W13 VanDerWaalsContact O-CD1 3.24Å; Q9-W13 PolarHBondContact O-N 2.87Å; A10-W13 PolarHBondContact O-N 3.49Å; W13-L16 HydrophobicContact CD2-CD1 4.49Å; W13-L16 HydrophobicContact CE3-CD1 3.91Å; W13-L16 HydrophobicContact CZ3-CD1 4.03Å; W13-L16 PolarHBondContact O-N 3.4Å; W13-N17 WeakPolarHBondContact O-CB 3.44Å; W13-N17 PolarHBondContact O-N 3.41Å; W13-N17 PolarHBondContact O-ND2 3.19Å; W13-N17 PolarHBondContact O-OD1 3.16Å; W13-L43 HydrophobicContact CD2-CD1 4.21Å; W13-L43 HydrophobicContact CZ2-CD1 3.9Å; W13-T46 HydrophobicContact CH2-CG2 4.07Å; W13-T46 HydrophobicContact CZ3-CG2 4.47Å
14	Q	96.6	Very high	91.9	Very high	125 Å²	125	73 Å²	73	58%	0.584	38%	0.375	S	S	*	.	H	α-helix	trans	-60.3	-47.8	173.1	-174.4	177.5	-2.6	0	0	110.9	A10 A11 V12 L16 N17 H18	A10-Q14 WeakPolarHBondContact O-CB 3.4Å; A10-Q14 PolarHBondContact O-N 3.04Å; A11-Q14 PolarHBondContact O-N 3Å; V12-Q14 PolarHBondContact O-N 2.87Å; Q14-L16 PolarHBondContact O-N 2.99Å; Q14-N17 PolarHBondContact O-N 2.89Å; Q14-H18 PolarHBondContact O-N 2.76Å; Q14-H18 PolarHBondContact O-ND1 2.96Å
15	A	95.9	Very high	93.5	Very high	15 Å²	15	67.8 Å²	67.8	12%	0.124	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-41.9	176.6	0	0	0	0	0	112.2	A11 V12 N17 H18 Y19 A20 A24	A11-A15 WeakPolarHBondContact O-CB 3.37Å; A11-A15 PolarHBondContact O-N 2.84Å; V12-A15 PolarHBondContact O-N 3.17Å; A15-N17 VanDerWaalsContact C-N 3.33Å; A15-N17 PolarHBondContact O-N 2.91Å; A15-H18 CarbonylContact O-C 3.49Å; A15-H18 PolarHBondContact O-N 2.87Å; A15-Y19 PolarHBondContact O-N 3.45Å; A15-Y19 VanDerWaalsContact O-N 3.13Å; A15-A20 HydrophobicContact CB-CB 4.16Å; A15-A20 PolarHBondContact O-N 3.37Å; A15-A24 HydrophobicContact CB-CB 3.81Å
16	L	95.4	Very high	94.4	Very high	0 Å²	0	72 Å²	72	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-62.8	-35.9	174.5	-72.6	179	0	0	0	113.3	V12 W13 Q14 H18 Y19 Y21 A24 L43 T46 C47 R50	V12-L16 HydrophobicContact CG1-CD1 4.26Å; V12-L16 HydrophobicContact CG1-CG 4.39Å; V12-L16 WeakPolarHBondContact O-CG 3.01Å; V12-L16 PolarHBondContact O-N 2.67Å; W13-L16 HydrophobicContact CD2-CD1 4.49Å; W13-L16 HydrophobicContact CE3-CD1 3.91Å; W13-L16 HydrophobicContact CZ3-CD1 4.03Å; W13-L16 PolarHBondContact O-N 3.4Å; Q14-L16 PolarHBondContact O-N 2.99Å; L16-H18 VanDerWaalsContact C-N 3.34Å; L16-Y19 PolarHBondContact O-N 3.11Å; L16-Y21 HydrophobicContact CD2-CD1 4.21Å; L16-A24 HydrophobicContact CD2-CB 3.61Å; L16-A24 HydrophobicContact CG-CB 3.86Å; L16-L43 HydrophobicContact CD1-CD1 4.35Å; L16-T46 HydrophobicContact CD1-CG2 4.36Å; L16-C47 HydrophobicContact CD2-CB 4.26Å; L16-R50 HydrophobicContact CD2-CB 4.38Å
17	N	96	Very high	94.9	Very high	95 Å²	95	68.3 Å²	68.3	51%	0.508	35%	0.351	S	S	.	.	H	α-helix	trans	-78.4	-19.6	179.6	-66.4	-12.6	0	0	0	112.7	W13 Q14 A15 R50	W13-N17 WeakPolarHBondContact O-CB 3.44Å; W13-N17 PolarHBondContact O-N 3.41Å; W13-N17 PolarHBondContact O-ND2 3.19Å; W13-N17 PolarHBondContact O-OD1 3.16Å; Q14-N17 PolarHBondContact O-N 2.89Å; A15-N17 VanDerWaalsContact C-N 3.33Å; A15-N17 PolarHBondContact O-N 2.91Å; N17-R50 PolarHBondContact OD1-NH1 3.41Å
18	H	96.6	Very high	95.2	Very high	133 Å²	133	65 Å²	65	62%	0.616	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	12.1	169.8	-63.8	77.3	0	0	0	112.6	Q14 A15 L16 A20	Q14-H18 PolarHBondContact O-N 2.76Å; Q14-H18 PolarHBondContact O-ND1 2.96Å; A15-H18 CarbonylContact O-C 3.49Å; A15-H18 PolarHBondContact O-N 2.87Å; L16-H18 VanDerWaalsContact C-N 3.34Å; H18-A20 PolarHBondContact O-N 3.14Å; H18-A20 VanDerWaalsContact O-N 3.09Å
19	Y	96.4	Very high	95.5	Very high	169 Å²	169	65.4 Å²	65.4	66%	0.663	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	18.7	-179	-45.4	-63.7	0	0	0	115.5	A15 L16 Y21	A15-Y19 PolarHBondContact O-N 3.45Å; A15-Y19 VanDerWaalsContact O-N 3.13Å; L16-Y19 PolarHBondContact O-N 3.11Å; Y19-Y21 HydrophobicContact CD1-CE1 4.43Å; Y19-Y21 AromaticContact CD1-CZ 3.98Å; Y19-Y21 WeakPolarHBondContact CD1-OH 3.4Å; Y19-Y21 WeakPolarHBondContact O-CD2 3.29Å; Y19-Y21 PolarHBondContact O-N 2.75Å
20	A	96.6	Very high	95.7	Very high	33 Å²	33	69.7 Å²	69.7	27%	0.273	34%	0.343	S	S	.	.			trans	-76.7	62.9	176	0	0	0	0	0	110.9	A15 H18 L22 D23 A24	A15-A20 HydrophobicContact CB-CB 4.16Å; A15-A20 PolarHBondContact O-N 3.37Å; H18-A20 PolarHBondContact O-N 3.14Å; H18-A20 VanDerWaalsContact O-N 3.09Å; A20-L22 VanDerWaalsContact C-N 3.28Å; A20-L22 PolarHBondContact O-N 2.83Å; A20-D23 PolarHBondContact O-N 2.87Å; A20-A24 WeakPolarHBondContact O-CB 3.26Å; A20-A24 PolarHBondContact O-N 3.11Å
21	Y	96.1	Very high	95.7	Very high	79 Å²	79	67.5 Å²	67.5	31%	0.31	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-28.2	-169.1	-59.3	-53.8	0	0	0	114.3	L16 Y19 V25 R50	L16-Y21 HydrophobicContact CD2-CD1 4.21Å; Y19-Y21 HydrophobicContact CD1-CE1 4.43Å; Y19-Y21 AromaticContact CD1-CZ 3.98Å; Y19-Y21 WeakPolarHBondContact CD1-OH 3.4Å; Y19-Y21 WeakPolarHBondContact O-CD2 3.29Å; Y19-Y21 PolarHBondContact O-N 2.75Å; Y21-V25 VanDerWaalsContact O-CB 3.26Å; Y21-V25 WeakPolarHBondContact O-CB 3.11Å; Y21-V25 WeakPolarHBondContact O-CG2 3.35Å; Y21-V25 PolarHBondContact O-N 3.23Å; Y21-R50 HydrophobicContact CD1-CB 4.36Å; Y21-R50 HydrophobicContact CE1-CB 3.88Å
22	L	96.5	Very high	95.6	Very high	142 Å²	142	67.7 Å²	67.7	74%	0.743	32%	0.317	S	S	*	.	H	α-helix	trans	-68.9	-49.1	178.4	-67.8	176.1	0	0	0	110.9	A20 V25 F26	A20-L22 VanDerWaalsContact C-N 3.28Å; A20-L22 PolarHBondContact O-N 2.83Å; L22-V25 PolarHBondContact O-N 2.69Å; L22-F26 WeakPolarHBondContact O-CB 3.39Å; L22-F26 PolarHBondContact O-N 3.36Å
23	D	96.1	Very high	95.5	Very high	99 Å²	99	70.3 Å²	70.3	53%	0.529	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-42	179.2	-49.7	-74	0	0	0	111.1	A20 V25 F26 L27	A20-D23 PolarHBondContact O-N 2.87Å; D23-V25 PolarHBondContact O-N 2.91Å; D23-F26 PolarHBondContact O-N 3.44Å; D23-L27 WeakPolarHBondContact O-CB 3.47Å; D23-L27 VanDerWaalsContact O-CG 3.32Å; D23-L27 WeakPolarHBondContact O-CG 3.43Å; D23-L27 PolarHBondContact O-N 2.91Å
24	A	96.1	Very high	95.3	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-58.6	-47.7	174.3	0	0	0	0	0	112.3	V12 A15 L16 A20 A28	V12-A24 HydrophobicContact CG1-CB 4.38Å; A15-A24 HydrophobicContact CB-CB 3.81Å; L16-A24 HydrophobicContact CD2-CB 3.61Å; L16-A24 HydrophobicContact CG-CB 3.86Å; A20-A24 WeakPolarHBondContact O-CB 3.26Å; A20-A24 PolarHBondContact O-N 3.11Å; A24-A28 WeakPolarHBondContact O-CB 3.49Å; A24-A28 PolarHBondContact O-N 3.27Å
25	V	96.4	Very high	94.8	Very high	20 Å²	20	70.2 Å²	70.2	12%	0.121	35%	0.345	C	S	.	.	H	α-helix	trans	-64.3	-45.8	176.2	165.4	0	0	0	0	111	Y21 L22 D23 L27 A28 E29 C47 Y48	Y21-V25 VanDerWaalsContact O-CB 3.26Å; Y21-V25 WeakPolarHBondContact O-CB 3.11Å; Y21-V25 WeakPolarHBondContact O-CG2 3.35Å; Y21-V25 PolarHBondContact O-N 3.23Å; L22-V25 PolarHBondContact O-N 2.69Å; D23-V25 PolarHBondContact O-N 2.91Å; V25-L27 PolarHBondContact O-N 3.2Å; V25-A28 PolarHBondContact O-N 3.45Å; V25-E29 HydrophobicContact CG1-CG 4.32Å; V25-E29 WeakPolarHBondContact O-CB 3.48Å; V25-E29 WeakPolarHBondContact O-CG 3.26Å; V25-E29 PolarHBondContact O-N 3.14Å; V25-C47 HydrophobicContact CG2-CB 3.66Å; V25-Y48 HydrophobicContact CG1-CD1 4.07Å; V25-Y48 HydrophobicContact CG1-CE1 3.48Å; V25-Y48 VanDerWaalsContact CG1-CE1 3.48Å; V25-Y48 HydrophobicContact CG2-CD1 4.01Å; V25-Y48 HydrophobicContact CG2-CE1 4.28Å
26	F	96.3	Very high	94.3	Very high	122 Å²	122	78.8 Å²	78.8	54%	0.535	38%	0.375	S	S	.	.	H	α-helix	trans	-61.2	-47.9	-178.5	178.5	-99.5	0	0	0	112	L22 D23 E29 R30	L22-F26 WeakPolarHBondContact O-CB 3.39Å; L22-F26 PolarHBondContact O-N 3.36Å; D23-F26 PolarHBondContact O-N 3.44Å; F26-E29 PolarHBondContact O-N 3.31Å; F26-R30 HydrophobicContact CE1-CG 4.23Å; F26-R30 HydrophobicContact CZ-CG 4.27Å; F26-R30 WeakPolarHBondContact O-CG 3.25Å; F26-R30 PolarHBondContact O-N 2.98Å
27	L	94.7	Very high	94	Very high	63 Å²	63	80.3 Å²	80.3	33%	0.33	39%	0.385	S	S	.	.	H	α-helix	trans	-63.9	-42.1	176.7	-70.8	173.1	0	0	0	111.7	V12 D23 V25 R30 L31	V12-L27 HydrophobicContact CG2-CB 3.54Å; V12-L27 HydrophobicContact CG2-CD1 4.5Å; D23-L27 WeakPolarHBondContact O-CB 3.47Å; D23-L27 VanDerWaalsContact O-CG 3.32Å; D23-L27 WeakPolarHBondContact O-CG 3.43Å; D23-L27 PolarHBondContact O-N 2.91Å; V25-L27 PolarHBondContact O-N 3.2Å; L27-R30 PolarHBondContact O-N 2.97Å; L27-L31 WeakPolarHBondContact O-CB 3.44Å; L27-L31 PolarHBondContact O-N 3.01Å
28	A	95	Very high	93.6	Very high	1 Å²	1	79.5 Å²	79.5	1%	0.008	38%	0.378	C	S	.	.	H	α-helix	trans	-66.2	-35.9	176.4	0	0	0	0	0	112.8	V12 A24 V25 L31 Y32 L44 C47	V12-A28 HydrophobicContact CG1-CB 4.27Å; V12-A28 HydrophobicContact CG2-CB 4.35Å; A24-A28 WeakPolarHBondContact O-CB 3.49Å; A24-A28 PolarHBondContact O-N 3.27Å; V25-A28 PolarHBondContact O-N 3.45Å; A28-L31 PolarHBondContact O-N 3.23Å; A28-Y32 WeakPolarHBondContact O-CB 3.46Å; A28-Y32 PolarHBondContact O-N 3.45Å; A28-L44 HydrophobicContact CB-CB 4.06Å; A28-L44 HydrophobicContact CB-CD1 3.91Å; A28-C47 HydrophobicContact CB-CB 4.49Å
29	E	95.4	Very high	93.2	Very high	55 Å²	55	78.3 Å²	78.3	26%	0.257	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-41.7	172.8	-78.6	-176.7	-168.8	0	0	111.6	V25 F26 A33 L44 Y48	V25-E29 HydrophobicContact CG1-CG 4.32Å; V25-E29 WeakPolarHBondContact O-CB 3.48Å; V25-E29 WeakPolarHBondContact O-CG 3.26Å; V25-E29 PolarHBondContact O-N 3.14Å; F26-E29 PolarHBondContact O-N 3.31Å; E29-A33 VanDerWaalsContact O-CB 3.3Å; E29-A33 WeakPolarHBondContact O-CB 3.47Å; E29-A33 PolarHBondContact O-N 3.43Å; E29-L44 HydrophobicContact CB-CD1 4.44Å; E29-L44 HydrophobicContact CG-CD1 3.67Å; E29-L44 HydrophobicContact CG-CD2 4.36Å; E29-Y48 PolarHBondContact OE1-OH 2.96Å
30	R	95.1	Very high	92.9	Very high	128 Å²	128	70.3 Å²	70.3	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-66.4	-46.7	176.4	-63.3	-42.5	90.9	-178.7	5.5	110.9	F26 L27 Y32 A33 E34	F26-R30 HydrophobicContact CE1-CG 4.23Å; F26-R30 HydrophobicContact CZ-CG 4.27Å; F26-R30 WeakPolarHBondContact O-CG 3.25Å; F26-R30 PolarHBondContact O-N 2.98Å; L27-R30 PolarHBondContact O-N 2.97Å; R30-Y32 PolarHBondContact O-N 3.38Å; R30-A33 PolarHBondContact O-N 2.92Å; R30-E34 WeakPolarHBondContact O-CB 3.09Å; R30-E34 PolarHBondContact O-N 3.09Å
31	L	92.6	Very high	92.7	Very high	11 Å²	11	68.8 Å²	68.8	6%	0.058	33%	0.329	C	S	.	.	H	α-helix	trans	-59	-44.2	178.3	-177.8	68	0	0	0	112.1	Q5 V8 Q9 L27 A28 V35 A40 L43	Q5-L31 HydrophobicContact CG-CD1 4.4Å; V8-L31 HydrophobicContact CB-CD1 4.28Å; V8-L31 HydrophobicContact CG1-CB 4.11Å; V8-L31 HydrophobicContact CG1-CD1 4.05Å; V8-L31 HydrophobicContact CG1-CD2 4.29Å; V8-L31 HydrophobicContact CG1-CG 4.37Å; Q9-L31 HydrophobicContact CG-CD2 3.65Å; L27-L31 WeakPolarHBondContact O-CB 3.44Å; L27-L31 PolarHBondContact O-N 3.01Å; A28-L31 PolarHBondContact O-N 3.23Å; L31-V35 HydrophobicContact CD1-CG2 3.92Å; L31-V35 WeakPolarHBondContact O-CB 3.49Å; L31-V35 PolarHBondContact O-N 2.97Å; L31-A40 HydrophobicContact CD2-CB 4.29Å; L31-A40 HydrophobicContact CG-CB 4.13Å; L31-L43 HydrophobicContact CD2-CD2 4.11Å
32	Y	92.7	Very high	92.5	Very high	41 Å²	41	67.7 Å²	67.7	16%	0.161	33%	0.325	C	S	.	.	H	α-helix	trans	-69.3	-38.6	177.8	-178.2	-114	0	0	0	112.4	A28 R30 E34 R36 A40 L41 L44 H64	A28-Y32 WeakPolarHBondContact O-CB 3.46Å; A28-Y32 PolarHBondContact O-N 3.45Å; R30-Y32 PolarHBondContact O-N 3.38Å; Y32-E34 VanDerWaalsContact C-N 3.32Å; Y32-E34 PolarHBondContact O-N 3.13Å; Y32-R36 VanDerWaalsContact O-CA 3.25Å; Y32-R36 WeakPolarHBondContact O-CA 3.49Å; Y32-R36 VanDerWaalsContact O-CG 3.24Å; Y32-R36 WeakPolarHBondContact O-CG 3.42Å; Y32-R36 PolarHBondContact O-N 2.83Å; Y32-A40 HydrophobicContact CD2-CB 4.03Å; Y32-L41 HydrophobicContact CD2-CB 4.01Å; Y32-L41 HydrophobicContact CE1-CD1 4.18Å; Y32-L41 HydrophobicContact CE2-CB 3.68Å; Y32-L41 HydrophobicContact CE2-CD1 3.98Å; Y32-L41 HydrophobicContact CE2-CG 4.39Å; Y32-L44 HydrophobicContact CD1-CD2 3.91Å; Y32-L44 HydrophobicContact CG-CD2 4.13Å; Y32-H64 PolarHBondContact OH-CD2 3.28Å; Y32-H64 VanDerWaalsContact OH-CD2 3.3Å; Y32-H64 PolarHBondContact OH-NE2 3.18Å
33	A	92.5	Very high	92.4	Very high	55 Å²	55	61.1 Å²	61.1	46%	0.455	29%	0.29	S	S	.	.	H	α-helix	trans	-62.6	-39.1	176.3	0	0	0	0	0	112.8	E29 R30	E29-A33 VanDerWaalsContact O-CB 3.3Å; E29-A33 WeakPolarHBondContact O-CB 3.47Å; E29-A33 PolarHBondContact O-N 3.43Å; R30-A33 PolarHBondContact O-N 2.92Å
34	E	91.3	Very high	92.3	Very high	155 Å²	155	56.7 Å²	56.7	72%	0.724	27%	0.266	S	S	*	.	H	α-helix	trans	-75.8	-54.3	-179.2	-170.8	70.9	-165.2	0	0	112.5	R30 Y32	R30-E34 WeakPolarHBondContact O-CB 3.09Å; R30-E34 PolarHBondContact O-N 3.09Å; Y32-E34 VanDerWaalsContact C-N 3.32Å; Y32-E34 PolarHBondContact O-N 3.13Å
35	V	87.3	Confident	92.3	Very high	58 Å²	58	56.7 Å²	56.7	35%	0.352	27%	0.266	S	S	.	.	H	α-helix	trans	-94.7	-29.8	-169	-174.9	0	0	0	0	112.9	L31 S37	L31-V35 HydrophobicContact CD1-CG2 3.92Å; L31-V35 WeakPolarHBondContact O-CB 3.49Å; L31-V35 PolarHBondContact O-N 2.97Å; V35-S37 PolarHBondContact O-N 3.09Å
36	R	85.8	Confident	92.2	Very high	196 Å²	196	56.1 Å²	56.1	74%	0.74	26%	0.263	S	S	*	.			trans	51.8	22.5	-178.5	-59.3	-175	-179.3	-159.9	0	116.2	Y32	Y32-R36 VanDerWaalsContact O-CA 3.25Å; Y32-R36 WeakPolarHBondContact O-CA 3.49Å; Y32-R36 VanDerWaalsContact O-CG 3.24Å; Y32-R36 WeakPolarHBondContact O-CG 3.42Å; Y32-R36 PolarHBondContact O-N 2.83Å
37	S	88.9	Confident	92.2	Very high	31 Å²	31	50.3 Å²	50.3	22%	0.217	24%	0.238	C	C	.	.			trans	-74.1	156	176.8	61.8	0	0	0	0	112.8	V35 E39 A40 L41	V35-S37 PolarHBondContact O-N 3.09Å; S37-E39 PolarHBondContact O-N 2.87Å; S37-A40 PolarHBondContact O-N 3.16Å; S37-A40 WeakPolarHBondContact OG-CB 3.24Å; S37-A40 PolarHBondContact OG-N 2.99Å; S37-L41 PolarHBondContact O-N 2.66Å
38	E	86.8	Confident	92.3	Very high	78 Å²	78	48.7 Å²	48.7	36%	0.364	23%	0.228	S	C	.	.	H	α-helix	trans	-62.6	-30.3	174.3	-62.1	-164.7	109.6	0	0	112.1	L41 Y42 C66 S67 T68	E38-L41 PolarHBondContact O-N 3.15Å; E38-Y42 WeakPolarHBondContact O-CB 3.5Å; E38-Y42 PolarHBondContact O-N 3Å; E38-C66 HydrophobicContact CG-CB 4.41Å; E38-C66 WeakPolarHBondContact OE1-CA 3.31Å; E38-C66 WeakPolarHBondContact OE1-CB 3.23Å; E38-C66 PolarHBondContact OE1-SG 3.25Å; E38-S67 PolarHBondContact OE1-N 3.26Å; E38-T68 HydrophobicContact CB-CG2 4.22Å; E38-T68 WeakPolarHBondContact OE2-CG2 3.4Å
39	E	88.3	Confident	92.3	Very high	109 Å²	109	51.6 Å²	51.6	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-63.5	-46.4	171.4	-64.2	175.1	-172.9	0	0	112.4	Q5 Q9 S37 L41 Y42 L43	Q5-E39 PolarHBondContact NE2-OE2 3.37Å; Q9-E39 PolarHBondContact NE2-OE2 3.26Å; S37-E39 PolarHBondContact O-N 2.87Å; E39-L41 VanDerWaalsContact C-N 3.3Å; E39-L41 PolarHBondContact O-N 2.98Å; E39-Y42 PolarHBondContact O-N 3.12Å; E39-L43 WeakPolarHBondContact O-CB 3.49Å; E39-L43 PolarHBondContact O-N 3.46Å
40	A	90.3	Very high	92.3	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-67.9	-33.6	178.8	0	0	0	0	0	111.2	L31 Y32 S37 L44	L31-A40 HydrophobicContact CD2-CB 4.29Å; L31-A40 HydrophobicContact CG-CB 4.13Å; Y32-A40 HydrophobicContact CD2-CB 4.03Å; S37-A40 PolarHBondContact O-N 3.16Å; S37-A40 WeakPolarHBondContact OG-CB 3.24Å; S37-A40 PolarHBondContact OG-N 2.99Å; A40-L44 VanDerWaalsContact O-CB 3.31Å; A40-L44 WeakPolarHBondContact O-CB 3.38Å; A40-L44 PolarHBondContact O-N 3.42Å
41	L	92.3	Very high	92.3	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-48.7	170.4	-178	71	0	0	0	111.6	Y32 S37 E38 E39 L43 L44 A45 L60 L61 H64 C66	Y32-L41 HydrophobicContact CD2-CB 4.01Å; Y32-L41 HydrophobicContact CE1-CD1 4.18Å; Y32-L41 HydrophobicContact CE2-CB 3.68Å; Y32-L41 HydrophobicContact CE2-CD1 3.98Å; Y32-L41 HydrophobicContact CE2-CG 4.39Å; S37-L41 PolarHBondContact O-N 2.66Å; E38-L41 PolarHBondContact O-N 3.15Å; E39-L41 VanDerWaalsContact C-N 3.3Å; E39-L41 PolarHBondContact O-N 2.98Å; L41-L43 VanDerWaalsContact C-N 3.34Å; L41-L43 PolarHBondContact O-N 3.47Å; L41-L44 PolarHBondContact O-N 3.36Å; L41-A45 WeakPolarHBondContact O-CB 3.36Å; L41-A45 PolarHBondContact O-N 2.81Å; L41-L60 HydrophobicContact CD1-CD1 3.72Å; L41-L60 HydrophobicContact CD1-CD2 4.05Å; L41-L60 HydrophobicContact CD1-CG 3.66Å; L41-L61 HydrophobicContact CD1-CD2 4.34Å; L41-L61 HydrophobicContact CD2-CD2 4.03Å; L41-L61 HydrophobicContact CG-CD2 3.82Å; L41-H64 HydrophobicContact CD1-CB 4.44Å; L41-H64 HydrophobicContact CD2-CB 3.83Å; L41-C66 HydrophobicContact CD2-CB 3.96Å; L41-C66 WeakPolarHBondContact CD2-SG 3.36Å
42	Y	92.8	Very high	92.4	Very high	55 Å²	55	50.9 Å²	50.9	22%	0.216	26%	0.255	C	S	.	.	H	α-helix	trans	-60.3	-43.1	177.1	173.5	-111.8	0	0	0	111.8	E38 E39 A45 T46 Q70 V71 L74	E38-Y42 WeakPolarHBondContact O-CB 3.5Å; E38-Y42 PolarHBondContact O-N 3Å; E39-Y42 PolarHBondContact O-N 3.12Å; Y42-A45 PolarHBondContact O-N 3.07Å; Y42-T46 VanDerWaalsContact O-CB 3.32Å; Y42-T46 WeakPolarHBondContact O-CB 3.47Å; Y42-T46 PolarHBondContact O-N 2.97Å; Y42-T46 PolarHBondContact O-OG1 3.39Å; Y42-Q70 HydrophobicContact CD1-CB 4.49Å; Y42-Q70 HydrophobicContact CD2-CB 3.95Å; Y42-Q70 HydrophobicContact CE1-CB 4.32Å; Y42-Q70 HydrophobicContact CE2-CB 3.76Å; Y42-Q70 HydrophobicContact CG-CB 4.31Å; Y42-V71 HydrophobicContact CD2-CG2 4.2Å; Y42-V71 HydrophobicContact CG-CG2 4.42Å; Y42-L74 HydrophobicContact CD2-CD2 4.01Å; Y42-L74 HydrophobicContact CE2-CB 4.17Å; Y42-L74 HydrophobicContact CE2-CD2 3.89Å
43	L	93.9	Very high	92.5	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-47.6	178	-173.8	57.6	0	0	0	111.3	Q9 V12 W13 L16 L31 E39 L41 A45 T46 C47	Q9-L43 HydrophobicContact CB-CD2 4.21Å; Q9-L43 HydrophobicContact CG-CD2 3.95Å; V12-L43 HydrophobicContact CB-CD2 4.06Å; V12-L43 HydrophobicContact CG1-CD1 3.8Å; V12-L43 HydrophobicContact CG1-CD2 3.9Å; V12-L43 HydrophobicContact CG1-CG 3.79Å; W13-L43 HydrophobicContact CD2-CD1 4.21Å; W13-L43 HydrophobicContact CZ2-CD1 3.9Å; L16-L43 HydrophobicContact CD1-CD1 4.35Å; L31-L43 HydrophobicContact CD2-CD2 4.11Å; E39-L43 WeakPolarHBondContact O-CB 3.49Å; E39-L43 PolarHBondContact O-N 3.46Å; L41-L43 VanDerWaalsContact C-N 3.34Å; L41-L43 PolarHBondContact O-N 3.47Å; L43-A45 PolarHBondContact O-N 3.49Å; L43-T46 CarbonylContact O-C 3.58Å; L43-T46 WeakPolarHBondContact O-CA 3.38Å; L43-T46 WeakPolarHBondContact O-CB 3.45Å; L43-T46 PolarHBondContact O-N 2.84Å; L43-T46 VanDerWaalsContact O-N 3.13Å; L43-C47 PolarHBondContact O-N 2.95Å; L43-C47 PolarHBondContact O-SG 3.3Å
44	L	94.6	Very high	92.5	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-41.9	175.7	176.8	57.7	0	0	0	112.5	A28 E29 Y32 A40 L41 T46 C47 Y48 L60	A28-L44 HydrophobicContact CB-CB 4.06Å; A28-L44 HydrophobicContact CB-CD1 3.91Å; E29-L44 HydrophobicContact CB-CD1 4.44Å; E29-L44 HydrophobicContact CG-CD1 3.67Å; E29-L44 HydrophobicContact CG-CD2 4.36Å; Y32-L44 HydrophobicContact CD1-CD2 3.91Å; Y32-L44 HydrophobicContact CG-CD2 4.13Å; A40-L44 VanDerWaalsContact O-CB 3.31Å; A40-L44 WeakPolarHBondContact O-CB 3.38Å; A40-L44 PolarHBondContact O-N 3.42Å; L41-L44 PolarHBondContact O-N 3.36Å; L44-T46 VanDerWaalsContact C-N 3.32Å; L44-T46 PolarHBondContact O-N 2.95Å; L44-C47 WeakPolarHBondContact O-CB 3.48Å; L44-C47 PolarHBondContact O-N 3.17Å; L44-Y48 HydrophobicContact CD1-CD2 4.19Å; L44-Y48 HydrophobicContact CD1-CE1 4.48Å; L44-Y48 HydrophobicContact CD1-CE2 3.76Å; L44-Y48 HydrophobicContact CD2-CE2 4.38Å; L44-Y48 HydrophobicContact CG-CD2 4.24Å; L44-Y48 HydrophobicContact CG-CE2 3.9Å; L44-Y48 PolarHBondContact O-N 3.35Å; L44-L60 HydrophobicContact CB-CD2 4.21Å; L44-L60 HydrophobicContact CD2-CD2 3.83Å; L44-L60 HydrophobicContact CG-CD2 3.68Å
45	A	94.7	Very high	92.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-39.4	173.5	0	0	0	0	0	111.8	L41 Y42 L43 Y48 Y49 A57 L60 L61 L74	L41-A45 WeakPolarHBondContact O-CB 3.36Å; L41-A45 PolarHBondContact O-N 2.81Å; Y42-A45 PolarHBondContact O-N 3.07Å; L43-A45 PolarHBondContact O-N 3.49Å; A45-Y48 PolarHBondContact O-N 2.89Å; A45-Y49 VanDerWaalsContact O-CB 3.29Å; A45-Y49 WeakPolarHBondContact O-CB 3.16Å; A45-Y49 PolarHBondContact O-N 3.15Å; A45-A57 HydrophobicContact CB-CB 4.37Å; A45-A57 WeakPolarHBondContact O-CB 3.15Å; A45-L60 HydrophobicContact CB-CD2 4.14Å; A45-L61 HydrophobicContact CB-CD1 3.82Å; A45-L61 HydrophobicContact CB-CD2 3.57Å; A45-L61 HydrophobicContact CB-CG 3.67Å; A45-L74 HydrophobicContact CB-CD2 3.73Å
46	T	95.6	Very high	93.1	Very high	9 Å²	9	50.7 Å²	50.7	6%	0.055	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-40.4	174.7	-61.3	0	0	0	0	111.4	W13 L16 Y42 L43 L44 Y49 R50	W13-T46 HydrophobicContact CH2-CG2 4.07Å; W13-T46 HydrophobicContact CZ3-CG2 4.47Å; L16-T46 HydrophobicContact CD1-CG2 4.36Å; Y42-T46 VanDerWaalsContact O-CB 3.32Å; Y42-T46 WeakPolarHBondContact O-CB 3.47Å; Y42-T46 PolarHBondContact O-N 2.97Å; Y42-T46 PolarHBondContact O-OG1 3.39Å; L43-T46 CarbonylContact O-C 3.58Å; L43-T46 WeakPolarHBondContact O-CA 3.38Å; L43-T46 WeakPolarHBondContact O-CB 3.45Å; L43-T46 PolarHBondContact O-N 2.84Å; L43-T46 VanDerWaalsContact O-N 3.13Å; L44-T46 VanDerWaalsContact C-N 3.32Å; L44-T46 PolarHBondContact O-N 2.95Å; T46-Y49 PolarHBondContact O-N 3.21Å; T46-R50 HydrophobicContact CG2-CG 4.4Å; T46-R50 WeakPolarHBondContact O-CB 3.37Å; T46-R50 WeakPolarHBondContact O-CG 3.44Å; T46-R50 PolarHBondContact O-N 2.53Å
47	C	96.4	Very high	93.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-47.6	173.3	-61.4	0	0	0	0	111.8	V12 L16 V25 A28 L43 L44 Y49 S51	V12-C47 WeakPolarHBondContact CG1-SG 3.37Å; L16-C47 HydrophobicContact CD2-CB 4.26Å; V25-C47 HydrophobicContact CG2-CB 3.66Å; A28-C47 HydrophobicContact CB-CB 4.49Å; L43-C47 PolarHBondContact O-N 2.95Å; L43-C47 PolarHBondContact O-SG 3.3Å; L44-C47 WeakPolarHBondContact O-CB 3.48Å; L44-C47 PolarHBondContact O-N 3.17Å; C47-Y49 PolarHBondContact O-N 3.22Å; C47-S51 VanDerWaalsContact O-CB 3.29Å; C47-S51 WeakPolarHBondContact O-CB 3.49Å; C47-S51 PolarHBondContact O-N 3.07Å; C47-S51 PolarHBondContact O-OG 2.87Å
48	Y	96.3	Very high	93.7	Very high	29 Å²	29	40.8 Å²	40.8	11%	0.114	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-42	176.4	-74.8	-38.5	0	0	0	112.5	V25 E29 L44 A45 S51 K53 K56 L60	V25-Y48 HydrophobicContact CG1-CD1 4.07Å; V25-Y48 HydrophobicContact CG1-CE1 3.48Å; V25-Y48 VanDerWaalsContact CG1-CE1 3.48Å; V25-Y48 HydrophobicContact CG2-CD1 4.01Å; V25-Y48 HydrophobicContact CG2-CE1 4.28Å; E29-Y48 PolarHBondContact OE1-OH 2.96Å; L44-Y48 HydrophobicContact CD1-CD2 4.19Å; L44-Y48 HydrophobicContact CD1-CE1 4.48Å; L44-Y48 HydrophobicContact CD1-CE2 3.76Å; L44-Y48 HydrophobicContact CD2-CE2 4.38Å; L44-Y48 HydrophobicContact CG-CD2 4.24Å; L44-Y48 HydrophobicContact CG-CE2 3.9Å; L44-Y48 PolarHBondContact O-N 3.35Å; A45-Y48 PolarHBondContact O-N 2.89Å; Y48-S51 PolarHBondContact O-N 2.9Å; Y48-S51 PolarHBondContact O-OG 3.21Å; Y48-K53 PolarHBondContact O-N 3.14Å; Y48-K56 HydrophobicContact CD1-CB 4.21Å; Y48-K56 HydrophobicContact CD1-CD 3.66Å; Y48-K56 HydrophobicContact CD2-CB 4.02Å; Y48-K56 HydrophobicContact CE1-CD 3.73Å; Y48-K56 HydrophobicContact CG-CB 3.81Å; Y48-K56 HydrophobicContact CG-CD 4.15Å; Y48-L60 HydrophobicContact CD2-CD2 3.97Å; Y48-L60 HydrophobicContact CE2-CD2 4.03Å
49	Y	95.8	Very high	94	Very high	61 Å²	61	46 Å²	46	24%	0.239	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-55.9	176.8	-179.2	-102.3	0	0	0	111.5	A45 T46 C47 S51 G52 P54 L74 K77 E81	A45-Y49 VanDerWaalsContact O-CB 3.29Å; A45-Y49 WeakPolarHBondContact O-CB 3.16Å; A45-Y49 PolarHBondContact O-N 3.15Å; T46-Y49 PolarHBondContact O-N 3.21Å; C47-Y49 PolarHBondContact O-N 3.22Å; Y49-S51 PolarHBondContact O-N 3.4Å; Y49-G52 PolarHBondContact O-N 2.92Å; Y49-P54 HydrophobicContact CD2-CB 4.16Å; Y49-P54 HydrophobicContact CE2-CB 4.39Å; Y49-L74 HydrophobicContact CD1-CD1 4.03Å; Y49-L74 HydrophobicContact CD2-CD1 4.1Å; Y49-L74 HydrophobicContact CG-CD1 3.8Å; Y49-K77 HydrophobicContact CE2-CG 4.22Å; Y49-K77 WeakPolarHBondContact OH-CE 3.47Å; Y49-E81 WeakPolarHBondContact CE2-OE1 3.33Å; Y49-E81 VanDerWaalsContact CE2-OE2 3.28Å; Y49-E81 WeakPolarHBondContact CE2-OE2 3.33Å; Y49-E81 PolarHBondContact OH-OE1 3.38Å
50	R	95.3	Very high	94.3	Very high	101 Å²	101	42 Å²	42	38%	0.381	19%	0.194	S	C	.	.	H	α-helix	trans	-59.9	-28.2	177	-72.8	-171.9	175	-162.3	1.4	113.2	L16 N17 Y21 T46 G52	L16-R50 HydrophobicContact CD2-CB 4.38Å; N17-R50 PolarHBondContact OD1-NH1 3.41Å; Y21-R50 HydrophobicContact CD1-CB 4.36Å; Y21-R50 HydrophobicContact CE1-CB 3.88Å; T46-R50 HydrophobicContact CG2-CG 4.4Å; T46-R50 WeakPolarHBondContact O-CB 3.37Å; T46-R50 WeakPolarHBondContact O-CG 3.44Å; T46-R50 PolarHBondContact O-N 2.53Å; R50-G52 PolarHBondContact O-N 3.2Å; R50-G52 VanDerWaalsContact O-N 3.09Å
51	S	94.7	Very high	94.3	Very high	17 Å²	17	42.1 Å²	42.1	12%	0.119	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	12.7	174	80.6	0	0	0	0	115.4	C47 Y48 Y49	C47-S51 VanDerWaalsContact O-CB 3.29Å; C47-S51 WeakPolarHBondContact O-CB 3.49Å; C47-S51 PolarHBondContact O-N 3.07Å; C47-S51 PolarHBondContact O-OG 2.87Å; Y48-S51 PolarHBondContact O-N 2.9Å; Y48-S51 PolarHBondContact O-OG 3.21Å; Y49-S51 PolarHBondContact O-N 3.4Å
52	G	93.6	Very high	94.2	Very high	62 Å²	62	47.3 Å²	47.3	64%	0.639	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	23.2	-179.8	0	0	0	0	0	114.1	Y49 R50 P54	Y49-G52 PolarHBondContact O-N 2.92Å; R50-G52 PolarHBondContact O-N 3.2Å; R50-G52 VanDerWaalsContact O-N 3.09Å; G52-P54 VanDerWaalsContact C-CD 3.42Å; G52-P54 WeakPolarHBondContact O-CD 3.42Å
53	K	95	Very high	94	Very high	82 Å²	82	48.2 Å²	48.2	36%	0.357	24%	0.235	S	C	.	.			trans	-127.1	59.8	-171.2	-66.5	160.5	-164	149.8	0	111.8	Y48 Y55 K56 A57	Y48-K53 PolarHBondContact O-N 3.14Å; K53-Y55 HydrophobicContact CB-CD1 4.48Å; K53-Y55 HydrophobicContact CB-CE1 3.99Å; K53-Y55 HydrophobicContact CG-CE1 4.05Å; K53-Y55 PolarHBondContact O-N 3.11Å; K53-Y55 VanDerWaalsContact O-N 3.12Å; K53-K56 HydrophobicContact CB-CB 4.38Å; K53-K56 HydrophobicContact CB-CG 4.3Å; K53-K56 WeakPolarHBondContact O-CB 3.25Å; K53-K56 PolarHBondContact O-N 2.67Å; K53-A57 PolarHBondContact O-N 3Å
54	P	93.7	Very high	93.4	Very high	25 Å²	25	51.3 Å²	51.3	16%	0.162	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-28.2	-178	24.5	-34.5	0	0	0	113	Y49 G52 K56 A57 Y58	Y49-P54 HydrophobicContact CD2-CB 4.16Å; Y49-P54 HydrophobicContact CE2-CB 4.39Å; G52-P54 VanDerWaalsContact C-CD 3.42Å; G52-P54 WeakPolarHBondContact O-CD 3.42Å; P54-K56 VanDerWaalsContact C-N 3.27Å; P54-K56 PolarHBondContact O-N 3.33Å; P54-A57 PolarHBondContact O-N 2.91Å; P54-Y58 WeakPolarHBondContact O-CB 3.5Å; P54-Y58 PolarHBondContact O-N 2.88Å
55	Y	94.9	Very high	92.1	Very high	115 Å²	115	57.2 Å²	57.2	45%	0.451	29%	0.292	S	S	.	.	H	α-helix	trans	-63.3	-28.4	173.8	72.8	-93.3	0	0	0	113.8	K53 R59	K53-Y55 HydrophobicContact CB-CD1 4.48Å; K53-Y55 HydrophobicContact CB-CE1 3.99Å; K53-Y55 HydrophobicContact CG-CE1 4.05Å; K53-Y55 PolarHBondContact O-N 3.11Å; K53-Y55 VanDerWaalsContact O-N 3.12Å; Y55-R59 WeakPolarHBondContact O-CG 3.41Å; Y55-R59 PolarHBondContact O-N 3.44Å
56	K	94.5	Very high	90.7	Very high	83 Å²	83	58.7 Å²	58.7	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-73.7	-49.1	173.4	-76.6	-162	171	-161.6	0	110.6	Y48 K53 P54 Y58 R59 L60	Y48-K56 HydrophobicContact CD1-CB 4.21Å; Y48-K56 HydrophobicContact CD1-CD 3.66Å; Y48-K56 HydrophobicContact CD2-CB 4.02Å; Y48-K56 HydrophobicContact CE1-CD 3.73Å; Y48-K56 HydrophobicContact CG-CB 3.81Å; Y48-K56 HydrophobicContact CG-CD 4.15Å; K53-K56 HydrophobicContact CB-CB 4.38Å; K53-K56 HydrophobicContact CB-CG 4.3Å; K53-K56 WeakPolarHBondContact O-CB 3.25Å; K53-K56 PolarHBondContact O-N 2.67Å; P54-K56 VanDerWaalsContact C-N 3.27Å; P54-K56 PolarHBondContact O-N 3.33Å; K56-Y58 PolarHBondContact O-N 2.64Å; K56-R59 PolarHBondContact O-N 2.95Å; K56-L60 WeakPolarHBondContact O-CB 3.27Å; K56-L60 PolarHBondContact O-N 3.11Å
57	A	93.9	Very high	89.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-57.5	-48.1	176.8	0	0	0	0	0	111.4	A45 K53 P54 R59 L60 L61	A45-A57 HydrophobicContact CB-CB 4.37Å; A45-A57 WeakPolarHBondContact O-CB 3.15Å; K53-A57 PolarHBondContact O-N 3Å; P54-A57 PolarHBondContact O-N 2.91Å; A57-R59 PolarHBondContact O-N 3.03Å; A57-L60 PolarHBondContact O-N 3.28Å; A57-L61 WeakPolarHBondContact O-CB 3.05Å; A57-L61 WeakPolarHBondContact O-CG 3.47Å; A57-L61 PolarHBondContact O-N 2.98Å
58	Y	94.1	Very high	89.1	Confident	19 Å²	19	63.5 Å²	63.5	8%	0.075	33%	0.334	C	S	.	.	H	α-helix	trans	-54.3	-49.7	173.8	171.2	-92.8	0	0	0	112.9	P54 K56 K62 L75 L82 K84 E87	P54-Y58 WeakPolarHBondContact O-CB 3.5Å; P54-Y58 PolarHBondContact O-N 2.88Å; K56-Y58 PolarHBondContact O-N 2.64Å; Y58-K62 HydrophobicContact CE1-CD 4.05Å; Y58-K62 HydrophobicContact CE2-CD 4.24Å; Y58-K62 WeakPolarHBondContact O-CB 3.43Å; Y58-K62 PolarHBondContact O-N 3.2Å; Y58-K62 WeakPolarHBondContact OH-CD 3.43Å; Y58-K62 PolarHBondContact OH-NZ 2.78Å; Y58-L75 HydrophobicContact CD2-CD1 3.85Å; Y58-L75 HydrophobicContact CE2-CD1 4.35Å; Y58-L82 HydrophobicContact CD1-CD1 4.06Å; Y58-L82 HydrophobicContact CD2-CD1 4.04Å; Y58-L82 HydrophobicContact CG-CD1 3.62Å; Y58-K84 HydrophobicContact CE2-CD 3.99Å; Y58-K84 PolarHBondContact OH-NZ 3.36Å; Y58-E87 WeakPolarHBondContact CE2-OE2 3.36Å; Y58-E87 VanDerWaalsContact OH-CD 3.25Å; Y58-E87 PolarHBondContact OH-OE1 2.86Å; Y58-E87 VanDerWaalsContact OH-OE1 3.09Å; Y58-E87 PolarHBondContact OH-OE2 3.31Å
59	R	94.1	Very high	88.7	Confident	186 Å²	186	64.1 Å²	64.1	70%	0.702	34%	0.342	S	S	*	.	H	α-helix	trans	-66	-39.9	-179.4	-75.2	-177.8	-176.2	-165.6	2.2	112.1	Y55 K56 A57 A63	Y55-R59 WeakPolarHBondContact O-CG 3.41Å; Y55-R59 PolarHBondContact O-N 3.44Å; K56-R59 PolarHBondContact O-N 2.95Å; A57-R59 PolarHBondContact O-N 3.03Å; R59-A63 WeakPolarHBondContact O-CB 3.41Å; R59-A63 PolarHBondContact O-N 3.21Å; R59-A63 VanDerWaalsContact O-N 3.15Å
60	L	92.9	Very high	88.4	Confident	25 Å²	25	66.1 Å²	66.1	13%	0.131	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-51.1	177.1	176.2	65.1	0	0	0	111.4	L41 L44 A45 Y48 K56 A57 A63 H64	L41-L60 HydrophobicContact CD1-CD1 3.72Å; L41-L60 HydrophobicContact CD1-CD2 4.05Å; L41-L60 HydrophobicContact CD1-CG 3.66Å; L44-L60 HydrophobicContact CB-CD2 4.21Å; L44-L60 HydrophobicContact CD2-CD2 3.83Å; L44-L60 HydrophobicContact CG-CD2 3.68Å; A45-L60 HydrophobicContact CB-CD2 4.14Å; Y48-L60 HydrophobicContact CD2-CD2 3.97Å; Y48-L60 HydrophobicContact CE2-CD2 4.03Å; K56-L60 WeakPolarHBondContact O-CB 3.27Å; K56-L60 PolarHBondContact O-N 3.11Å; A57-L60 PolarHBondContact O-N 3.28Å; L60-A63 PolarHBondContact O-N 2.87Å; L60-H64 PolarHBondContact O-ND1 3.14Å
61	L	91.4	Very high	88.2	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-72.2	-29.1	-178.2	-64.9	-175	0	0	0	113	L41 A45 A57 V71 L74 L75	L41-L61 HydrophobicContact CD1-CD2 4.34Å; L41-L61 HydrophobicContact CD2-CD2 4.03Å; L41-L61 HydrophobicContact CG-CD2 3.82Å; A45-L61 HydrophobicContact CB-CD1 3.82Å; A45-L61 HydrophobicContact CB-CD2 3.57Å; A45-L61 HydrophobicContact CB-CG 3.67Å; A57-L61 WeakPolarHBondContact O-CB 3.05Å; A57-L61 WeakPolarHBondContact O-CG 3.47Å; A57-L61 PolarHBondContact O-N 2.98Å; L61-V71 HydrophobicContact CD1-CG1 4.29Å; L61-V71 HydrophobicContact CD2-CG1 3.84Å; L61-V71 HydrophobicContact CD2-CG2 4.42Å; L61-V71 HydrophobicContact CG-CG1 4.45Å; L61-L74 HydrophobicContact CD1-CB 4.16Å; L61-L74 HydrophobicContact CD1-CD2 4.13Å; L61-L74 HydrophobicContact CD1-CG 4.01Å; L61-L75 HydrophobicContact CB-CB 4.29Å; L61-L75 HydrophobicContact CB-CD1 4.12Å; L61-L75 HydrophobicContact CD1-CB 4.04Å
62	K	90.3	Very high	87.9	Confident	111 Å²	111	63 Å²	63	48%	0.483	34%	0.339	S	S	.	.	H	α-helix	trans	-74.8	-27.2	174.4	-176.7	163.7	-176.6	159.3	0	113.3	Y58 E87	Y58-K62 HydrophobicContact CE1-CD 4.05Å; Y58-K62 HydrophobicContact CE2-CD 4.24Å; Y58-K62 WeakPolarHBondContact O-CB 3.43Å; Y58-K62 PolarHBondContact O-N 3.2Å; Y58-K62 WeakPolarHBondContact OH-CD 3.43Å; Y58-K62 PolarHBondContact OH-NZ 2.78Å; K62-E87 WeakPolarHBondContact CD-OE1 3.1Å; K62-E87 WeakPolarHBondContact CE-OE1 3.41Å; K62-E87 IonicContact NZ-OE1 3.6Å; K62-E87 PolarHBondContact NZ-OE1 3.42Å; K62-E87 IonicContact NZ-OE2 2.74Å
63	A	87.5	Confident	87.9	Confident	73 Å²	73	62.5 Å²	62.5	60%	0.603	32%	0.319	S	S	*	.	H	α-helix	trans	-77.5	-20.7	178.3	0	0	0	0	0	113.6	R59 L60	R59-A63 WeakPolarHBondContact O-CB 3.41Å; R59-A63 PolarHBondContact O-N 3.21Å; R59-A63 VanDerWaalsContact O-N 3.15Å; L60-A63 PolarHBondContact O-N 2.87Å
64	H	81.6	Confident	87.8	Confident	69 Å²	69	59.2 Å²	59.2	32%	0.319	31%	0.306	S	S	.	.	S	Bend	trans	-120.2	109.4	-178	-56.2	89.3	0	0	0	108.8	Y32 L41 L60 C66	Y32-H64 PolarHBondContact OH-CD2 3.28Å; Y32-H64 VanDerWaalsContact OH-CD2 3.3Å; Y32-H64 PolarHBondContact OH-NE2 3.18Å; L41-H64 HydrophobicContact CD1-CB 4.44Å; L41-H64 HydrophobicContact CD2-CB 3.83Å; L60-H64 PolarHBondContact O-ND1 3.14Å; H64-C66 PolarHBondContact O-N 2.74Å
65	S	68.2	Low	87.7	Confident	131 Å²	131	59 Å²	59	92%	0.916	30%	0.303	S	S	*	.			trans	-73.4	63.6	-172.9	-53	0	0	0	0	113.2
66	C	65.1	Low	87.6	Confident	31 Å²	31	53.5 Å²	53.5	21%	0.209	28%	0.282	C	S	.	.			trans	-85.8	145.9	-174.2	-77.6	0	0	0	0	113	E38 L41 H64 V71	E38-C66 HydrophobicContact CG-CB 4.41Å; E38-C66 WeakPolarHBondContact OE1-CA 3.31Å; E38-C66 WeakPolarHBondContact OE1-CB 3.23Å; E38-C66 PolarHBondContact OE1-SG 3.25Å; L41-C66 HydrophobicContact CD2-CB 3.96Å; L41-C66 WeakPolarHBondContact CD2-SG 3.36Å; H64-C66 PolarHBondContact O-N 2.74Å; C66-V71 HydrophobicContact CB-CG1 4.01Å
67	S	72.9	Confident	87.6	Confident	70 Å²	70	53 Å²	53	49%	0.49	28%	0.279	S	S	.	.			trans	-101.3	-18	-165.6	-162.3	0	0	0	0	114.1	E38 R72	E38-S67 PolarHBondContact OE1-N 3.26Å; S67-R72 VanDerWaalsContact O-CZ 3.22Å; S67-R72 PolarHBondContact O-NE 3.02Å; S67-R72 PolarHBondContact O-NH2 3.44Å; S67-R72 PolarHBondContact OG-NH2 3.49Å
68	T	86.5	Confident	87.7	Confident	40 Å²	40	53 Å²	53	25%	0.245	28%	0.279	C	S	.	.			trans	-62.9	143.4	-170.2	61.2	0	0	0	0	113.6	E38 Q70 V71 R72	E38-T68 HydrophobicContact CB-CG2 4.22Å; E38-T68 WeakPolarHBondContact OE2-CG2 3.4Å; T68-Q70 PolarHBondContact O-N 3.27Å; T68-V71 PolarHBondContact O-N 2.92Å; T68-V71 VanDerWaalsContact O-N 3.15Å; T68-V71 WeakPolarHBondContact OG1-CB 3.48Å; T68-V71 VanDerWaalsContact OG1-CG2 3.27Å; T68-V71 WeakPolarHBondContact OG1-CG2 3.28Å; T68-R72 PolarHBondContact O-N 3.49Å
69	P	87.5	Confident	87.7	Confident	42 Å²	42	52 Å²	52	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-58	-36.7	-179.3	-24.5	33.5	0	0	0	113.1	R72 F73 E109 F110	P69-R72 PolarHBondContact O-N 3.27Å; P69-F73 WeakPolarHBondContact O-CB 3.41Å; P69-F73 PolarHBondContact O-N 2.85Å; P69-E109 WeakPolarHBondContact CG-O 3.38Å; P69-F110 HydrophobicContact CB-CB 4.49Å; P69-F110 HydrophobicContact CB-CD1 3.58Å; P69-F110 HydrophobicContact CB-CE1 4Å; P69-F110 HydrophobicContact CB-CG 4.08Å; P69-F110 VanDerWaalsContact O-CE1 3.31Å; P69-F110 WeakPolarHBondContact O-CE1 3.44Å
70	Q	88.9	Confident	87.6	Confident	102 Å²	102	44.1 Å²	44.1	48%	0.477	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-44.5	177.8	-61.8	176.9	5.4	0	0	112.1	Y42 T68 L74	Y42-Q70 HydrophobicContact CD1-CB 4.49Å; Y42-Q70 HydrophobicContact CD2-CB 3.95Å; Y42-Q70 HydrophobicContact CE1-CB 4.32Å; Y42-Q70 HydrophobicContact CE2-CB 3.76Å; Y42-Q70 HydrophobicContact CG-CB 4.31Å; T68-Q70 PolarHBondContact O-N 3.27Å; Q70-L74 WeakPolarHBondContact O-CB 3.47Å; Q70-L74 PolarHBondContact O-N 3.37Å
71	V	90	Very high	87.5	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.018	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-44.4	175.3	165.9	0	0	0	0	111.1	Y42 L61 C66 T68 L74 L75	Y42-V71 HydrophobicContact CD2-CG2 4.2Å; Y42-V71 HydrophobicContact CG-CG2 4.42Å; L61-V71 HydrophobicContact CD1-CG1 4.29Å; L61-V71 HydrophobicContact CD2-CG1 3.84Å; L61-V71 HydrophobicContact CD2-CG2 4.42Å; L61-V71 HydrophobicContact CG-CG1 4.45Å; C66-V71 HydrophobicContact CB-CG1 4.01Å; T68-V71 PolarHBondContact O-N 2.92Å; T68-V71 VanDerWaalsContact O-N 3.15Å; T68-V71 WeakPolarHBondContact OG1-CB 3.48Å; T68-V71 VanDerWaalsContact OG1-CG2 3.27Å; T68-V71 WeakPolarHBondContact OG1-CG2 3.28Å; V71-L74 PolarHBondContact O-N 2.93Å; V71-L75 VanDerWaalsContact O-CB 3.32Å; V71-L75 WeakPolarHBondContact O-CB 3.46Å; V71-L75 PolarHBondContact O-N 3.04Å
72	R	89.7	Confident	87.6	Confident	50 Å²	50	49.1 Å²	49.1	19%	0.189	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-43.3	178.2	-64.8	-172	-158.3	169.3	8.4	112.1	S67 T68 P69 L75 A76 V91 E109 F110	S67-R72 VanDerWaalsContact O-CZ 3.22Å; S67-R72 PolarHBondContact O-NE 3.02Å; S67-R72 PolarHBondContact O-NH2 3.44Å; S67-R72 PolarHBondContact OG-NH2 3.49Å; T68-R72 PolarHBondContact O-N 3.49Å; P69-R72 PolarHBondContact O-N 3.27Å; R72-L75 PolarHBondContact O-N 3.02Å; R72-A76 WeakPolarHBondContact O-CB 3.36Å; R72-A76 PolarHBondContact O-N 2.98Å; R72-V91 HydrophobicContact CB-CG1 3.87Å; R72-V91 HydrophobicContact CG-CG1 4.38Å; R72-V91 WeakPolarHBondContact O-CG1 3.43Å; R72-E109 IonicContact CZ-OE1 3.85Å; R72-E109 IonicContact NH1-OE1 3.12Å; R72-E109 PolarHBondContact NH1-OE1 3.03Å; R72-E109 IonicContact NH1-OE2 2.64Å; R72-E109 PolarHBondContact NH1-OE2 3.12Å; R72-E109 IonicContact NH2-OE1 3.38Å; R72-F110 HydrophobicContact CB-CE1 4.19Å; R72-F110 HydrophobicContact CB-CZ 4.19Å
73	F	92.3	Very high	87.7	Confident	52 Å²	52	48.6 Å²	48.6	23%	0.228	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-47	175.7	176.3	-111.5	0	0	0	111.9	P69 L75 A76 K77 F110 F116 T117 L120	P69-F73 WeakPolarHBondContact O-CB 3.41Å; P69-F73 PolarHBondContact O-N 2.85Å; F73-L75 PolarHBondContact O-N 2.88Å; F73-A76 PolarHBondContact O-N 3.33Å; F73-K77 WeakPolarHBondContact O-CB 3.35Å; F73-K77 PolarHBondContact O-N 3.13Å; F73-F110 HydrophobicContact CB-CE1 4.28Å; F73-F116 HydrophobicContact CE2-CB 3.97Å; F73-F116 HydrophobicContact CZ-CB 3.79Å; F73-T117 HydrophobicContact CB-CG2 4.14Å; F73-T117 HydrophobicContact CD2-CG2 3.44Å; F73-T117 VanDerWaalsContact CD2-CG2 3.44Å; F73-T117 HydrophobicContact CE2-CG2 4.15Å; F73-T117 HydrophobicContact CG-CG2 4.03Å; F73-L120 HydrophobicContact CD2-CD2 4.07Å; F73-L120 HydrophobicContact CE2-CB 4.28Å; F73-L120 HydrophobicContact CE2-CD2 3.85Å
74	L	93.4	Very high	87.9	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-39.4	178.5	-177.2	58.6	0	0	0	112.3	Y42 A45 Y49 L61 Q70 V71 K77 C78	Y42-L74 HydrophobicContact CD2-CD2 4.01Å; Y42-L74 HydrophobicContact CE2-CB 4.17Å; Y42-L74 HydrophobicContact CE2-CD2 3.89Å; A45-L74 HydrophobicContact CB-CD2 3.73Å; Y49-L74 HydrophobicContact CD1-CD1 4.03Å; Y49-L74 HydrophobicContact CD2-CD1 4.1Å; Y49-L74 HydrophobicContact CG-CD1 3.8Å; L61-L74 HydrophobicContact CD1-CB 4.16Å; L61-L74 HydrophobicContact CD1-CD2 4.13Å; L61-L74 HydrophobicContact CD1-CG 4.01Å; Q70-L74 WeakPolarHBondContact O-CB 3.47Å; Q70-L74 PolarHBondContact O-N 3.37Å; V71-L74 PolarHBondContact O-N 2.93Å; L74-K77 PolarHBondContact O-N 2.74Å; L74-C78 PolarHBondContact O-N 3.25Å; L74-C78 PolarHBondContact O-SG 2.88Å
75	L	92.8	Very high	88.4	Confident	20 Å²	20	47.3 Å²	47.3	11%	0.105	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-48.2	173.5	176.1	58.9	0	0	0	111.2	Y58 L61 V71 R72 F73 K77 C78 C79 V91	Y58-L75 HydrophobicContact CD2-CD1 3.85Å; Y58-L75 HydrophobicContact CE2-CD1 4.35Å; L61-L75 HydrophobicContact CB-CB 4.29Å; L61-L75 HydrophobicContact CB-CD1 4.12Å; L61-L75 HydrophobicContact CD1-CB 4.04Å; V71-L75 VanDerWaalsContact O-CB 3.32Å; V71-L75 WeakPolarHBondContact O-CB 3.46Å; V71-L75 PolarHBondContact O-N 3.04Å; R72-L75 PolarHBondContact O-N 3.02Å; F73-L75 PolarHBondContact O-N 2.88Å; L75-K77 VanDerWaalsContact C-N 3.33Å; L75-K77 PolarHBondContact O-N 3.45Å; L75-C78 PolarHBondContact O-N 3.17Å; L75-C79 PolarHBondContact O-N 3.07Å; L75-C79 PolarHBondContact O-SG 3.43Å; L75-V91 HydrophobicContact CB-CG1 4.29Å; L75-V91 HydrophobicContact CD2-CG1 4.1Å; L75-V91 HydrophobicContact CD2-CG2 3.81Å; L75-V91 HydrophobicContact CG-CG1 4.22Å; L75-V91 HydrophobicContact CG-CG2 4.14Å
76	A	92.8	Very high	89.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-40.2	177.1	0	0	0	0	0	112.3	R72 F73 C79 V80 V91 L92 L120	R72-A76 WeakPolarHBondContact O-CB 3.36Å; R72-A76 PolarHBondContact O-N 2.98Å; F73-A76 PolarHBondContact O-N 3.33Å; A76-C79 WeakPolarHBondContact O-CB 3.41Å; A76-C79 PolarHBondContact O-N 3.11Å; A76-V80 WeakPolarHBondContact O-CG2 3.31Å; A76-V80 PolarHBondContact O-N 3.11Å; A76-V91 HydrophobicContact CB-CB 4.41Å; A76-V91 HydrophobicContact CB-CG1 4.12Å; A76-L92 HydrophobicContact CB-CD1 4.07Å; A76-L92 HydrophobicContact CB-CD2 3.8Å; A76-L92 HydrophobicContact CB-CG 3.76Å; A76-L120 HydrophobicContact CB-CD2 4.01Å
77	K	94.5	Very high	90.7	Very high	71 Å²	71	45 Å²	45	31%	0.309	25%	0.246	S	C	.	.	H	α-helix	trans	-61.5	-45	174.5	-179.7	57.3	169.9	155.6	0	111.5	Y49 F73 L74 L75 C79 V80 E81 L120	Y49-K77 HydrophobicContact CE2-CG 4.22Å; Y49-K77 WeakPolarHBondContact OH-CE 3.47Å; F73-K77 WeakPolarHBondContact O-CB 3.35Å; F73-K77 PolarHBondContact O-N 3.13Å; L74-K77 PolarHBondContact O-N 2.74Å; L75-K77 VanDerWaalsContact C-N 3.33Å; L75-K77 PolarHBondContact O-N 3.45Å; K77-C79 VanDerWaalsContact C-N 3.34Å; K77-C79 PolarHBondContact O-N 3.25Å; K77-V80 PolarHBondContact O-N 2.87Å; K77-E81 WeakPolarHBondContact CE-OE1 3.3Å; K77-E81 IonicContact NZ-OE1 2.67Å; K77-E81 PolarHBondContact NZ-OE1 3.21Å; K77-E81 PolarHBondContact O-N 2.85Å; K77-E81 VanDerWaalsContact O-N 3.16Å; K77-L120 HydrophobicContact CB-CD2 4.17Å; K77-L120 HydrophobicContact CD-CD1 4.21Å
78	C	94.4	Very high	91.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-37.1	172.9	-64.1	0	0	0	0	112.4	L74 L75 E81 L82	L74-C78 PolarHBondContact O-N 3.25Å; L74-C78 PolarHBondContact O-SG 2.88Å; L75-C78 PolarHBondContact O-N 3.17Å; C78-E81 PolarHBondContact O-N 3.47Å; C78-L82 WeakPolarHBondContact O-CB 3.41Å; C78-L82 WeakPolarHBondContact O-CG 3.45Å; C78-L82 PolarHBondContact O-N 3.15Å
79	C	94	Very high	91.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-43.4	174.4	-70	0	0	0	0	111.7	L75 A76 K77 L82 S83 K84	L75-C79 PolarHBondContact O-N 3.07Å; L75-C79 PolarHBondContact O-SG 3.43Å; A76-C79 WeakPolarHBondContact O-CB 3.41Å; A76-C79 PolarHBondContact O-N 3.11Å; K77-C79 VanDerWaalsContact C-N 3.34Å; K77-C79 PolarHBondContact O-N 3.25Å; C79-L82 CarbonylContact O-C 3.51Å; C79-L82 PolarHBondContact O-N 2.91Å; C79-S83 PolarHBondContact O-N 3.22Å; C79-K84 HydrophobicContact CB-CB 4.23Å; C79-K84 WeakPolarHBondContact O-CA 3.41Å; C79-K84 PolarHBondContact O-N 3.33Å
80	V	92.8	Very high	91.8	Very high	20 Å²	20	44.1 Å²	44.1	12%	0.121	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-41.6	178.9	172.1	0	0	0	0	112.2	A76 K77 S83 L85 L120 I124	A76-V80 WeakPolarHBondContact O-CG2 3.31Å; A76-V80 PolarHBondContact O-N 3.11Å; K77-V80 PolarHBondContact O-N 2.87Å; V80-S83 PolarHBondContact O-N 2.98Å; V80-S83 VanDerWaalsContact O-N 3.14Å; V80-L85 HydrophobicContact CG1-CD2 4.41Å; V80-L85 HydrophobicContact CG2-CD2 4.35Å; V80-L120 HydrophobicContact CB-CD1 4.25Å; V80-L120 HydrophobicContact CG1-CD1 4.37Å; V80-L120 HydrophobicContact CG2-CD1 3.89Å; V80-L120 HydrophobicContact CG2-CG 4.41Å; V80-I124 HydrophobicContact CG2-CD1 3.63Å; V80-I124 HydrophobicContact CG2-CG1 3.5Å
81	E	91.1	Very high	91.8	Very high	77 Å²	77	40.6 Å²	40.6	36%	0.36	21%	0.213	S	C	.	.	H	α-helix	trans	-68.6	-32.7	176.4	-74	169.2	-156.8	0	0	113	Y49 K77 C78 S83	Y49-E81 WeakPolarHBondContact CE2-OE1 3.33Å; Y49-E81 VanDerWaalsContact CE2-OE2 3.28Å; Y49-E81 WeakPolarHBondContact CE2-OE2 3.33Å; Y49-E81 PolarHBondContact OH-OE1 3.38Å; K77-E81 WeakPolarHBondContact CE-OE1 3.3Å; K77-E81 IonicContact NZ-OE1 2.67Å; K77-E81 PolarHBondContact NZ-OE1 3.21Å; K77-E81 PolarHBondContact O-N 2.85Å; K77-E81 VanDerWaalsContact O-N 3.16Å; C78-E81 PolarHBondContact O-N 3.47Å; E81-S83 PolarHBondContact O-N 2.84Å
82	L	92.9	Very high	91.6	Very high	57 Å²	57	40.5 Å²	40.5	30%	0.298	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	11.5	172.7	-61.7	171.2	0	0	0	112.9	Y58 C78 C79 K84	Y58-L82 HydrophobicContact CD1-CD1 4.06Å; Y58-L82 HydrophobicContact CD2-CD1 4.04Å; Y58-L82 HydrophobicContact CG-CD1 3.62Å; C78-L82 WeakPolarHBondContact O-CB 3.41Å; C78-L82 WeakPolarHBondContact O-CG 3.45Å; C78-L82 PolarHBondContact O-N 3.15Å; C79-L82 CarbonylContact O-C 3.51Å; C79-L82 PolarHBondContact O-N 2.91Å; L82-K84 HydrophobicContact CB-CD 4.45Å; L82-K84 HydrophobicContact CB-CG 4.3Å; L82-K84 PolarHBondContact O-N 3.27Å; L82-K84 VanDerWaalsContact O-N 3.15Å
83	S	91.8	Very high	91.3	Very high	100 Å²	100	38.8 Å²	38.8	70%	0.699	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	19.3	-177.5	-62.7	0	0	0	0	115.6	C79 V80 E81 L85	C79-S83 PolarHBondContact O-N 3.22Å; V80-S83 PolarHBondContact O-N 2.98Å; V80-S83 VanDerWaalsContact O-N 3.14Å; E81-S83 PolarHBondContact O-N 2.84Å; S83-L85 VanDerWaalsContact C-N 3.29Å; S83-L85 PolarHBondContact O-N 3.14Å; S83-L85 VanDerWaalsContact O-N 3.14Å
84	K	92.9	Very high	90.4	Very high	83 Å²	83	37.2 Å²	37.2	36%	0.361	21%	0.206	S	C	.	.			trans	-88.9	57.4	178.5	-61.2	-176.1	177.9	179.5	0	111.8	Y58 C79 L82 A86 E87 G88	Y58-K84 HydrophobicContact CE2-CD 3.99Å; Y58-K84 PolarHBondContact OH-NZ 3.36Å; C79-K84 HydrophobicContact CB-CB 4.23Å; C79-K84 WeakPolarHBondContact O-CA 3.41Å; C79-K84 PolarHBondContact O-N 3.33Å; L82-K84 HydrophobicContact CB-CD 4.45Å; L82-K84 HydrophobicContact CB-CG 4.3Å; L82-K84 PolarHBondContact O-N 3.27Å; L82-K84 VanDerWaalsContact O-N 3.15Å; K84-A86 PolarHBondContact O-N 2.99Å; K84-E87 HydrophobicContact CB-CB 4.19Å; K84-E87 WeakPolarHBondContact CD-OE2 3.27Å; K84-E87 PolarHBondContact O-N 3.41Å; K84-E87 VanDerWaalsContact O-N 3.09Å; K84-G88 PolarHBondContact O-N 3.2Å
85	L	92.1	Very high	89	Confident	32 Å²	32	38 Å²	38	17%	0.168	22%	0.218	C	C	.	.	H	α-helix	trans	-55.2	-47.5	-169.5	-59.6	176.4	0	0	0	113.4	V80 S83 E87 G88 E89 I124 K127 T128	V80-L85 HydrophobicContact CG1-CD2 4.41Å; V80-L85 HydrophobicContact CG2-CD2 4.35Å; S83-L85 VanDerWaalsContact C-N 3.29Å; S83-L85 PolarHBondContact O-N 3.14Å; S83-L85 VanDerWaalsContact O-N 3.14Å; L85-E87 VanDerWaalsContact C-N 3.3Å; L85-E87 PolarHBondContact O-N 3.26Å; L85-G88 PolarHBondContact O-N 3.2Å; L85-E89 PolarHBondContact O-N 3.39Å; L85-I124 HydrophobicContact CB-CG2 4.39Å; L85-K127 HydrophobicContact CD1-CB 3.58Å; L85-K127 HydrophobicContact CD1-CD 4.44Å; L85-K127 HydrophobicContact CD2-CB 4.43Å; L85-K127 HydrophobicContact CD2-CD 4.32Å; L85-T128 HydrophobicContact CB-CG2 4.04Å; L85-T128 HydrophobicContact CD1-CG2 4.04Å
86	A	91	Very high	87.3	Confident	67 Å²	67	42.8 Å²	42.8	55%	0.554	25%	0.247	S	C	*	.	H	α-helix	trans	-66.2	-28	-180	0	0	0	0	0	113.8	K84 Q90	K84-A86 PolarHBondContact O-N 2.99Å; A86-Q90 PolarHBondContact O-N 2.96Å
87	E	90.8	Very high	85.4	Confident	45 Å²	45	51.2 Å²	51.2	21%	0.21	29%	0.292	C	S	.	.	H	α-helix	trans	-75	-40.2	173.3	-174.5	173.4	-168.2	0	0	110.8	Y58 K62 K84 L85 E89 Q90 V91	Y58-E87 WeakPolarHBondContact CE2-OE2 3.36Å; Y58-E87 VanDerWaalsContact OH-CD 3.25Å; Y58-E87 PolarHBondContact OH-OE1 2.86Å; Y58-E87 VanDerWaalsContact OH-OE1 3.09Å; Y58-E87 PolarHBondContact OH-OE2 3.31Å; K62-E87 WeakPolarHBondContact CD-OE1 3.1Å; K62-E87 WeakPolarHBondContact CE-OE1 3.41Å; K62-E87 IonicContact NZ-OE1 3.6Å; K62-E87 PolarHBondContact NZ-OE1 3.42Å; K62-E87 IonicContact NZ-OE2 2.74Å; K84-E87 HydrophobicContact CB-CB 4.19Å; K84-E87 WeakPolarHBondContact CD-OE2 3.27Å; K84-E87 PolarHBondContact O-N 3.41Å; K84-E87 VanDerWaalsContact O-N 3.09Å; L85-E87 VanDerWaalsContact C-N 3.3Å; L85-E87 PolarHBondContact O-N 3.26Å; E87-E89 VanDerWaalsContact C-N 3.3Å; E87-E89 PolarHBondContact O-N 3.38Å; E87-Q90 PolarHBondContact O-N 3.46Å; E87-V91 VanDerWaalsContact O-CG2 3.31Å; E87-V91 WeakPolarHBondContact O-CG2 3.48Å; E87-V91 PolarHBondContact O-N 3.03Å; E87-V91 VanDerWaalsContact O-N 3.14Å
88	G	90.1	Very high	84	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-38.5	172.7	0	0	0	0	0	112.9	K84 L85 V91 L92	K84-G88 PolarHBondContact O-N 3.2Å; L85-G88 PolarHBondContact O-N 3.2Å; G88-V91 PolarHBondContact O-N 3.48Å; G88-L92 WeakPolarHBondContact O-CG 3.35Å; G88-L92 PolarHBondContact O-N 2.99Å
89	E	91.1	Very high	82.8	Confident	33 Å²	33	63 Å²	63	15%	0.154	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-50.6	174.8	-173.2	176.3	177.4	0	0	112.3	L85 E87 V91 L92 I93 L121 I124 R130	L85-E89 PolarHBondContact O-N 3.39Å; E87-E89 VanDerWaalsContact C-N 3.3Å; E87-E89 PolarHBondContact O-N 3.38Å; E89-V91 VanDerWaalsContact C-N 3.26Å; E89-V91 PolarHBondContact O-N 2.97Å; E89-L92 PolarHBondContact O-N 3.37Å; E89-L92 VanDerWaalsContact O-N 3.14Å; E89-I93 HydrophobicContact CG-CD1 3.59Å; E89-I93 HydrophobicContact CG-CG1 4.28Å; E89-I93 PolarHBondContact O-N 3.2Å; E89-L121 HydrophobicContact CG-CD1 4.4Å; E89-I124 HydrophobicContact CB-CG2 4.12Å; E89-R130 VanDerWaalsContact CD-NH2 3.29Å; E89-R130 IonicContact OE1-CZ 3.19Å; E89-R130 IonicContact OE1-NH1 3.35Å; E89-R130 PolarHBondContact OE1-NH1 2.98Å; E89-R130 IonicContact OE1-NH2 3.16Å; E89-R130 PolarHBondContact OE1-NH2 2.64Å; E89-R130 IonicContact OE2-CZ 2.8Å; E89-R130 IonicContact OE2-NH1 2.73Å; E89-R130 IonicContact OE2-NH2 2.66Å; E89-R130 PolarHBondContact OE2-NH2 2.67Å
90	Q	89.1	Confident	82	Confident	101 Å²	101	70 Å²	70	47%	0.472	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-31.7	178.8	-76.5	-171.1	-11.7	0	0	113.2	A86 E87 L92 G94	A86-Q90 PolarHBondContact O-N 2.96Å; E87-Q90 PolarHBondContact O-N 3.46Å; Q90-L92 VanDerWaalsContact C-N 3.32Å; Q90-G94 CarbonylContact O-C 3.14Å; Q90-G94 WeakPolarHBondContact O-CA 3.37Å; Q90-G94 PolarHBondContact O-N 3.3Å
91	V	88.3	Confident	81.3	Confident	28 Å²	28	71.4 Å²	71.4	17%	0.17	39%	0.385	C	S	.	.	H	α-helix	trans	-69.9	-29.1	177.4	169.7	0	0	0	0	112.2	R72 L75 A76 E87 G88 E89	R72-V91 HydrophobicContact CB-CG1 3.87Å; R72-V91 HydrophobicContact CG-CG1 4.38Å; R72-V91 WeakPolarHBondContact O-CG1 3.43Å; L75-V91 HydrophobicContact CB-CG1 4.29Å; L75-V91 HydrophobicContact CD2-CG1 4.1Å; L75-V91 HydrophobicContact CD2-CG2 3.81Å; L75-V91 HydrophobicContact CG-CG1 4.22Å; L75-V91 HydrophobicContact CG-CG2 4.14Å; A76-V91 HydrophobicContact CB-CB 4.41Å; A76-V91 HydrophobicContact CB-CG1 4.12Å; E87-V91 VanDerWaalsContact O-CG2 3.31Å; E87-V91 WeakPolarHBondContact O-CG2 3.48Å; E87-V91 PolarHBondContact O-N 3.03Å; E87-V91 VanDerWaalsContact O-N 3.14Å; G88-V91 PolarHBondContact O-N 3.48Å; E89-V91 VanDerWaalsContact C-N 3.26Å; E89-V91 PolarHBondContact O-N 2.97Å
92	L	86.8	Confident	81	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.01	39%	0.385	C	S	.	.	H	α-helix	trans	-88.6	-58.1	178.7	-62.9	176	0	0	0	111.9	A76 G88 E89 Q90 G94 K101 F110 L120 L121 I124	A76-L92 HydrophobicContact CB-CD1 4.07Å; A76-L92 HydrophobicContact CB-CD2 3.8Å; A76-L92 HydrophobicContact CB-CG 3.76Å; G88-L92 WeakPolarHBondContact O-CG 3.35Å; G88-L92 PolarHBondContact O-N 2.99Å; E89-L92 PolarHBondContact O-N 3.37Å; E89-L92 VanDerWaalsContact O-N 3.14Å; Q90-L92 VanDerWaalsContact C-N 3.32Å; L92-G94 VanDerWaalsContact C-N 3.31Å; L92-G94 PolarHBondContact O-N 3.41Å; L92-K101 PolarHBondContact O-NZ 2.94Å; L92-F110 HydrophobicContact CD2-CE1 4.2Å; L92-F110 HydrophobicContact CD2-CZ 3.86Å; L92-L120 HydrophobicContact CD1-CD2 4.4Å; L92-L121 HydrophobicContact CD1-CB 4.11Å; L92-L121 HydrophobicContact CD1-CD1 4.26Å; L92-I124 HydrophobicContact CD1-CD1 4.29Å
93	I	82.7	Confident	80.5	Confident	13 Å²	13	69.3 Å²	69.3	7%	0.067	38%	0.379	C	S	.	.	H	α-helix	trans	-72.6	-26.5	-176.4	-52.1	179	0	0	0	111.6	E89 Q100 K101 L121 Y125	E89-I93 HydrophobicContact CG-CD1 3.59Å; E89-I93 HydrophobicContact CG-CG1 4.28Å; E89-I93 PolarHBondContact O-N 3.2Å; I93-Q100 HydrophobicContact CG2-CB 4.07Å; I93-Q100 HydrophobicContact CG2-CG 4.32Å; I93-K101 HydrophobicContact CG2-CB 4.5Å; I93-K101 VanDerWaalsContact O-CD 3.29Å; I93-K101 WeakPolarHBondContact O-CD 3.37Å; I93-K101 WeakPolarHBondContact O-CE 3.35Å; I93-K101 VanDerWaalsContact O-CG 3.24Å; I93-K101 WeakPolarHBondContact O-CG 3.3Å; I93-L121 HydrophobicContact CD1-CD1 4.15Å; I93-L121 HydrophobicContact CD1-CD2 4.45Å; I93-L121 HydrophobicContact CG1-CD1 4.14Å; I93-L121 HydrophobicContact CG1-CD2 4.16Å; I93-Y125 HydrophobicContact CD1-CE1 4.37Å; I93-Y125 VanDerWaalsContact CD1-OH 3.23Å; I93-Y125 WeakPolarHBondContact CD1-OH 3.46Å
94	G	73.7	Confident	80.2	Confident	20 Å²	20	68.2 Å²	68.2	21%	0.206	37%	0.366	C	S	.	.			trans	99.3	160.7	-163.6	0	0	0	0	0	111.7	Q90 L92	Q90-G94 CarbonylContact O-C 3.14Å; Q90-G94 WeakPolarHBondContact O-CA 3.37Å; Q90-G94 PolarHBondContact O-N 3.3Å; L92-G94 VanDerWaalsContact C-N 3.31Å; L92-G94 PolarHBondContact O-N 3.41Å
95	G	63.1	Low	79.9	Confident	30 Å²	30	68 Å²	68	31%	0.309	37%	0.369	S	S	.	.			trans	-68.9	156.4	179.5	0	0	0	0	0	113.1	L97 N98	G95-L97 PolarHBondContact O-N 3.37Å; G95-N98 PolarHBondContact O-N 2.97Å
96	V	58	Low	79.6	Confident	120 Å²	120	66.8 Å²	66.8	73%	0.727	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-17.6	-176.1	175.7	0	0	0	0	114.3
97	L	53.3	Low	79.5	Confident	177 Å²	177	65.7 Å²	65.7	93%	0.927	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-17.5	176.4	-62.7	172.6	0	0	0	113.7	G95	G95-L97 PolarHBondContact O-N 3.37Å
98	N	64.2	Low	79.4	Confident	115 Å²	115	69.1 Å²	69.1	62%	0.615	37%	0.371	S	S	*	.	S	Bend	trans	-92.6	161.2	174.3	-66.7	-7.2	0	0	0	109.6	G95 Q100	G95-N98 PolarHBondContact O-N 2.97Å; N98-Q100 PolarHBondContact O-N 3.34Å
99	K	70.1	Confident	79.2	Confident	202 Å²	202	71.9 Å²	71.9	88%	0.878	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-57.6	133.2	166.6	-68.3	-176.4	177.7	-179.6	0	108.9	K101	K99-K101 PolarHBondContact O-N 2.94Å
100	Q	75.4	Confident	79	Confident	149 Å²	149	70.8 Å²	70.8	70%	0.696	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-61.7	124.7	172.3	-68.7	-178.7	0.3	0	0	108.6	I93 N98	I93-Q100 HydrophobicContact CG2-CB 4.07Å; I93-Q100 HydrophobicContact CG2-CG 4.32Å; N98-Q100 PolarHBondContact O-N 3.34Å
101	K	79.8	Confident	78.9	Confident	49 Å²	49	68 Å²	68	21%	0.213	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-61.1	138.4	176.6	-75.5	176.3	-163.6	167.7	0	111.5	L92 I93 K99 D105 I106 E109	L92-K101 PolarHBondContact O-NZ 2.94Å; I93-K101 HydrophobicContact CG2-CB 4.5Å; I93-K101 VanDerWaalsContact O-CD 3.29Å; I93-K101 WeakPolarHBondContact O-CD 3.37Å; I93-K101 WeakPolarHBondContact O-CE 3.35Å; I93-K101 VanDerWaalsContact O-CG 3.24Å; I93-K101 WeakPolarHBondContact O-CG 3.3Å; K99-K101 PolarHBondContact O-N 2.94Å; K101-D105 WeakPolarHBondContact CA-OD2 3.37Å; K101-D105 HydrophobicContact CB-CB 3.83Å; K101-D105 HydrophobicContact CG-CB 4.03Å; K101-I106 HydrophobicContact CB-CG1 4.11Å; K101-I106 HydrophobicContact CD-CG1 4.39Å; K101-E109 VanDerWaalsContact NZ-CD 3.29Å; K101-E109 IonicContact NZ-OE1 2.95Å; K101-E109 PolarHBondContact NZ-OE1 3.03Å; K101-E109 VanDerWaalsContact NZ-OE1 3.16Å; K101-E109 IonicContact NZ-OE2 3.73Å; K101-E109 PolarHBondContact NZ-OE2 3.16Å
102	S	83.8	Confident	78.8	Confident	49 Å²	49	71.4 Å²	71.4	34%	0.343	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-61.5	162.4	163.8	-169.7	0	0	0	0	110.8	D104 D105 I106	S102-D104 PolarHBondContact O-N 3.2Å; S102-D104 PolarHBondContact OG-N 2.85Å; S102-D104 PolarHBondContact OG-OD2 3.04Å; S102-D105 PolarHBondContact N-OD2 2.93Å; S102-D105 PolarHBondContact O-N 3.05Å; S102-I106 WeakPolarHBondContact O-CG1 3.18Å; S102-I106 PolarHBondContact O-N 3.36Å; S102-I106 VanDerWaalsContact O-N 3.13Å
103	Q	81.7	Confident	78.9	Confident	40 Å²	40	73.2 Å²	73.2	19%	0.187	41%	0.407	C	S	.	.	H	α-helix	trans	-55.4	-36.8	164.6	-67.3	167.2	2	0	0	110.3	I106 I107 E136 R140	Q103-I106 PolarHBondContact O-N 2.86Å; Q103-I107 VanDerWaalsContact O-CG1 3.27Å; Q103-I107 WeakPolarHBondContact O-CG1 3.49Å; Q103-I107 PolarHBondContact O-N 3.26Å; Q103-E136 PolarHBondContact NE2-OE2 3.28Å; Q103-R140 VanDerWaalsContact OE1-CG 3.29Å
104	D	86	Confident	79.3	Confident	78 Å²	78	72.6 Å²	72.6	42%	0.417	40%	0.404	S	S	.	.	H	α-helix	trans	-73.3	-32	179.8	-39.4	-73.2	0	0	0	112.9	S102 I106 I107 T108	S102-D104 PolarHBondContact O-N 3.2Å; S102-D104 PolarHBondContact OG-N 2.85Å; S102-D104 PolarHBondContact OG-OD2 3.04Å; D104-I106 VanDerWaalsContact C-N 3.33Å; D104-I107 PolarHBondContact O-N 3.49Å; D104-T108 WeakPolarHBondContact O-CG2 3.31Å; D104-T108 PolarHBondContact O-N 3.43Å; D104-T108 PolarHBondContact O-OG1 2.88Å
105	D	86.9	Confident	80.1	Confident	79 Å²	79	72 Å²	72	42%	0.422	40%	0.397	S	S	.	.	H	α-helix	trans	-67.1	-36.5	172.1	-61	-27.7	0	0	0	110.8	K101 S102 T108 E109	K101-D105 WeakPolarHBondContact CA-OD2 3.37Å; K101-D105 HydrophobicContact CB-CB 3.83Å; K101-D105 HydrophobicContact CG-CB 4.03Å; S102-D105 PolarHBondContact N-OD2 2.93Å; S102-D105 PolarHBondContact O-N 3.05Å; D105-T108 WeakPolarHBondContact CA-OG1 3.38Å; D105-T108 PolarHBondContact O-OG1 3.35Å; D105-E109 WeakPolarHBondContact O-CB 3.43Å; D105-E109 PolarHBondContact O-N 2.86Å
106	I	86.9	Confident	81.6	Confident	6 Å²	6	75.2 Å²	75.2	3%	0.031	40%	0.402	C	S	.	.	H	α-helix	trans	-69.3	-38.1	173.9	-65.1	168.5	0	0	0	110.3	K101 S102 Q103 D104 F110 L118 L121	K101-I106 HydrophobicContact CB-CG1 4.11Å; K101-I106 HydrophobicContact CD-CG1 4.39Å; S102-I106 WeakPolarHBondContact O-CG1 3.18Å; S102-I106 PolarHBondContact O-N 3.36Å; S102-I106 VanDerWaalsContact O-N 3.13Å; Q103-I106 PolarHBondContact O-N 2.86Å; D104-I106 VanDerWaalsContact C-N 3.33Å; I106-F110 HydrophobicContact CG2-CD2 3.91Å; I106-F110 HydrophobicContact CG2-CE2 4.33Å; I106-F110 WeakPolarHBondContact O-CB 3.24Å; I106-F110 WeakPolarHBondContact O-CD2 3.39Å; I106-F110 PolarHBondContact O-N 3.1Å; I106-L118 HydrophobicContact CD1-CD2 4.48Å; I106-L118 HydrophobicContact CG2-CD2 4.07Å; I106-L118 HydrophobicContact CG2-CG 4.22Å; I106-L121 HydrophobicContact CD1-CD2 4.01Å
107	I	88.3	Confident	83.3	Confident	44 Å²	44	69.5 Å²	69.5	23%	0.226	37%	0.368	C	S	.	.	H	α-helix	trans	-64.7	-47	176.5	-69.5	163.2	0	0	0	111.1	Q103 D104 G111 A114 L118 L144	Q103-I107 VanDerWaalsContact O-CG1 3.27Å; Q103-I107 WeakPolarHBondContact O-CG1 3.49Å; Q103-I107 PolarHBondContact O-N 3.26Å; D104-I107 PolarHBondContact O-N 3.49Å; I107-G111 WeakPolarHBondContact O-CA 3.43Å; I107-G111 PolarHBondContact O-N 3.13Å; I107-A114 HydrophobicContact CB-CB 4.41Å; I107-A114 HydrophobicContact CG1-CB 4.21Å; I107-L118 HydrophobicContact CD1-CD1 4.31Å; I107-L118 HydrophobicContact CG1-CD1 4Å; I107-L144 HydrophobicContact CD1-CD1 4.03Å; I107-L144 HydrophobicContact CD1-CD2 4.2Å; I107-L144 HydrophobicContact CG1-CD1 3.81Å; I107-L144 HydrophobicContact CG1-CD2 4.36Å; I107-L144 HydrophobicContact CG2-CD2 4.21Å
108	T	88.3	Confident	85.2	Confident	116 Å²	116	61.1 Å²	61.1	71%	0.712	32%	0.324	S	S	*	.	H	α-helix	trans	-70.2	-33.6	179.4	49.1	0	0	0	0	113.2	D104 D105	D104-T108 WeakPolarHBondContact O-CG2 3.31Å; D104-T108 PolarHBondContact O-N 3.43Å; D104-T108 PolarHBondContact O-OG1 2.88Å; D105-T108 WeakPolarHBondContact CA-OG1 3.38Å; D105-T108 PolarHBondContact O-OG1 3.35Å
109	E	86.6	Confident	86.7	Confident	59 Å²	59	56.2 Å²	56.2	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-76	-38.3	177.3	-172.2	179.4	-117.6	0	0	113.3	P69 R72 K101 D105	P69-E109 WeakPolarHBondContact CG-O 3.38Å; R72-E109 IonicContact CZ-OE1 3.85Å; R72-E109 IonicContact NH1-OE1 3.12Å; R72-E109 PolarHBondContact NH1-OE1 3.03Å; R72-E109 IonicContact NH1-OE2 2.64Å; R72-E109 PolarHBondContact NH1-OE2 3.12Å; R72-E109 IonicContact NH2-OE1 3.38Å; K101-E109 VanDerWaalsContact NZ-CD 3.29Å; K101-E109 IonicContact NZ-OE1 2.95Å; K101-E109 PolarHBondContact NZ-OE1 3.03Å; K101-E109 VanDerWaalsContact NZ-OE1 3.16Å; K101-E109 IonicContact NZ-OE2 3.73Å; K101-E109 PolarHBondContact NZ-OE2 3.16Å; D105-E109 WeakPolarHBondContact O-CB 3.43Å; D105-E109 PolarHBondContact O-N 2.86Å
110	F	86.1	Confident	87.9	Confident	10 Å²	10	47.3 Å²	47.3	4%	0.044	26%	0.26	C	S	.	.	H	α-helix	trans	-98.9	-11	-174.8	-70.6	-96.4	0	0	0	114.7	P69 R72 F73 L92 I106 D112 S113 A114 T117	P69-F110 HydrophobicContact CB-CB 4.49Å; P69-F110 HydrophobicContact CB-CD1 3.58Å; P69-F110 HydrophobicContact CB-CE1 4Å; P69-F110 HydrophobicContact CB-CG 4.08Å; P69-F110 VanDerWaalsContact O-CE1 3.31Å; P69-F110 WeakPolarHBondContact O-CE1 3.44Å; R72-F110 HydrophobicContact CB-CE1 4.19Å; R72-F110 HydrophobicContact CB-CZ 4.19Å; F73-F110 HydrophobicContact CB-CE1 4.28Å; L92-F110 HydrophobicContact CD2-CE1 4.2Å; L92-F110 HydrophobicContact CD2-CZ 3.86Å; I106-F110 HydrophobicContact CG2-CD2 3.91Å; I106-F110 HydrophobicContact CG2-CE2 4.33Å; I106-F110 WeakPolarHBondContact O-CB 3.24Å; I106-F110 WeakPolarHBondContact O-CD2 3.39Å; I106-F110 PolarHBondContact O-N 3.1Å; F110-D112 PolarHBondContact O-N 3.04Å; F110-S113 WeakPolarHBondContact O-CB 3.28Å; F110-S113 PolarHBondContact O-N 3.05Å; F110-A114 HydrophobicContact CB-CB 4.09Å; F110-T117 HydrophobicContact CB-CG2 4.07Å; F110-T117 HydrophobicContact CD1-CG2 3.27Å; F110-T117 HydrophobicContact CD2-CG2 4.47Å; F110-T117 HydrophobicContact CE1-CG2 3.71Å; F110-T117 HydrophobicContact CG-CG2 3.7Å; F110-T117 HydrophobicContact CZ-CG2 4.48Å
111	G	88	Confident	88.7	Confident	43 Å²	43	40.4 Å²	40.4	44%	0.443	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	54.7	-129.7	176	0	0	0	0	0	112.6	I107 S113 A114	I107-G111 WeakPolarHBondContact O-CA 3.43Å; I107-G111 PolarHBondContact O-N 3.13Å; G111-S113 PolarHBondContact O-N 3.05Å; G111-S113 VanDerWaalsContact O-N 3.09Å; G111-A114 WeakPolarHBondContact O-CB 3.49Å; G111-A114 PolarHBondContact O-N 2.91Å
112	D	84.6	Confident	89.4	Confident	98 Å²	98	38 Å²	38	52%	0.524	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-57.9	-26.3	178.7	-53.8	-53.5	0	0	0	113.4	F110 A114 S176	F110-D112 PolarHBondContact O-N 3.04Å; D112-A114 VanDerWaalsContact C-N 3.29Å; D112-A114 PolarHBondContact O-N 3.44Å; D112-S176 PolarHBondContact OD1-OG 3.46Å; D112-S176 VanDerWaalsContact OD1-OG 3.1Å
113	S	89.1	Confident	89.8	Confident	40 Å²	40	38.7 Å²	38.7	28%	0.28	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-77.6	-10.3	176.4	-61	0	0	0	0	113.7	F110 G111 S115 F116 T117	F110-S113 WeakPolarHBondContact O-CB 3.28Å; F110-S113 PolarHBondContact O-N 3.05Å; G111-S113 PolarHBondContact O-N 3.05Å; G111-S113 VanDerWaalsContact O-N 3.09Å; S113-S115 VanDerWaalsContact C-N 3.27Å; S113-S115 PolarHBondContact O-N 2.99Å; S113-F116 PolarHBondContact O-N 2.81Å; S113-F116 VanDerWaalsContact O-N 3.13Å; S113-T117 VanDerWaalsContact O-CG2 3.26Å; S113-T117 WeakPolarHBondContact O-CG2 3.21Å; S113-T117 PolarHBondContact O-N 2.84Å
114	A	90.5	Very high	90.3	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-33	-175.7	0	0	0	0	0	113.6	I107 F110 G111 D112 T117 L118 L144	I107-A114 HydrophobicContact CB-CB 4.41Å; I107-A114 HydrophobicContact CG1-CB 4.21Å; F110-A114 HydrophobicContact CB-CB 4.09Å; G111-A114 WeakPolarHBondContact O-CB 3.49Å; G111-A114 PolarHBondContact O-N 2.91Å; D112-A114 VanDerWaalsContact C-N 3.29Å; D112-A114 PolarHBondContact O-N 3.44Å; A114-T117 WeakPolarHBondContact CA-OG1 3.35Å; A114-T117 PolarHBondContact O-N 3.02Å; A114-T117 PolarHBondContact O-OG1 3.48Å; A114-T117 VanDerWaalsContact O-OG1 3.1Å; A114-L118 WeakPolarHBondContact O-CB 3.47Å; A114-L118 VanDerWaalsContact O-CG 3.31Å; A114-L118 WeakPolarHBondContact O-CG 3.49Å; A114-L118 PolarHBondContact O-N 2.96Å; A114-L144 HydrophobicContact CB-CD1 4.16Å
115	S	92.5	Very high	90.6	Very high	7 Å²	7	34.1 Å²	34.1	5%	0.049	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-48.4	174.5	60.2	0	0	0	0	111.4	S113 S119 S141	S113-S115 VanDerWaalsContact C-N 3.27Å; S113-S115 PolarHBondContact O-N 2.99Å; S115-S119 WeakPolarHBondContact O-CB 3.5Å; S115-S119 PolarHBondContact O-N 3.42Å; S115-S141 PolarHBondContact O-OG 3.22Å
116	F	94.3	Very high	90.8	Very high	97 Å²	97	32.3 Å²	32.3	43%	0.425	18%	0.184	S	C	.	.	H	α-helix	trans	-68.9	-34.2	176.9	-57.3	-75.1	0	0	0	113	F73 S113 L120 L148	F73-F116 HydrophobicContact CE2-CB 3.97Å; F73-F116 HydrophobicContact CZ-CB 3.79Å; S113-F116 PolarHBondContact O-N 2.81Å; S113-F116 VanDerWaalsContact O-N 3.13Å; F116-L120 WeakPolarHBondContact O-CB 3.42Å; F116-L120 PolarHBondContact O-N 3.31Å; F116-L148 HydrophobicContact CD1-CD2 4.34Å; F116-L148 HydrophobicContact CE1-CD2 3.64Å; F116-L148 HydrophobicContact CZ-CD2 4.19Å
117	T	93	Very high	90.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-72.5	-39.8	179.5	70.5	0	0	0	0	111.8	F73 F110 S113 A114 L120 L121	F73-T117 HydrophobicContact CB-CG2 4.14Å; F73-T117 HydrophobicContact CD2-CG2 3.44Å; F73-T117 VanDerWaalsContact CD2-CG2 3.44Å; F73-T117 HydrophobicContact CE2-CG2 4.15Å; F73-T117 HydrophobicContact CG-CG2 4.03Å; F110-T117 HydrophobicContact CB-CG2 4.07Å; F110-T117 HydrophobicContact CD1-CG2 3.27Å; F110-T117 HydrophobicContact CD2-CG2 4.47Å; F110-T117 HydrophobicContact CE1-CG2 3.71Å; F110-T117 HydrophobicContact CG-CG2 3.7Å; F110-T117 HydrophobicContact CZ-CG2 4.48Å; S113-T117 VanDerWaalsContact O-CG2 3.26Å; S113-T117 WeakPolarHBondContact O-CG2 3.21Å; S113-T117 PolarHBondContact O-N 2.84Å; A114-T117 WeakPolarHBondContact CA-OG1 3.35Å; A114-T117 PolarHBondContact O-N 3.02Å; A114-T117 PolarHBondContact O-OG1 3.48Å; A114-T117 VanDerWaalsContact O-OG1 3.1Å; T117-L120 PolarHBondContact O-N 3.08Å; T117-L121 WeakPolarHBondContact O-CB 3.45Å; T117-L121 PolarHBondContact O-N 2.96Å
118	L	93.9	Very high	91	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.3	-39	173.5	-71.7	168.7	0	0	0	111.8	I106 I107 A114 L121 G122 R140 L144	I106-L118 HydrophobicContact CD1-CD2 4.48Å; I106-L118 HydrophobicContact CG2-CD2 4.07Å; I106-L118 HydrophobicContact CG2-CG 4.22Å; I107-L118 HydrophobicContact CD1-CD1 4.31Å; I107-L118 HydrophobicContact CG1-CD1 4Å; A114-L118 WeakPolarHBondContact O-CB 3.47Å; A114-L118 VanDerWaalsContact O-CG 3.31Å; A114-L118 WeakPolarHBondContact O-CG 3.49Å; A114-L118 PolarHBondContact O-N 2.96Å; L118-L121 PolarHBondContact O-N 3.29Å; L118-G122 PolarHBondContact O-N 3.19Å; L118-R140 HydrophobicContact CD1-CB 3.94Å; L118-L144 HydrophobicContact CD1-CD1 3.61Å
119	S	94.8	Very high	91	Very high	13 Å²	13	40.2 Å²	40.2	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-60.3	-46.9	170.4	179.4	0	0	0	0	111.7	S115 L121 G122 H123 F138	S115-S119 WeakPolarHBondContact O-CB 3.5Å; S115-S119 PolarHBondContact O-N 3.42Å; S119-L121 PolarHBondContact O-N 3.14Å; S119-G122 PolarHBondContact O-N 3.24Å; S119-H123 PolarHBondContact O-N 3.29Å; S119-H123 VanDerWaalsContact O-N 3.07Å; S119-H123 PolarHBondContact O-ND1 3.33Å; S119-F138 WeakPolarHBondContact O-CE1 3.39Å
120	L	94.4	Very high	91.2	Very high	14 Å²	14	41.6 Å²	41.6	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-41.6	177.2	-175.5	64.6	0	0	0	112	F73 A76 K77 V80 L92 F116 T117 H123 I124	F73-L120 HydrophobicContact CD2-CD2 4.07Å; F73-L120 HydrophobicContact CE2-CB 4.28Å; F73-L120 HydrophobicContact CE2-CD2 3.85Å; A76-L120 HydrophobicContact CB-CD2 4.01Å; K77-L120 HydrophobicContact CB-CD2 4.17Å; K77-L120 HydrophobicContact CD-CD1 4.21Å; V80-L120 HydrophobicContact CB-CD1 4.25Å; V80-L120 HydrophobicContact CG1-CD1 4.37Å; V80-L120 HydrophobicContact CG2-CD1 3.89Å; V80-L120 HydrophobicContact CG2-CG 4.41Å; L92-L120 HydrophobicContact CD1-CD2 4.4Å; F116-L120 WeakPolarHBondContact O-CB 3.42Å; F116-L120 PolarHBondContact O-N 3.31Å; T117-L120 PolarHBondContact O-N 3.08Å; L120-H123 PolarHBondContact O-N 3.14Å; L120-I124 WeakPolarHBondContact O-CG1 3.15Å; L120-I124 PolarHBondContact O-N 2.88Å; L120-I124 VanDerWaalsContact O-N 3.08Å
121	L	93.2	Very high	91.4	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-38.3	175.7	-172.7	62	0	0	0	111.8	E89 L92 I93 I106 T117 L118 S119 H123 I124 Y125	E89-L121 HydrophobicContact CG-CD1 4.4Å; L92-L121 HydrophobicContact CD1-CB 4.11Å; L92-L121 HydrophobicContact CD1-CD1 4.26Å; I93-L121 HydrophobicContact CD1-CD1 4.15Å; I93-L121 HydrophobicContact CD1-CD2 4.45Å; I93-L121 HydrophobicContact CG1-CD1 4.14Å; I93-L121 HydrophobicContact CG1-CD2 4.16Å; I106-L121 HydrophobicContact CD1-CD2 4.01Å; T117-L121 WeakPolarHBondContact O-CB 3.45Å; T117-L121 PolarHBondContact O-N 2.96Å; L118-L121 PolarHBondContact O-N 3.29Å; S119-L121 PolarHBondContact O-N 3.14Å; L121-H123 PolarHBondContact O-N 2.93Å; L121-I124 WeakPolarHBondContact O-CB 3.31Å; L121-I124 PolarHBondContact O-N 3.43Å; L121-I124 VanDerWaalsContact O-N 3.14Å; L121-Y125 HydrophobicContact CD1-CE1 4.45Å; L121-Y125 HydrophobicContact CD1-CE2 4.21Å; L121-Y125 HydrophobicContact CD2-CE2 3.9Å; L121-Y125 HydrophobicContact CG-CD2 4.04Å; L121-Y125 HydrophobicContact CG-CE2 3.67Å; L121-Y125 PolarHBondContact O-N 2.61Å
122	G	93.6	Very high	91.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.4	-45.6	172.2	0	0	0	0	0	112.4	L118 S119 I124 Y125 C126 F138	L118-G122 PolarHBondContact O-N 3.19Å; S119-G122 PolarHBondContact O-N 3.24Å; G122-I124 VanDerWaalsContact C-N 3.34Å; G122-I124 PolarHBondContact O-N 3.34Å; G122-Y125 PolarHBondContact O-N 2.91Å; G122-C126 PolarHBondContact O-N 3.42Å; G122-C126 PolarHBondContact O-SG 2.99Å; G122-F138 VanDerWaalsContact C-CZ 3.42Å
123	H	92.4	Very high	91.8	Very high	63 Å²	63	44.4 Å²	44.4	29%	0.292	24%	0.237	S	C	.	.	H	α-helix	trans	-62	-39.1	174	-69.7	84.3	0	0	0	112.5	S119 L120 L121 K127 F138 N154	S119-H123 PolarHBondContact O-N 3.29Å; S119-H123 VanDerWaalsContact O-N 3.07Å; S119-H123 PolarHBondContact O-ND1 3.33Å; L120-H123 PolarHBondContact O-N 3.14Å; L121-H123 PolarHBondContact O-N 2.93Å; H123-K127 WeakPolarHBondContact O-CB 3.47Å; H123-K127 WeakPolarHBondContact O-CG 3.5Å; H123-K127 PolarHBondContact O-N 3.26Å; H123-F138 AromaticContact CE1-CE1 3.85Å; H123-F138 AromaticContact ND1-CE1 3.6Å; H123-F138 AromaticContact ND1-CZ 3.88Å; H123-N154 PolarHBondContact CE1-ND2 3.2Å; H123-N154 PolarHBondContact NE2-ND2 3.24Å
124	I	93.1	Very high	92	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-46.5	175.9	-67.6	166.5	0	0	0	110.6	V80 L85 E89 L92 L120 L121 G122 K127 T128	V80-I124 HydrophobicContact CG2-CD1 3.63Å; V80-I124 HydrophobicContact CG2-CG1 3.5Å; L85-I124 HydrophobicContact CB-CG2 4.39Å; E89-I124 HydrophobicContact CB-CG2 4.12Å; L92-I124 HydrophobicContact CD1-CD1 4.29Å; L120-I124 WeakPolarHBondContact O-CG1 3.15Å; L120-I124 PolarHBondContact O-N 2.88Å; L120-I124 VanDerWaalsContact O-N 3.08Å; L121-I124 WeakPolarHBondContact O-CB 3.31Å; L121-I124 PolarHBondContact O-N 3.43Å; L121-I124 VanDerWaalsContact O-N 3.14Å; G122-I124 VanDerWaalsContact C-N 3.34Å; G122-I124 PolarHBondContact O-N 3.34Å; I124-K127 PolarHBondContact O-N 2.83Å; I124-T128 WeakPolarHBondContact O-CB 3.14Å; I124-T128 WeakPolarHBondContact O-CG2 3.29Å; I124-T128 PolarHBondContact O-N 3.39Å; I124-T128 PolarHBondContact O-OG1 3.29Å
125	Y	93.1	Very high	92.1	Very high	22 Å²	22	42.6 Å²	42.6	9%	0.086	22%	0.224	C	C	.	.	H	α-helix	trans	-61.5	-43.5	177.2	-74	-36.9	0	0	0	112.2	I93 L121 G122 T128 D129 R130 K133 C137	I93-Y125 HydrophobicContact CD1-CE1 4.37Å; I93-Y125 VanDerWaalsContact CD1-OH 3.23Å; I93-Y125 WeakPolarHBondContact CD1-OH 3.46Å; L121-Y125 HydrophobicContact CD1-CE1 4.45Å; L121-Y125 HydrophobicContact CD1-CE2 4.21Å; L121-Y125 HydrophobicContact CD2-CE2 3.9Å; L121-Y125 HydrophobicContact CG-CD2 4.04Å; L121-Y125 HydrophobicContact CG-CE2 3.67Å; L121-Y125 PolarHBondContact O-N 2.61Å; G122-Y125 PolarHBondContact O-N 2.91Å; Y125-T128 WeakPolarHBondContact CA-OG1 3.24Å; Y125-T128 CarbonylContact O-C 3.55Å; Y125-T128 PolarHBondContact O-N 3.33Å; Y125-T128 VanDerWaalsContact O-N 3.14Å; Y125-T128 PolarHBondContact O-OG1 3Å; Y125-D129 PolarHBondContact O-N 3.16Å; Y125-R130 HydrophobicContact CD1-CB 4.36Å; Y125-R130 WeakPolarHBondContact O-CA 3.48Å; Y125-R130 PolarHBondContact O-N 3.46Å; Y125-K133 HydrophobicContact CD1-CB 4.48Å; Y125-K133 HydrophobicContact CD2-CB 3.76Å; Y125-K133 WeakPolarHBondContact CD2-O 3.4Å; Y125-K133 HydrophobicContact CE2-CB 3.89Å; Y125-K133 HydrophobicContact CG-CB 4.06Å; Y125-C137 VanDerWaalsContact CE2-SG 3.58Å
126	C	90.8	Very high	92.1	Very high	40 Å²	40	46.4 Å²	46.4	27%	0.27	24%	0.241	S	C	.	.	H	α-helix	trans	-62	-44.8	174.9	-64.7	0	0	0	0	112.5	G122 T128 D129	G122-C126 PolarHBondContact O-N 3.42Å; G122-C126 PolarHBondContact O-SG 2.99Å; C126-T128 PolarHBondContact O-N 3.19Å; C126-D129 PolarHBondContact O-N 3.4Å
127	K	88.5	Confident	92.1	Very high	137 Å²	137	42 Å²	42	60%	0.596	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-4.2	176	-70.2	-168.3	174.6	-167.9	0	114.4	L85 H123 I124	L85-K127 HydrophobicContact CD1-CB 3.58Å; L85-K127 HydrophobicContact CD1-CD 4.44Å; L85-K127 HydrophobicContact CD2-CB 4.43Å; L85-K127 HydrophobicContact CD2-CD 4.32Å; H123-K127 WeakPolarHBondContact O-CB 3.47Å; H123-K127 WeakPolarHBondContact O-CG 3.5Å; H123-K127 PolarHBondContact O-N 3.26Å; I124-K127 PolarHBondContact O-N 2.83Å
128	T	90.6	Very high	92.1	Very high	44 Å²	44	42 Å²	42	27%	0.27	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120	29.8	175.7	54.2	0	0	0	0	112.1	L85 I124 Y125 C126 R130	L85-T128 HydrophobicContact CB-CG2 4.04Å; L85-T128 HydrophobicContact CD1-CG2 4.04Å; I124-T128 WeakPolarHBondContact O-CB 3.14Å; I124-T128 WeakPolarHBondContact O-CG2 3.29Å; I124-T128 PolarHBondContact O-N 3.39Å; I124-T128 PolarHBondContact O-OG1 3.29Å; Y125-T128 WeakPolarHBondContact CA-OG1 3.24Å; Y125-T128 CarbonylContact O-C 3.55Å; Y125-T128 PolarHBondContact O-N 3.33Å; Y125-T128 VanDerWaalsContact O-N 3.14Å; Y125-T128 PolarHBondContact O-OG1 3Å; C126-T128 PolarHBondContact O-N 3.19Å; T128-R130 PolarHBondContact O-N 3.42Å; T128-R130 VanDerWaalsContact O-N 3.12Å; T128-R130 PolarHBondContact OG1-NE 3.47Å; T128-R130 PolarHBondContact OG1-NH2 3.32Å
129	D	88.1	Confident	92.1	Very high	152 Å²	152	46.1 Å²	46.1	81%	0.813	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	22.2	173.9	-151.6	26.4	0	0	0	115.3	Y125 C126	Y125-D129 PolarHBondContact O-N 3.16Å; C126-D129 PolarHBondContact O-N 3.4Å
130	R	91	Very high	91.9	Very high	88 Å²	88	50.2 Å²	50.2	33%	0.332	26%	0.255	S	S	.	.			trans	-108.8	49.4	179.7	-71.2	174.1	-67.2	166.2	2.1	111.2	E89 Y125 T128 A132 K133 G134	E89-R130 VanDerWaalsContact CD-NH2 3.29Å; E89-R130 IonicContact OE1-CZ 3.19Å; E89-R130 IonicContact OE1-NH1 3.35Å; E89-R130 PolarHBondContact OE1-NH1 2.98Å; E89-R130 IonicContact OE1-NH2 3.16Å; E89-R130 PolarHBondContact OE1-NH2 2.64Å; E89-R130 IonicContact OE2-CZ 2.8Å; E89-R130 IonicContact OE2-NH1 2.73Å; E89-R130 IonicContact OE2-NH2 2.66Å; E89-R130 PolarHBondContact OE2-NH2 2.67Å; Y125-R130 HydrophobicContact CD1-CB 4.36Å; Y125-R130 WeakPolarHBondContact O-CA 3.48Å; Y125-R130 PolarHBondContact O-N 3.46Å; T128-R130 PolarHBondContact O-N 3.42Å; T128-R130 VanDerWaalsContact O-N 3.12Å; T128-R130 PolarHBondContact OG1-NE 3.47Å; T128-R130 PolarHBondContact OG1-NH2 3.32Å; R130-A132 VanDerWaalsContact C-N 3.3Å; R130-A132 PolarHBondContact O-N 2.8Å; R130-A132 VanDerWaalsContact O-N 3.15Å; R130-K133 PolarHBondContact O-N 3.44Å; R130-K133 VanDerWaalsContact O-N 3.14Å; R130-G134 PolarHBondContact O-N 3.03Å; R130-G134 VanDerWaalsContact O-N 3.07Å
131	A	88.9	Confident	91.8	Very high	45 Å²	45	49.5 Å²	49.5	37%	0.372	25%	0.251	S	S	.	.	H	α-helix	trans	-47.8	-43.8	-173.5	0	0	0	0	0	114.4	G134 A135 L158	A131-G134 CarbonylContact O-C 3.53Å; A131-G134 WeakPolarHBondContact O-CA 3.43Å; A131-G134 PolarHBondContact O-N 3.29Å; A131-G134 VanDerWaalsContact O-N 3.11Å; A131-A135 PolarHBondContact O-N 3.46Å; A131-L158 HydrophobicContact CB-CD2 4.06Å
132	A	91.3	Very high	91.7	Very high	69 Å²	69	49.5 Å²	49.5	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-60.5	-49.3	179.8	0	0	0	0	0	113	R130 G134 A135 E136	R130-A132 VanDerWaalsContact C-N 3.3Å; R130-A132 PolarHBondContact O-N 2.8Å; R130-A132 VanDerWaalsContact O-N 3.15Å; A132-G134 PolarHBondContact O-N 3.26Å; A132-A135 WeakPolarHBondContact O-CB 3.32Å; A132-A135 PolarHBondContact O-N 3.37Å; A132-A135 VanDerWaalsContact O-N 3.13Å; A132-E136 PolarHBondContact O-N 2.9Å
133	K	90.9	Very high	91.6	Very high	95 Å²	95	53.6 Å²	53.6	41%	0.413	28%	0.277	S	S	.	.	H	α-helix	trans	-64.3	-30.2	174.2	-67	-164.1	173.1	-163.2	0	112.2	Y125 R130 C137	Y125-K133 HydrophobicContact CD1-CB 4.48Å; Y125-K133 HydrophobicContact CD2-CB 3.76Å; Y125-K133 WeakPolarHBondContact CD2-O 3.4Å; Y125-K133 HydrophobicContact CE2-CB 3.89Å; Y125-K133 HydrophobicContact CG-CB 4.06Å; R130-K133 PolarHBondContact O-N 3.44Å; R130-K133 VanDerWaalsContact O-N 3.14Å; K133-C137 PolarHBondContact O-N 3.08Å; K133-C137 PolarHBondContact O-SG 2.95Å
134	G	92.6	Very high	91.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.1	-48.2	170.8	0	0	0	0	0	112.4	R130 A131 A132 C137 F138	R130-G134 PolarHBondContact O-N 3.03Å; R130-G134 VanDerWaalsContact O-N 3.07Å; A131-G134 CarbonylContact O-C 3.53Å; A131-G134 WeakPolarHBondContact O-CA 3.43Å; A131-G134 PolarHBondContact O-N 3.29Å; A131-G134 VanDerWaalsContact O-N 3.11Å; A132-G134 PolarHBondContact O-N 3.26Å; G134-C137 PolarHBondContact O-N 2.76Å; G134-F138 WeakPolarHBondContact O-CD2 3.41Å; G134-F138 WeakPolarHBondContact O-CG 3.32Å; G134-F138 PolarHBondContact O-N 3.46Å
135	A	93.2	Very high	91.2	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-47.3	177	0	0	0	0	0	112.3	A131 A132 C137 F138 Q139 L155 L158 E160	A131-A135 PolarHBondContact O-N 3.46Å; A132-A135 WeakPolarHBondContact O-CB 3.32Å; A132-A135 PolarHBondContact O-N 3.37Å; A132-A135 VanDerWaalsContact O-N 3.13Å; A135-C137 VanDerWaalsContact C-N 3.3Å; A135-C137 PolarHBondContact O-N 3.31Å; A135-F138 PolarHBondContact O-N 3.45Å; A135-F138 VanDerWaalsContact O-N 3.16Å; A135-Q139 WeakPolarHBondContact O-CG 3.35Å; A135-Q139 PolarHBondContact O-N 2.66Å; A135-L155 HydrophobicContact CB-CD2 3.66Å; A135-L158 HydrophobicContact CB-CD1 4.06Å; A135-E160 HydrophobicContact CB-CG 3.93Å
136	E	92.6	Very high	91.1	Very high	87 Å²	87	53.2 Å²	53.2	41%	0.407	28%	0.278	S	S	.	.	H	α-helix	trans	-53.3	-46.5	173.6	-68.6	168.7	-151.8	0	0	111.8	Q103 A132 F138 Q139 R140	Q103-E136 PolarHBondContact NE2-OE2 3.28Å; A132-E136 PolarHBondContact O-N 2.9Å; E136-F138 PolarHBondContact O-N 3.36Å; E136-Q139 PolarHBondContact O-N 3.1Å; E136-R140 WeakPolarHBondContact O-CG 3.43Å; E136-R140 PolarHBondContact O-N 3.47Å
137	C	93.3	Very high	91	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-36.1	179.8	-66.7	0	0	0	0	112.7	Y125 K133 G134 A135 S141	Y125-C137 VanDerWaalsContact CE2-SG 3.58Å; K133-C137 PolarHBondContact O-N 3.08Å; K133-C137 PolarHBondContact O-SG 2.95Å; G134-C137 PolarHBondContact O-N 2.76Å; A135-C137 VanDerWaalsContact C-N 3.3Å; A135-C137 PolarHBondContact O-N 3.31Å; C137-S141 VanDerWaalsContact O-CB 3.32Å; C137-S141 WeakPolarHBondContact O-CB 3.13Å; C137-S141 PolarHBondContact O-N 3.43Å
138	F	94.9	Very high	91.3	Very high	1 Å²	1	50.4 Å²	50.4	0%	0.004	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-41.1	172.9	-67.6	-45.9	0	0	0	112.3	S119 G122 H123 G134 A135 E136 S141 L142 P151 N154 L155 L158	S119-F138 WeakPolarHBondContact O-CE1 3.39Å; G122-F138 VanDerWaalsContact C-CZ 3.42Å; H123-F138 AromaticContact CE1-CE1 3.85Å; H123-F138 AromaticContact ND1-CE1 3.6Å; H123-F138 AromaticContact ND1-CZ 3.88Å; G134-F138 WeakPolarHBondContact O-CD2 3.41Å; G134-F138 WeakPolarHBondContact O-CG 3.32Å; G134-F138 PolarHBondContact O-N 3.46Å; A135-F138 PolarHBondContact O-N 3.45Å; A135-F138 VanDerWaalsContact O-N 3.16Å; E136-F138 PolarHBondContact O-N 3.36Å; F138-S141 WeakPolarHBondContact O-CB 3.34Å; F138-S141 PolarHBondContact O-N 3.03Å; F138-L142 WeakPolarHBondContact O-CG 3.34Å; F138-L142 PolarHBondContact O-N 3.13Å; F138-P151 HydrophobicContact CB-CB 3.97Å; F138-P151 HydrophobicContact CD1-CB 3.8Å; F138-P151 HydrophobicContact CD1-CG 4.41Å; F138-P151 HydrophobicContact CG-CB 4.21Å; F138-N154 HydrophobicContact CD2-CB 3.95Å; F138-N154 HydrophobicContact CE1-CB 4.27Å; F138-N154 HydrophobicContact CE2-CB 3.52Å; F138-N154 HydrophobicContact CZ-CB 3.7Å; F138-N154 VanDerWaalsContact CZ-ND2 3.29Å; F138-N154 WeakPolarHBondContact CZ-ND2 3.24Å; F138-L155 HydrophobicContact CB-CD1 3.93Å; F138-L155 HydrophobicContact CB-CD2 4.06Å; F138-L155 HydrophobicContact CB-CG 3.74Å; F138-L155 HydrophobicContact CD2-CG 4.45Å; F138-L158 HydrophobicContact CD2-CD1 4.35Å; F138-L158 HydrophobicContact CE2-CD1 4.37Å
139	Q	92.7	Very high	91.5	Very high	87 Å²	87	50.6 Å²	50.6	41%	0.407	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-47.2	174.5	-70.5	172.2	8.6	0	0	110.7	A135 E136 S141 L142 T143 L155	A135-Q139 WeakPolarHBondContact O-CG 3.35Å; A135-Q139 PolarHBondContact O-N 2.66Å; E136-Q139 PolarHBondContact O-N 3.1Å; Q139-S141 PolarHBondContact O-N 3.34Å; Q139-L142 PolarHBondContact O-N 2.99Å; Q139-T143 PolarHBondContact O-N 3.1Å; Q139-L155 HydrophobicContact CG-CD1 3.93Å; Q139-L155 HydrophobicContact CG-CD2 4.08Å
140	R	91.1	Very high	91.8	Very high	99 Å²	99	46 Å²	46	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-60.7	-44.1	174.4	-67.8	-59	-162.6	160.3	10.3	112.6	Q103 L118 E136 L142 T143 L144	Q103-R140 VanDerWaalsContact OE1-CG 3.29Å; L118-R140 HydrophobicContact CD1-CB 3.94Å; E136-R140 WeakPolarHBondContact O-CG 3.43Å; E136-R140 PolarHBondContact O-N 3.47Å; R140-L142 PolarHBondContact O-N 3.45Å; R140-T143 WeakPolarHBondContact CA-OG1 3.42Å; R140-T143 PolarHBondContact O-N 3.45Å; R140-T143 VanDerWaalsContact O-N 3.14Å; R140-T143 PolarHBondContact O-OG1 3.05Å; R140-L144 WeakPolarHBondContact O-CG 3.43Å; R140-L144 PolarHBondContact O-N 3.41Å
141	S	92.9	Very high	91.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-54.4	-38.4	175	175.6	0	0	0	0	112.5	S115 C137 F138 Q139 N145	S115-S141 PolarHBondContact O-OG 3.22Å; C137-S141 VanDerWaalsContact O-CB 3.32Å; C137-S141 WeakPolarHBondContact O-CB 3.13Å; C137-S141 PolarHBondContact O-N 3.43Å; F138-S141 WeakPolarHBondContact O-CB 3.34Å; F138-S141 PolarHBondContact O-N 3.03Å; Q139-S141 PolarHBondContact O-N 3.34Å; S141-N145 PolarHBondContact O-N 3.02Å; S141-N145 VanDerWaalsContact O-N 3.14Å
142	L	91.3	Very high	92.2	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-73.6	-40.2	177.3	-68.8	167	0	0	0	112.3	F138 Q139 R140 L144 N145 L148 P151 F152 L155 V167	F138-L142 WeakPolarHBondContact O-CG 3.34Å; F138-L142 PolarHBondContact O-N 3.13Å; Q139-L142 PolarHBondContact O-N 2.99Å; R140-L142 PolarHBondContact O-N 3.45Å; L142-L144 PolarHBondContact O-N 2.89Å; L142-L144 VanDerWaalsContact O-N 3.17Å; L142-N145 CarbonylContact O-C 3.33Å; L142-N145 PolarHBondContact O-N 3.47Å; L142-L148 WeakPolarHBondContact CD2-O 3.41Å; L142-P151 HydrophobicContact CD1-CB 4.33Å; L142-P151 HydrophobicContact CD2-CB 4.04Å; L142-P151 HydrophobicContact CG-CB 3.92Å; L142-F152 HydrophobicContact CD1-CB 4.11Å; L142-F152 HydrophobicContact CD2-CB 4.2Å; L142-L155 HydrophobicContact CD1-CD1 3.66Å; L142-V167 HydrophobicContact CB-CG1 4.17Å; L142-V167 HydrophobicContact CD1-CG1 3.91Å; L142-V167 HydrophobicContact CD1-CG2 4.14Å; L142-V167 HydrophobicContact CD2-CG1 3.89Å; L142-V167 HydrophobicContact CG-CG1 4.21Å
143	T	90	Very high	92.4	Very high	86 Å²	86	39 Å²	39	53%	0.528	19%	0.189	S	C	.	.	H	α-helix	trans	-64.1	-17.9	176.1	58.1	0	0	0	0	114	Q139 R140 A172	Q139-T143 PolarHBondContact O-N 3.1Å; R140-T143 WeakPolarHBondContact CA-OG1 3.42Å; R140-T143 PolarHBondContact O-N 3.45Å; R140-T143 VanDerWaalsContact O-N 3.14Å; R140-T143 PolarHBondContact O-OG1 3.05Å; T143-A172 WeakPolarHBondContact O-CB 3.32Å
144	L	88.4	Confident	92.4	Very high	48 Å²	48	36.1 Å²	36.1	25%	0.251	18%	0.178	S	C	.	.	H	α-helix	trans	-93.6	-37.4	174.3	-63.4	167	0	0	0	112.5	I107 A114 L118 R140 L142	I107-L144 HydrophobicContact CD1-CD1 4.03Å; I107-L144 HydrophobicContact CD1-CD2 4.2Å; I107-L144 HydrophobicContact CG1-CD1 3.81Å; I107-L144 HydrophobicContact CG1-CD2 4.36Å; I107-L144 HydrophobicContact CG2-CD2 4.21Å; A114-L144 HydrophobicContact CB-CD1 4.16Å; L118-L144 HydrophobicContact CD1-CD1 3.61Å; R140-L144 WeakPolarHBondContact O-CG 3.43Å; R140-L144 PolarHBondContact O-N 3.41Å; L142-L144 PolarHBondContact O-N 2.89Å; L142-L144 VanDerWaalsContact O-N 3.17Å
145	N	89.4	Confident	92.5	Very high	29 Å²	29	36.1 Å²	36.1	16%	0.155	18%	0.178	C	C	.	.			trans	-142.8	96.4	-177.6	-173.7	-8.4	0	0	0	111.1	S141 L142 F147 L148	S141-N145 PolarHBondContact O-N 3.02Å; S141-N145 VanDerWaalsContact O-N 3.14Å; L142-N145 CarbonylContact O-C 3.33Å; L142-N145 PolarHBondContact O-N 3.47Å; N145-F147 PolarHBondContact O-N 3.15Å; N145-F147 WeakPolarHBondContact OD1-CB 3.4Å; N145-F147 PolarHBondContact OD1-N 3.22Å; N145-F147 VanDerWaalsContact OD1-N 3.12Å; N145-L148 HydrophobicContact CB-CD1 3.92Å; N145-L148 HydrophobicContact CB-CG 3.96Å; N145-L148 PolarHBondContact O-N 3.31Å
146	P	89.8	Confident	92.5	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-9.7	-178.4	29.1	-36.3	0	0	0	113.8	L148 V167 F168 A172 L173 M448	P146-L148 VanDerWaalsContact C-N 3.25Å; P146-L148 PolarHBondContact O-N 2.92Å; P146-V167 WeakPolarHBondContact CB-O 3.16Å; P146-F168 VanDerWaalsContact O-CD1 3.23Å; P146-F168 WeakPolarHBondContact O-CD1 3.31Å; P146-F168 WeakPolarHBondContact O-CE1 3.41Å; P146-A172 HydrophobicContact CG-CB 4.36Å; P146-L173 HydrophobicContact CG-CD1 4.22Å; P146-L173 HydrophobicContact CG-CG 4.17Å; P146-M448 HydrophobicContact CB-CE 3.82Å; P146-M448 HydrophobicContact CB-SD 3.99Å; P146-M448 HydrophobicContact CG-CE 3.72Å; P146-M448 HydrophobicContact CG-SD 4.34Å
147	F	90.5	Very high	92.3	Very high	93 Å²	93	35.2 Å²	35.2	41%	0.408	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-8	175.9	-62.7	-80.4	0	0	0	113.4	N145 W149 L170 L173 A444 M448	N145-F147 PolarHBondContact O-N 3.15Å; N145-F147 WeakPolarHBondContact OD1-CB 3.4Å; N145-F147 PolarHBondContact OD1-N 3.22Å; N145-F147 VanDerWaalsContact OD1-N 3.12Å; F147-W149 PolarHBondContact O-N 2.87Å; F147-L170 HydrophobicContact CZ-CD2 4.46Å; F147-L173 HydrophobicContact CD2-CD1 4.48Å; F147-L173 HydrophobicContact CE2-CD1 3.61Å; F147-L173 HydrophobicContact CE2-CD2 4.2Å; F147-L173 HydrophobicContact CZ-CD1 4.2Å; F147-A444 HydrophobicContact CZ-CB 4.25Å; F147-M448 HydrophobicContact CD1-CE 3.42Å; F147-M448 VanDerWaalsContact CD1-CE 3.42Å; F147-M448 HydrophobicContact CD2-CE 4.07Å; F147-M448 HydrophobicContact CE1-CE 3.42Å; F147-M448 VanDerWaalsContact CE1-CE 3.42Å; F147-M448 HydrophobicContact CE2-CE 4.07Å; F147-M448 HydrophobicContact CG-CE 3.76Å; F147-M448 HydrophobicContact CZ-CE 3.75Å
148	L	93	Very high	92.1	Very high	24 Å²	24	38 Å²	38	13%	0.126	19%	0.188	C	C	.	.			trans	-82.3	101.9	-176.9	-59.8	-178.3	0	0	0	111.5	F116 L142 N145 P146 P151	F116-L148 HydrophobicContact CD1-CD2 4.34Å; F116-L148 HydrophobicContact CE1-CD2 3.64Å; F116-L148 HydrophobicContact CZ-CD2 4.19Å; L142-L148 WeakPolarHBondContact CD2-O 3.41Å; N145-L148 HydrophobicContact CB-CD1 3.92Å; N145-L148 HydrophobicContact CB-CG 3.96Å; N145-L148 PolarHBondContact O-N 3.31Å; P146-L148 VanDerWaalsContact C-N 3.25Å; P146-L148 PolarHBondContact O-N 2.92Å; L148-P151 HydrophobicContact CB-CG 3.89Å; L148-P151 HydrophobicContact CD1-CG 4.45Å; L148-P151 WeakPolarHBondContact O-CD 3.12Å
149	W	94.8	Very high	91.7	Very high	49 Å²	49	39.5 Å²	39.5	19%	0.186	20%	0.204	C	C	.	.	H	α-helix	trans	-69.2	-38.8	175.7	-179	-103.5	0	0	0	113.8	F147 F152 Q153 F168 L451 L454 Y458 W485	F147-W149 PolarHBondContact O-N 2.87Å; W149-F152 HydrophobicContact CD2-CD1 4.48Å; W149-F152 HydrophobicContact CE3-CD1 4.02Å; W149-F152 AromaticContact CH2-CD1 3.75Å; W149-F152 HydrophobicContact CH2-CD1 3.75Å; W149-F152 AromaticContact CH2-CE1 3.69Å; W149-F152 HydrophobicContact CH2-CE1 3.69Å; W149-F152 HydrophobicContact CZ2-CD1 4.19Å; W149-F152 HydrophobicContact CZ2-CE1 4.38Å; W149-F152 AromaticContact CZ3-CD1 3.64Å; W149-F152 HydrophobicContact CZ3-CD1 3.64Å; W149-F152 AromaticContact CZ3-CE1 3.85Å; W149-F152 HydrophobicContact CZ3-CE1 3.85Å; W149-F152 WeakPolarHBondContact O-CB 3.42Å; W149-F152 PolarHBondContact O-N 3.39Å; W149-F152 VanDerWaalsContact O-N 3.09Å; W149-Q153 PolarHBondContact O-N 3.04Å; W149-F168 HydrophobicContact CE3-CZ 4.02Å; W149-F168 HydrophobicContact CZ3-CE2 4.44Å; W149-F168 HydrophobicContact CZ3-CZ 4.06Å; W149-L451 HydrophobicContact CE3-CD2 4.22Å; W149-L454 HydrophobicContact CH2-CB 4.43Å; W149-L454 HydrophobicContact CZ3-CB 4.45Å; W149-Y458 HydrophobicContact CH2-CD1 4.36Å; W149-Y458 HydrophobicContact CH2-CG 4.12Å; W149-Y458 AromaticContact CZ2-CD1 3.92Å; W149-Y458 HydrophobicContact CZ2-CD1 3.92Å; W149-Y458 HydrophobicContact CZ2-CD2 4.19Å; W149-Y458 AromaticContact CZ2-CG 3.73Å; W149-Y458 HydrophobicContact CZ2-CG 3.73Å; W149-W485 HydrophobicContact CH2-CH2 4.24Å; W149-W485 AromaticContact CZ2-CH2 3.73Å; W149-W485 HydrophobicContact CZ2-CH2 3.73Å; W149-W485 AromaticContact CZ2-CZ2 3.62Å; W149-W485 HydrophobicContact CZ2-CZ2 3.62Å
150	S	94.4	Very high	91.6	Very high	56 Å²	56	39.4 Å²	39.4	39%	0.392	20%	0.203	S	C	.	.	H	α-helix	trans	-66.1	-34.2	-171.3	55.7	0	0	0	0	115.9	Q153 N154	S150-Q153 PolarHBondContact O-N 3.08Å; S150-N154 WeakPolarHBondContact O-CB 3.44Å; S150-N154 VanDerWaalsContact O-CG 3.27Å; S150-N154 PolarHBondContact O-N 3.31Å; S150-N154 PolarHBondContact O-ND2 3.1Å
151	P	94.9	Very high	91.5	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-42.2	167.4	-24.6	35	0	0	0	113.2	F138 L142 L148 N154 L155	F138-P151 HydrophobicContact CB-CB 3.97Å; F138-P151 HydrophobicContact CD1-CB 3.8Å; F138-P151 HydrophobicContact CD1-CG 4.41Å; F138-P151 HydrophobicContact CG-CB 4.21Å; L142-P151 HydrophobicContact CD1-CB 4.33Å; L142-P151 HydrophobicContact CD2-CB 4.04Å; L142-P151 HydrophobicContact CG-CB 3.92Å; L148-P151 HydrophobicContact CB-CG 3.89Å; L148-P151 HydrophobicContact CD1-CG 4.45Å; L148-P151 WeakPolarHBondContact O-CD 3.12Å; P151-N154 PolarHBondContact O-N 2.89Å; P151-L155 WeakPolarHBondContact O-CG 3.38Å; P151-L155 PolarHBondContact O-N 3.06Å
152	F	95.1	Very high	91.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-45.4	177.2	176.9	-91.2	0	0	0	111.1	L142 W149 N154 L155 C156 P162 P164 V167 F168 G455 Y458 Q459	L142-F152 HydrophobicContact CD1-CB 4.11Å; L142-F152 HydrophobicContact CD2-CB 4.2Å; W149-F152 HydrophobicContact CD2-CD1 4.48Å; W149-F152 HydrophobicContact CE3-CD1 4.02Å; W149-F152 AromaticContact CH2-CD1 3.75Å; W149-F152 HydrophobicContact CH2-CD1 3.75Å; W149-F152 AromaticContact CH2-CE1 3.69Å; W149-F152 HydrophobicContact CH2-CE1 3.69Å; W149-F152 HydrophobicContact CZ2-CD1 4.19Å; W149-F152 HydrophobicContact CZ2-CE1 4.38Å; W149-F152 AromaticContact CZ3-CD1 3.64Å; W149-F152 HydrophobicContact CZ3-CD1 3.64Å; W149-F152 AromaticContact CZ3-CE1 3.85Å; W149-F152 HydrophobicContact CZ3-CE1 3.85Å; W149-F152 WeakPolarHBondContact O-CB 3.42Å; W149-F152 PolarHBondContact O-N 3.39Å; W149-F152 VanDerWaalsContact O-N 3.09Å; F152-N154 VanDerWaalsContact C-N 3.32Å; F152-N154 PolarHBondContact O-N 2.97Å; F152-L155 PolarHBondContact O-N 3.44Å; F152-C156 PolarHBondContact O-N 3.47Å; F152-C156 VanDerWaalsContact O-N 3.09Å; F152-P162 HydrophobicContact CD2-CB 4.46Å; F152-P162 HydrophobicContact CD2-CG 3.91Å; F152-P162 HydrophobicContact CE2-CB 4.37Å; F152-P162 HydrophobicContact CE2-CG 3.74Å; F152-P164 HydrophobicContact CE2-CB 4.45Å; F152-P164 HydrophobicContact CE2-CG 4.16Å; F152-P164 HydrophobicContact CZ-CG 4.07Å; F152-V167 HydrophobicContact CD2-CG1 4.19Å; F152-V167 HydrophobicContact CD2-CG2 4.43Å; F152-F168 HydrophobicContact CB-CZ 4.22Å; F152-F168 HydrophobicContact CD1-CZ 4.28Å; F152-F168 HydrophobicContact CD2-CE2 4.02Å; F152-F168 HydrophobicContact CD2-CZ 4.06Å; F152-F168 HydrophobicContact CE2-CE2 4.08Å; F152-F168 HydrophobicContact CG-CE2 4.25Å; F152-F168 AromaticContact CG-CZ 3.92Å; F152-F168 HydrophobicContact CG-CZ 3.92Å; F152-F168 HydrophobicContact CZ-CE2 4.38Å; F152-G455 WeakPolarHBondContact CZ-O 3.29Å; F152-Y458 HydrophobicContact CE1-CD1 4.26Å; F152-Q459 HydrophobicContact CZ-CB 4.44Å
153	Q	93.8	Very high	91.2	Very high	53 Å²	53	45.5 Å²	45.5	25%	0.248	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-45.5	175.1	-164.6	-176.6	-13.6	0	0	111.7	W149 S150 C156 H157 Y458	W149-Q153 PolarHBondContact O-N 3.04Å; S150-Q153 PolarHBondContact O-N 3.08Å; Q153-C156 PolarHBondContact O-N 3.33Å; Q153-H157 PolarHBondContact O-N 2.94Å; Q153-Y458 HydrophobicContact CB-CE1 4.35Å; Q153-Y458 HydrophobicContact CG-CE1 3.67Å; Q153-Y458 VanDerWaalsContact CG-OH 3.23Å; Q153-Y458 WeakPolarHBondContact CG-OH 3.48Å; Q153-Y458 PolarHBondContact NE2-OH 3.37Å
154	N	92.8	Very high	91.2	Very high	35 Å²	35	41.6 Å²	41.6	19%	0.187	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-38.9	177.8	-75.2	-27.6	0	0	0	113	H123 F138 S150 P151 F152 H157 L158	H123-N154 PolarHBondContact CE1-ND2 3.2Å; H123-N154 PolarHBondContact NE2-ND2 3.24Å; F138-N154 HydrophobicContact CD2-CB 3.95Å; F138-N154 HydrophobicContact CE1-CB 4.27Å; F138-N154 HydrophobicContact CE2-CB 3.52Å; F138-N154 HydrophobicContact CZ-CB 3.7Å; F138-N154 VanDerWaalsContact CZ-ND2 3.29Å; F138-N154 WeakPolarHBondContact CZ-ND2 3.24Å; S150-N154 WeakPolarHBondContact O-CB 3.44Å; S150-N154 VanDerWaalsContact O-CG 3.27Å; S150-N154 PolarHBondContact O-N 3.31Å; S150-N154 PolarHBondContact O-ND2 3.1Å; P151-N154 PolarHBondContact O-N 2.89Å; F152-N154 VanDerWaalsContact C-N 3.32Å; F152-N154 PolarHBondContact O-N 2.97Å; N154-H157 WeakPolarHBondContact O-CB 3.31Å; N154-H157 PolarHBondContact O-N 2.83Å; N154-L158 WeakPolarHBondContact O-CG 3.16Å; N154-L158 PolarHBondContact O-N 3.09Å
155	L	93.9	Very high	91.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.8	-49.1	173.9	-77.1	166	0	0	0	111.5	A135 F138 Q139 L142 P151 F152 H157 L158 G159 E160 P162	A135-L155 HydrophobicContact CB-CD2 3.66Å; F138-L155 HydrophobicContact CB-CD1 3.93Å; F138-L155 HydrophobicContact CB-CD2 4.06Å; F138-L155 HydrophobicContact CB-CG 3.74Å; F138-L155 HydrophobicContact CD2-CG 4.45Å; Q139-L155 HydrophobicContact CG-CD1 3.93Å; Q139-L155 HydrophobicContact CG-CD2 4.08Å; L142-L155 HydrophobicContact CD1-CD1 3.66Å; P151-L155 WeakPolarHBondContact O-CG 3.38Å; P151-L155 PolarHBondContact O-N 3.06Å; F152-L155 PolarHBondContact O-N 3.44Å; L155-H157 VanDerWaalsContact C-N 3.29Å; L155-H157 PolarHBondContact O-N 3.02Å; L155-L158 PolarHBondContact O-N 3.4Å; L155-L158 VanDerWaalsContact O-N 3.13Å; L155-G159 PolarHBondContact O-N 2.93Å; L155-G159 VanDerWaalsContact O-N 3.16Å; L155-E160 HydrophobicContact CB-CB 4.23Å; L155-E160 HydrophobicContact CD2-CB 4.03Å; L155-E160 HydrophobicContact CD2-CG 3.95Å; L155-E160 PolarHBondContact O-N 3.41Å; L155-E160 VanDerWaalsContact O-N 3.12Å; L155-P162 HydrophobicContact CB-CG 3.97Å; L155-P162 HydrophobicContact CD1-CB 4.3Å; L155-P162 HydrophobicContact CD1-CG 4.27Å
156	C	92.7	Very high	91.1	Very high	2 Å²	2	46 Å²	46	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-36.3	175.8	-68.6	0	0	0	0	112.3	F152 Q153 G159 Y458 C462 R618	F152-C156 PolarHBondContact O-N 3.47Å; F152-C156 VanDerWaalsContact O-N 3.09Å; Q153-C156 PolarHBondContact O-N 3.33Å; C156-G159 PolarHBondContact O-N 3.13Å; C156-Y458 HydrophobicContact CB-CD1 4.12Å; C156-Y458 HydrophobicContact CB-CE1 3.92Å; C156-C462 HydrophobicContact CB-CB 3.92Å; C156-R618 PolarHBondContact O-NH1 3.2Å
157	H	89.6	Confident	90.9	Very high	70 Å²	70	47.1 Å²	47.1	32%	0.324	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-37.1	172.3	-76.9	168.1	0	0	0	113.8	Q153 N154 L155 G159 Y458 R618	Q153-H157 PolarHBondContact O-N 2.94Å; N154-H157 WeakPolarHBondContact O-CB 3.31Å; N154-H157 PolarHBondContact O-N 2.83Å; L155-H157 VanDerWaalsContact C-N 3.29Å; L155-H157 PolarHBondContact O-N 3.02Å; H157-G159 PolarHBondContact O-N 3.29Å; H157-Y458 PolarHBondContact NE2-OH 3.12Å; H157-R618 WeakPolarHBondContact O-CD 3.29Å
158	L	89.1	Confident	90.7	Very high	61 Å²	61	42.7 Å²	42.7	32%	0.319	22%	0.22	S	C	.	.	H	α-helix	trans	-66.3	-25.1	174.4	-70.4	175	0	0	0	112.3	A131 A135 F138 N154 L155	A131-L158 HydrophobicContact CB-CD2 4.06Å; A135-L158 HydrophobicContact CB-CD1 4.06Å; F138-L158 HydrophobicContact CD2-CD1 4.35Å; F138-L158 HydrophobicContact CE2-CD1 4.37Å; N154-L158 WeakPolarHBondContact O-CG 3.16Å; N154-L158 PolarHBondContact O-N 3.09Å; L155-L158 PolarHBondContact O-N 3.4Å; L155-L158 VanDerWaalsContact O-N 3.13Å
159	G	86.2	Confident	90.1	Very high	33 Å²	33	47.1 Å²	47.1	34%	0.34	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.6	2.9	-176.3	0	0	0	0	0	114.1	L155 C156 H157	L155-G159 PolarHBondContact O-N 2.93Å; L155-G159 VanDerWaalsContact O-N 3.16Å; C156-G159 PolarHBondContact O-N 3.13Å; H157-G159 PolarHBondContact O-N 3.29Å
160	E	89.3	Confident	89	Confident	86 Å²	86	46 Å²	46	40%	0.402	23%	0.233	S	C	.	.			trans	-64	150.9	168.1	-66.6	-58.6	150.7	0	0	110.8	A135 L155 P162	A135-E160 HydrophobicContact CB-CG 3.93Å; L155-E160 HydrophobicContact CB-CB 4.23Å; L155-E160 HydrophobicContact CD2-CB 4.03Å; L155-E160 HydrophobicContact CD2-CG 3.95Å; L155-E160 PolarHBondContact O-N 3.41Å; L155-E160 VanDerWaalsContact O-N 3.12Å; E160-P162 WeakPolarHBondContact O-CD 3.43Å
161	K	88.9	Confident	87.3	Confident	154 Å²	154	46.8 Å²	46.8	67%	0.67	24%	0.238	S	C	*	.			trans	-115.5	69.7	176.1	-65.7	-172.8	179.5	-172	0	110.6	D163	K161-D163 PolarHBondContact O-N 3.32Å
162	P	89.6	Confident	85.1	Confident	15 Å²	15	48.1 Å²	48.1	10%	0.097	25%	0.249	C	C	.	.			trans	-66.4	129.1	176.1	29.4	-35.1	0	0	0	110.2	F152 L155 E160 P164 V167 Q459	F152-P162 HydrophobicContact CD2-CB 4.46Å; F152-P162 HydrophobicContact CD2-CG 3.91Å; F152-P162 HydrophobicContact CE2-CB 4.37Å; F152-P162 HydrophobicContact CE2-CG 3.74Å; L155-P162 HydrophobicContact CB-CG 3.97Å; L155-P162 HydrophobicContact CD1-CB 4.3Å; L155-P162 HydrophobicContact CD1-CG 4.27Å; E160-P162 WeakPolarHBondContact O-CD 3.43Å; P162-P164 WeakPolarHBondContact O-CD 3.42Å; P162-V167 HydrophobicContact CB-CG2 4.16Å; P162-Q459 PolarHBondContact O-NE2 3.35Å
163	D	89.8	Confident	83	Confident	62 Å²	62	49 Å²	49	33%	0.332	25%	0.254	S	S	.	.			trans	-66	113.5	175.7	176.1	4	0	0	0	110.5	K161 D165 Q166 V167	K161-D163 PolarHBondContact O-N 3.32Å; D163-D165 PolarHBondContact O-N 2.94Å; D163-D165 WeakPolarHBondContact OD1-CB 3.21Å; D163-D165 PolarHBondContact OD1-N 3.48Å; D163-Q166 HydrophobicContact CB-CB 4.13Å; D163-Q166 HydrophobicContact CB-CG 4.28Å; D163-Q166 PolarHBondContact O-N 3.03Å; D163-Q166 VanDerWaalsContact O-N 3.11Å; D163-Q166 VanDerWaalsContact OD2-CG 3.3Å; D163-Q166 WeakPolarHBondContact OD2-CG 3.43Å; D163-Q166 PolarHBondContact OD2-NE2 2.94Å; D163-V167 WeakPolarHBondContact O-CG2 3.48Å; D163-V167 PolarHBondContact O-N 3.38Å
164	P	89.1	Confident	80.7	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.019	28%	0.275	C	S	.	.	H	α-helix	trans	-59.7	-32.7	179.6	-22.5	35.9	0	0	0	112.3	F152 P162 Q166 V167 F168 R456	F152-P164 HydrophobicContact CE2-CB 4.45Å; F152-P164 HydrophobicContact CE2-CG 4.16Å; F152-P164 HydrophobicContact CZ-CG 4.07Å; P162-P164 WeakPolarHBondContact O-CD 3.42Å; P164-Q166 VanDerWaalsContact C-N 3.25Å; P164-Q166 PolarHBondContact O-N 3.07Å; P164-V167 PolarHBondContact O-N 3.12Å; P164-F168 HydrophobicContact CB-CD2 4.12Å; P164-F168 HydrophobicContact CB-CE2 4.31Å; P164-F168 VanDerWaalsContact O-CD2 3.32Å; P164-F168 WeakPolarHBondContact O-CD2 3.46Å; P164-F168 PolarHBondContact O-N 3.35Å; P164-R456 HydrophobicContact CB-CG 4.07Å; P164-R456 HydrophobicContact CG-CB 4.48Å; P164-R456 HydrophobicContact CG-CG 3.82Å
165	D	88.4	Confident	78.2	Confident	48 Å²	48	59.6 Å²	59.6	26%	0.257	31%	0.307	S	S	.	.	H	α-helix	trans	-72	-21.5	-178.5	-65.5	-0.4	0	0	0	112.2	D163 R169 R456	D163-D165 PolarHBondContact O-N 2.94Å; D163-D165 WeakPolarHBondContact OD1-CB 3.21Å; D163-D165 PolarHBondContact OD1-N 3.48Å; D165-R169 VanDerWaalsContact O-CG 3.31Å; D165-R169 WeakPolarHBondContact O-CG 3.46Å; D165-R169 PolarHBondContact O-NE 3.06Å; D165-R169 PolarHBondContact O-NH2 2.95Å; D165-R456 VanDerWaalsContact CG-NH2 3.31Å; D165-R456 IonicContact OD1-CZ 3.81Å; D165-R456 IonicContact OD1-NE 2.7Å; D165-R456 PolarHBondContact OD1-NE 3.39Å; D165-R456 IonicContact OD1-NH2 3.98Å; D165-R456 PolarHBondContact OD1-NH2 3.05Å; D165-R456 VanDerWaalsContact OD1-NH2 3.12Å; D165-R456 IonicContact OD2-CZ 3.51Å; D165-R456 IonicContact OD2-NE 2.86Å; D165-R456 IonicContact OD2-NH2 2.9Å; D165-R456 PolarHBondContact OD2-NH2 3.48Å
166	Q	86.9	Confident	75.5	Confident	123 Å²	123	61.6 Å²	61.6	58%	0.575	32%	0.321	S	S	*	.	H	α-helix	trans	-89.4	-38.9	171.8	-75.7	176.7	69.7	0	0	112.4	D163 P164	D163-Q166 HydrophobicContact CB-CB 4.13Å; D163-Q166 HydrophobicContact CB-CG 4.28Å; D163-Q166 PolarHBondContact O-N 3.03Å; D163-Q166 VanDerWaalsContact O-N 3.11Å; D163-Q166 VanDerWaalsContact OD2-CG 3.3Å; D163-Q166 WeakPolarHBondContact OD2-CG 3.43Å; D163-Q166 PolarHBondContact OD2-NE2 2.94Å; P164-Q166 VanDerWaalsContact C-N 3.25Å; P164-Q166 PolarHBondContact O-N 3.07Å
167	V	85.9	Confident	72.7	Confident	23 Å²	23	66.2 Å²	66.2	14%	0.139	35%	0.354	C	S	.	.	H	α-helix	trans	-64.1	-51	178.7	167	0	0	0	0	111.7	L142 P146 F152 P162 D163 P164 R169	L142-V167 HydrophobicContact CB-CG1 4.17Å; L142-V167 HydrophobicContact CD1-CG1 3.91Å; L142-V167 HydrophobicContact CD1-CG2 4.14Å; L142-V167 HydrophobicContact CD2-CG1 3.89Å; L142-V167 HydrophobicContact CG-CG1 4.21Å; P146-V167 WeakPolarHBondContact CB-O 3.16Å; F152-V167 HydrophobicContact CD2-CG1 4.19Å; F152-V167 HydrophobicContact CD2-CG2 4.43Å; P162-V167 HydrophobicContact CB-CG2 4.16Å; D163-V167 WeakPolarHBondContact O-CG2 3.48Å; D163-V167 PolarHBondContact O-N 3.38Å; P164-V167 PolarHBondContact O-N 3.12Å; V167-R169 PolarHBondContact O-N 3.46Å; V167-R169 VanDerWaalsContact O-N 3.12Å
168	F	86.1	Confident	70.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.364	C	S	.	.	S	Bend	trans	-93	66.3	-171.5	-60.1	-65	0	0	0	111.5	P146 W149 F152 P164 M448 L451 R452	P146-F168 VanDerWaalsContact O-CD1 3.23Å; P146-F168 WeakPolarHBondContact O-CD1 3.31Å; P146-F168 WeakPolarHBondContact O-CE1 3.41Å; W149-F168 HydrophobicContact CE3-CZ 4.02Å; W149-F168 HydrophobicContact CZ3-CE2 4.44Å; W149-F168 HydrophobicContact CZ3-CZ 4.06Å; F152-F168 HydrophobicContact CB-CZ 4.22Å; F152-F168 HydrophobicContact CD1-CZ 4.28Å; F152-F168 HydrophobicContact CD2-CE2 4.02Å; F152-F168 HydrophobicContact CD2-CZ 4.06Å; F152-F168 HydrophobicContact CE2-CE2 4.08Å; F152-F168 HydrophobicContact CG-CE2 4.25Å; F152-F168 AromaticContact CG-CZ 3.92Å; F152-F168 HydrophobicContact CG-CZ 3.92Å; F152-F168 HydrophobicContact CZ-CE2 4.38Å; P164-F168 HydrophobicContact CB-CD2 4.12Å; P164-F168 HydrophobicContact CB-CE2 4.31Å; P164-F168 VanDerWaalsContact O-CD2 3.32Å; P164-F168 WeakPolarHBondContact O-CD2 3.46Å; P164-F168 PolarHBondContact O-N 3.35Å; F168-M448 HydrophobicContact CB-SD 3.84Å; F168-M448 HydrophobicContact CD1-SD 4.21Å; F168-L451 HydrophobicContact CB-CB 4.4Å; F168-L451 HydrophobicContact CD1-CB 3.74Å; F168-L451 HydrophobicContact CD1-CD1 4.06Å; F168-L451 HydrophobicContact CD1-CG 4.47Å; F168-L451 HydrophobicContact CD2-CB 4.21Å; F168-L451 WeakPolarHBondContact CD2-O 3.45Å; F168-L451 HydrophobicContact CE1-CB 4.04Å; F168-L451 HydrophobicContact CE1-CD1 4.28Å; F168-L451 HydrophobicContact CE2-CB 4.47Å; F168-L451 WeakPolarHBondContact CE2-O 3.45Å; F168-L451 HydrophobicContact CG-CB 3.85Å; F168-L451 HydrophobicContact CZ-CB 4.4Å; F168-R452 HydrophobicContact CB-CG 3.7Å; F168-R452 HydrophobicContact CD2-CG 4.31Å; F168-R452 HydrophobicContact CG-CG 4.47Å; F168-R452 PolarHBondContact O-NH1 3.25Å
169	R	80.6	Confident	67.8	Low	117 Å²	117	68.9 Å²	68.9	44%	0.442	38%	0.382	S	S	.	.			trans	-122	127.4	177.6	-65.8	-174.2	178.2	167.5	10.1	112.3	D165 V167 S171 A172	D165-R169 VanDerWaalsContact O-CG 3.31Å; D165-R169 WeakPolarHBondContact O-CG 3.46Å; D165-R169 PolarHBondContact O-NE 3.06Å; D165-R169 PolarHBondContact O-NH2 2.95Å; V167-R169 PolarHBondContact O-N 3.46Å; V167-R169 VanDerWaalsContact O-N 3.12Å; R169-S171 PolarHBondContact O-N 3.29Å; R169-A172 PolarHBondContact O-N 2.74Å
170	L	71.2	Confident	65.3	Low	25 Å²	25	73 Å²	73	13%	0.131	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-65.8	-15.6	176.5	-62.8	-170.6	0	0	0	114.5	F147 A172 L173 R441 A444 D445 M448	F147-L170 HydrophobicContact CZ-CD2 4.46Å; L170-A172 PolarHBondContact O-N 2.8Å; L170-L173 HydrophobicContact CD2-CD1 3.68Å; L170-L173 WeakPolarHBondContact O-CB 3.45Å; L170-L173 PolarHBondContact O-N 3.23Å; L170-R441 HydrophobicContact CD1-CB 4.49Å; L170-A444 HydrophobicContact CD1-CB 3.71Å; L170-A444 HydrophobicContact CD2-CB 3.76Å; L170-A444 HydrophobicContact CG-CB 4.4Å; L170-D445 HydrophobicContact CD1-CB 4.27Å; L170-D445 VanDerWaalsContact CD1-OD1 3.25Å; L170-D445 WeakPolarHBondContact CD1-OD1 3.49Å; L170-M448 HydrophobicContact CD2-CE 4Å; L170-M448 HydrophobicContact CD2-CG 3.52Å; L170-M448 HydrophobicContact CD2-SD 4.4Å; L170-M448 HydrophobicContact CG-CG 4.09Å
171	S	58.6	Low	62.6	Low	73 Å²	73	73.8 Å²	73.8	51%	0.51	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-58.9	-26.8	176.1	51.5	0	0	0	0	112.9	R169 L173 Q174	R169-S171 PolarHBondContact O-N 3.29Å; S171-L173 VanDerWaalsContact C-N 3.27Å; S171-L173 PolarHBondContact O-N 2.84Å; S171-Q174 PolarHBondContact O-N 3.31Å
172	A	49.9	Very low	60.1	Low	27 Å²	27	71.7 Å²	71.7	22%	0.223	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-59.1	-35	173.2	0	0	0	0	0	113.3	T143 P146 R169 L170 Q174	T143-A172 WeakPolarHBondContact O-CB 3.32Å; P146-A172 HydrophobicContact CG-CB 4.36Å; R169-A172 PolarHBondContact O-N 2.74Å; L170-A172 PolarHBondContact O-N 2.8Å; A172-Q174 VanDerWaalsContact C-N 3.25Å; A172-Q174 PolarHBondContact O-N 3.07Å
173	L	51.1	Low	57.5	Low	20 Å²	20	76.9 Å²	76.9	11%	0.105	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-76.5	-9.7	-174.5	-64.9	159.9	0	0	0	113.3	P146 F147 L170 S171 N175 S176	P146-L173 HydrophobicContact CG-CD1 4.22Å; P146-L173 HydrophobicContact CG-CG 4.17Å; F147-L173 HydrophobicContact CD2-CD1 4.48Å; F147-L173 HydrophobicContact CE2-CD1 3.61Å; F147-L173 HydrophobicContact CE2-CD2 4.2Å; F147-L173 HydrophobicContact CZ-CD1 4.2Å; L170-L173 HydrophobicContact CD2-CD1 3.68Å; L170-L173 WeakPolarHBondContact O-CB 3.45Å; L170-L173 PolarHBondContact O-N 3.23Å; S171-L173 VanDerWaalsContact C-N 3.27Å; S171-L173 PolarHBondContact O-N 2.84Å; L173-N175 PolarHBondContact O-N 3.06Å; L173-S176 PolarHBondContact O-N 2.9Å
174	Q	44.2	Very low	54.7	Low	149 Å²	149	82.2 Å²	82.2	70%	0.696	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-66.4	-17.2	-178.8	-64.2	-177.7	-1.6	0	0	113.1	S171 A172	S171-Q174 PolarHBondContact O-N 3.31Å; A172-Q174 VanDerWaalsContact C-N 3.25Å; A172-Q174 PolarHBondContact O-N 3.07Å
175	N	41.5	Very low	52	Low	161 Å²	161	89.9 Å²	89.9	86%	0.861	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-103.3	1.8	179.8	-69.1	-5.7	0	0	0	114.2	L173	L173-N175 PolarHBondContact O-N 3.06Å
176	S	36.7	Very low	49.1	Very low	42 Å²	42	92.7 Å²	92.7	29%	0.294	54%	0.536	S	S	.	.	S	Bend	trans	-114	122.7	174.9	173.1	0	0	0	0	110.5	D112 L173 L178	D112-S176 PolarHBondContact OD1-OG 3.46Å; D112-S176 VanDerWaalsContact OD1-OG 3.1Å; L173-S176 PolarHBondContact O-N 2.9Å; S176-L178 PolarHBondContact O-N 3.41Å
177	S	34.4	Very low	46.4	Very low	99 Å²	99	92.7 Å²	92.7	69%	0.692	55%	0.546	S	S	*	.			trans	-74.6	86.1	-179.5	47.6	0	0	0	0	111.4	A179	S177-A179 PolarHBondContact O-N 3.05Å
178	L	44.3	Very low	43.6	Very low	105 Å²	105	96.4 Å²	96.4	55%	0.55	58%	0.58	S	S	.	*			trans	-57.9	105	176.9	-78.6	159.7	0	0	0	112.4	S176 M436	S176-L178 PolarHBondContact O-N 3.41Å; L178-M436 HydrophobicContact CD1-CE 4.45Å; L178-M436 HydrophobicContact CD1-CG 4.44Å; L178-M436 HydrophobicContact CD1-SD 3.77Å
179	A	31.9	Very low	41	Very low	82 Å²	82	105.4 Å²	105.4	68%	0.678	62%	0.622	S	S	*	*			trans	34.9	137.4	154.3	0	0	0	0	0	120.8	S177	S177-A179 PolarHBondContact O-N 3.05Å
180	P	32.4	Very low	38.4	Very low	120 Å²	120	107.5 Å²	107.5	78%	0.779	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-63.7	148.6	171.6	29.8	-35.6	0	0	0	111.8
181	P	32.6	Very low	36.4	Very low	102 Å²	102	112.5 Å²	112.5	66%	0.662	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-68.8	152.4	179.4	29.6	-35.6	0	0	0	111.9
182	P	36.8	Very low	34.9	Very low	109 Å²	109	114 Å²	114	71%	0.708	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-63.5	149.4	167.1	29.6	-34.8	0	0	0	110.4	H184	P182-H184 PolarHBondContact O-N 2.94Å
183	P	35.2	Very low	33.8	Very low	125 Å²	125	122.3 Å²	122.3	81%	0.812	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-61.3	130.7	-179.8	25.1	-33.9	0	0	0	111.2	I185	P183-I185 PolarHBondContact O-N 3.05Å
184	H	30.3	Very low	32.7	Very low	174 Å²	174	132.5 Å²	132.5	81%	0.806	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-62.4	133.6	-174.7	-71.7	-89.7	0	0	0	113	P182	P182-H184 PolarHBondContact O-N 2.94Å
185	I	32.9	Very low	31.7	Very low	163 Å²	163	133.6 Å²	133.6	84%	0.836	77%	0.767	S	S	*	*			trans	-108.9	123.4	153.7	-61	178.1	0	0	0	106.7	P183	P183-I185 PolarHBondContact O-N 3.05Å
186	S	28.1	Very low	30.9	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-72.5	136.6	-173.5	-53.5	0	0	0	0	112.4
187	P	30.2	Very low	30.3	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-75.1	138.3	172.9	31	-33.7	0	0	0	111.5
188	A	27	Very low	29.8	Very low	102 Å²	102	136.3 Å²	136.3	84%	0.843	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-78.8	159.2	167	0	0	0	0	0	111.1
189	Q	30.6	Very low	28.8	Very low	188 Å²	188	139.3 Å²	139.3	88%	0.879	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.5	141.9	-167.9	-65.2	163.4	-42.3	0	0	113.3
190	N	27.3	Very low	28.5	Very low	162 Å²	162	142.9 Å²	142.9	87%	0.866	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-69.2	150.6	159.6	-76.7	-16.2	0	0	0	110.6
191	P	28.9	Very low	28.1	Very low	129 Å²	129	144.9 Å²	144.9	84%	0.838	81%	0.806	S	S	*	*			trans	-123.7	125.8	137.4	34.2	-25.9	0	0	0	111.1
192	S	26.1	Very low	28	Very low	105 Å²	105	146.2 Å²	146.2	73%	0.734	81%	0.813	S	S	*	*			trans	-92.4	135.8	169.2	55.5	0	0	0	0	110.7
193	H	28.2	Very low	27.6	Very low	202 Å²	202	146.7 Å²	146.7	94%	0.935	82%	0.815	S	S	*	*			trans	-153.7	146.5	146	-104	-75.4	0	0	0	110.5
194	R	26.2	Very low	27.3	Very low	233 Å²	233	149 Å²	149	88%	0.879	82%	0.815	S	S	*	*			trans	-84.3	152.7	177.7	-68.7	177.5	173.4	167.2	-5.1	111.5
195	L	25.1	Very low	27.1	Very low	172 Å²	172	148 Å²	148	90%	0.901	82%	0.816	S	S	*	*			trans	-158.8	132.1	141.1	-114.1	157.3	0	0	0	109.8
196	D	24.1	Very low	26.9	Very low	138 Å²	138	145.2 Å²	145.2	74%	0.738	81%	0.807	S	S	*	*			trans	-82.2	137.2	172.8	-52.8	-87.3	0	0	0	110.6
197	T	23.9	Very low	26.9	Very low	140 Å²	140	147.5 Å²	147.5	86%	0.859	81%	0.81	S	S	*	*			trans	-168.1	149.5	131	-2.1	0	0	0	0	114.1
198	A	23.4	Very low	26.8	Very low	81 Å²	81	150.6 Å²	150.6	67%	0.669	81%	0.813	S	S	*	*			trans	52.2	110	144.9	0	0	0	0	0	121.4
199	L	24.6	Very low	26.9	Very low	169 Å²	169	152.2 Å²	152.2	89%	0.885	81%	0.807	S	S	*	*				38.9	120.8	116.1	-58.3	167.2	0	0	0	119.2
200	M	24.6	Very low	26.8	Very low	157 Å²	157	149.9 Å²	149.9	77%	0.773	80%	0.801	S	S	*	*				-164.9	127.8	102.1	-99.2	-168.1	87.8	0	0	113.2
201	E	23.7	Very low	26.9	Very low	161 Å²	161	154.2 Å²	154.2	75%	0.752	81%	0.805	S	S	*	*			trans	26.8	109.8	138.9	-63.1	171.3	-177.4	0	0	120.5
202	T	31.5	Very low	26.9	Very low	131 Å²	131	155.3 Å²	155.3	80%	0.804	80%	0.803	S	S	*	*			trans	-92.6	145.2	133.1	54.8	0	0	0	0	108.6
203	P	28.1	Very low	27.1	Very low	118 Å²	118	156 Å²	156	77%	0.766	80%	0.798	S	S	*	*				-137.8	176.7	106.5	38.1	-27.6	0	0	0	113.8
204	Q	29.6	Very low	27.1	Very low	173 Å²	173	152.8 Å²	152.8	81%	0.808	79%	0.787	S	S	*	*			trans	-93.4	157.5	-177.9	-56.8	127.4	-80	0	0	112.4
205	D	24.7	Very low	26.9	Very low	154 Å²	154	149.2 Å²	149.2	82%	0.824	78%	0.781	S	S	*	*			trans	-123.2	124.7	136.7	-99.4	-41.4	0	0	0	107.1
206	T	29.1	Very low	27	Very low	104 Å²	104	145.9 Å²	145.9	64%	0.638	77%	0.772	S	S	*	*				96.6	109.9	52.7	-63.8	0	0	0	0	110.8
207	L	27.5	Very low	27.1	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	77%	0.771	S	S	*	*			trans	-172.7	86.9	132	-104.1	171.9	0	0	0	110.8
208	E	29.5	Very low	27.2	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	77%	0.772	S	S	*	*			trans	-89.8	167.2	145.4	-79.8	-149.6	152.2	0	0	109.4
209	L	28.7	Very low	27.2	Very low	137 Å²	137	144.8 Å²	144.8	72%	0.717	77%	0.774	S	S	*	*			trans	-126.2	120.7	171.6	-98.9	166.9	0	0	0	112.2
210	N	28.3	Very low	27.3	Very low	139 Å²	139	146 Å²	146	74%	0.743	77%	0.772	S	S	*	*			trans	66.8	97.1	156.5	-60.7	-28	0	0	0	119.1
211	R	28.4	Very low	27.3	Very low	253 Å²	253	145.7 Å²	145.7	96%	0.955	77%	0.773	S	S	*	*				-148.2	122.7	112.7	-110.9	172.7	-170.3	-176.5	3	113.1
212	L	30.6	Very low	27.2	Very low	151 Å²	151	143.3 Å²	143.3	79%	0.791	77%	0.769	S	S	*	*			trans	-77.8	162.9	163.1	-62.4	164.2	0	0	0	108.5
213	N	28.6	Very low	26.9	Very low	119 Å²	119	141.2 Å²	141.2	64%	0.636	76%	0.76	S	S	*	*			cis	-156.3	163.4	10.7	-141	9.7	0	0	0	111.5
214	L	28.1	Very low	26.7	Very low	135 Å²	135	142.7 Å²	142.7	71%	0.707	76%	0.761	S	S	*	*			trans	29.7	141.9	135.4	-106.1	65.4	0	0	0	120.9
215	E	24.1	Very low	26.5	Very low	159 Å²	159	142.1 Å²	142.1	74%	0.743	76%	0.763	S	S	*	*			cis	-143.1	148.7	15.3	-73.6	169.4	159.6	0	0	108.4
216	S	26.7	Very low	26.6	Very low	102 Å²	102	139.2 Å²	139.2	71%	0.713	75%	0.754	S	S	*	*				57.3	131.7	62.1	98.2	0	0	0	0	113.8
217	S	26.1	Very low	26.4	Very low	102 Å²	102	141.9 Å²	141.9	71%	0.713	76%	0.763	S	S	*	*			cis	-155.3	171.7	21	-66.2	0	0	0	0	114.2
218	N	25.7	Very low	26.3	Very low	166 Å²	166	138.7 Å²	138.7	89%	0.888	75%	0.754	S	S	*	*			trans	-0.5	146	156.3	-54.8	-29.7	0	0	0	120.5
219	G	24.1	Very low	26.1	Very low	68 Å²	68	139.7 Å²	139.7	70%	0.701	75%	0.751	S	S	*	*			cis	131.1	159.8	-0.2	0	0	0	0	0	114.2
220	K	25	Very low	26.1	Very low	194 Å²	194	139.3 Å²	139.3	84%	0.843	75%	0.748	S	S	*	*			trans	101.6	123.8	172.8	-69.5	-175.6	173	-178.5	0	119.3
221	L	24.5	Very low	25.8	Very low	151 Å²	151	139.3 Å²	139.3	79%	0.791	75%	0.748	S	S	*	*			trans	67.8	146.1	132.4	-62.2	174.1	0	0	0	119.2
222	T	23.3	Very low	25.7	Very low	110 Å²	110	131.6 Å²	131.6	68%	0.675	73%	0.733	S	S	*	*			cis	-143.5	157	-1.4	49.5	0	0	0	0	113
223	S	24.8	Very low	25.6	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	73%	0.731	S	S	*	*			trans	51.3	131.7	133.6	70.8	0	0	0	0	124.4
224	D	22.9	Very low	25.5	Very low	149 Å²	149	130.8 Å²	130.8	80%	0.797	74%	0.737	S	S	*	*			trans	85.1	102.9	131	-59.9	-3.9	0	0	0	122.9
225	L	25.8	Very low	25.5	Very low	161 Å²	161	131.4 Å²	131.4	84%	0.843	74%	0.74	S	S	*	*				-5.6	144.9	118.4	-65.5	163.3	0	0	0	115.9
226	S	26.2	Very low	25.5	Very low	92 Å²	92	129 Å²	129	64%	0.643	74%	0.74	S	S	*	*			cis	-177.2	-164.6	3.3	48.6	0	0	0	0	109.8
227	I	25.1	Very low	26.5	Very low	160 Å²	160	128.7 Å²	128.7	82%	0.821	74%	0.736	S	S	*	*			trans	86.2	103.8	165.3	-56	169.9	0	0	0	117.2
228	S	25.9	Very low	26.7	Very low	88 Å²	88	131.9 Å²	131.9	62%	0.615	74%	0.74	S	S	*	*			trans	-50.6	155.5	159	48.9	0	0	0	0	117.9
229	Y	25.2	Very low	26.8	Very low	210 Å²	210	130.2 Å²	130.2	82%	0.824	74%	0.736	S	S	*	*				-173.2	145.5	112.6	-115.8	-124.7	0	0	0	114.3
230	I	27.8	Very low	26.9	Very low	129 Å²	129	130.6 Å²	130.6	66%	0.662	74%	0.74	S	S	*	*			trans	17	145.3	166.3	11.5	173.7	0	0	0	126.3
231	D	23.6	Very low	26.9	Very low	138 Å²	138	126.9 Å²	126.9	74%	0.738	74%	0.738	S	S	*	*			trans	61.8	153	136.4	-81.6	-20.1	0	0	0	123.3
232	S	25	Very low	27	Very low	91 Å²	91	127.2 Å²	127.2	64%	0.636	74%	0.74	S	S	*	*			cis	-169.8	149.3	-27.6	-119.4	0	0	0	0	111.8
233	S	28.8	Very low	27.2	Very low	107 Å²	107	130.3 Å²	130.3	75%	0.748	75%	0.752	S	S	*	*			trans	62.4	149.5	169.1	67.5	0	0	0	0	116.8
234	L	27.3	Very low	27.1	Very low	146 Å²	146	129.1 Å²	129.1	76%	0.764	75%	0.753	S	S	*	*				-168.1	163.4	63.4	-101	173.1	0	0	0	113.2
235	I	27.6	Very low	27.4	Very low	149 Å²	149	129.5 Å²	129.5	76%	0.764	76%	0.755	S	S	*	*			trans	76.5	119	155	-66.8	156.9	0	0	0	118.7
236	S	25.1	Very low	27.4	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	75%	0.749	S	S	*	*			trans	-110.9	-162.2	161.8	-45.7	0	0	0	0	107.3
237	P	46.7	Very low	27.6	Very low	96 Å²	96	129.3 Å²	129.3	62%	0.623	76%	0.756	S	S	*	*			cis	-143.8	-167.8	6.5	45	-24.6	0	0	0	115.9
238	E	29.9	Very low	27.7	Very low	168 Å²	168	126.9 Å²	126.9	79%	0.785	75%	0.754	S	S	*	*			trans	65.9	159.8	150.7	-75.8	163.7	-130.8	0	0	119.3
239	T	28.6	Very low	27.9	Very low	131 Å²	131	130.6 Å²	130.6	80%	0.804	76%	0.763	S	S	*	*			cis	-151.1	174.2	-11.4	18.7	0	0	0	0	108.3
240	G	25.9	Very low	27.9	Very low	76 Å²	76	124.3 Å²	124.3	78%	0.784	76%	0.755	S	S	*	*			trans	141.1	153.3	150.9	0	0	0	0	0	116.7
241	S	25	Very low	28	Very low	117 Å²	117	123.4 Å²	123.4	82%	0.818	76%	0.76	S	S	*	*			trans	-159.3	169.8	-177.8	-163.8	0	0	0	0	113.7
242	L	26.9	Very low	28.3	Very low	157 Å²	157	121.5 Å²	121.5	82%	0.822	76%	0.764	S	S	*	*			trans	79.7	158	163.7	-68.7	165.1	0	0	0	120.9
243	L	26.5	Very low	28.3	Very low	176 Å²	176	120.5 Å²	120.5	92%	0.921	77%	0.768	S	S	*	*			trans	75.7	141.5	175.2	-53.1	171.5	0	0	0	117
244	G	23.9	Very low	28.3	Very low	63 Å²	63	121.7 Å²	121.7	65%	0.649	77%	0.771	S	S	*	*			cis	149.3	128.8	-15.3	0	0	0	0	0	115.5
245	N	29.1	Very low	28.2	Very low	157 Å²	157	122.4 Å²	122.4	84%	0.84	77%	0.774	S	S	*	*			trans	68.5	155.5	162.6	-66.6	-2.8	0	0	0	118
246	T	26.3	Very low	28.2	Very low	116 Å²	116	123.3 Å²	123.3	71%	0.712	78%	0.78	S	S	*	*			cis	-168.1	-172.9	-12.3	25.2	0	0	0	0	110.4
247	V	30.5	Very low	28.3	Very low	132 Å²	132	123.1 Å²	123.1	80%	0.8	79%	0.785	S	S	*	*			trans	88.6	128.4	160.8	-170.7	0	0	0	0	114.8
248	S	26.2	Very low	27.4	Very low	109 Å²	109	128.1 Å²	128.1	76%	0.762	80%	0.797	S	S	*	*			cis	-146.5	169.9	-1.9	-111.2	0	0	0	0	109.8
249	M	29.2	Very low	27.3	Very low	166 Å²	166	128 Å²	128	82%	0.818	80%	0.796	S	S	*	*			cis	105.3	150.9	19.2	-121.8	-63.3	-68.2	0	0	116
250	A	26.9	Very low	27.1	Very low	78 Å²	78	128.5 Å²	128.5	65%	0.645	79%	0.794	S	S	*	*			trans	74.7	129.3	-172	0	0	0	0	0	116.7
251	S	29.5	Very low	27.2	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	80%	0.797	S	S	*	*			cis	102.1	137.3	17.1	75.9	0	0	0	0	114.8
252	A	28.9	Very low	27.3	Very low	99 Å²	99	134.2 Å²	134.2	82%	0.818	79%	0.794	S	S	*	*			cis	-170.5	160.2	-9.7	0	0	0	0	0	112.6
253	G	26.1	Very low	27.1	Very low	70 Å²	70	136.2 Å²	136.2	72%	0.722	80%	0.796	S	S	*	*			trans	76.4	164	153.5	0	0	0	0	0	119.7
254	T	27.9	Very low	27	Very low	132 Å²	132	134.1 Å²	134.1	81%	0.81	80%	0.796	S	S	*	*			cis	-162.4	162.8	-13.9	-25.1	0	0	0	0	112.5
255	L	25.5	Very low	26.9	Very low	160 Å²	160	134.5 Å²	134.5	84%	0.838	80%	0.801	S	S	*	*			trans	83.9	150.6	155.8	-66.9	-178.6	0	0	0	122.4
256	L	28.1	Very low	26.8	Very low	169 Å²	169	138.6 Å²	138.6	89%	0.885	80%	0.804	S	S	*	*			trans	-107.3	158.8	-168.6	-59.5	110.7	0	0	0	113.9
257	A	26.7	Very low	26.6	Very low	103 Å²	103	138 Å²	138	85%	0.851	81%	0.805	S	S	*	*			trans	-139.3	169.6	151.5	0	0	0	0	0	110.5
258	K	27	Very low	26.3	Very low	202 Å²	202	139.4 Å²	139.4	88%	0.878	81%	0.807	S	S	*	*			trans	-138.6	172.1	-160.3	-126.6	178.2	-175.4	176.5	0	113.2
259	Q	28.7	Very low	26.2	Very low	165 Å²	165	141.9 Å²	141.9	77%	0.771	81%	0.811	S	S	*	*			trans	86.6	142.9	171.2	-54.4	-167	27.3	0	0	116.2
260	N	23.3	Very low	25.9	Very low	142 Å²	142	137.6 Å²	137.6	76%	0.759	81%	0.809	S	S	*	*			cis	-152.9	164.4	-8	-111	-16.6	0	0	0	112.5
261	K	28.6	Very low	25.6	Very low	197 Å²	197	137.5 Å²	137.5	86%	0.857	82%	0.816	S	S	*	*			trans	-86	162.8	176.6	-68.7	-177.2	174.8	178.8	0	112.5
262	P	27.7	Very low	26	Very low	116 Å²	116	138.6 Å²	138.6	75%	0.753	82%	0.82	S	S	*	*				-145.7	136.7	102.2	36.4	-20.7	0	0	0	118.1
263	K	23.5	Very low	26	Very low	198 Å²	198	137 Å²	137	86%	0.861	81%	0.807	S	S	*	*			trans	52.9	120	135.6	-61.2	-178.1	178.7	179.6	0	123.5
264	S	23.1	Very low	26	Very low	132 Å²	132	135.8 Å²	135.8	92%	0.923	80%	0.795	S	S	*	*			trans	86.4	124.4	131.1	-154.5	0	0	0	0	120.6
265	G	23.1	Very low	26	Very low	72 Å²	72	135.9 Å²	135.9	74%	0.742	79%	0.789	S	S	*	*			trans	170.2	91.8	173.2	0	0	0	0	0	111.6	S267	G265-S267 PolarHBondContact O-N 2.92Å
266	R	25.2	Very low	26.1	Very low	243 Å²	243	129 Å²	129	92%	0.917	76%	0.755	S	S	*	*			trans	-22	121.3	-175.3	-76.3	175.8	165.7	166.4	-6.2	116.7
267	S	23	Very low	26.3	Very low	103 Å²	103	122.8 Å²	122.8	72%	0.72	73%	0.725	S	S	*	*			trans	-91.5	142.9	155.9	-168.9	0	0	0	0	109.6	G265	G265-S267 PolarHBondContact O-N 2.92Å
268	L	24.5	Very low	26.6	Very low	162 Å²	162	119.7 Å²	119.7	85%	0.848	69%	0.694	S	S	*	*			trans	-129.2	105.4	167.3	-84.3	171	0	0	0	108.9
269	L	24.5	Very low	26.9	Very low	160 Å²	160	112.9 Å²	112.9	84%	0.838	67%	0.669	S	S	*	*			trans	-66.2	155.8	157.9	-79.1	61.3	0	0	0	108.2
270	G	22.7	Very low	26.9	Very low	77 Å²	77	106.6 Å²	106.6	79%	0.794	64%	0.643	S	S	*	*			cis	151.2	124.7	-0.6	0	0	0	0	0	110.1
271	G	21.2	Very low	27.2	Very low	75 Å²	75	104 Å²	104	77%	0.773	64%	0.635	S	S	*	*			trans	-129.6	-169.4	174.6	0	0	0	0	0	111.2
272	P	37.5	Very low	27.4	Very low	134 Å²	134	95.5 Å²	95.5	87%	0.87	60%	0.598	S	S	*	*			cis	-119.7	-179.3	-2.1	40.1	-27.3	0	0	0	113
273	A	28.7	Very low	27.5	Very low	64 Å²	64	91.9 Å²	91.9	53%	0.529	58%	0.582	S	S	.	*			trans	-157.6	113.6	161.6	0	0	0	0	0	109.2	R566	A273-R566 PolarHBondContact O-NH1 3.14Å; A273-R566 PolarHBondContact O-NH2 3.21Å
274	G	26.3	Very low	27.8	Very low	46 Å²	46	87 Å²	87	47%	0.474	56%	0.564	S	S	.	*			trans	-76.4	156.5	-171.3	0	0	0	0	0	114.9
275	L	26.6	Very low	28	Very low	133 Å²	133	86.5 Å²	86.5	70%	0.696	55%	0.551	S	S	*	*			trans	-148.9	134.8	170.3	-72.4	174.1	0	0	0	107	R566	L275-R566 VanDerWaalsContact CB-NH2 3.35Å
276	S	28.3	Very low	28.2	Very low	15 Å²	15	85.5 Å²	85.5	11%	0.105	53%	0.531	C	S	.	.			trans	-144.6	110.1	-166.5	-66.3	0	0	0	0	110.8	L278 T279 Q532	S276-L278 PolarHBondContact O-N 3.12Å; S276-T279 WeakPolarHBondContact CB-OG1 3.35Å; S276-T279 PolarHBondContact O-N 2.97Å; S276-Q532 PolarHBondContact OG-NE2 3.42Å
277	P	32.1	Very low	28.2	Very low	40 Å²	40	80 Å²	80	26%	0.26	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-2.9	-175	25.3	-38.5	0	0	0	117.6	W529 L598	P277-W529 VanDerWaalsContact CD-CH2 3.44Å; P277-W529 HydrophobicContact CG-CH2 3.84Å; P277-W529 HydrophobicContact CG-CZ2 3.94Å; P277-L598 HydrophobicContact CB-CD2 3.98Å; P277-L598 HydrophobicContact CB-CG 4.31Å; P277-L598 HydrophobicContact CG-CD1 3.78Å; P277-L598 HydrophobicContact CG-CD2 3.96Å; P277-L598 HydrophobicContact CG-CG 3.91Å
278	L	33.5	Very low	28.3	Very low	38 Å²	38	83.9 Å²	83.9	20%	0.199	53%	0.526	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-9.1	178.4	-60.8	174.4	0	0	0	113.5	S276 T526 W529 H530	S276-L278 PolarHBondContact O-N 3.12Å; L278-T526 HydrophobicContact CD1-CG2 3.96Å; L278-W529 HydrophobicContact CB-CH2 4.02Å; L278-W529 HydrophobicContact CB-CZ3 3.78Å; L278-W529 HydrophobicContact CD1-CH2 4.4Å; L278-W529 HydrophobicContact CD1-CZ3 4.34Å; L278-W529 HydrophobicContact CG-CH2 4.14Å; L278-W529 HydrophobicContact CG-CZ3 4.28Å; L278-H530 VanDerWaalsContact CB-CE1 3.43Å; L278-H530 WeakPolarHBondContact CB-CE1 3.38Å
279	T	32.8	Very low	28.4	Very low	59 Å²	59	81.2 Å²	81.2	36%	0.362	52%	0.519	S	S	.	.	S	Bend	trans	-103.4	118.7	161	19.5	0	0	0	0	107.3	S276 S281	S276-T279 WeakPolarHBondContact CB-OG1 3.35Å; S276-T279 PolarHBondContact O-N 2.97Å; T279-S281 PolarHBondContact O-N 3.39Å
280	P	29.3	Very low	28.6	Very low	33 Å²	33	79.1 Å²	79.1	21%	0.214	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-70.3	121.9	-173	-15	28.8	0	0	0	110.6	V655 L689	P280-V655 HydrophobicContact CG-CG1 4.2Å; P280-L689 HydrophobicContact CB-CD1 3.87Å; P280-L689 HydrophobicContact CB-CD2 3.79Å; P280-L689 HydrophobicContact CB-CG 4.44Å; P280-L689 HydrophobicContact CG-CD1 3.84Å
281	S	29.4	Very low	28.9	Very low	86 Å²	86	80.7 Å²	80.7	60%	0.601	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-66.5	145.1	156.2	-179.3	0	0	0	0	108.4	T279 G283	T279-S281 PolarHBondContact O-N 3.39Å; S281-G283 VanDerWaalsContact C-N 3.34Å; S281-G283 PolarHBondContact O-N 2.89Å
282	F	32.1	Very low	29.3	Very low	20 Å²	20	80.6 Å²	80.6	9%	0.088	51%	0.513	C	S	.	.	S	Bend	trans	-70.3	83.7	-172.6	-68	-94.4	0	0	0	112.7	P688 L689 F692 E721 L723	F282-P688 HydrophobicContact CE1-CB 4.25Å; F282-P688 HydrophobicContact CZ-CB 3.79Å; F282-L689 HydrophobicContact CB-CD2 4.47Å; F282-L689 HydrophobicContact CD1-CD2 3.53Å; F282-L689 HydrophobicContact CD1-CG 3.95Å; F282-L689 HydrophobicContact CD2-CD2 4.43Å; F282-L689 HydrophobicContact CE1-CB 4.33Å; F282-L689 HydrophobicContact CE1-CD2 3.9Å; F282-L689 HydrophobicContact CE1-CG 3.76Å; F282-L689 HydrophobicContact CG-CD2 3.86Å; F282-L689 HydrophobicContact CZ-CD2 4.49Å; F282-L689 HydrophobicContact CZ-CG 4.17Å; F282-F692 HydrophobicContact CB-CD1 4.1Å; F282-F692 HydrophobicContact CB-CE1 3.97Å; F282-F692 HydrophobicContact CB-CZ 4.36Å; F282-F692 HydrophobicContact CD1-CB 3.48Å; F282-F692 VanDerWaalsContact CD1-CB 3.48Å; F282-F692 AromaticContact CD1-CD1 3.55Å; F282-F692 HydrophobicContact CD1-CD1 3.55Å; F282-F692 HydrophobicContact CD1-CD2 4.04Å; F282-F692 HydrophobicContact CD1-CE1 4.25Å; F282-F692 AromaticContact CD1-CG 3.41Å; F282-F692 HydrophobicContact CD1-CG 3.41Å; F282-F692 VanDerWaalsContact CD1-CG 3.41Å; F282-F692 HydrophobicContact CE1-CB 3.46Å; F282-F692 VanDerWaalsContact CE1-CB 3.46Å; F282-F692 HydrophobicContact CE1-CD1 4.41Å; F282-F692 HydrophobicContact CE1-CD2 4.38Å; F282-F692 AromaticContact CE1-CG 3.86Å; F282-F692 HydrophobicContact CE1-CG 3.86Å; F282-F692 HydrophobicContact CG-CD1 4.27Å; F282-F692 HydrophobicContact CG-CG 4.35Å; F282-E721 HydrophobicContact CD2-CG 3.66Å; F282-E721 WeakPolarHBondContact CD2-OE1 3.31Å; F282-E721 HydrophobicContact CE2-CB 4.43Å; F282-E721 HydrophobicContact CE2-CG 3.46Å; F282-E721 VanDerWaalsContact CE2-CG 3.46Å; F282-E721 WeakPolarHBondContact CE2-OE2 3.34Å; F282-E721 HydrophobicContact CZ-CG 4.2Å; F282-L723 HydrophobicContact CB-CB 4.44Å; F282-L723 HydrophobicContact CB-CD1 3.8Å
283	G	30.9	Very low	28.6	Very low	40 Å²	40	81.7 Å²	81.7	41%	0.412	51%	0.511	S	S	.	.			trans	95.7	110	168.2	0	0	0	0	0	115	S281	S281-G283 VanDerWaalsContact C-N 3.34Å; S281-G283 PolarHBondContact O-N 2.89Å
284	I	29.3	Very low	28.6	Very low	95 Å²	95	83.3 Å²	83.3	49%	0.487	52%	0.516	S	S	.	.			trans	-87	128.8	135.9	-65.6	175.3	0	0	0	105.6	Y631 K632	I284-Y631 HydrophobicContact CB-CE1 4.29Å; I284-Y631 HydrophobicContact CG2-CE1 4.36Å; I284-Y631 WeakPolarHBondContact O-CE1 3.48Å; I284-Y631 PolarHBondContact O-OH 3.26Å; I284-K632 HydrophobicContact CD1-CG 4.45Å
285	L	26.7	Very low	28.6	Very low	121 Å²	121	86.9 Å²	86.9	63%	0.634	53%	0.529	S	S	*	.			trans	-125.9	155.4	169.6	-85	172.1	0	0	0	109.4
286	P	28.4	Very low	28.5	Very low	51 Å²	51	89.6 Å²	89.6	33%	0.331	53%	0.531	S	S	.	.			trans	-91.8	177.1	-160.1	38.2	-39.2	0	0	0	114.1	E634 F636	P286-E634 HydrophobicContact CB-CG 3.85Å; P286-E634 VanDerWaalsContact CB-OE1 3.25Å; P286-E634 WeakPolarHBondContact CB-OE1 3.19Å; P286-F636 HydrophobicContact CB-CZ 3.96Å; P286-F636 HydrophobicContact CG-CZ 3.96Å
287	L	24.9	Very low	28.4	Very low	128 Å²	128	95.6 Å²	95.6	67%	0.67	56%	0.561	S	S	*	*			trans	65.5	110.9	169.9	-60.2	167.2	0	0	0	117.3	E634	L287-E634 VanDerWaalsContact CD2-OE2 3.26Å; L287-E634 WeakPolarHBondContact CD2-OE2 3.3Å; L287-E634 PolarHBondContact N-OE1 2.87Å
288	E	25.3	Very low	28.2	Very low	185 Å²	185	100.3 Å²	100.3	86%	0.864	58%	0.58	S	S	*	*				-140.2	146.4	112.4	-91.7	-153.5	137.1	0	0	110.5
289	P	26.9	Very low	27.8	Very low	106 Å²	106	103.2 Å²	103.2	69%	0.688	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-77.3	143.2	173.3	33.1	-33.6	0	0	0	110.7	P291	P289-P291 WeakPolarHBondContact O-CD 3.41Å
290	S	27.6	Very low	27.5	Very low	116 Å²	116	109.8 Å²	109.8	81%	0.811	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-64.1	121.2	177.3	179.3	0	0	0	0	111.6
291	P	29.6	Very low	27.3	Very low	109 Å²	109	113 Å²	113	71%	0.708	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-75.7	124.9	160.9	-5.8	25	0	0	0	108	P289	P289-P291 WeakPolarHBondContact O-CD 3.41Å
292	G	28.2	Very low	27.1	Very low	74 Å²	74	113.1 Å²	113.1	76%	0.763	65%	0.645	S	S	*	*			trans	-100.3	107.9	168.3	0	0	0	0	0	109.5
293	D	24.1	Very low	26.8	Very low	157 Å²	157	118.1 Å²	118.1	84%	0.84	68%	0.677	S	S	*	*			trans	-93.3	133.4	-176.1	-103.1	-37.6	0	0	0	113.5
294	P	27.2	Very low	26.6	Very low	98 Å²	98	123.4 Å²	123.4	64%	0.636	69%	0.693	S	S	*	*			trans	-98.7	119.7	179.5	35.2	-31.5	0	0	0	114.7
295	T	26.4	Very low	26.4	Very low	121 Å²	121	126 Å²	126	74%	0.742	70%	0.703	S	S	*	*			trans	76.2	162	140.3	69	0	0	0	0	121.4
296	Y	25.7	Very low	26.3	Very low	190 Å²	190	124.9 Å²	124.9	75%	0.745	70%	0.701	S	S	*	*			trans	66.5	108.4	178.3	-70.2	-94.2	0	0	0	116.6
297	L	26.9	Very low	26.2	Very low	140 Å²	140	129.9 Å²	129.9	73%	0.733	72%	0.72	S	S	*	*				80.5	148.9	59.1	-69.1	169.4	0	0	0	112.6
298	Q	27.5	Very low	26.3	Very low	140 Å²	140	129.4 Å²	129.4	65%	0.654	72%	0.723	S	S	*	*			cis	-157.7	176.4	28.3	-149.3	177.5	-66.5	0	0	114.4
299	N	25	Very low	26.3	Very low	98 Å²	98	127.1 Å²	127.1	52%	0.524	72%	0.722	S	S	.	*			trans	76.7	151.9	161.5	-63.3	-18.5	0	0	0	115.9
300	Y	26.4	Very low	26.1	Very low	198 Å²	198	126.4 Å²	126.4	78%	0.776	73%	0.725	S	S	*	*			cis	-158.9	168.1	-5.9	-95.9	-25.5	0	0	0	107.4
301	S	23.8	Very low	26.6	Very low	101 Å²	101	126.3 Å²	126.3	71%	0.706	72%	0.721	S	S	*	*			cis	179.1	129.8	-34	55.8	0	0	0	0	109.8
302	A	25.1	Very low	26.6	Very low	88 Å²	88	125.6 Å²	125.6	73%	0.727	72%	0.719	S	S	*	*			trans	178.2	103.3	160.6	0	0	0	0	0	109.8
303	T	26.1	Very low	26.7	Very low	124 Å²	124	130.8 Å²	130.8	76%	0.761	72%	0.72	S	S	*	*				57.5	123.7	94.5	61.8	0	0	0	0	115.5
304	M	26.5	Very low	26.9	Very low	151 Å²	151	133.1 Å²	133.1	74%	0.744	72%	0.723	S	S	*	*			cis	-168.3	-172.1	-2.2	-121.9	150.9	64.6	0	0	108.6
305	E	25.2	Very low	26.7	Very low	149 Å²	149	132.5 Å²	132.5	70%	0.696	73%	0.726	S	S	*	*			cis	-150.5	-76.2	13.4	-150.9	171.8	126.4	0	0	116.4
306	T	25.7	Very low	26.7	Very low	98 Å²	98	133.2 Å²	133.2	60%	0.601	73%	0.73	S	S	*	*			trans	-151.3	164.9	-151.8	42.5	0	0	0	0	113.5
307	Q	26.9	Very low	26.6	Very low	157 Å²	157	128.9 Å²	128.9	73%	0.734	73%	0.728	S	S	*	*			cis	-156.9	146.2	9.3	-130.9	159.5	58.5	0	0	113.8
308	T	26.3	Very low	26.5	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.724	73%	0.734	S	S	*	*			trans	20.5	145.8	146.6	60.3	0	0	0	0	122.7
309	T	24.5	Very low	26.5	Very low	137 Å²	137	133.8 Å²	133.8	84%	0.84	74%	0.74	S	S	*	*				-156.5	168.2	52.2	46.5	0	0	0	0	114.6
310	A	24.2	Very low	26.5	Very low	91 Å²	91	133 Å²	133	75%	0.752	74%	0.742	S	S	*	*			trans	-140.1	-174.9	170.3	0	0	0	0	0	108.7
311	P	37.9	Very low	26.6	Very low	113 Å²	113	132.1 Å²	132.1	73%	0.734	75%	0.745	S	S	*	*				-159.7	179.9	54.8	42.4	-19.1	0	0	0	120.3
312	S	29.3	Very low	26.8	Very low	95 Å²	95	131.3 Å²	131.3	66%	0.664	74%	0.739	S	S	*	*			trans	75.7	149.2	143.3	64.1	0	0	0	0	122.3
313	K	30	Very low	26.8	Very low	182 Å²	182	136.1 Å²	136.1	79%	0.791	74%	0.744	S	S	*	*			cis	-166.6	135.4	-9	-108.7	164.2	-168.3	170.3	0	112.3
314	K	27.5	Very low	26.9	Very low	207 Å²	207	135 Å²	135	90%	0.9	74%	0.741	S	S	*	*			trans	48.8	161.4	143.4	-55.9	-172	176.7	-171.8	0	120.3
315	A	23.8	Very low	26.9	Very low	84 Å²	84	133.6 Å²	133.6	69%	0.694	74%	0.741	S	S	*	*			cis	-145.5	152.5	10.6	0	0	0	0	0	109.5
316	V	25.5	Very low	26.8	Very low	136 Å²	136	135.6 Å²	135.6	82%	0.824	75%	0.747	S	S	*	*				54.8	129.6	72.8	-171.1	0	0	0	0	112.7
317	S	25.4	Very low	26.9	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	74%	0.743	S	S	*	*			cis	-153.4	145.4	15.2	25.6	0	0	0	0	110.8
318	R	24.9	Very low	27	Very low	232 Å²	232	135.4 Å²	135.4	88%	0.875	75%	0.748	S	S	*	*				83.3	148.1	75.6	-152.5	-158.5	-118.8	-169.7	-0.1	114.6
319	I	26.5	Very low	27	Very low	150 Å²	150	135 Å²	135	77%	0.769	75%	0.75	S	S	*	*			trans	83.3	143.1	166.8	-54.7	176.9	0	0	0	115.7
320	S	24.4	Very low	27	Very low	82 Å²	82	131.7 Å²	131.7	57%	0.573	74%	0.743	S	S	*	*			cis	-173	165.2	-35.7	73.3	0	0	0	0	111.1
321	Q	29.8	Very low	27.2	Very low	180 Å²	180	135.2 Å²	135.2	84%	0.841	75%	0.749	S	S	*	*			trans	66.3	160.1	156.7	-67.6	178.7	23.5	0	0	118.1
322	S	26.6	Very low	26.8	Very low	83 Å²	83	134.4 Å²	134.4	58%	0.58	75%	0.746	S	S	*	*			cis	-165	165.4	-30.5	65.3	0	0	0	0	110.6
323	K	26.9	Very low	26.8	Very low	190 Å²	190	140 Å²	140	83%	0.826	75%	0.752	S	S	*	*			trans	63.4	126.9	164.2	-63.6	172.6	-177.9	175.8	0	116.5
324	S	26.4	Very low	26.8	Very low	99 Å²	99	137.7 Å²	137.7	69%	0.692	75%	0.749	S	S	*	*			cis	99.2	147.7	26.2	74.8	0	0	0	0	114.7
325	V	26.6	Very low	26.8	Very low	123 Å²	123	134.1 Å²	134.1	75%	0.745	74%	0.744	S	S	*	*			trans	100.4	111.8	162.2	177.6	0	0	0	0	117.6
326	F	23.8	Very low	27.1	Very low	190 Å²	190	137.4 Å²	137.4	83%	0.833	75%	0.749	S	S	*	*			trans	63	159.4	150.2	-85.2	-134.2	0	0	0	119.1
327	S	27.5	Very low	27.8	Very low	73 Å²	73	136.1 Å²	136.1	51%	0.51	74%	0.743	S	S	.	*			cis	-174.3	165.4	-24.1	54.7	0	0	0	0	110.4
328	Q	29.1	Very low	28.1	Very low	178 Å²	178	138.1 Å²	138.1	83%	0.832	75%	0.745	S	S	*	*			trans	65.7	133.2	160.2	-71	173.8	1.2	0	0	115.4
329	S	26	Very low	28.9	Very low	111 Å²	111	132.4 Å²	132.4	78%	0.776	74%	0.738	S	S	*	*			cis	116.7	121.5	18	68	0	0	0	0	110.6
330	G	25.6	Very low	29	Very low	66 Å²	66	133 Å²	133	68%	0.68	74%	0.735	S	S	*	*			trans	143.2	120.4	-176.7	0	0	0	0	0	108.1
331	N	28.1	Very low	29.1	Very low	166 Å²	166	135.5 Å²	135.5	89%	0.888	74%	0.742	S	S	*	*				59.9	124.1	67.4	-67.3	-8.8	0	0	0	111.8
332	S	29.9	Very low	29.1	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	73%	0.733	S	S	*	*			cis	-158.8	174.4	3.5	-153.7	0	0	0	0	111.8
333	R	29.2	Very low	29.2	Very low	213 Å²	213	134.9 Å²	134.9	80%	0.804	74%	0.742	S	S	*	*			trans	18.2	137.2	139.9	-78.8	-177	-173	162.3	0.9	119.2
334	D	28.4	Very low	29.3	Very low	133 Å²	133	133.6 Å²	133.6	71%	0.711	74%	0.739	S	S	*	*			cis	-167.4	153.5	45.2	-103.7	-33.4	0	0	0	115.8
335	V	28.1	Very low	29.4	Very low	132 Å²	132	135 Å²	135	80%	0.8	74%	0.744	S	S	*	*			trans	68.5	154.1	137.5	179.8	0	0	0	0	122.9
336	L	29.3	Very low	29.4	Very low	153 Å²	153	134.7 Å²	134.7	80%	0.801	75%	0.747	S	S	*	*			trans	-94	-171.9	-170.9	-59.8	165.7	0	0	0	112
337	P	41.5	Very low	29.7	Very low	109 Å²	109	129.9 Å²	129.9	71%	0.708	74%	0.742	S	S	*	*			cis	-144.4	160	5.9	43.6	-23.5	0	0	0	120.3
338	I	30.6	Very low	30.5	Very low	142 Å²	142	131.2 Å²	131.2	73%	0.728	75%	0.749	S	S	*	*				28.3	126.1	128.5	-56.6	173.2	0	0	0	118.2
339	P	43	Very low	30.6	Very low	112 Å²	112	130.9 Å²	130.9	73%	0.727	75%	0.747	S	S	*	*				-156.9	152.7	84	41.6	-21	0	0	0	122.3
340	F	28	Very low	30.8	Very low	163 Å²	163	131.4 Å²	131.4	72%	0.715	75%	0.746	S	S	*	*			trans	46.2	119.3	141.5	-86.5	-99.6	0	0	0	124.4
341	N	26.3	Very low	31	Very low	135 Å²	135	134 Å²	134	72%	0.722	75%	0.754	S	S	*	*				170.7	163.7	106.7	-97.9	-13.1	0	0	0	111.1
342	Q	30.8	Very low	30.9	Very low	139 Å²	139	130 Å²	130	65%	0.65	75%	0.752	S	S	*	*			cis	-168.2	172.3	-38.8	-125.1	-169.2	41.1	0	0	108.7
343	S	28.3	Very low	30.9	Very low	110 Å²	110	131 Å²	131	77%	0.769	76%	0.759	S	S	*	*			trans	81.3	150.9	169	81.6	0	0	0	0	119.3
344	Q	29.6	Very low	31.6	Very low	163 Å²	163	126.1 Å²	126.1	76%	0.762	76%	0.755	S	S	*	*				-174.3	179.1	-52.9	-112.4	-172.9	20.9	0	0	109.7
345	T	26.7	Very low	31.7	Very low	130 Å²	130	128.2 Å²	128.2	80%	0.798	76%	0.76	S	S	*	*			trans	72.4	159.3	169.9	75.5	0	0	0	0	117.4
346	S	28.1	Very low	31.7	Very low	115 Å²	115	127.6 Å²	127.6	80%	0.804	76%	0.756	S	S	*	*				-161.4	161.5	-62.5	41.6	0	0	0	0	111
347	A	28.7	Very low	31.7	Very low	89 Å²	89	128.1 Å²	128.1	74%	0.736	76%	0.759	S	S	*	*			trans	-84.9	-170.6	179.1	0	0	0	0	0	111.8
348	P	45	Very low	31.3	Very low	101 Å²	101	128 Å²	128	66%	0.656	76%	0.761	S	S	*	*			cis	-155	-177.9	13.6	47.9	-26.6	0	0	0	121.1
349	H	32.1	Very low	32.1	Very low	171 Å²	171	126.5 Å²	126.5	79%	0.792	76%	0.761	S	S	*	*			trans	71.6	141.3	141.4	-68.4	-37.7	0	0	0	127.2
350	T	28.9	Very low	31.4	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	76%	0.76	S	S	*	*			trans	89.5	108.9	139.1	35.7	0	0	0	0	125.7
351	S	29.8	Very low	31.5	Very low	121 Å²	121	126.6 Å²	126.6	85%	0.846	77%	0.767	S	S	*	*				58.7	133.4	129.6	64.2	0	0	0	0	124.5
352	G	26	Very low	31.7	Very low	83 Å²	83	126.3 Å²	126.3	86%	0.856	78%	0.775	S	S	*	*			trans	178	133.2	158.1	0	0	0	0	0	116.1
353	S	30.1	Very low	31.5	Very low	115 Å²	115	122.9 Å²	122.9	80%	0.804	78%	0.778	S	S	*	*			trans	-146.9	164.4	166.1	69.8	0	0	0	0	107.2
354	P	43.8	Very low	32.9	Very low	111 Å²	111	123.7 Å²	123.7	72%	0.721	78%	0.78	S	S	*	*			cis	-155.7	-177.6	48.1	44.5	-22	0	0	0	119.1
355	Q	30.3	Very low	34.2	Very low	177 Å²	177	121 Å²	121	83%	0.827	78%	0.777	S	S	*	*			trans	47.4	127.3	141.6	-76.9	-168.1	-21.5	0	0	126.5
356	V	29.5	Very low	34.5	Very low	118 Å²	118	121.7 Å²	121.7	72%	0.715	78%	0.776	S	S	*	*				67.6	125.2	124.8	179.5	0	0	0	0	121.7
357	L	27.6	Very low	34.7	Very low	165 Å²	165	121.8 Å²	121.8	86%	0.864	77%	0.771	S	S	*	*				-176.5	153	122.4	-100.6	173	0	0	0	113.5
358	S	33.7	Very low	35.1	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	78%	0.775	S	S	*	*			trans	-159.3	149.9	165	63.9	0	0	0	0	109.6
359	P	46.8	Very low	35.3	Very low	111 Å²	111	126 Å²	126	72%	0.721	78%	0.776	S	S	*	*				-160.2	167	120.2	39.2	-20.5	0	0	0	118.1
360	S	30.3	Very low	35.2	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	78%	0.779	S	S	*	*			trans	66.5	160.7	142.2	69.4	0	0	0	0	121.3
361	M	29.9	Very low	35.4	Very low	174 Å²	174	133.2 Å²	133.2	86%	0.857	78%	0.783	S	S	*	*			cis	-170.7	138.7	-24.4	-104	-66.1	124.9	0	0	109.1
362	S	29.3	Very low	35.7	Very low	128 Å²	128	131.5 Å²	131.5	90%	0.895	77%	0.771	S	S	*	*			trans	171.3	147.4	143.7	58.3	0	0	0	0	114.2
363	G	26.4	Very low	36.1	Very low	68 Å²	68	132 Å²	132	70%	0.701	76%	0.761	S	S	*	*			trans	-168.7	-149.2	169.3	0	0	0	0	0	108
364	P	57.7	Low	36.2	Very low	126 Å²	126	137.2 Å²	137.2	82%	0.818	76%	0.763	S	S	*	*			cis	-102.1	-118.7	-17.7	43.4	-30.4	0	0	0	106.6
365	P	58.4	Low	35.7	Very low	108 Å²	108	137.9 Å²	137.9	70%	0.701	76%	0.76	S	S	*	*			cis	-91.9	-143.1	-27.3	35.3	-18.6	0	0	0	109.4
366	N	32	Very low	35.8	Very low	143 Å²	143	138 Å²	138	77%	0.765	76%	0.758	S	S	*	*			cis	-160.6	163.9	-5.5	-129.2	-7.8	0	0	0	106.3
367	V	33.4	Very low	35.9	Very low	117 Å²	117	137.9 Å²	137.9	71%	0.709	76%	0.757	S	S	*	*			cis	-154.2	174.3	-11.7	78	0	0	0	0	107.6
368	Q	35.2	Very low	36	Very low	175 Å²	175	134.8 Å²	134.8	82%	0.818	75%	0.749	S	S	*	*			trans	-143.6	172.9	171.1	-54.5	-174.7	-15.2	0	0	110.9
369	P	50.6	Low	35.8	Very low	105 Å²	105	134.2 Å²	134.2	68%	0.682	75%	0.751	S	S	*	*				-139.4	-173.2	76.5	39	-21.3	0	0	0	112.2
370	R	30.2	Very low	35	Very low	225 Å²	225	134.1 Å²	134.1	85%	0.849	75%	0.753	S	S	*	*			cis	-161.2	162.4	17.2	-122.2	141.9	-163.5	-169.4	5.4	105.5
371	R	33.2	Very low	35.1	Very low	219 Å²	219	134.1 Å²	134.1	83%	0.826	75%	0.754	S	S	*	*			cis	-165.7	147.9	-4.2	-148	-164	175.1	-169.2	-0.1	109.1
372	S	35.1	Very low	35	Very low	85 Å²	85	133.2 Å²	133.2	59%	0.594	76%	0.758	S	S	*	*			trans	26.9	147.6	138.8	70.5	0	0	0	0	123.1
373	S	33.6	Very low	35.2	Very low	92 Å²	92	131.6 Å²	131.6	64%	0.643	75%	0.752	S	S	*	*			cis	-172.3	137.9	15.3	19.9	0	0	0	0	116.3
374	R	33.4	Very low	35.3	Very low	225 Å²	225	137.1 Å²	137.1	85%	0.849	76%	0.757	S	S	*	*				63.1	149.4	125	-57.7	-179.1	165.2	-172.1	-4.8	121.4
375	L	33.7	Very low	33.9	Very low	125 Å²	125	137.6 Å²	137.6	65%	0.654	75%	0.748	S	S	*	*			cis	-162.7	133.6	-17.7	-99.2	159.1	0	0	0	109.2
376	F	32	Very low	32.5	Very low	180 Å²	180	138.5 Å²	138.5	79%	0.789	75%	0.747	S	S	*	*			trans	36.3	165.6	131.5	-62.4	-108	0	0	0	122.2
377	T	30.3	Very low	32.4	Very low	115 Å²	115	136 Å²	136	71%	0.706	74%	0.741	S	S	*	*			cis	-160.1	145.7	18.4	-18.4	0	0	0	0	114.3
378	S	30.5	Very low	32.3	Very low	100 Å²	100	139 Å²	139	70%	0.699	75%	0.745	S	S	*	*			trans	36.2	116.7	139.4	65.7	0	0	0	0	125.7
379	A	30.2	Very low	32.1	Very low	94 Å²	94	139 Å²	139	78%	0.777	74%	0.742	S	S	*	*				59.9	132.1	106.6	0	0	0	0	0	125.8
380	S	29.4	Very low	31.1	Very low	109 Å²	109	140.9 Å²	140.9	76%	0.762	75%	0.745	S	S	*	*			trans	69.5	108.5	133.7	-60.8	0	0	0	0	125
381	S	32.3	Very low	30.9	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	74%	0.74	S	S	*	*			trans	45.7	123.5	130.5	66.6	0	0	0	0	123.3
382	T	28.8	Very low	30.8	Very low	155 Å²	155	135.1 Å²	135.1	95%	0.951	74%	0.737	S	S	*	*				-174	176.7	127.5	18.4	0	0	0	0	110.1
383	A	31.7	Very low	30.4	Very low	94 Å²	94	139.8 Å²	139.8	78%	0.777	75%	0.746	S	S	*	*			trans	-140.7	139.4	-174.2	0	0	0	0	0	114.2
384	K	29.2	Very low	30.3	Very low	184 Å²	184	144.3 Å²	144.3	80%	0.8	76%	0.755	S	S	*	*			trans	-177.1	133.7	143	-108.8	169.4	173.7	-95.7	0	115.1
385	E	28.3	Very low	30.6	Very low	135 Å²	135	139.4 Å²	139.4	63%	0.631	75%	0.752	S	S	*	*			trans	58.2	125.6	137.7	-72.5	-178.3	85.4	0	0	125.9
386	N	28.9	Very low	30.4	Very low	127 Å²	127	138.8 Å²	138.8	68%	0.679	75%	0.753	S	S	*	*				85.3	96.7	129.8	-73.7	-32.6	0	0	0	124.4
387	S	30.3	Very low	30.2	Very low	91 Å²	91	140 Å²	140	64%	0.636	76%	0.758	S	S	*	*				126.9	154.2	94.2	73.1	0	0	0	0	119.1
388	K	31.7	Very low	30.4	Very low	181 Å²	181	141.7 Å²	141.7	79%	0.787	76%	0.762	S	S	*	*			trans	81	138.2	170.6	-60	158.7	-172.2	164.6	0	115
389	K	30.9	Very low	30.5	Very low	175 Å²	175	142.9 Å²	142.9	76%	0.761	77%	0.767	S	S	*	*			cis	-162.9	142.7	4.8	-121.2	176.6	178.3	-179.1	0	112.4
390	L	28.4	Very low	30.3	Very low	143 Å²	143	145.9 Å²	145.9	75%	0.749	77%	0.77	S	S	*	*			trans	69.9	150.8	150.6	-58.6	166.5	0	0	0	118.3
391	K	27.8	Very low	30.2	Very low	171 Å²	171	152.6 Å²	152.6	74%	0.743	78%	0.778	S	S	*	*			cis	-160.6	139.5	5.5	-126	179.6	-176.2	-179.1	0	112.5
392	M	29.7	Very low	29.8	Very low	153 Å²	153	156.4 Å²	156.4	75%	0.754	78%	0.782	S	S	*	*			trans	56.9	161.5	151.3	-53.6	-48.7	-129.7	0	0	122.3
393	K	27	Very low	29.6	Very low	183 Å²	183	155 Å²	155	80%	0.796	77%	0.773	S	S	*	*			cis	-166.2	158.8	-49.1	-117.5	-174.9	-176.7	-175.6	0	110
394	F	32.6	Very low	29.2	Very low	187 Å²	187	159.9 Å²	159.9	82%	0.82	78%	0.777	S	S	*	*			trans	-71.7	161.2	-176.9	-69	-90.4	0	0	0	115.3
395	P	38.9	Very low	29	Very low	122 Å²	122	157.2 Å²	157.2	79%	0.792	78%	0.78	S	S	*	*				-126.6	-163.8	105.4	12.2	8.9	0	0	0	115.4
396	T	29.1	Very low	28.8	Very low	111 Å²	111	161 Å²	161	68%	0.681	79%	0.794	S	S	*	*			trans	-159.3	170.6	-142.8	47.7	0	0	0	0	115.1
397	K	27.7	Very low	28.6	Very low	205 Å²	205	160.5 Å²	160.5	89%	0.891	80%	0.801	S	S	*	*			trans	89.8	158	151.6	-79.8	-177.1	179.6	-179.5	0	120.4
398	I	34.2	Very low	28.3	Very low	152 Å²	152	160.4 Å²	160.4	78%	0.779	81%	0.805	S	S	*	*			trans	-107.2	159.3	-170.2	-53.3	154.2	0	0	0	109.8
399	P	33.2	Very low	28	Very low	125 Å²	125	160.9 Å²	160.9	81%	0.812	81%	0.808	S	S	*	*			trans	-135.7	147.5	135.4	37.1	-26	0	0	0	115.4
400	N	26	Very low	27.7	Very low	156 Å²	156	158.7 Å²	158.7	83%	0.834	81%	0.809	S	S	*	*			trans	-78.3	151.1	170.1	-76.5	-52.1	0	0	0	112.2
401	R	26.6	Very low	27.4	Very low	251 Å²	251	155.4 Å²	155.4	95%	0.947	80%	0.802	S	S	*	*			trans	-153.1	159.7	136	-137.3	170.5	-179.8	166.3	0.5	113.4
402	K	25.6	Very low	27.2	Very low	184 Å²	184	154.3 Å²	154.3	80%	0.8	81%	0.805	S	S	*	*			trans	-107.9	178.3	-172	-57.7	-178.5	177.3	-177.9	0	112.5
403	T	23.9	Very low	27	Very low	125 Å²	125	152.3 Å²	152.3	77%	0.767	81%	0.806	S	S	*	*			trans	93	131	137.6	30.5	0	0	0	0	122.9
404	K	23.7	Very low	26.9	Very low	197 Å²	197	149 Å²	149	86%	0.857	81%	0.806	S	S	*	*			trans	87.8	120.4	143.5	-79.5	-177.1	174.5	-177.9	0	120.2
405	C	24.8	Very low	26.5	Very low	128 Å²	128	147.4 Å²	147.4	87%	0.865	81%	0.806	S	S	*	*			trans	-67.4	160.6	163.6	-35.6	0	0	0	0	112
406	K	24.2	Very low	25.9	Very low	213 Å²	213	149.1 Å²	149.1	93%	0.926	81%	0.807	S	S	*	*			trans	-151.9	162.6	153.8	-116.4	179	-178.5	-175.5	0	110.8
407	S	24.6	Very low	25.7	Very low	118 Å²	118	149.4 Å²	149.4	83%	0.825	81%	0.805	S	S	*	*			trans	-129.6	152.5	-158.3	54.9	0	0	0	0	114.5
408	A	24.5	Very low	25.5	Very low	88 Å²	88	147.1 Å²	147.1	73%	0.727	80%	0.797	S	S	*	*			trans	-131.6	130.1	155.7	0	0	0	0	0	106.8
409	K	24.8	Very low	25.1	Very low	192 Å²	192	145 Å²	145	84%	0.835	80%	0.796	S	S	*	*				63.9	129.6	67.3	-71.2	-163.6	172.7	-171.6	0	112
410	T	23.5	Very low	24.8	Very low	128 Å²	128	145.5 Å²	145.5	79%	0.785	79%	0.791	S	S	*	*			cis	-167.7	165.2	4	7.6	0	0	0	0	108.3
411	A	23.7	Very low	24.7	Very low	74 Å²	74	144.8 Å²	144.8	61%	0.612	79%	0.787	S	S	*	*			cis	-162.1	-161.6	-1.6	0	0	0	0	0	109.3
412	N	23.9	Very low	24.8	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	78%	0.777	S	S	*	*			trans	70.2	107.1	157.6	-63.7	6.9	0	0	0	117.2
413	S	23.8	Very low	25.2	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	78%	0.782	S	S	*	*				87.4	138.4	79.6	72.7	0	0	0	0	113.2
414	S	25.7	Very low	25.3	Very low	114 Å²	114	144.5 Å²	144.5	80%	0.797	79%	0.788	S	S	*	*			cis	-152.1	167.4	10.3	50.4	0	0	0	0	112.3
415	N	24.8	Very low	25.7	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	79%	0.79	S	S	*	*			trans	-67	161.7	170.6	-62.4	-18.8	0	0	0	112.5
416	L	26.3	Very low	25.7	Very low	158 Å²	158	143.7 Å²	143.7	83%	0.827	78%	0.784	S	S	*	*				-170.9	137.8	121.8	-99	168.1	0	0	0	111.8
417	N	24.6	Very low	26.3	Very low	118 Å²	118	139.9 Å²	139.9	63%	0.631	78%	0.781	S	S	*	*			trans	52.6	115.1	154.2	-73.5	35.8	0	0	0	121
418	E	23.8	Very low	26.7	Very low	157 Å²	157	138 Å²	138	73%	0.734	77%	0.768	S	S	*	*				81.3	102.8	73.9	-77.5	-176.2	139.3	0	0	112.1
419	S	25.4	Very low	27	Very low	106 Å²	106	142.1 Å²	142.1	74%	0.741	78%	0.776	S	S	*	*				98.9	156.3	93.4	79.4	0	0	0	0	110.6
420	L	26.9	Very low	27.2	Very low	137 Å²	137	140.4 Å²	140.4	72%	0.717	78%	0.776	S	S	*	*			cis	-153.5	166.2	5	-161.9	69.1	0	0	0	109
421	D	23.6	Very low	27.5	Very low	140 Å²	140	142 Å²	142	75%	0.749	78%	0.779	S	S	*	*			trans	62.7	160.7	162	-62.2	-33.8	0	0	0	118.7
422	I	28.7	Very low	28.2	Very low	144 Å²	144	144.3 Å²	144.3	74%	0.738	79%	0.788	S	S	*	*			cis	-128.9	144.9	3.1	-67.9	174.2	0	0	0	110.1
423	L	34.6	Very low	28.7	Very low	173 Å²	173	142.4 Å²	142.4	91%	0.906	78%	0.778	S	S	*	*			trans	-82.2	117.6	159.4	-84.4	169.3	0	0	0	111.6
424	R	26.3	Very low	29.6	Very low	237 Å²	237	142.4 Å²	142.4	89%	0.894	79%	0.785	S	S	*	*			trans	-154.8	146.8	158.9	-109.5	163.1	-159.9	-168.7	4.2	111.4
425	L	32.2	Very low	30.7	Very low	173 Å²	173	145.4 Å²	145.4	91%	0.906	78%	0.779	S	S	*	*			trans	-89.7	146.3	179.7	-61.8	98.4	0	0	0	111
426	D	23.8	Very low	32	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	75%	0.753	S	S	*	*			trans	-136.6	111.1	164.8	-131.3	-38.1	0	0	0	109	S428	D426-S428 VanDerWaalsContact C-N 3.29Å; D426-S428 PolarHBondContact O-N 3.29Å; D426-S428 VanDerWaalsContact O-N 3.11Å; D426-S428 PolarHBondContact OD1-OG 2.97Å
427	P	37.8	Very low	33.8	Very low	134 Å²	134	137 Å²	137	87%	0.87	74%	0.738	S	S	*	*			trans	-88.4	61.2	-174.5	35.7	-35	0	0	0	111.4
428	S	32.4	Very low	35.8	Very low	78 Å²	78	139.4 Å²	139.4	55%	0.545	75%	0.745	S	S	.	*			trans	-142.7	27.2	-164.1	52.6	0	0	0	0	115.3	D426	D426-S428 VanDerWaalsContact C-N 3.29Å; D426-S428 PolarHBondContact O-N 3.29Å; D426-S428 VanDerWaalsContact O-N 3.11Å; D426-S428 PolarHBondContact OD1-OG 2.97Å
429	L	29.6	Very low	38	Very low	174 Å²	174	141.1 Å²	141.1	91%	0.911	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-102.8	118	171.2	-72	177.1	0	0	0	112
430	N	29.8	Very low	40.1	Very low	156 Å²	156	141.1 Å²	141.1	83%	0.834	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-61.5	142.1	-178.5	-64.3	-53	0	0	0	112.5
431	L	30.3	Very low	42.3	Very low	161 Å²	161	138.6 Å²	138.6	84%	0.843	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-56.5	140.2	158.8	-74.9	150.3	0	0	0	109.1	D433	L431-D433 PolarHBondContact O-N 2.91Å
432	P	37.6	Very low	44.9	Very low	123 Å²	123	134.8 Å²	134.8	80%	0.799	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-66.8	120.4	179.4	26.8	-33.3	0	0	0	110.3	A434	P432-A434 PolarHBondContact O-N 3.44Å
433	D	35.1	Very low	47.5	Very low	109 Å²	109	130.1 Å²	130.1	58%	0.583	69%	0.686	S	S	*	*			trans	-44.3	127.2	175.4	-116	4.6	0	0	0	111.9	L431 R435	L431-D433 PolarHBondContact O-N 2.91Å; D433-R435 HydrophobicContact CB-CG 4.02Å; D433-R435 PolarHBondContact O-N 3.31Å; D433-R435 IonicContact OD2-CZ 3.11Å; D433-R435 IonicContact OD2-NE 2.65Å; D433-R435 PolarHBondContact OD2-NE 3.08Å; D433-R435 IonicContact OD2-NH2 2.7Å; D433-R435 PolarHBondContact OD2-NH2 3.08Å
434	A	42.4	Very low	49.8	Very low	110 Å²	110	122.5 Å²	122.5	91%	0.909	65%	0.648	S	S	*	*			trans	-73.7	48.7	178.2	0	0	0	0	0	112.8	P432 M436	P432-A434 PolarHBondContact O-N 3.44Å; A434-M436 PolarHBondContact O-N 2.83Å
435	R	48.1	Very low	52.6	Low	178 Å²	178	114.8 Å²	114.8	67%	0.672	62%	0.624	S	S	*	*			trans	-73	113.8	179	-80.7	172.5	-164.8	-149.8	5.1	109.7	D433	D433-R435 HydrophobicContact CB-CG 4.02Å; D433-R435 PolarHBondContact O-N 3.31Å; D433-R435 IonicContact OD2-CZ 3.11Å; D433-R435 IonicContact OD2-NE 2.65Å; D433-R435 PolarHBondContact OD2-NE 3.08Å; D433-R435 IonicContact OD2-NH2 2.7Å; D433-R435 PolarHBondContact OD2-NH2 3.08Å
436	M	53.7	Low	55.2	Low	58 Å²	58	110 Å²	110	29%	0.286	61%	0.606	S	S	.	*			trans	-43.2	131.3	164.9	-82	-175.8	71.6	0	0	110.3	L178 A434 Q438 Q440 R441	L178-M436 HydrophobicContact CD1-CE 4.45Å; L178-M436 HydrophobicContact CD1-CG 4.44Å; L178-M436 HydrophobicContact CD1-SD 3.77Å; A434-M436 PolarHBondContact O-N 2.83Å; M436-Q438 PolarHBondContact O-N 3.28Å; M436-Q440 HydrophobicContact CE-CB 3.74Å; M436-R441 HydrophobicContact CB-CG 4.02Å; M436-R441 HydrophobicContact CE-CG 4.48Å; M436-R441 VanDerWaalsContact O-CZ 3.31Å; M436-R441 PolarHBondContact O-NE 3.39Å; M436-R441 PolarHBondContact O-NH2 3.21Å; M436-R441 HydrophobicContact SD-CG 4.47Å
437	P	63.7	Low	58.3	Low	77 Å²	77	106.8 Å²	106.8	50%	0.5	59%	0.591	S	S	.	*			trans	-47.6	135.8	175.1	-29.9	34.6	0	0	0	111.9	Y439 Q440 R441	P437-Y439 PolarHBondContact O-N 3.28Å; P437-Y439 VanDerWaalsContact O-N 3.11Å; P437-Q440 HydrophobicContact CB-CG 4.41Å; P437-Q440 PolarHBondContact O-N 3.47Å; P437-R441 PolarHBondContact O-N 2.93Å
438	Q	66.4	Low	60.8	Low	168 Å²	168	100.4 Å²	100.4	79%	0.785	55%	0.549	S	S	*	.	H	α-helix	trans	-54.9	-35.8	-175	-73.4	174	-37.1	0	0	112.5	M436 R441 A442	M436-Q438 PolarHBondContact O-N 3.28Å; Q438-R441 PolarHBondContact O-N 3.32Å; Q438-A442 PolarHBondContact O-N 3.46Å
439	Y	69.4	Low	63.6	Low	193 Å²	193	98.5 Å²	98.5	76%	0.757	54%	0.538	S	S	*	.	H	α-helix	trans	-60.7	-42.3	174.5	-178.5	-100.3	0	0	0	113.4	P437 R441 A442 A443	P437-Y439 PolarHBondContact O-N 3.28Å; P437-Y439 VanDerWaalsContact O-N 3.11Å; Y439-R441 VanDerWaalsContact C-N 3.31Å; Y439-R441 PolarHBondContact O-N 3.03Å; Y439-A442 PolarHBondContact O-N 3.36Å; Y439-A443 WeakPolarHBondContact O-CB 3.26Å; Y439-A443 PolarHBondContact O-N 3.05Å
440	Q	68.8	Low	66.6	Low	105 Å²	105	92.1 Å²	92.1	49%	0.491	51%	0.505	S	S	.	.	H	α-helix	trans	-67.5	-32.7	177.5	-71.7	-175.9	-18.6	0	0	112	M436 P437 A444	M436-Q440 HydrophobicContact CE-CB 3.74Å; P437-Q440 HydrophobicContact CB-CG 4.41Å; P437-Q440 PolarHBondContact O-N 3.47Å; Q440-A444 WeakPolarHBondContact O-CB 3.48Å; Q440-A444 PolarHBondContact O-N 3.44Å
441	R	74.6	Confident	69.7	Low	85 Å²	85	86 Å²	86	32%	0.321	47%	0.472	S	S	.	.	H	α-helix	trans	-67.6	-51.4	172.1	-72.4	-174.1	-109.5	179.5	-7.2	111.3	L170 M436 P437 Q438 Y439 A443 A444 D445	L170-R441 HydrophobicContact CD1-CB 4.49Å; M436-R441 HydrophobicContact CB-CG 4.02Å; M436-R441 HydrophobicContact CE-CG 4.48Å; M436-R441 VanDerWaalsContact O-CZ 3.31Å; M436-R441 PolarHBondContact O-NE 3.39Å; M436-R441 PolarHBondContact O-NH2 3.21Å; M436-R441 HydrophobicContact SD-CG 4.47Å; P437-R441 PolarHBondContact O-N 2.93Å; Q438-R441 PolarHBondContact O-N 3.32Å; Y439-R441 VanDerWaalsContact C-N 3.31Å; Y439-R441 PolarHBondContact O-N 3.03Å; R441-A443 VanDerWaalsContact C-N 3.26Å; R441-A443 PolarHBondContact O-N 3.44Å; R441-A444 CarbonylContact O-C 3.52Å; R441-A444 WeakPolarHBondContact O-CA 3.49Å; R441-A444 PolarHBondContact O-N 3.09Å; R441-D445 WeakPolarHBondContact O-CB 3.47Å; R441-D445 PolarHBondContact O-N 3.14Å
442	A	78.5	Confident	72.7	Confident	60 Å²	60	81.2 Å²	81.2	50%	0.496	44%	0.443	S	S	.	.	H	α-helix	trans	-56.5	-38.1	177.4	0	0	0	0	0	113.2	Q438 Y439 S446	Q438-A442 PolarHBondContact O-N 3.46Å; Y439-A442 PolarHBondContact O-N 3.36Å; A442-S446 PolarHBondContact O-N 3.42Å
443	A	82.1	Confident	75.4	Confident	46 Å²	46	78.2 Å²	78.2	38%	0.38	42%	0.418	S	S	.	.	H	α-helix	trans	-70.8	-31.6	174.6	0	0	0	0	0	113.6	Y439 R441 S446 V447	Y439-A443 WeakPolarHBondContact O-CB 3.26Å; Y439-A443 PolarHBondContact O-N 3.05Å; R441-A443 VanDerWaalsContact C-N 3.26Å; R441-A443 PolarHBondContact O-N 3.44Å; A443-S446 PolarHBondContact O-OG 2.87Å; A443-S446 VanDerWaalsContact O-OG 3.07Å; A443-V447 WeakPolarHBondContact O-CG2 3.18Å
444	A	82.6	Confident	78.3	Confident	13 Å²	13	74.2 Å²	74.2	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-80	-31.1	174.2	0	0	0	0	0	112.3	F147 L170 Q440 R441 V447 M448	F147-A444 HydrophobicContact CZ-CB 4.25Å; L170-A444 HydrophobicContact CD1-CB 3.71Å; L170-A444 HydrophobicContact CD2-CB 3.76Å; L170-A444 HydrophobicContact CG-CB 4.4Å; Q440-A444 WeakPolarHBondContact O-CB 3.48Å; Q440-A444 PolarHBondContact O-N 3.44Å; R441-A444 CarbonylContact O-C 3.52Å; R441-A444 WeakPolarHBondContact O-CA 3.49Å; R441-A444 PolarHBondContact O-N 3.09Å; A444-V447 PolarHBondContact O-N 3.38Å; A444-M448 WeakPolarHBondContact O-CB 3.33Å; A444-M448 VanDerWaalsContact O-CG 3.29Å; A444-M448 WeakPolarHBondContact O-CG 3.35Å; A444-M448 PolarHBondContact O-N 3.02Å
445	D	85.3	Confident	80.8	Confident	74 Å²	74	69 Å²	69	40%	0.396	35%	0.353	S	S	.	.	H	α-helix	trans	-67.8	-35.1	178.8	-83.6	-51.9	0	0	0	112	L170 R441 M448 A449	L170-D445 HydrophobicContact CD1-CB 4.27Å; L170-D445 VanDerWaalsContact CD1-OD1 3.25Å; L170-D445 WeakPolarHBondContact CD1-OD1 3.49Å; R441-D445 WeakPolarHBondContact O-CB 3.47Å; R441-D445 PolarHBondContact O-N 3.14Å; D445-M448 PolarHBondContact O-N 2.99Å; D445-A449 WeakPolarHBondContact O-CB 3.39Å; D445-A449 PolarHBondContact O-N 3.44Å
446	S	86.1	Confident	83	Confident	74 Å²	74	64.6 Å²	64.6	52%	0.517	34%	0.337	S	S	.	.	H	α-helix	trans	-69	-39.9	173.4	62	0	0	0	0	112.3	A442 A443 A449 L450	A442-S446 PolarHBondContact O-N 3.42Å; A443-S446 PolarHBondContact O-OG 2.87Å; A443-S446 VanDerWaalsContact O-OG 3.07Å; S446-A449 PolarHBondContact O-N 2.96Å; S446-L450 PolarHBondContact O-N 3.11Å
447	V	90.3	Very high	85	Confident	67 Å²	67	61.8 Å²	61.8	41%	0.406	32%	0.323	S	S	.	.	H	α-helix	trans	-64.8	-40.8	172.3	175.8	0	0	0	0	111	A443 A444 L450 L451	A443-V447 WeakPolarHBondContact O-CG2 3.18Å; A444-V447 PolarHBondContact O-N 3.38Å; V447-L450 PolarHBondContact O-N 3.13Å; V447-L451 HydrophobicContact CG1-CD1 4.19Å; V447-L451 WeakPolarHBondContact O-CG 3.39Å; V447-L451 PolarHBondContact O-N 3.13Å
448	M	90.3	Very high	86.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-65.5	-36.1	174.1	-71.9	-68	155.2	0	0	112.5	P146 F147 F168 L170 A444 D445 L451 R452	P146-M448 HydrophobicContact CB-CE 3.82Å; P146-M448 HydrophobicContact CB-SD 3.99Å; P146-M448 HydrophobicContact CG-CE 3.72Å; P146-M448 HydrophobicContact CG-SD 4.34Å; F147-M448 HydrophobicContact CD1-CE 3.42Å; F147-M448 VanDerWaalsContact CD1-CE 3.42Å; F147-M448 HydrophobicContact CD2-CE 4.07Å; F147-M448 HydrophobicContact CE1-CE 3.42Å; F147-M448 VanDerWaalsContact CE1-CE 3.42Å; F147-M448 HydrophobicContact CE2-CE 4.07Å; F147-M448 HydrophobicContact CG-CE 3.76Å; F147-M448 HydrophobicContact CZ-CE 3.75Å; F168-M448 HydrophobicContact CB-SD 3.84Å; F168-M448 HydrophobicContact CD1-SD 4.21Å; L170-M448 HydrophobicContact CD2-CE 4Å; L170-M448 HydrophobicContact CD2-CG 3.52Å; L170-M448 HydrophobicContact CD2-SD 4.4Å; L170-M448 HydrophobicContact CG-CG 4.09Å; A444-M448 WeakPolarHBondContact O-CB 3.33Å; A444-M448 VanDerWaalsContact O-CG 3.29Å; A444-M448 WeakPolarHBondContact O-CG 3.35Å; A444-M448 PolarHBondContact O-N 3.02Å; D445-M448 PolarHBondContact O-N 2.99Å; M448-L451 HydrophobicContact CE-CD1 4.32Å; M448-L451 PolarHBondContact O-N 2.94Å; M448-L451 HydrophobicContact SD-CD1 4.2Å; M448-R452 WeakPolarHBondContact O-CG 3.36Å; M448-R452 PolarHBondContact O-N 3.19Å
449	A	91.2	Very high	87.8	Confident	38 Å²	38	52.3 Å²	52.3	31%	0.314	27%	0.272	S	S	.	.	H	α-helix	trans	-62.6	-43.7	173.5	0	0	0	0	0	111.7	D445 S446 R452 E453	D445-A449 WeakPolarHBondContact O-CB 3.39Å; D445-A449 PolarHBondContact O-N 3.44Å; S446-A449 PolarHBondContact O-N 2.96Å; A449-R452 PolarHBondContact O-N 2.98Å; A449-E453 PolarHBondContact O-N 2.88Å
450	L	92.8	Very high	89	Confident	40 Å²	40	43.4 Å²	43.4	21%	0.209	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-44.1	173.2	179.1	62.7	0	0	0	111.9	S446 V447 R452 E453 L454 L476 H480	S446-L450 PolarHBondContact O-N 3.11Å; V447-L450 PolarHBondContact O-N 3.13Å; L450-R452 VanDerWaalsContact C-N 3.31Å; L450-R452 PolarHBondContact O-N 3.38Å; L450-E453 PolarHBondContact O-N 3.35Å; L450-L454 HydrophobicContact CD1-CD1 4.03Å; L450-L454 HydrophobicContact CD1-CG 4.17Å; L450-L454 HydrophobicContact CD2-CD1 4.44Å; L450-L454 HydrophobicContact CG-CD1 3.77Å; L450-L454 HydrophobicContact CG-CG 4.36Å; L450-L454 WeakPolarHBondContact O-CB 3.45Å; L450-L454 VanDerWaalsContact O-CG 3.28Å; L450-L454 WeakPolarHBondContact O-CG 3.14Å; L450-L454 PolarHBondContact O-N 3.01Å; L450-L476 HydrophobicContact CD1-CD2 4.04Å; L450-H480 HydrophobicContact CD1-CB 4.07Å
451	L	93.9	Very high	90.2	Very high	27 Å²	27	38.4 Å²	38.4	14%	0.141	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-31.5	176.7	-72	171.7	0	0	0	113	W149 F168 V447 M448 G455	W149-L451 HydrophobicContact CE3-CD2 4.22Å; F168-L451 HydrophobicContact CB-CB 4.4Å; F168-L451 HydrophobicContact CD1-CB 3.74Å; F168-L451 HydrophobicContact CD1-CD1 4.06Å; F168-L451 HydrophobicContact CD1-CG 4.47Å; F168-L451 HydrophobicContact CD2-CB 4.21Å; F168-L451 WeakPolarHBondContact CD2-O 3.45Å; F168-L451 HydrophobicContact CE1-CB 4.04Å; F168-L451 HydrophobicContact CE1-CD1 4.28Å; F168-L451 HydrophobicContact CE2-CB 4.47Å; F168-L451 WeakPolarHBondContact CE2-O 3.45Å; F168-L451 HydrophobicContact CG-CB 3.85Å; F168-L451 HydrophobicContact CZ-CB 4.4Å; V447-L451 HydrophobicContact CG1-CD1 4.19Å; V447-L451 WeakPolarHBondContact O-CG 3.39Å; V447-L451 PolarHBondContact O-N 3.13Å; M448-L451 HydrophobicContact CE-CD1 4.32Å; M448-L451 PolarHBondContact O-N 2.94Å; M448-L451 HydrophobicContact SD-CD1 4.2Å; L451-G455 WeakPolarHBondContact O-CA 3.43Å; L451-G455 PolarHBondContact O-N 2.84Å
452	R	94.2	Very high	91.1	Very high	61 Å²	61	34.6 Å²	34.6	23%	0.23	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-51.4	172.7	-75.3	-174	-66.4	-97.5	4.9	112	F168 M448 A449 L450 G455 R456	F168-R452 HydrophobicContact CB-CG 3.7Å; F168-R452 HydrophobicContact CD2-CG 4.31Å; F168-R452 HydrophobicContact CG-CG 4.47Å; F168-R452 PolarHBondContact O-NH1 3.25Å; M448-R452 WeakPolarHBondContact O-CG 3.36Å; M448-R452 PolarHBondContact O-N 3.19Å; A449-R452 PolarHBondContact O-N 2.98Å; L450-R452 VanDerWaalsContact C-N 3.31Å; L450-R452 PolarHBondContact O-N 3.38Å; R452-G455 WeakPolarHBondContact O-CA 3.28Å; R452-G455 PolarHBondContact O-N 3.02Å; R452-R456 VanDerWaalsContact O-CG 3.28Å; R452-R456 WeakPolarHBondContact O-CG 3.34Å; R452-R456 PolarHBondContact O-N 3.32Å
453	E	94.5	Very high	91.7	Very high	60 Å²	60	33 Å²	33	28%	0.28	19%	0.186	S	C	.	.	H	α-helix	trans	-70	-39.4	-178.8	-56.6	-50.7	150.2	0	0	112.5	A449 L450 G455 R456 G457 I472 L476	A449-E453 PolarHBondContact O-N 2.88Å; L450-E453 PolarHBondContact O-N 3.35Å; E453-G455 VanDerWaalsContact C-N 3.28Å; E453-G455 PolarHBondContact O-N 2.98Å; E453-R456 VanDerWaalsContact CD-NH1 3.28Å; E453-R456 PolarHBondContact O-N 3.44Å; E453-R456 IonicContact OE1-CZ 2.66Å; E453-R456 IonicContact OE1-NE 3.27Å; E453-R456 IonicContact OE1-NH1 3.86Å; E453-R456 PolarHBondContact OE1-NH1 2.93Å; E453-R456 WeakPolarHBondContact OE2-CD 3.48Å; E453-R456 IonicContact OE2-CZ 2.64Å; E453-R456 IonicContact OE2-NE 2.71Å; E453-R456 IonicContact OE2-NH1 2.78Å; E453-R456 PolarHBondContact OE2-NH1 3.3Å; E453-G457 PolarHBondContact O-N 3.37Å; E453-I472 WeakPolarHBondContact O-CG2 3.43Å; E453-L476 HydrophobicContact CB-CD2 3.84Å
454	L	95.4	Very high	92.2	Very high	24 Å²	24	31.4 Å²	31.4	13%	0.126	17%	0.17	C	C	.	.	H	α-helix	trans	-58.9	-41.8	168.8	-70.9	170.1	0	0	0	111.3	W149 L450 Y458 L473 L476 W485 V486	W149-L454 HydrophobicContact CH2-CB 4.43Å; W149-L454 HydrophobicContact CZ3-CB 4.45Å; L450-L454 HydrophobicContact CD1-CD1 4.03Å; L450-L454 HydrophobicContact CD1-CG 4.17Å; L450-L454 HydrophobicContact CD2-CD1 4.44Å; L450-L454 HydrophobicContact CG-CD1 3.77Å; L450-L454 HydrophobicContact CG-CG 4.36Å; L450-L454 WeakPolarHBondContact O-CB 3.45Å; L450-L454 VanDerWaalsContact O-CG 3.28Å; L450-L454 WeakPolarHBondContact O-CG 3.14Å; L450-L454 PolarHBondContact O-N 3.01Å; L454-Y458 WeakPolarHBondContact O-CB 3.32Å; L454-Y458 PolarHBondContact O-N 3.17Å; L454-L473 HydrophobicContact CD2-CD2 4.38Å; L454-L476 HydrophobicContact CD2-CD1 3.6Å; L454-L476 HydrophobicContact CG-CD1 4.43Å; L454-W485 HydrophobicContact CD2-CE3 4.29Å; L454-W485 HydrophobicContact CD2-CZ3 3.77Å; L454-V486 HydrophobicContact CD2-CG2 3.74Å
455	G	94.4	Very high	92.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.1	-49.6	176.9	0	0	0	0	0	112.5	F152 L451 R452 E453 Y458 Q459	F152-G455 WeakPolarHBondContact CZ-O 3.29Å; L451-G455 WeakPolarHBondContact O-CA 3.43Å; L451-G455 PolarHBondContact O-N 2.84Å; R452-G455 WeakPolarHBondContact O-CA 3.28Å; R452-G455 PolarHBondContact O-N 3.02Å; E453-G455 VanDerWaalsContact C-N 3.28Å; E453-G455 PolarHBondContact O-N 2.98Å; G455-Y458 PolarHBondContact O-N 3.22Å; G455-Q459 WeakPolarHBondContact O-CB 3.46Å; G455-Q459 PolarHBondContact O-N 3.25Å
456	R	94.7	Very high	93.1	Very high	86 Å²	86	28.5 Å²	28.5	33%	0.325	16%	0.155	S	C	.	.	H	α-helix	trans	-59.4	-50.2	176.1	-70.2	160.8	168.1	-157.8	-5.6	111.4	P164 D165 R452 E453 Y458 Q459 A460 I472	P164-R456 HydrophobicContact CB-CG 4.07Å; P164-R456 HydrophobicContact CG-CB 4.48Å; P164-R456 HydrophobicContact CG-CG 3.82Å; D165-R456 VanDerWaalsContact CG-NH2 3.31Å; D165-R456 IonicContact OD1-CZ 3.81Å; D165-R456 IonicContact OD1-NE 2.7Å; D165-R456 PolarHBondContact OD1-NE 3.39Å; D165-R456 IonicContact OD1-NH2 3.98Å; D165-R456 PolarHBondContact OD1-NH2 3.05Å; D165-R456 VanDerWaalsContact OD1-NH2 3.12Å; D165-R456 IonicContact OD2-CZ 3.51Å; D165-R456 IonicContact OD2-NE 2.86Å; D165-R456 IonicContact OD2-NH2 2.9Å; D165-R456 PolarHBondContact OD2-NH2 3.48Å; R452-R456 VanDerWaalsContact O-CG 3.28Å; R452-R456 WeakPolarHBondContact O-CG 3.34Å; R452-R456 PolarHBondContact O-N 3.32Å; E453-R456 VanDerWaalsContact CD-NH1 3.28Å; E453-R456 PolarHBondContact O-N 3.44Å; E453-R456 IonicContact OE1-CZ 2.66Å; E453-R456 IonicContact OE1-NE 3.27Å; E453-R456 IonicContact OE1-NH1 3.86Å; E453-R456 PolarHBondContact OE1-NH1 2.93Å; E453-R456 WeakPolarHBondContact OE2-CD 3.48Å; E453-R456 IonicContact OE2-CZ 2.64Å; E453-R456 IonicContact OE2-NE 2.71Å; E453-R456 IonicContact OE2-NH1 2.78Å; E453-R456 PolarHBondContact OE2-NH1 3.3Å; R456-Y458 PolarHBondContact O-N 3.29Å; R456-Q459 PolarHBondContact O-N 3.12Å; R456-A460 WeakPolarHBondContact O-CB 3.36Å; R456-A460 PolarHBondContact O-N 3.25Å; R456-I472 HydrophobicContact CB-CD1 4.33Å; R456-I472 HydrophobicContact CB-CG2 4.23Å
457	G	95.1	Very high	93.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.5	-41.6	178.1	0	0	0	0	0	113	E453 L461 A469	E453-G457 PolarHBondContact O-N 3.37Å; G457-L461 WeakPolarHBondContact O-CB 3.46Å; G457-L461 PolarHBondContact O-N 3.46Å; G457-A469 WeakPolarHBondContact O-CB 3.48Å
458	Y	95.4	Very high	93.6	Very high	3 Å²	3	33.6 Å²	33.6	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-70.3	-38.7	177.5	-170.7	-98.8	0	0	0	113	W149 F152 Q153 C156 H157 L454 G455 R456 L461 C462 W485 H489	W149-Y458 HydrophobicContact CH2-CD1 4.36Å; W149-Y458 HydrophobicContact CH2-CG 4.12Å; W149-Y458 AromaticContact CZ2-CD1 3.92Å; W149-Y458 HydrophobicContact CZ2-CD1 3.92Å; W149-Y458 HydrophobicContact CZ2-CD2 4.19Å; W149-Y458 AromaticContact CZ2-CG 3.73Å; W149-Y458 HydrophobicContact CZ2-CG 3.73Å; F152-Y458 HydrophobicContact CE1-CD1 4.26Å; Q153-Y458 HydrophobicContact CB-CE1 4.35Å; Q153-Y458 HydrophobicContact CG-CE1 3.67Å; Q153-Y458 VanDerWaalsContact CG-OH 3.23Å; Q153-Y458 WeakPolarHBondContact CG-OH 3.48Å; Q153-Y458 PolarHBondContact NE2-OH 3.37Å; C156-Y458 HydrophobicContact CB-CD1 4.12Å; C156-Y458 HydrophobicContact CB-CE1 3.92Å; H157-Y458 PolarHBondContact NE2-OH 3.12Å; L454-Y458 WeakPolarHBondContact O-CB 3.32Å; L454-Y458 PolarHBondContact O-N 3.17Å; G455-Y458 PolarHBondContact O-N 3.22Å; R456-Y458 PolarHBondContact O-N 3.29Å; Y458-L461 PolarHBondContact O-N 3.45Å; Y458-C462 WeakPolarHBondContact CE1-SG 3.3Å; Y458-C462 WeakPolarHBondContact O-CB 3.44Å; Y458-C462 PolarHBondContact O-N 3.45Å; Y458-C462 PolarHBondContact O-SG 3.19Å; Y458-W485 AromaticContact CD2-CH2 3.79Å; Y458-W485 HydrophobicContact CD2-CH2 3.79Å; Y458-W485 AromaticContact CD2-CZ2 3.82Å; Y458-W485 HydrophobicContact CD2-CZ2 3.82Å; Y458-W485 HydrophobicContact CE2-CZ2 4.21Å; Y458-W485 HydrophobicContact CG-CH2 4.32Å; Y458-H489 AromaticContact CD2-CD2 3.86Å; Y458-H489 AromaticContact CE2-CD2 3.62Å; Y458-H489 AromaticContact CE2-NE2 3.52Å
459	Q	94.6	Very high	93.9	Very high	42 Å²	42	33.6 Å²	33.6	20%	0.196	16%	0.16	C	C	.	.	H	α-helix	trans	-63	-46.8	174.2	-176.2	-167.8	45.2	0	0	110.8	F152 P162 G455 R456 L461 C462 S463	F152-Q459 HydrophobicContact CZ-CB 4.44Å; P162-Q459 PolarHBondContact O-NE2 3.35Å; G455-Q459 WeakPolarHBondContact O-CB 3.46Å; G455-Q459 PolarHBondContact O-N 3.25Å; R456-Q459 PolarHBondContact O-N 3.12Å; Q459-L461 PolarHBondContact O-N 3.45Å; Q459-C462 CarbonylContact O-C 3.48Å; Q459-C462 PolarHBondContact O-N 2.91Å; Q459-C462 VanDerWaalsContact O-N 3.14Å; Q459-S463 PolarHBondContact O-N 3.1Å; Q459-S463 PolarHBondContact O-OG 3.41Å
460	A	94.5	Very high	94.1	Very high	6 Å²	6	32.3 Å²	32.3	5%	0.05	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-42.7	176	0	0	0	0	0	111.9	R456 S463 Y464 S465 E468 A469	R456-A460 WeakPolarHBondContact O-CB 3.36Å; R456-A460 PolarHBondContact O-N 3.25Å; A460-S463 WeakPolarHBondContact CA-OG 3.47Å; A460-S463 CarbonylContact O-C 3.55Å; A460-S463 PolarHBondContact O-N 3.48Å; A460-S463 PolarHBondContact O-OG 3.44Å; A460-Y464 PolarHBondContact O-N 3.13Å; A460-S465 WeakPolarHBondContact O-CB 3.45Å; A460-S465 PolarHBondContact O-N 3.31Å; A460-E468 HydrophobicContact CB-CG 4.21Å; A460-A469 HydrophobicContact CB-CB 3.97Å
461	L	94.3	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-43.3	173.1	179.5	57.9	0	0	0	111.4	G457 Y458 Q459 S463 Y464 A469 H489 R492 A493	G457-L461 WeakPolarHBondContact O-CB 3.46Å; G457-L461 PolarHBondContact O-N 3.46Å; Y458-L461 PolarHBondContact O-N 3.45Å; Q459-L461 PolarHBondContact O-N 3.45Å; L461-S463 VanDerWaalsContact C-N 3.28Å; L461-S463 PolarHBondContact O-N 3.02Å; L461-Y464 PolarHBondContact O-N 3.33Å; L461-A469 HydrophobicContact CB-CB 3.9Å; L461-H489 HydrophobicContact CD2-CB 3.82Å; L461-H489 WeakPolarHBondContact CD2-O 2.99Å; L461-R492 HydrophobicContact CD1-CG 4.44Å; L461-A493 HydrophobicContact CD1-CB 3.84Å
462	C	92.6	Very high	94.3	Very high	6 Å²	6	36.3 Å²	36.3	4%	0.041	17%	0.169	C	C	.	.	H	α-helix	trans	-67.7	-24.1	175.8	-70.7	0	0	0	0	113	C156 Y458 Q459 Y464 R618	C156-C462 HydrophobicContact CB-CB 3.92Å; Y458-C462 WeakPolarHBondContact CE1-SG 3.3Å; Y458-C462 WeakPolarHBondContact O-CB 3.44Å; Y458-C462 PolarHBondContact O-N 3.45Å; Y458-C462 PolarHBondContact O-SG 3.19Å; Q459-C462 CarbonylContact O-C 3.48Å; Q459-C462 PolarHBondContact O-N 2.91Å; Q459-C462 VanDerWaalsContact O-N 3.14Å; C462-Y464 VanDerWaalsContact C-N 3.3Å; C462-R618 PolarHBondContact O-NH1 3.46Å; C462-R618 PolarHBondContact O-NH2 3.17Å
463	S	91.8	Very high	94.3	Very high	25 Å²	25	33.4 Å²	33.4	18%	0.175	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	5.8	169.8	62.7	0	0	0	0	114.1	Q459 A460 L461 S465	Q459-S463 PolarHBondContact O-N 3.1Å; Q459-S463 PolarHBondContact O-OG 3.41Å; A460-S463 WeakPolarHBondContact CA-OG 3.47Å; A460-S463 CarbonylContact O-C 3.55Å; A460-S463 PolarHBondContact O-N 3.48Å; A460-S463 PolarHBondContact O-OG 3.44Å; L461-S463 VanDerWaalsContact C-N 3.28Å; L461-S463 PolarHBondContact O-N 3.02Å; S463-S465 PolarHBondContact O-N 2.85Å; S463-S465 PolarHBondContact OG-OG 2.98Å
464	Y	93.1	Very high	94.3	Very high	13 Å²	13	34 Å²	34	5%	0.051	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	24.3	-174.4	-56.2	-92.3	0	0	0	113.7	A460 L461 C462 C466 E496 Y620 I649 N650 Q652	A460-Y464 PolarHBondContact O-N 3.13Å; L461-Y464 PolarHBondContact O-N 3.33Å; C462-Y464 VanDerWaalsContact C-N 3.3Å; Y464-C466 PolarHBondContact O-N 3.38Å; Y464-E496 VanDerWaalsContact CE1-OE2 3.29Å; Y464-E496 WeakPolarHBondContact CE1-OE2 3.35Å; Y464-Y620 AromaticContact CE1-CD1 3.9Å; Y464-Y620 HydrophobicContact CE1-CD1 3.9Å; Y464-Y620 AromaticContact CE1-CE1 3.75Å; Y464-Y620 HydrophobicContact CE1-CE1 3.75Å; Y464-Y620 AromaticContact CZ-CD1 3.85Å; Y464-I649 WeakPolarHBondContact CD2-O 3.19Å; Y464-I649 HydrophobicContact CE2-CG2 3.8Å; Y464-I649 WeakPolarHBondContact CE2-O 3.31Å; Y464-N650 HydrophobicContact CD1-CB 3.84Å; Y464-N650 VanDerWaalsContact CD1-ND2 3.33Å; Y464-N650 WeakPolarHBondContact CD1-ND2 3.44Å; Y464-N650 HydrophobicContact CD2-CB 3.95Å; Y464-N650 HydrophobicContact CE1-CB 4.1Å; Y464-N650 HydrophobicContact CE2-CB 4.22Å; Y464-N650 HydrophobicContact CG-CB 3.77Å; Y464-Q652 VanDerWaalsContact O-CD 3.28Å; Y464-Q652 PolarHBondContact O-OE1 3.5Å
465	S	92.8	Very high	94.3	Very high	22 Å²	22	37.2 Å²	37.2	15%	0.154	19%	0.19	C	C	.	.			trans	-78.3	56.4	167.7	-58.5	0	0	0	0	110.1	A460 S463 R467 E468 A469	A460-S465 WeakPolarHBondContact O-CB 3.45Å; A460-S465 PolarHBondContact O-N 3.31Å; S463-S465 PolarHBondContact O-N 2.85Å; S463-S465 PolarHBondContact OG-OG 2.98Å; S465-R467 VanDerWaalsContact C-N 3.34Å; S465-R467 PolarHBondContact O-N 2.77Å; S465-E468 WeakPolarHBondContact CB-OE2 3.48Å; S465-E468 WeakPolarHBondContact O-CB 3.22Å; S465-E468 PolarHBondContact O-N 2.97Å; S465-E468 PolarHBondContact OG-OE2 3.07Å; S465-A469 PolarHBondContact O-N 3.12Å
466	C	93.3	Very high	94.3	Very high	4 Å²	4	37.8 Å²	37.8	3%	0.027	19%	0.194	C	C	.	.	H	α-helix	trans	-62.6	-35.6	-161.1	-61.5	0	0	0	0	114	Y464 A469 I470 A493 L497	Y464-C466 PolarHBondContact O-N 3.38Å; C466-A469 PolarHBondContact O-N 3.3Å; C466-I470 WeakPolarHBondContact O-CD1 3.39Å; C466-I470 VanDerWaalsContact O-CG1 3.27Å; C466-I470 WeakPolarHBondContact O-CG1 3.26Å; C466-I470 PolarHBondContact O-N 3.34Å; C466-A493 HydrophobicContact CB-CB 4.28Å; C466-L497 HydrophobicContact CB-CD1 3.86Å; C466-L497 HydrophobicContact CB-CD2 3.95Å; C466-L497 HydrophobicContact CB-CG 3.61Å
467	R	92.9	Very high	94.3	Very high	144 Å²	144	37 Å²	37	54%	0.543	20%	0.199	S	C	.	.	H	α-helix	trans	-65.7	-38.2	175.7	-61.7	-178.7	-174	151.9	6.8	112.5	S465 N471 L497	S465-R467 VanDerWaalsContact C-N 3.34Å; S465-R467 PolarHBondContact O-N 2.77Å; R467-N471 VanDerWaalsContact O-CG 3.25Å; R467-N471 PolarHBondContact O-N 3.11Å; R467-N471 PolarHBondContact O-ND2 3.11Å; R467-L497 HydrophobicContact CG-CD1 3.93Å; R467-L497 HydrophobicContact CG-CD2 4.13Å
468	E	94.1	Very high	94.2	Very high	105 Å²	105	41.4 Å²	41.4	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-68.1	-44.5	175.8	177.2	179.4	-150.4	0	0	110.8	A460 S465 I470 N471 I472	A460-E468 HydrophobicContact CB-CG 4.21Å; S465-E468 WeakPolarHBondContact CB-OE2 3.48Å; S465-E468 WeakPolarHBondContact O-CB 3.22Å; S465-E468 PolarHBondContact O-N 2.97Å; S465-E468 PolarHBondContact OG-OE2 3.07Å; E468-I470 PolarHBondContact O-N 3Å; E468-N471 PolarHBondContact O-N 3.42Å; E468-I472 HydrophobicContact CG-CD1 3.85Å; E468-I472 WeakPolarHBondContact O-CG1 3.49Å; E468-I472 PolarHBondContact O-N 3.11Å
469	A	95.6	Very high	94.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-43.3	175.3	0	0	0	0	0	112.6	G457 A460 L461 S465 C466 I472 L473	G457-A469 WeakPolarHBondContact O-CB 3.48Å; A460-A469 HydrophobicContact CB-CB 3.97Å; L461-A469 HydrophobicContact CB-CB 3.9Å; S465-A469 PolarHBondContact O-N 3.12Å; C466-A469 PolarHBondContact O-N 3.3Å; A469-I472 PolarHBondContact O-N 2.03Å; A469-L473 WeakPolarHBondContact O-CB 3.48Å; A469-L473 VanDerWaalsContact O-CG 3.26Å; A469-L473 WeakPolarHBondContact O-CG 3.47Å; A469-L473 PolarHBondContact O-N 3.43Å
470	I	95.8	Very high	94.1	Very high	11 Å²	11	50.1 Å²	50.1	6%	0.056	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-46.7	175.3	-69	160.5	0	0	0	110.6	C466 E468 I472 L473 T474 V490 A493 Y494 L497	C466-I470 WeakPolarHBondContact O-CD1 3.39Å; C466-I470 VanDerWaalsContact O-CG1 3.27Å; C466-I470 WeakPolarHBondContact O-CG1 3.26Å; C466-I470 PolarHBondContact O-N 3.34Å; E468-I470 PolarHBondContact O-N 3Å; I470-I472 PolarHBondContact O-N 2.73Å; I470-L473 PolarHBondContact O-N 3.35Å; I470-T474 VanDerWaalsContact O-CB 3.23Å; I470-T474 WeakPolarHBondContact O-CB 3.46Å; I470-T474 PolarHBondContact O-N 3.02Å; I470-T474 PolarHBondContact O-OG1 3.02Å; I470-V490 HydrophobicContact CG1-CG1 4.31Å; I470-A493 HydrophobicContact CD1-CB 3.85Å; I470-A493 HydrophobicContact CG1-CB 3.54Å; I470-Y494 HydrophobicContact CD1-CD1 3.97Å; I470-Y494 HydrophobicContact CD1-CD2 3.99Å; I470-Y494 HydrophobicContact CD1-CE1 3.89Å; I470-Y494 HydrophobicContact CD1-CE2 3.91Å; I470-Y494 HydrophobicContact CD1-CG 4.04Å; I470-Y494 HydrophobicContact CG1-CD2 4.39Å; I470-Y494 HydrophobicContact CG1-CE2 4.17Å; I470-Y494 HydrophobicContact CG2-CE2 4.12Å; I470-L497 HydrophobicContact CD1-CD1 3.71Å
471	N	96.2	Very high	94.1	Very high	117 Å²	117	52.2 Å²	52.2	63%	0.626	28%	0.276	S	S	*	.	H	α-helix	trans	-62	-43.5	-179.8	-69.7	-12.6	0	0	0	112.4	R467 E468 S475	R467-N471 VanDerWaalsContact O-CG 3.25Å; R467-N471 PolarHBondContact O-N 3.11Å; R467-N471 PolarHBondContact O-ND2 3.11Å; E468-N471 PolarHBondContact O-N 3.42Å; N471-S475 PolarHBondContact O-N 3.39Å
472	I	95.4	Very high	94.1	Very high	33 Å²	33	56.1 Å²	56.1	17%	0.169	30%	0.296	C	S	.	.	H	α-helix	trans	-69.4	-42.3	179.1	-63.4	164.7	0	0	0	111.3	E453 R456 E468 A469 I470 T474 S475	E453-I472 WeakPolarHBondContact O-CG2 3.43Å; R456-I472 HydrophobicContact CB-CD1 4.33Å; R456-I472 HydrophobicContact CB-CG2 4.23Å; E468-I472 HydrophobicContact CG-CD1 3.85Å; E468-I472 WeakPolarHBondContact O-CG1 3.49Å; E468-I472 PolarHBondContact O-N 3.11Å; A469-I472 PolarHBondContact O-N 2.03Å; I470-I472 PolarHBondContact O-N 2.73Å; I472-T474 VanDerWaalsContact C-N 3.34Å; I472-S475 PolarHBondContact O-N 3.23Å; I472-S475 PolarHBondContact O-OG 2.76Å
473	L	94.6	Very high	94.3	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-71.6	-29.7	179.2	-68	175.8	0	0	0	112.2	L454 A469 I470 L476 Y481 V486 H489 V490	L454-L473 HydrophobicContact CD2-CD2 4.38Å; A469-L473 WeakPolarHBondContact O-CB 3.48Å; A469-L473 VanDerWaalsContact O-CG 3.26Å; A469-L473 WeakPolarHBondContact O-CG 3.47Å; A469-L473 PolarHBondContact O-N 3.43Å; I470-L473 PolarHBondContact O-N 3.35Å; L473-L476 HydrophobicContact CD2-CD1 3.95Å; L473-L476 WeakPolarHBondContact O-CB 3.32Å; L473-L476 WeakPolarHBondContact O-CD1 3.41Å; L473-L476 WeakPolarHBondContact O-CG 3.48Å; L473-Y481 WeakPolarHBondContact O-CD2 3.35Å; L473-V486 HydrophobicContact CB-CG1 4.21Å; L473-V486 HydrophobicContact CD2-CG1 4.45Å; L473-H489 HydrophobicContact CD1-CB 4.16Å; L473-V490 HydrophobicContact CB-CG2 3.59Å; L473-V490 HydrophobicContact CD1-CG2 3.75Å; L473-V490 HydrophobicContact CG-CG2 4.33Å
474	T	94.4	Very high	94.4	Very high	73 Å²	73	56.9 Å²	56.9	45%	0.448	30%	0.3	S	S	.	.	H	α-helix	trans	-79.8	-19.1	178.5	-50.4	0	0	0	0	113.1	I470 I472 L476 Y481	I470-T474 VanDerWaalsContact O-CB 3.23Å; I470-T474 WeakPolarHBondContact O-CB 3.46Å; I470-T474 PolarHBondContact O-N 3.02Å; I470-T474 PolarHBondContact O-OG1 3.02Å; I472-T474 VanDerWaalsContact C-N 3.34Å; T474-L476 VanDerWaalsContact C-N 3.28Å; T474-Y481 HydrophobicContact CG2-CE2 4.35Å
475	S	94.8	Very high	94.5	Very high	90 Å²	90	59 Å²	59	63%	0.629	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.4	173.3	69	0	0	0	0	113.8	N471 I472	N471-S475 PolarHBondContact O-N 3.39Å; I472-S475 PolarHBondContact O-N 3.23Å; I472-S475 PolarHBondContact O-OG 2.76Å
476	L	94.8	Very high	94.7	Very high	13 Å²	13	58 Å²	58	7%	0.068	30%	0.301	C	S	.	.	S	Bend	trans	-63.1	150	175.8	-67.2	174.1	0	0	0	111.9	L450 E453 L454 L473 T474 V486	L450-L476 HydrophobicContact CD1-CD2 4.04Å; E453-L476 HydrophobicContact CB-CD2 3.84Å; L454-L476 HydrophobicContact CD2-CD1 3.6Å; L454-L476 HydrophobicContact CG-CD1 4.43Å; L473-L476 HydrophobicContact CD2-CD1 3.95Å; L473-L476 WeakPolarHBondContact O-CB 3.32Å; L473-L476 WeakPolarHBondContact O-CD1 3.41Å; L473-L476 WeakPolarHBondContact O-CG 3.48Å; T474-L476 VanDerWaalsContact C-N 3.28Å; L476-V486 HydrophobicContact CD1-CG1 4.17Å; L476-V486 HydrophobicContact CD1-CG2 3.99Å
477	P	94.9	Very high	94.9	Very high	69 Å²	69	58 Å²	58	45%	0.448	30%	0.301	S	S	.	.			trans	-54.3	141.9	173.2	-25.1	34.1	0	0	0	111.7	Q479 H480 Y481	P477-Q479 PolarHBondContact O-N 3.16Å; P477-H480 WeakPolarHBondContact O-CA 3.43Å; P477-H480 PolarHBondContact O-N 3.36Å; P477-Y481 PolarHBondContact O-N 2.64Å
478	P	92	Very high	95	Very high	93 Å²	93	51.4 Å²	51.4	60%	0.604	28%	0.277	S	S	*	.	H	α-helix	trans	-61.3	-26.7	-169.7	22.1	-33.7	0	0	0	113.8	H480 N482	P478-H480 VanDerWaalsContact C-N 3.26Å; P478-H480 PolarHBondContact O-N 3.47Å; P478-N482 WeakPolarHBondContact O-CB 3.48Å; P478-N482 VanDerWaalsContact O-CG 3.27Å; P478-N482 PolarHBondContact O-N 2.88Å; P478-N482 VanDerWaalsContact O-N 3.1Å; P478-N482 PolarHBondContact O-ND2 3.11Å
479	Q	93.6	Very high	95.1	Very high	160 Å²	160	47.4 Å²	47.4	75%	0.748	26%	0.258	S	S	*	.	H	α-helix	trans	-64	-29.4	173.6	-63.7	178	-3.1	0	0	113.1	P477	P477-Q479 PolarHBondContact O-N 3.16Å
480	H	94.1	Very high	95.2	Very high	67 Å²	67	47.4 Å²	47.4	31%	0.31	26%	0.258	S	S	.	.	H	α-helix	trans	-96.6	-35.9	177.9	-57	-48.4	0	0	0	111.7	L450 P477 P478 N482 T483 V486	L450-H480 HydrophobicContact CD1-CB 4.07Å; P477-H480 WeakPolarHBondContact O-CA 3.43Å; P477-H480 PolarHBondContact O-N 3.36Å; P478-H480 VanDerWaalsContact C-N 3.26Å; P478-H480 PolarHBondContact O-N 3.47Å; H480-N482 VanDerWaalsContact C-N 3.32Å; H480-N482 PolarHBondContact O-N 3.33Å; H480-T483 WeakPolarHBondContact O-CB 3.27Å; H480-T483 WeakPolarHBondContact O-CG2 3.43Å; H480-T483 PolarHBondContact O-N 3.36Å; H480-T483 PolarHBondContact O-OG1 2.86Å; H480-V486 WeakPolarHBondContact O-CG2 3.24Å
481	Y	94.8	Very high	95.2	Very high	51 Å²	51	46.9 Å²	46.9	20%	0.2	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-43.8	173.6	179	-97.5	0	0	0	112.1	L473 T474 P477 T483 V486 L487 V490	L473-Y481 WeakPolarHBondContact O-CD2 3.35Å; T474-Y481 HydrophobicContact CG2-CE2 4.35Å; P477-Y481 PolarHBondContact O-N 2.64Å; Y481-T483 PolarHBondContact O-N 2.88Å; Y481-T483 VanDerWaalsContact O-N 3.09Å; Y481-V486 HydrophobicContact CD2-CG1 4.06Å; Y481-L487 HydrophobicContact CD1-CD2 4.23Å; Y481-L487 HydrophobicContact CE1-CD2 3.63Å; Y481-L487 HydrophobicContact CE2-CD2 4.37Å; Y481-L487 WeakPolarHBondContact O-CG 3.48Å; Y481-V490 HydrophobicContact CE2-CG2 4.42Å
482	N	94.5	Very high	95.2	Very high	81 Å²	81	43.3 Å²	43.3	43%	0.433	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	5.8	-179.9	-68.8	-19.7	0	0	0	114.5	P478 H480	P478-N482 WeakPolarHBondContact O-CB 3.48Å; P478-N482 VanDerWaalsContact O-CG 3.27Å; P478-N482 PolarHBondContact O-N 2.88Å; P478-N482 VanDerWaalsContact O-N 3.1Å; P478-N482 PolarHBondContact O-ND2 3.11Å; H480-N482 VanDerWaalsContact C-N 3.32Å; H480-N482 PolarHBondContact O-N 3.33Å
483	T	96	Very high	95.2	Very high	48 Å²	48	41.8 Å²	41.8	29%	0.294	23%	0.225	S	C	.	.	S	Bend	trans	-73.9	141.1	171.7	62.5	0	0	0	0	110.3	H480 Y481 W485 V486 L487	H480-T483 WeakPolarHBondContact O-CB 3.27Å; H480-T483 WeakPolarHBondContact O-CG2 3.43Å; H480-T483 PolarHBondContact O-N 3.36Å; H480-T483 PolarHBondContact O-OG1 2.86Å; Y481-T483 PolarHBondContact O-N 2.88Å; Y481-T483 VanDerWaalsContact O-N 3.09Å; T483-W485 PolarHBondContact O-N 3.14Å; T483-V486 PolarHBondContact O-N 3.36Å; T483-V486 VanDerWaalsContact O-N 3.1Å; T483-V486 WeakPolarHBondContact OG1-CG2 3.49Å; T483-V486 PolarHBondContact OG1-N 3.44Å; T483-L487 PolarHBondContact O-N 3.35Å
484	G	95.3	Very high	95.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.6	-28.1	178.6	0	0	0	0	0	112.3	T488 E514	G484-T488 WeakPolarHBondContact O-CB 3.35Å; G484-T488 PolarHBondContact O-N 2.96Å; G484-T488 PolarHBondContact O-OG1 2.83Å; G484-E514 VanDerWaalsContact CA-CD 3.47Å; G484-E514 WeakPolarHBondContact CA-OE1 3.41Å; G484-E514 WeakPolarHBondContact CA-OE2 3.39Å; G484-E514 VanDerWaalsContact N-CD 3.33Å; G484-E514 PolarHBondContact N-OE1 2.99Å
485	W	95.5	Very high	95.3	Very high	56 Å²	56	41.2 Å²	41.2	21%	0.212	22%	0.215	C	C	.	.	H	α-helix	trans	-61.4	-52.8	171.2	-170.6	94.7	0	0	0	112.3	W149 L454 Y458 T483 T488 H489	W149-W485 HydrophobicContact CH2-CH2 4.24Å; W149-W485 AromaticContact CZ2-CH2 3.73Å; W149-W485 HydrophobicContact CZ2-CH2 3.73Å; W149-W485 AromaticContact CZ2-CZ2 3.62Å; W149-W485 HydrophobicContact CZ2-CZ2 3.62Å; L454-W485 HydrophobicContact CD2-CE3 4.29Å; L454-W485 HydrophobicContact CD2-CZ3 3.77Å; Y458-W485 AromaticContact CD2-CH2 3.79Å; Y458-W485 HydrophobicContact CD2-CH2 3.79Å; Y458-W485 AromaticContact CD2-CZ2 3.82Å; Y458-W485 HydrophobicContact CD2-CZ2 3.82Å; Y458-W485 HydrophobicContact CE2-CZ2 4.21Å; Y458-W485 HydrophobicContact CG-CH2 4.32Å; T483-W485 PolarHBondContact O-N 3.14Å; W485-T488 PolarHBondContact O-N 3.5Å; W485-H489 AromaticContact CD1-CE1 3.86Å; W485-H489 AromaticContact CD2-CE1 3.82Å; W485-H489 AromaticContact CD2-ND1 3.55Å; W485-H489 AromaticContact CE2-CE1 3.34Å; W485-H489 AromaticContact CE2-ND1 3.5Å; W485-H489 AromaticContact CE3-ND1 3.86Å; W485-H489 AromaticContact CZ2-CE1 3.66Å; W485-H489 AromaticContact CZ2-ND1 3.78Å; W485-H489 AromaticContact NE1-CE1 3.39Å; W485-H489 PolarHBondContact NE1-CE1 3.4Å; W485-H489 AromaticContact NE1-ND1 3.92Å; W485-H489 PolarHBondContact O-N 3.04Å; W485-H489 PolarHBondContact O-ND1 3.36Å
486	V	96.7	Very high	95.1	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-49.4	-179.4	172.4	0	0	0	0	110.2	L454 L473 L476 H480 Y481 T483 T488 H489 V490	L454-V486 HydrophobicContact CD2-CG2 3.74Å; L473-V486 HydrophobicContact CB-CG1 4.21Å; L473-V486 HydrophobicContact CD2-CG1 4.45Å; L476-V486 HydrophobicContact CD1-CG1 4.17Å; L476-V486 HydrophobicContact CD1-CG2 3.99Å; H480-V486 WeakPolarHBondContact O-CG2 3.24Å; Y481-V486 HydrophobicContact CD2-CG1 4.06Å; T483-V486 PolarHBondContact O-N 3.36Å; T483-V486 VanDerWaalsContact O-N 3.1Å; T483-V486 WeakPolarHBondContact OG1-CG2 3.49Å; T483-V486 PolarHBondContact OG1-N 3.44Å; V486-T488 VanDerWaalsContact C-N 3.29Å; V486-T488 PolarHBondContact O-N 3.34Å; V486-H489 PolarHBondContact O-N 2.89Å; V486-V490 HydrophobicContact CG1-CG2 4.13Å; V486-V490 WeakPolarHBondContact O-CG2 3.35Å; V486-V490 PolarHBondContact O-N 2.68Å
487	L	96.3	Very high	94.9	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-35.8	179.4	-66.9	176	0	0	0	112.9	Y481 T483 G491 L506 E509 V510 I513	Y481-L487 HydrophobicContact CD1-CD2 4.23Å; Y481-L487 HydrophobicContact CE1-CD2 3.63Å; Y481-L487 HydrophobicContact CE2-CD2 4.37Å; Y481-L487 WeakPolarHBondContact O-CG 3.48Å; T483-L487 PolarHBondContact O-N 3.35Å; L487-G491 PolarHBondContact O-N 2.71Å; L487-L506 HydrophobicContact CD2-CD2 4.12Å; L487-E509 HydrophobicContact CD1-CG 4.25Å; L487-V510 HydrophobicContact CB-CG2 3.41Å; L487-V510 VanDerWaalsContact CB-CG2 3.41Å; L487-V510 HydrophobicContact CD1-CG2 4.38Å; L487-I513 HydrophobicContact CD1-CD1 3.76Å
488	T	96.6	Very high	94.7	Very high	6 Å²	6	38.8 Å²	38.8	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-42.2	173.1	-63.8	0	0	0	0	111.5	G484 W485 V486 R492 F507 R517	G484-T488 WeakPolarHBondContact O-CB 3.35Å; G484-T488 PolarHBondContact O-N 2.96Å; G484-T488 PolarHBondContact O-OG1 2.83Å; W485-T488 PolarHBondContact O-N 3.5Å; V486-T488 VanDerWaalsContact C-N 3.29Å; V486-T488 PolarHBondContact O-N 3.34Å; T488-R492 WeakPolarHBondContact O-CB 3.4Å; T488-R492 PolarHBondContact O-N 3.46Å; T488-F507 HydrophobicContact CG2-CE1 4.28Å; T488-R517 PolarHBondContact OG1-NE 2.94Å
489	H	95.7	Very high	94.7	Very high	21 Å²	21	38.9 Å²	38.9	10%	0.097	19%	0.19	C	C	.	.	H	α-helix	trans	-76	-34.2	-178.8	-70.8	90.1	0	0	0	112.8	Y458 L461 L473 W485 V486 R492 A493	Y458-H489 AromaticContact CD2-CD2 3.86Å; Y458-H489 AromaticContact CE2-CD2 3.62Å; Y458-H489 AromaticContact CE2-NE2 3.52Å; L461-H489 HydrophobicContact CD2-CB 3.82Å; L461-H489 WeakPolarHBondContact CD2-O 2.99Å; L473-H489 HydrophobicContact CD1-CB 4.16Å; W485-H489 AromaticContact CD1-CE1 3.86Å; W485-H489 AromaticContact CD2-CE1 3.82Å; W485-H489 AromaticContact CD2-ND1 3.55Å; W485-H489 AromaticContact CE2-CE1 3.34Å; W485-H489 AromaticContact CE2-ND1 3.5Å; W485-H489 AromaticContact CE3-ND1 3.86Å; W485-H489 AromaticContact CZ2-CE1 3.66Å; W485-H489 AromaticContact CZ2-ND1 3.78Å; W485-H489 AromaticContact NE1-CE1 3.39Å; W485-H489 PolarHBondContact NE1-CE1 3.4Å; W485-H489 AromaticContact NE1-ND1 3.92Å; W485-H489 PolarHBondContact O-N 3.04Å; W485-H489 PolarHBondContact O-ND1 3.36Å; V486-H489 PolarHBondContact O-N 2.89Å; H489-R492 PolarHBondContact O-N 3.09Å; H489-A493 PolarHBondContact O-N 3.05Å
490	V	96.6	Very high	94.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.9	-43.7	169.7	-178.1	0	0	0	0	110.5	I470 L473 Y481 V486 R492 A493 Y494 L506	I470-V490 HydrophobicContact CG1-CG1 4.31Å; L473-V490 HydrophobicContact CB-CG2 3.59Å; L473-V490 HydrophobicContact CD1-CG2 3.75Å; L473-V490 HydrophobicContact CG-CG2 4.33Å; Y481-V490 HydrophobicContact CE2-CG2 4.42Å; V486-V490 HydrophobicContact CG1-CG2 4.13Å; V486-V490 WeakPolarHBondContact O-CG2 3.35Å; V486-V490 PolarHBondContact O-N 2.68Å; V490-R492 VanDerWaalsContact C-N 3.33Å; V490-R492 PolarHBondContact O-N 3.49Å; V490-A493 WeakPolarHBondContact O-CB 3.42Å; V490-A493 PolarHBondContact O-N 3.28Å; V490-Y494 HydrophobicContact CG1-CD2 3.94Å; V490-Y494 HydrophobicContact CG1-CE2 3.72Å; V490-Y494 VanDerWaalsContact O-CD2 3.31Å; V490-Y494 WeakPolarHBondContact O-CD2 3.01Å; V490-Y494 PolarHBondContact O-N 2.84Å; V490-L506 HydrophobicContact CB-CD1 4.36Å; V490-L506 HydrophobicContact CG1-CD1 3.72Å
491	G	96.4	Very high	94.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.8	-41.9	173.6	0	0	0	0	0	112.6	L487 Y494 F495 A503	L487-G491 PolarHBondContact O-N 2.71Å; G491-Y494 PolarHBondContact O-N 3.3Å; G491-F495 PolarHBondContact O-N 3.11Å; G491-A503 WeakPolarHBondContact O-CB 2.73Å
492	R	95.6	Very high	94.7	Very high	42 Å²	42	38.7 Å²	38.7	16%	0.158	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-43	170.4	178.8	175.6	175.4	-145.8	-11.1	112.1	L461 T488 H489 V490 Y494 F495 E496 I523	L461-R492 HydrophobicContact CD1-CG 4.44Å; T488-R492 WeakPolarHBondContact O-CB 3.4Å; T488-R492 PolarHBondContact O-N 3.46Å; H489-R492 PolarHBondContact O-N 3.09Å; V490-R492 VanDerWaalsContact C-N 3.33Å; V490-R492 PolarHBondContact O-N 3.49Å; R492-Y494 VanDerWaalsContact C-N 3.31Å; R492-Y494 PolarHBondContact O-N 3.26Å; R492-F495 WeakPolarHBondContact O-CB 3.46Å; R492-F495 PolarHBondContact O-N 3.33Å; R492-F495 VanDerWaalsContact O-N 3.15Å; R492-E496 HydrophobicContact CG-CG 4.04Å; R492-E496 IonicContact CZ-OE1 3.58Å; R492-E496 VanDerWaalsContact CZ-OE1 3.28Å; R492-E496 IonicContact NE-OE1 3.41Å; R492-E496 PolarHBondContact NE-OE1 3.49Å; R492-E496 IonicContact NH2-OE1 2.75Å; R492-E496 PolarHBondContact NH2-OE1 2.88Å; R492-E496 WeakPolarHBondContact O-CG 3.46Å; R492-E496 PolarHBondContact O-N 3.01Å; R492-I523 HydrophobicContact CB-CD1 4.18Å; R492-I523 HydrophobicContact CG-CD1 3.76Å
493	A	95.8	Very high	94.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-40.3	178.4	0	0	0	0	0	112.2	L461 C466 I470 H489 V490 L497	L461-A493 HydrophobicContact CD1-CB 3.84Å; C466-A493 HydrophobicContact CB-CB 4.28Å; I470-A493 HydrophobicContact CD1-CB 3.85Å; I470-A493 HydrophobicContact CG1-CB 3.54Å; H489-A493 PolarHBondContact O-N 3.05Å; V490-A493 WeakPolarHBondContact O-CB 3.42Å; V490-A493 PolarHBondContact O-N 3.28Å; A493-L497 WeakPolarHBondContact O-CG 3.46Å; A493-L497 PolarHBondContact O-N 3.47Å
494	Y	95.6	Very high	94.8	Very high	42 Å²	42	34.3 Å²	34.3	17%	0.165	17%	0.165	C	C	.	.	H	α-helix	trans	-68.3	-36.3	172.9	-78.3	-71.6	0	0	0	113.1	I470 V490 G491 R492 L497 A498 E499 Q502 L506	I470-Y494 HydrophobicContact CD1-CD1 3.97Å; I470-Y494 HydrophobicContact CD1-CD2 3.99Å; I470-Y494 HydrophobicContact CD1-CE1 3.89Å; I470-Y494 HydrophobicContact CD1-CE2 3.91Å; I470-Y494 HydrophobicContact CD1-CG 4.04Å; I470-Y494 HydrophobicContact CG1-CD2 4.39Å; I470-Y494 HydrophobicContact CG1-CE2 4.17Å; I470-Y494 HydrophobicContact CG2-CE2 4.12Å; V490-Y494 HydrophobicContact CG1-CD2 3.94Å; V490-Y494 HydrophobicContact CG1-CE2 3.72Å; V490-Y494 VanDerWaalsContact O-CD2 3.31Å; V490-Y494 WeakPolarHBondContact O-CD2 3.01Å; V490-Y494 PolarHBondContact O-N 2.84Å; G491-Y494 PolarHBondContact O-N 3.3Å; R492-Y494 VanDerWaalsContact C-N 3.31Å; R492-Y494 PolarHBondContact O-N 3.26Å; Y494-L497 CarbonylContact O-C 3.4Å; Y494-L497 PolarHBondContact O-N 3.45Å; Y494-A498 PolarHBondContact O-N 2.89Å; Y494-E499 HydrophobicContact CD1-CB 3.97Å; Y494-E499 VanDerWaalsContact CD1-OE2 3.3Å; Y494-E499 WeakPolarHBondContact CD1-OE2 3.46Å; Y494-E499 WeakPolarHBondContact CE1-OE2 3.28Å; Y494-E499 PolarHBondContact O-N 2.96Å; Y494-Q502 HydrophobicContact CD1-CB 4.05Å; Y494-Q502 HydrophobicContact CD1-CG 3.83Å; Y494-Q502 HydrophobicContact CD2-CG 4.14Å; Y494-Q502 HydrophobicContact CE1-CB 4.32Å; Y494-Q502 HydrophobicContact CE1-CG 3.67Å; Y494-Q502 HydrophobicContact CE2-CG 3.99Å; Y494-Q502 HydrophobicContact CG-CB 4.29Å; Y494-Q502 HydrophobicContact CG-CG 4.05Å; Y494-L506 HydrophobicContact CD2-CD1 3.41Å; Y494-L506 VanDerWaalsContact CD2-CD1 3.41Å; Y494-L506 HydrophobicContact CE2-CD1 3.64Å
495	F	95.2	Very high	94.9	Very high	20 Å²	20	42.8 Å²	42.8	9%	0.088	20%	0.197	C	C	.	.	H	α-helix	trans	-62.4	-44.5	173.4	172.8	-91.2	0	0	0	112.2	G491 R492 L497 A498 Y500 A503 I523 T526 T527 H530	G491-F495 PolarHBondContact O-N 3.11Å; R492-F495 WeakPolarHBondContact O-CB 3.46Å; R492-F495 PolarHBondContact O-N 3.33Å; R492-F495 VanDerWaalsContact O-N 3.15Å; F495-L497 PolarHBondContact O-N 3.5Å; F495-A498 WeakPolarHBondContact O-CA 3.45Å; F495-A498 PolarHBondContact O-N 2.88Å; F495-Y500 AromaticContact CD2-CD1 3.88Å; F495-Y500 HydrophobicContact CD2-CD1 3.88Å; F495-Y500 AromaticContact CD2-CE1 3.75Å; F495-Y500 HydrophobicContact CD2-CE1 3.75Å; F495-Y500 HydrophobicContact CE2-CD1 4.3Å; F495-Y500 AromaticContact CE2-CE1 3.87Å; F495-Y500 HydrophobicContact CE2-CE1 3.87Å; F495-A503 HydrophobicContact CB-CB 4.37Å; F495-I523 HydrophobicContact CB-CG2 3.84Å; F495-I523 HydrophobicContact CD1-CG2 3.61Å; F495-I523 HydrophobicContact CD2-CG2 3.86Å; F495-I523 HydrophobicContact CE1-CG2 4.11Å; F495-I523 HydrophobicContact CE2-CG2 4.31Å; F495-I523 HydrophobicContact CG-CG2 3.48Å; F495-I523 VanDerWaalsContact CG-CG2 3.48Å; F495-I523 HydrophobicContact CZ-CG2 4.43Å; F495-T526 HydrophobicContact CE2-CG2 4Å; F495-T526 HydrophobicContact CZ-CG2 3.99Å; F495-T527 VanDerWaalsContact CD2-OG1 3.28Å; F495-T527 WeakPolarHBondContact CD2-OG1 3.44Å; F495-H530 AromaticContact CE2-CD2 3.89Å
496	E	92.4	Very high	94.9	Very high	31 Å²	31	41 Å²	41	15%	0.145	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-19.7	177.9	-58.3	-93.5	-166	0	0	112	Y464 R492 Y620	Y464-E496 VanDerWaalsContact CE1-OE2 3.29Å; Y464-E496 WeakPolarHBondContact CE1-OE2 3.35Å; R492-E496 HydrophobicContact CG-CG 4.04Å; R492-E496 IonicContact CZ-OE1 3.58Å; R492-E496 VanDerWaalsContact CZ-OE1 3.28Å; R492-E496 IonicContact NE-OE1 3.41Å; R492-E496 PolarHBondContact NE-OE1 3.49Å; R492-E496 IonicContact NH2-OE1 2.75Å; R492-E496 PolarHBondContact NH2-OE1 2.88Å; R492-E496 WeakPolarHBondContact O-CG 3.46Å; R492-E496 PolarHBondContact O-N 3.01Å; E496-Y620 WeakPolarHBondContact OE2-CE1 3.24Å; E496-Y620 PolarHBondContact OE2-OH 3.02Å
497	L	90.3	Very high	95	Very high	40 Å²	40	40.9 Å²	40.9	21%	0.209	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	2	168.7	-70.4	170.6	0	0	0	113.8	C466 R467 I470 A493 Y494 F495 E499	C466-L497 HydrophobicContact CB-CD1 3.86Å; C466-L497 HydrophobicContact CB-CD2 3.95Å; C466-L497 HydrophobicContact CB-CG 3.61Å; R467-L497 HydrophobicContact CG-CD1 3.93Å; R467-L497 HydrophobicContact CG-CD2 4.13Å; I470-L497 HydrophobicContact CD1-CD1 3.71Å; A493-L497 WeakPolarHBondContact O-CG 3.46Å; A493-L497 PolarHBondContact O-N 3.47Å; Y494-L497 CarbonylContact O-C 3.4Å; Y494-L497 PolarHBondContact O-N 3.45Å; F495-L497 PolarHBondContact O-N 3.5Å; L497-E499 HydrophobicContact CB-CG 4.4Å; L497-E499 PolarHBondContact O-N 3.46Å
498	A	89.3	Confident	94.9	Very high	50 Å²	50	43 Å²	43	41%	0.413	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	17.1	-173.4	0	0	0	0	0	115.8	Y494 F495 Y500	Y494-A498 PolarHBondContact O-N 2.89Å; F495-A498 WeakPolarHBondContact O-CA 3.45Å; F495-A498 PolarHBondContact O-N 2.88Å; A498-Y500 HydrophobicContact CB-CE1 4.46Å; A498-Y500 HydrophobicContact CB-CE2 4.07Å; A498-Y500 WeakPolarHBondContact O-CD2 3.4Å; A498-Y500 PolarHBondContact O-N 3.15Å
499	E	91.9	Very high	94.9	Very high	95 Å²	95	45.7 Å²	45.7	44%	0.444	22%	0.218	S	C	.	.			trans	-83.3	56.6	176.3	-66.7	-169.1	-179	0	0	111.3	Y494 L497 M501 Q502 A503	Y494-E499 HydrophobicContact CD1-CB 3.97Å; Y494-E499 VanDerWaalsContact CD1-OE2 3.3Å; Y494-E499 WeakPolarHBondContact CD1-OE2 3.46Å; Y494-E499 WeakPolarHBondContact CE1-OE2 3.28Å; Y494-E499 PolarHBondContact O-N 2.96Å; L497-E499 HydrophobicContact CB-CG 4.4Å; L497-E499 PolarHBondContact O-N 3.46Å; E499-M501 VanDerWaalsContact C-N 3.28Å; E499-M501 PolarHBondContact O-N 3.48Å; E499-M501 VanDerWaalsContact O-N 3.1Å; E499-Q502 HydrophobicContact CB-CB 4.49Å; E499-Q502 PolarHBondContact O-N 2.64Å; E499-A503 PolarHBondContact O-N 2.66Å; E499-A503 VanDerWaalsContact O-N 3.12Å
500	Y	94.3	Very high	94.9	Very high	49 Å²	49	44.7 Å²	44.7	19%	0.192	21%	0.213	C	C	.	.	H	α-helix	trans	-54.9	-34.7	-167.3	-56.1	-56.9	0	0	0	114.8	F495 A498 Q502 A503 E504 T527 H530	F495-Y500 AromaticContact CD2-CD1 3.88Å; F495-Y500 HydrophobicContact CD2-CD1 3.88Å; F495-Y500 AromaticContact CD2-CE1 3.75Å; F495-Y500 HydrophobicContact CD2-CE1 3.75Å; F495-Y500 HydrophobicContact CE2-CD1 4.3Å; F495-Y500 AromaticContact CE2-CE1 3.87Å; F495-Y500 HydrophobicContact CE2-CE1 3.87Å; A498-Y500 HydrophobicContact CB-CE1 4.46Å; A498-Y500 HydrophobicContact CB-CE2 4.07Å; A498-Y500 WeakPolarHBondContact O-CD2 3.4Å; A498-Y500 PolarHBondContact O-N 3.15Å; Y500-Q502 VanDerWaalsContact C-N 3.34Å; Y500-Q502 PolarHBondContact O-N 3.3Å; Y500-A503 PolarHBondContact O-N 2.84Å; Y500-E504 WeakPolarHBondContact O-CB 3.12Å; Y500-E504 PolarHBondContact O-N 3.02Å; Y500-T527 HydrophobicContact CD1-CG2 4.34Å; Y500-T527 VanDerWaalsContact O-CG2 3.23Å; Y500-T527 WeakPolarHBondContact O-CG2 3.38Å; Y500-H530 HydrophobicContact CD1-CB 4.33Å; Y500-H530 HydrophobicContact CD2-CB 3.97Å; Y500-H530 HydrophobicContact CE1-CB 4.42Å; Y500-H530 AromaticContact CE1-CD2 3.57Å; Y500-H530 AromaticContact CE1-NE2 3.96Å; Y500-H530 HydrophobicContact CE2-CB 4.07Å; Y500-H530 HydrophobicContact CG-CB 4.11Å; Y500-H530 AromaticContact CZ-CD2 3.72Å; Y500-H530 AromaticContact CZ-CE1 4Å; Y500-H530 AromaticContact CZ-CG 3.83Å; Y500-H530 AromaticContact CZ-NE2 3.86Å
501	M	94.6	Very high	94.9	Very high	149 Å²	149	46.4 Å²	46.4	73%	0.734	22%	0.219	S	C	*	.	H	α-helix	trans	-65	-36.6	177.1	-65.3	-174.1	-70.3	0	0	112.6	E499 R505 L531	E499-M501 VanDerWaalsContact C-N 3.28Å; E499-M501 PolarHBondContact O-N 3.48Å; E499-M501 VanDerWaalsContact O-N 3.1Å; M501-R505 PolarHBondContact O-N 3.47Å; M501-L531 HydrophobicContact CG-CD2 3.86Å
502	Q	94.8	Very high	94.8	Very high	77 Å²	77	54.7 Å²	54.7	36%	0.36	25%	0.251	S	S	.	.	H	α-helix	trans	-78.6	-36.2	179.1	-169.4	67.3	-2.1	0	0	110.8	Y494 E499 Y500 R505 L506	Y494-Q502 HydrophobicContact CD1-CB 4.05Å; Y494-Q502 HydrophobicContact CD1-CG 3.83Å; Y494-Q502 HydrophobicContact CD2-CG 4.14Å; Y494-Q502 HydrophobicContact CE1-CB 4.32Å; Y494-Q502 HydrophobicContact CE1-CG 3.67Å; Y494-Q502 HydrophobicContact CE2-CG 3.99Å; Y494-Q502 HydrophobicContact CG-CB 4.29Å; Y494-Q502 HydrophobicContact CG-CG 4.05Å; E499-Q502 HydrophobicContact CB-CB 4.49Å; E499-Q502 PolarHBondContact O-N 2.64Å; Y500-Q502 VanDerWaalsContact C-N 3.34Å; Y500-Q502 PolarHBondContact O-N 3.3Å; Q502-R505 PolarHBondContact O-N 3.16Å; Q502-L506 WeakPolarHBondContact O-CG 3.45Å; Q502-L506 PolarHBondContact O-N 2.67Å
503	A	96.4	Very high	94.8	Very high	0 Å²	0	56 Å²	56	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-47.2	170.6	0	0	0	0	0	111.9	G491 F495 E499 Y500 R505 L506 F507 T527	G491-A503 WeakPolarHBondContact O-CB 2.73Å; F495-A503 HydrophobicContact CB-CB 4.37Å; E499-A503 PolarHBondContact O-N 2.66Å; E499-A503 VanDerWaalsContact O-N 3.12Å; Y500-A503 PolarHBondContact O-N 2.84Å; A503-R505 PolarHBondContact O-N 3.02Å; A503-L506 PolarHBondContact O-N 3.4Å; A503-L506 VanDerWaalsContact O-N 3.14Å; A503-F507 HydrophobicContact CB-CD2 4.33Å; A503-F507 HydrophobicContact CB-CE2 4.14Å; A503-F507 WeakPolarHBondContact O-CD2 3.37Å; A503-F507 PolarHBondContact O-N 3.41Å; A503-T527 HydrophobicContact CB-CG2 3.96Å
504	E	96.6	Very high	94.8	Very high	36 Å²	36	57.3 Å²	57.3	17%	0.168	27%	0.266	C	S	.	.	H	α-helix	trans	-59.3	-43.2	176.8	-175.4	-135.9	-179.8	0	0	112.4	Y500 L506 F507 S508 Y524 T527 L528 L531 K533	Y500-E504 WeakPolarHBondContact O-CB 3.12Å; Y500-E504 PolarHBondContact O-N 3.02Å; E504-L506 VanDerWaalsContact C-N 3.25Å; E504-L506 PolarHBondContact O-N 3.15Å; E504-F507 PolarHBondContact O-N 2.9Å; E504-S508 WeakPolarHBondContact O-CB 3.41Å; E504-S508 PolarHBondContact O-N 2.87Å; E504-S508 PolarHBondContact O-OG 3.02Å; E504-Y524 HydrophobicContact CB-CE2 4.44Å; E504-Y524 HydrophobicContact CG-CE2 3.86Å; E504-T527 HydrophobicContact CB-CG2 4.23Å; E504-L528 HydrophobicContact CG-CD2 3.89Å; E504-L531 HydrophobicContact CB-CD1 3.77Å; E504-L531 HydrophobicContact CG-CD1 4.11Å; E504-K533 IonicContact OE1-NZ 3.97Å; E504-K533 PolarHBondContact OE1-NZ 3.09Å; E504-K533 IonicContact OE2-NZ 2.8Å; E504-K533 PolarHBondContact OE2-NZ 3.24Å
505	R	96.7	Very high	94.7	Very high	179 Å²	179	58.6 Å²	58.6	68%	0.675	28%	0.281	S	S	*	.	H	α-helix	trans	-58.5	-38	175.9	-176.6	176.4	178.8	165	1.6	112.2	M501 Q502 A503 S508 E509	M501-R505 PolarHBondContact O-N 3.47Å; Q502-R505 PolarHBondContact O-N 3.16Å; A503-R505 PolarHBondContact O-N 3.02Å; R505-S508 WeakPolarHBondContact CA-OG 3.37Å; R505-S508 PolarHBondContact O-OG 3.13Å; R505-S508 VanDerWaalsContact O-OG 3.08Å; R505-E509 PolarHBondContact O-N 2.81Å
506	L	96.2	Very high	94.6	Very high	17 Å²	17	65.3 Å²	65.3	9%	0.089	31%	0.307	C	S	.	.	H	α-helix	trans	-75	-42.9	177.8	-68.9	166.4	0	0	0	112.1	L487 V490 Y494 Q502 A503 E504 E509 V510	L487-L506 HydrophobicContact CD2-CD2 4.12Å; V490-L506 HydrophobicContact CB-CD1 4.36Å; V490-L506 HydrophobicContact CG1-CD1 3.72Å; Y494-L506 HydrophobicContact CD2-CD1 3.41Å; Y494-L506 VanDerWaalsContact CD2-CD1 3.41Å; Y494-L506 HydrophobicContact CE2-CD1 3.64Å; Q502-L506 WeakPolarHBondContact O-CG 3.45Å; Q502-L506 PolarHBondContact O-N 2.67Å; A503-L506 PolarHBondContact O-N 3.4Å; A503-L506 VanDerWaalsContact O-N 3.14Å; E504-L506 VanDerWaalsContact C-N 3.25Å; E504-L506 PolarHBondContact O-N 3.15Å; L506-E509 WeakPolarHBondContact O-CB 3.37Å; L506-E509 PolarHBondContact O-N 3.31Å; L506-V510 WeakPolarHBondContact O-CG2 3.27Å; L506-V510 PolarHBondContact O-N 2.94Å
507	F	97.1	Very high	94.7	Very high	1 Å²	1	65.1 Å²	65.1	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-69	-33.9	178.5	-70.4	-59.8	0	0	0	113.5	T488 A503 E504 E509 V510 R511 I523 Y524	T488-F507 HydrophobicContact CG2-CE1 4.28Å; A503-F507 HydrophobicContact CB-CD2 4.33Å; A503-F507 HydrophobicContact CB-CE2 4.14Å; A503-F507 WeakPolarHBondContact O-CD2 3.37Å; A503-F507 PolarHBondContact O-N 3.41Å; E504-F507 PolarHBondContact O-N 2.9Å; F507-E509 VanDerWaalsContact C-N 3.32Å; F507-V510 WeakPolarHBondContact O-CB 3.44Å; F507-V510 PolarHBondContact O-N 3.02Å; F507-R511 PolarHBondContact O-N 3.3Å; F507-I523 HydrophobicContact CE2-CG2 4.18Å; F507-I523 HydrophobicContact CZ-CB 4.18Å; F507-I523 HydrophobicContact CZ-CG2 3.91Å; F507-Y524 HydrophobicContact CB-CD1 3.75Å; F507-Y524 HydrophobicContact CB-CD2 3.27Å; F507-Y524 HydrophobicContact CB-CE1 4.11Å; F507-Y524 HydrophobicContact CB-CE2 3.67Å; F507-Y524 HydrophobicContact CB-CG 3.32Å; F507-Y524 HydrophobicContact CD1-CG 4.44Å; F507-Y524 AromaticContact CD2-CD2 3.73Å; F507-Y524 HydrophobicContact CD2-CD2 3.73Å; F507-Y524 HydrophobicContact CD2-CG 4Å; F507-Y524 HydrophobicContact CG-CD1 4.49Å; F507-Y524 AromaticContact CG-CD2 3.77Å; F507-Y524 HydrophobicContact CG-CD2 3.77Å; F507-Y524 AromaticContact CG-CG 3.72Å; F507-Y524 HydrophobicContact CG-CG 3.72Å
508	S	95.7	Very high	94.9	Very high	49 Å²	49	64.6 Å²	64.6	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-65.7	-35.1	170.6	51.4	0	0	0	0	112	E504 R505 R511 R512	E504-S508 WeakPolarHBondContact O-CB 3.41Å; E504-S508 PolarHBondContact O-N 2.87Å; E504-S508 PolarHBondContact O-OG 3.02Å; R505-S508 WeakPolarHBondContact CA-OG 3.37Å; R505-S508 PolarHBondContact O-OG 3.13Å; R505-S508 VanDerWaalsContact O-OG 3.08Å; S508-R511 PolarHBondContact O-N 3.21Å; S508-R512 PolarHBondContact O-N 3.21Å
509	E	95.4	Very high	95	Very high	61 Å²	61	67.2 Å²	67.2	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-67.5	-39.8	170.2	-173.9	64.2	-173.5	0	0	112.3	L487 R505 L506 F507 R511 R512 I513	L487-E509 HydrophobicContact CD1-CG 4.25Å; R505-E509 PolarHBondContact O-N 2.81Å; L506-E509 WeakPolarHBondContact O-CB 3.37Å; L506-E509 PolarHBondContact O-N 3.31Å; F507-E509 VanDerWaalsContact C-N 3.32Å; E509-R511 VanDerWaalsContact C-N 3.34Å; E509-R511 PolarHBondContact O-N 3.49Å; E509-R512 WeakPolarHBondContact O-CB 3.08Å; E509-R512 PolarHBondContact O-N 3.34Å; E509-R512 IonicContact OE1-CZ 2.65Å; E509-R512 IonicContact OE1-NE 2.71Å; E509-R512 PolarHBondContact OE1-NE 3.44Å; E509-R512 IonicContact OE1-NH2 3.68Å; E509-R512 PolarHBondContact OE1-NH2 3.23Å; E509-R512 IonicContact OE2-CZ 2.67Å; E509-R512 IonicContact OE2-NE 2.99Å; E509-R512 PolarHBondContact OE2-NE 3.26Å; E509-R512 IonicContact OE2-NH2 3.16Å; E509-I513 HydrophobicContact CG-CD1 3.97Å; E509-I513 WeakPolarHBondContact O-CG1 3.49Å; E509-I513 PolarHBondContact O-N 3.46Å
510	V	96.5	Very high	95.1	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.8	-48.7	170.8	176.6	0	0	0	0	110.7	L487 L506 F507 R512 I513 E514 M521	L487-V510 HydrophobicContact CB-CG2 3.41Å; L487-V510 VanDerWaalsContact CB-CG2 3.41Å; L487-V510 HydrophobicContact CD1-CG2 4.38Å; L506-V510 WeakPolarHBondContact O-CG2 3.27Å; L506-V510 PolarHBondContact O-N 2.94Å; F507-V510 WeakPolarHBondContact O-CB 3.44Å; F507-V510 PolarHBondContact O-N 3.02Å; V510-R512 PolarHBondContact O-N 3Å; V510-I513 PolarHBondContact O-N 3.22Å; V510-E514 CarbonylContact O-C 3.51Å; V510-E514 WeakPolarHBondContact O-CA 3.32Å; V510-E514 PolarHBondContact O-N 3.28Å; V510-M521 HydrophobicContact CB-CE 4.29Å; V510-M521 HydrophobicContact CG1-CE 3.55Å
511	R	95.2	Very high	95.1	Very high	36 Å²	36	60.8 Å²	60.8	14%	0.136	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-27	177.3	-70.3	-69.4	-64	155	5.3	112.9	F507 S508 E509 S515 M521 Y524 L540 D543	F507-R511 PolarHBondContact O-N 3.3Å; S508-R511 PolarHBondContact O-N 3.21Å; E509-R511 VanDerWaalsContact C-N 3.34Å; E509-R511 PolarHBondContact O-N 3.49Å; R511-S515 PolarHBondContact NH1-O 3.48Å; R511-S515 WeakPolarHBondContact O-CA 3.33Å; R511-S515 PolarHBondContact O-N 3.15Å; R511-M521 HydrophobicContact CG-SD 4.11Å; R511-Y524 HydrophobicContact CG-CE1 4.11Å; R511-L540 HydrophobicContact CG-CD1 4.22Å; R511-D543 IonicContact CZ-OD2 2.73Å; R511-D543 IonicContact NH2-OD2 2.79Å; R511-D543 PolarHBondContact NH2-OD2 3.14Å
512	R	95.5	Very high	95.1	Very high	175 Å²	175	55 Å²	55	66%	0.66	25%	0.252	S	S	*	.	H	α-helix	trans	-77.5	-35	177.6	-163.3	-174.4	72.8	78.7	0.6	113	S508 E509 V510	S508-R512 PolarHBondContact O-N 3.21Å; E509-R512 WeakPolarHBondContact O-CB 3.08Å; E509-R512 PolarHBondContact O-N 3.34Å; E509-R512 IonicContact OE1-CZ 2.65Å; E509-R512 IonicContact OE1-NE 2.71Å; E509-R512 PolarHBondContact OE1-NE 3.44Å; E509-R512 IonicContact OE1-NH2 3.68Å; E509-R512 PolarHBondContact OE1-NH2 3.23Å; E509-R512 IonicContact OE2-CZ 2.67Å; E509-R512 IonicContact OE2-NE 2.99Å; E509-R512 PolarHBondContact OE2-NE 3.26Å; E509-R512 IonicContact OE2-NH2 3.16Å; V510-R512 PolarHBondContact O-N 3Å
513	I	95.1	Very high	95.2	Very high	68 Å²	68	52.2 Å²	52.2	35%	0.349	24%	0.24	S	C	.	.	H	α-helix	trans	-88.2	-48.3	179.6	-58.5	171	0	0	0	110.9	L487 E509 V510	L487-I513 HydrophobicContact CD1-CD1 3.76Å; E509-I513 HydrophobicContact CG-CD1 3.97Å; E509-I513 WeakPolarHBondContact O-CG1 3.49Å; E509-I513 PolarHBondContact O-N 3.46Å; V510-I513 PolarHBondContact O-N 3.22Å
514	E	95.3	Very high	95.2	Very high	29 Å²	29	53 Å²	53	14%	0.136	24%	0.243	C	C	.	.			trans	-121.4	72.4	-176.6	-66.4	-179.9	-164.9	0	0	110.4	G484 V510 Y516 R517	G484-E514 VanDerWaalsContact CA-CD 3.47Å; G484-E514 WeakPolarHBondContact CA-OE1 3.41Å; G484-E514 WeakPolarHBondContact CA-OE2 3.39Å; G484-E514 VanDerWaalsContact N-CD 3.33Å; G484-E514 PolarHBondContact N-OE1 2.99Å; V510-E514 CarbonylContact O-C 3.51Å; V510-E514 WeakPolarHBondContact O-CA 3.32Å; V510-E514 PolarHBondContact O-N 3.28Å; E514-Y516 HydrophobicContact CB-CD1 4.5Å; E514-Y516 HydrophobicContact CB-CE1 4.04Å; E514-Y516 HydrophobicContact CG-CE1 4.08Å; E514-Y516 PolarHBondContact O-N 3.23Å; E514-R517 HydrophobicContact CB-CB 3.91Å; E514-R517 WeakPolarHBondContact O-CB 3.39Å; E514-R517 PolarHBondContact O-N 3.47Å; E514-R517 WeakPolarHBondContact OE2-CD 3.29Å
515	S	93.9	Very high	95.2	Very high	68 Å²	68	51.3 Å²	51.3	48%	0.476	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.8	177.1	59.9	0	0	0	0	114.2	R511 M547	R511-S515 PolarHBondContact NH1-O 3.48Å; R511-S515 WeakPolarHBondContact O-CA 3.33Å; R511-S515 PolarHBondContact O-N 3.15Å; S515-M547 VanDerWaalsContact O-CE 3.31Å; S515-M547 WeakPolarHBondContact O-CE 3.39Å
516	Y	93.1	Very high	95.2	Very high	161 Å²	161	42.9 Å²	42.9	63%	0.631	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-6.6	175.9	63.5	-90.4	0	0	0	114.6	E514 V518	E514-Y516 HydrophobicContact CB-CD1 4.5Å; E514-Y516 HydrophobicContact CB-CE1 4.04Å; E514-Y516 HydrophobicContact CG-CE1 4.08Å; E514-Y516 PolarHBondContact O-N 3.23Å; Y516-V518 PolarHBondContact O-N 2.92Å
517	R	94.6	Very high	95.2	Very high	27 Å²	27	42 Å²	42	10%	0.102	20%	0.199	C	C	.	.			trans	-79.3	121.2	180	-176.3	168.1	177.5	72.2	15.6	111.1	T488 E514 E519 M521	T488-R517 PolarHBondContact OG1-NE 2.94Å; E514-R517 HydrophobicContact CB-CB 3.91Å; E514-R517 WeakPolarHBondContact O-CB 3.39Å; E514-R517 PolarHBondContact O-N 3.47Å; E514-R517 WeakPolarHBondContact OE2-CD 3.29Å; R517-E519 IonicContact CZ-OE2 3.36Å; R517-E519 PolarHBondContact NE-O 3.3Å; R517-E519 IonicContact NH1-OE2 3.56Å; R517-E519 PolarHBondContact NH1-OE2 3.27Å; R517-E519 PolarHBondContact NH2-O 3.2Å; R517-E519 IonicContact NH2-OE2 3.51Å; R517-E519 PolarHBondContact NH2-OE2 2.92Å; R517-M521 HydrophobicContact CG-CE 4.27Å
518	V	93.8	Very high	95.2	Very high	30 Å²	30	42 Å²	42	18%	0.182	20%	0.199	C	C	.	.			trans	-103.3	-29.7	175	-53.3	0	0	0	0	113.1	Y516 G520 M521 L544 C551	Y516-V518 PolarHBondContact O-N 2.92Å; V518-G520 PolarHBondContact O-N 3.23Å; V518-M521 VanDerWaalsContact O-CB 3.28Å; V518-M521 WeakPolarHBondContact O-CB 3.37Å; V518-M521 WeakPolarHBondContact O-CG 2.98Å; V518-M521 PolarHBondContact O-N 3.24Å; V518-L544 HydrophobicContact CB-CD2 4.24Å; V518-L544 HydrophobicContact CG1-CD2 3.88Å; V518-C551 HydrophobicContact CG2-CB 4.26Å
519	E	92.9	Very high	95.2	Very high	105 Å²	105	40 Å²	40	49%	0.491	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	127.3	178.2	-68.3	175.5	-175.2	0	0	112.6	R517 M521	R517-E519 IonicContact CZ-OE2 3.36Å; R517-E519 PolarHBondContact NE-O 3.3Å; R517-E519 IonicContact NH1-OE2 3.56Å; R517-E519 PolarHBondContact NH1-OE2 3.27Å; R517-E519 PolarHBondContact NH2-O 3.2Å; R517-E519 IonicContact NH2-OE2 3.51Å; R517-E519 PolarHBondContact NH2-OE2 2.92Å; E519-M521 VanDerWaalsContact C-N 3.29Å
520	G	92.6	Very high	95	Very high	9 Å²	9	38.1 Å²	38.1	9%	0.093	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.6	-6.7	179.9	0	0	0	0	0	113.8	V518 E522 I523 Y524	V518-G520 PolarHBondContact O-N 3.23Å; G520-E522 WeakPolarHBondContact CA-OE2 3.33Å; G520-E522 PolarHBondContact N-OE2 3.44Å; G520-E522 PolarHBondContact O-N 3.21Å; G520-I523 PolarHBondContact O-N 2.84Å; G520-Y524 PolarHBondContact O-N 3.43Å
521	M	95.6	Very high	94.9	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-72.1	-16.4	177.5	-58.9	-61.1	145.7	0	0	112.5	V510 R511 R517 V518 E519 I523 Y524 S525 L544 V557	V510-M521 HydrophobicContact CB-CE 4.29Å; V510-M521 HydrophobicContact CG1-CE 3.55Å; R511-M521 HydrophobicContact CG-SD 4.11Å; R517-M521 HydrophobicContact CG-CE 4.27Å; V518-M521 VanDerWaalsContact O-CB 3.28Å; V518-M521 WeakPolarHBondContact O-CB 3.37Å; V518-M521 WeakPolarHBondContact O-CG 2.98Å; V518-M521 PolarHBondContact O-N 3.24Å; E519-M521 VanDerWaalsContact C-N 3.29Å; M521-I523 VanDerWaalsContact C-N 3.34Å; M521-Y524 PolarHBondContact O-N 3Å; M521-Y524 HydrophobicContact SD-CD1 3.9Å; M521-S525 WeakPolarHBondContact O-CB 3.44Å; M521-S525 PolarHBondContact O-N 3.47Å; M521-L544 HydrophobicContact CB-CD1 3.65Å; M521-L544 HydrophobicContact CG-CD1 4.16Å; M521-L544 HydrophobicContact CG-CD2 4.21Å; M521-V557 HydrophobicContact CB-CG2 4.35Å; M521-V557 WeakPolarHBondContact O-CG2 3.45Å
522	E	94.8	Very high	94.9	Very high	26 Å²	26	43.3 Å²	43.3	12%	0.121	20%	0.202	C	C	.	.	H	α-helix	trans	-60.8	-43.1	167.9	76.9	-68.7	167.9	0	0	111	G520 S525 T526 E553 C556 F585 Y587	G520-E522 WeakPolarHBondContact CA-OE2 3.33Å; G520-E522 PolarHBondContact N-OE2 3.44Å; G520-E522 PolarHBondContact O-N 3.21Å; E522-S525 PolarHBondContact O-N 3.3Å; E522-S525 PolarHBondContact O-OG 2.95Å; E522-T526 PolarHBondContact O-N 3.1Å; E522-T526 VanDerWaalsContact O-N 3.14Å; E522-T526 PolarHBondContact O-OG1 3.05Å; E522-E553 WeakPolarHBondContact OE2-CG 3.34Å; E522-C556 HydrophobicContact CB-CB 4.35Å; E522-F585 HydrophobicContact CB-CZ 4.35Å; E522-F585 HydrophobicContact CG-CZ 3.94Å; E522-Y587 HydrophobicContact CB-CD1 3.79Å; E522-Y587 HydrophobicContact CB-CE1 3.83Å; E522-Y587 HydrophobicContact CG-CD1 3.43Å; E522-Y587 VanDerWaalsContact CG-CD1 3.43Å; E522-Y587 HydrophobicContact CG-CE1 3.64Å; E522-Y587 HydrophobicContact CG-CG 4.41Å
523	I	95.8	Very high	94.9	Very high	20 Å²	20	38.8 Å²	38.8	10%	0.103	19%	0.187	C	C	.	.	H	α-helix	trans	-71.3	-39.1	177.8	-59	177.5	0	0	0	110.4	R492 F495 F507 G520 M521 S525 T526 T527	R492-I523 HydrophobicContact CB-CD1 4.18Å; R492-I523 HydrophobicContact CG-CD1 3.76Å; F495-I523 HydrophobicContact CB-CG2 3.84Å; F495-I523 HydrophobicContact CD1-CG2 3.61Å; F495-I523 HydrophobicContact CD2-CG2 3.86Å; F495-I523 HydrophobicContact CE1-CG2 4.11Å; F495-I523 HydrophobicContact CE2-CG2 4.31Å; F495-I523 HydrophobicContact CG-CG2 3.48Å; F495-I523 VanDerWaalsContact CG-CG2 3.48Å; F495-I523 HydrophobicContact CZ-CG2 4.43Å; F507-I523 HydrophobicContact CE2-CG2 4.18Å; F507-I523 HydrophobicContact CZ-CB 4.18Å; F507-I523 HydrophobicContact CZ-CG2 3.91Å; G520-I523 PolarHBondContact O-N 2.84Å; M521-I523 VanDerWaalsContact C-N 3.34Å; I523-S525 VanDerWaalsContact C-N 3.33Å; I523-S525 PolarHBondContact O-N 2.74Å; I523-T526 PolarHBondContact O-N 2.93Å; I523-T527 PolarHBondContact O-N 3.33Å; I523-T527 PolarHBondContact O-OG1 3.37Å
524	Y	97.2	Very high	94.9	Very high	17 Å²	17	39.3 Å²	39.3	7%	0.067	19%	0.191	C	C	.	.	H	α-helix	trans	-60.5	-42.2	172.9	-177.9	-152.2	0	0	0	111.9	E504 F507 R511 G520 M521 T526 T527 L528 L540	E504-Y524 HydrophobicContact CB-CE2 4.44Å; E504-Y524 HydrophobicContact CG-CE2 3.86Å; F507-Y524 HydrophobicContact CB-CD1 3.75Å; F507-Y524 HydrophobicContact CB-CD2 3.27Å; F507-Y524 HydrophobicContact CB-CE1 4.11Å; F507-Y524 HydrophobicContact CB-CE2 3.67Å; F507-Y524 HydrophobicContact CB-CG 3.32Å; F507-Y524 HydrophobicContact CD1-CG 4.44Å; F507-Y524 AromaticContact CD2-CD2 3.73Å; F507-Y524 HydrophobicContact CD2-CD2 3.73Å; F507-Y524 HydrophobicContact CD2-CG 4Å; F507-Y524 HydrophobicContact CG-CD1 4.49Å; F507-Y524 AromaticContact CG-CD2 3.77Å; F507-Y524 HydrophobicContact CG-CD2 3.77Å; F507-Y524 AromaticContact CG-CG 3.72Å; F507-Y524 HydrophobicContact CG-CG 3.72Å; R511-Y524 HydrophobicContact CG-CE1 4.11Å; G520-Y524 PolarHBondContact O-N 3.43Å; M521-Y524 PolarHBondContact O-N 3Å; M521-Y524 HydrophobicContact SD-CD1 3.9Å; Y524-T526 PolarHBondContact O-N 2.92Å; Y524-T527 WeakPolarHBondContact O-CA 3.42Å; Y524-T527 VanDerWaalsContact O-CB 3.25Å; Y524-T527 WeakPolarHBondContact O-CB 3.29Å; Y524-T527 PolarHBondContact O-N 3.32Å; Y524-T527 VanDerWaalsContact O-N 3.09Å; Y524-L528 HydrophobicContact CD2-CD1 4.17Å; Y524-L528 HydrophobicContact CD2-CG 3.93Å; Y524-L528 HydrophobicContact CE1-CD1 4.14Å; Y524-L528 HydrophobicContact CE2-CD1 3.77Å; Y524-L528 HydrophobicContact CE2-CD2 3.74Å; Y524-L528 HydrophobicContact CE2-CG 3.57Å; Y524-L528 PolarHBondContact O-N 3.25Å; Y524-L540 HydrophobicContact CD1-CD1 3.99Å; Y524-L540 HydrophobicContact CD1-CD2 3.39Å; Y524-L540 HydrophobicContact CD1-CG 4.34Å; Y524-L540 HydrophobicContact CE1-CD1 3.93Å; Y524-L540 HydrophobicContact CE1-CD2 3.75Å; Y524-L540 HydrophobicContact CE1-CG 4.42Å; Y524-L540 HydrophobicContact CG-CD2 4.08Å
525	S	96.9	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-41.7	178.5	76.6	0	0	0	0	112.4	M521 E522 I523 T527 L528 W529 N560	M521-S525 WeakPolarHBondContact O-CB 3.44Å; M521-S525 PolarHBondContact O-N 3.47Å; E522-S525 PolarHBondContact O-N 3.3Å; E522-S525 PolarHBondContact O-OG 2.95Å; I523-S525 VanDerWaalsContact C-N 3.33Å; I523-S525 PolarHBondContact O-N 2.74Å; S525-T527 VanDerWaalsContact C-N 3.32Å; S525-T527 PolarHBondContact O-N 3.19Å; S525-L528 PolarHBondContact O-N 2.96Å; S525-W529 VanDerWaalsContact O-CB 3.32Å; S525-W529 WeakPolarHBondContact O-CB 3.39Å; S525-W529 PolarHBondContact O-N 3.12Å; S525-N560 PolarHBondContact OG-ND2 3.26Å
526	T	96.3	Very high	95	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-67.2	-34	173.6	-51.6	0	0	0	0	111.4	L278 F495 E522 I523 Y524 W529 H530 N560 Y587	L278-T526 HydrophobicContact CD1-CG2 3.96Å; F495-T526 HydrophobicContact CE2-CG2 4Å; F495-T526 HydrophobicContact CZ-CG2 3.99Å; E522-T526 PolarHBondContact O-N 3.1Å; E522-T526 VanDerWaalsContact O-N 3.14Å; E522-T526 PolarHBondContact O-OG1 3.05Å; I523-T526 PolarHBondContact O-N 2.93Å; Y524-T526 PolarHBondContact O-N 2.92Å; T526-W529 WeakPolarHBondContact O-CB 3.32Å; T526-W529 PolarHBondContact O-N 3.31Å; T526-H530 PolarHBondContact O-CD2 3.45Å; T526-H530 PolarHBondContact O-N 3.48Å; T526-N560 PolarHBondContact OG1-ND2 2.76Å; T526-N560 VanDerWaalsContact OG1-ND2 3.11Å; T526-Y587 WeakPolarHBondContact CB-OH 3.47Å; T526-Y587 PolarHBondContact OG1-OH 3.18Å
527	T	96.6	Very high	95.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62	-47.8	172.4	-52.2	0	0	0	0	111.5	F495 Y500 A503 E504 I523 Y524 S525 W529 H530 L531	F495-T527 VanDerWaalsContact CD2-OG1 3.28Å; F495-T527 WeakPolarHBondContact CD2-OG1 3.44Å; Y500-T527 HydrophobicContact CD1-CG2 4.34Å; Y500-T527 VanDerWaalsContact O-CG2 3.23Å; Y500-T527 WeakPolarHBondContact O-CG2 3.38Å; A503-T527 HydrophobicContact CB-CG2 3.96Å; E504-T527 HydrophobicContact CB-CG2 4.23Å; I523-T527 PolarHBondContact O-N 3.33Å; I523-T527 PolarHBondContact O-OG1 3.37Å; Y524-T527 WeakPolarHBondContact O-CA 3.42Å; Y524-T527 VanDerWaalsContact O-CB 3.25Å; Y524-T527 WeakPolarHBondContact O-CB 3.29Å; Y524-T527 PolarHBondContact O-N 3.32Å; Y524-T527 VanDerWaalsContact O-N 3.09Å; S525-T527 VanDerWaalsContact C-N 3.32Å; S525-T527 PolarHBondContact O-N 3.19Å; T527-W529 VanDerWaalsContact C-N 3.3Å; T527-W529 PolarHBondContact O-N 2.75Å; T527-H530 PolarHBondContact O-N 3.24Å; T527-L531 HydrophobicContact CG2-CD1 4.37Å; T527-L531 WeakPolarHBondContact O-CG 3.33Å; T527-L531 PolarHBondContact O-N 2.78Å
528	L	96.4	Very high	95.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-35.5	176.3	-69.9	173	0	0	0	112.4	E504 Y524 S525 L531 Q532 K533 A536 L537 L540	E504-L528 HydrophobicContact CG-CD2 3.89Å; Y524-L528 HydrophobicContact CD2-CD1 4.17Å; Y524-L528 HydrophobicContact CD2-CG 3.93Å; Y524-L528 HydrophobicContact CE1-CD1 4.14Å; Y524-L528 HydrophobicContact CE2-CD1 3.77Å; Y524-L528 HydrophobicContact CE2-CD2 3.74Å; Y524-L528 HydrophobicContact CE2-CG 3.57Å; Y524-L528 PolarHBondContact O-N 3.25Å; S525-L528 PolarHBondContact O-N 2.96Å; L528-L531 CarbonylContact O-C 3.23Å; L528-L531 PolarHBondContact O-N 2.71Å; L528-Q532 PolarHBondContact O-N 3.27Å; L528-K533 HydrophobicContact CB-CB 4.47Å; L528-K533 HydrophobicContact CD2-CB 4.01Å; L528-K533 HydrophobicContact CD2-CD 3.97Å; L528-K533 PolarHBondContact O-N 3.29Å; L528-A536 HydrophobicContact CD1-CB 4.3Å; L528-A536 HydrophobicContact CD2-CB 3.98Å; L528-L537 HydrophobicContact CB-CB 4.12Å; L528-L537 HydrophobicContact CB-CD1 4.38Å; L528-L537 HydrophobicContact CD1-CB 4.29Å; L528-L537 HydrophobicContact CD1-CD1 4.42Å; L528-L540 HydrophobicContact CD1-CD2 3.91Å
529	W	95.9	Very high	95.4	Very high	7 Å²	7	37.2 Å²	37.2	3%	0.027	21%	0.208	C	C	.	.	H	α-helix	trans	-66.2	-42.3	175	-178.9	108.7	0	0	0	111.9	P277 L278 S525 T526 T527 L531 Q532 L537 S563 L564	P277-W529 VanDerWaalsContact CD-CH2 3.44Å; P277-W529 HydrophobicContact CG-CH2 3.84Å; P277-W529 HydrophobicContact CG-CZ2 3.94Å; L278-W529 HydrophobicContact CB-CH2 4.02Å; L278-W529 HydrophobicContact CB-CZ3 3.78Å; L278-W529 HydrophobicContact CD1-CH2 4.4Å; L278-W529 HydrophobicContact CD1-CZ3 4.34Å; L278-W529 HydrophobicContact CG-CH2 4.14Å; L278-W529 HydrophobicContact CG-CZ3 4.28Å; S525-W529 VanDerWaalsContact O-CB 3.32Å; S525-W529 WeakPolarHBondContact O-CB 3.39Å; S525-W529 PolarHBondContact O-N 3.12Å; T526-W529 WeakPolarHBondContact O-CB 3.32Å; T526-W529 PolarHBondContact O-N 3.31Å; T527-W529 VanDerWaalsContact C-N 3.3Å; T527-W529 PolarHBondContact O-N 2.75Å; W529-L531 VanDerWaalsContact C-N 3.31Å; W529-L531 PolarHBondContact O-N 2.87Å; W529-Q532 PolarHBondContact O-N 2.91Å; W529-Q532 VanDerWaalsContact O-N 3.08Å; W529-L537 HydrophobicContact CB-CD2 4.1Å; W529-S563 PolarHBondContact NE1-OG 3.3Å; W529-S563 VanDerWaalsContact NE1-OG 3.16Å; W529-L564 HydrophobicContact CG-CD1 4.34Å
530	H	91.6	Very high	95.5	Very high	22 Å²	22	32.5 Å²	32.5	10%	0.102	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-35.8	172.5	-77.3	-69.6	0	0	0	112.5	L278 F495 Y500 T526 T527 Q532	L278-H530 VanDerWaalsContact CB-CE1 3.43Å; L278-H530 WeakPolarHBondContact CB-CE1 3.38Å; F495-H530 AromaticContact CE2-CD2 3.89Å; Y500-H530 HydrophobicContact CD1-CB 4.33Å; Y500-H530 HydrophobicContact CD2-CB 3.97Å; Y500-H530 HydrophobicContact CE1-CB 4.42Å; Y500-H530 AromaticContact CE1-CD2 3.57Å; Y500-H530 AromaticContact CE1-NE2 3.96Å; Y500-H530 HydrophobicContact CE2-CB 4.07Å; Y500-H530 HydrophobicContact CG-CB 4.11Å; Y500-H530 AromaticContact CZ-CD2 3.72Å; Y500-H530 AromaticContact CZ-CE1 4Å; Y500-H530 AromaticContact CZ-CG 3.83Å; Y500-H530 AromaticContact CZ-NE2 3.86Å; T526-H530 PolarHBondContact O-CD2 3.45Å; T526-H530 PolarHBondContact O-N 3.48Å; T527-H530 PolarHBondContact O-N 3.24Å; H530-Q532 PolarHBondContact O-N 2.8Å
531	L	93.9	Very high	95.7	Very high	48 Å²	48	32.5 Å²	32.5	25%	0.251	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.5	174.7	-65.3	174.2	0	0	0	113.6	M501 E504 T527 L528 W529 K533	M501-L531 HydrophobicContact CG-CD2 3.86Å; E504-L531 HydrophobicContact CB-CD1 3.77Å; E504-L531 HydrophobicContact CG-CD1 4.11Å; T527-L531 HydrophobicContact CG2-CD1 4.37Å; T527-L531 WeakPolarHBondContact O-CG 3.33Å; T527-L531 PolarHBondContact O-N 2.78Å; L528-L531 CarbonylContact O-C 3.23Å; L528-L531 PolarHBondContact O-N 2.71Å; W529-L531 VanDerWaalsContact C-N 3.31Å; W529-L531 PolarHBondContact O-N 2.87Å; L531-K533 VanDerWaalsContact C-N 3.28Å; L531-K533 HydrophobicContact CB-CD 4.05Å; L531-K533 HydrophobicContact CB-CG 3.93Å; L531-K533 HydrophobicContact CD1-CD 4.22Å; L531-K533 PolarHBondContact O-N 3.12Å
532	Q	94.9	Very high	95.8	Very high	97 Å²	97	38.7 Å²	38.7	45%	0.453	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	44.2	-177.1	-58.7	-177.9	-6.9	0	0	112.8	S276 L528 W529 H530 D534 L564	S276-Q532 PolarHBondContact OG-NE2 3.42Å; L528-Q532 PolarHBondContact O-N 3.27Å; W529-Q532 PolarHBondContact O-N 2.91Å; W529-Q532 VanDerWaalsContact O-N 3.08Å; H530-Q532 PolarHBondContact O-N 2.8Å; Q532-D534 PolarHBondContact O-N 2.9Å; Q532-L564 HydrophobicContact CB-CD1 4.46Å; Q532-L564 HydrophobicContact CG-CD1 4.2Å
533	K	95.4	Very high	95.8	Very high	80 Å²	80	40.9 Å²	40.9	35%	0.348	23%	0.225	S	C	.	.			trans	-95.8	62.2	-176.9	-75.2	-174.7	164.6	-173.2	0	112.8	E504 L528 L531 V535 A536 L537	E504-K533 IonicContact OE1-NZ 3.97Å; E504-K533 PolarHBondContact OE1-NZ 3.09Å; E504-K533 IonicContact OE2-NZ 2.8Å; E504-K533 PolarHBondContact OE2-NZ 3.24Å; L528-K533 HydrophobicContact CB-CB 4.47Å; L528-K533 HydrophobicContact CD2-CB 4.01Å; L528-K533 HydrophobicContact CD2-CD 3.97Å; L528-K533 PolarHBondContact O-N 3.29Å; L531-K533 VanDerWaalsContact C-N 3.28Å; L531-K533 HydrophobicContact CB-CD 4.05Å; L531-K533 HydrophobicContact CB-CG 3.93Å; L531-K533 HydrophobicContact CD1-CD 4.22Å; L531-K533 PolarHBondContact O-N 3.12Å; K533-V535 VanDerWaalsContact C-N 3.32Å; K533-V535 PolarHBondContact O-N 3.36Å; K533-V535 VanDerWaalsContact O-N 3.14Å; K533-A536 HydrophobicContact CB-CB 4.23Å; K533-A536 PolarHBondContact O-N 3.32Å; K533-A536 VanDerWaalsContact O-N 3.09Å; K533-L537 PolarHBondContact O-N 2.65Å
534	D	94.6	Very high	95.8	Very high	78 Å²	78	39.9 Å²	39.9	42%	0.417	22%	0.22	S	C	.	.	H	α-helix	trans	-41.2	-52	-176.6	-57.8	2	0	0	0	114.2	Q532 L537 S538 L564	Q532-D534 PolarHBondContact O-N 2.9Å; D534-L537 PolarHBondContact O-N 2.6Å; D534-S538 VanDerWaalsContact O-CB 3.31Å; D534-S538 WeakPolarHBondContact O-CB 3.46Å; D534-S538 PolarHBondContact O-N 3.19Å; D534-L564 WeakPolarHBondContact OD1-CD2 3.49Å; D534-L564 WeakPolarHBondContact OD1-CG 3.21Å
535	V	96.1	Very high	95.7	Very high	127 Å²	127	40.3 Å²	40.3	77%	0.77	22%	0.224	S	C	*	.	H	α-helix	trans	-66.7	-41.7	-174.7	-178.1	0	0	0	0	111.9	K533 A539	K533-V535 VanDerWaalsContact C-N 3.32Å; K533-V535 PolarHBondContact O-N 3.36Å; K533-V535 VanDerWaalsContact O-N 3.14Å; V535-A539 WeakPolarHBondContact O-CB 3.4Å; V535-A539 PolarHBondContact O-N 3.09Å
536	A	95.8	Very high	95.7	Very high	39 Å²	39	45 Å²	45	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-71	-38.6	179	0	0	0	0	0	111.4	L528 K533 A539 L540	L528-A536 HydrophobicContact CD1-CB 4.3Å; L528-A536 HydrophobicContact CD2-CB 3.98Å; K533-A536 HydrophobicContact CB-CB 4.23Å; K533-A536 PolarHBondContact O-N 3.32Å; K533-A536 VanDerWaalsContact O-N 3.09Å; A536-A539 PolarHBondContact O-N 3.14Å; A536-L540 WeakPolarHBondContact O-CB 3.44Å; A536-L540 PolarHBondContact O-N 3.06Å
537	L	96.6	Very high	95.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-67.6	-38.6	176.3	-177.6	54.4	0	0	0	111.7	L528 W529 K533 D534 L540 A541 V557 N560 C561 L564	L528-L537 HydrophobicContact CB-CB 4.12Å; L528-L537 HydrophobicContact CB-CD1 4.38Å; L528-L537 HydrophobicContact CD1-CB 4.29Å; L528-L537 HydrophobicContact CD1-CD1 4.42Å; W529-L537 HydrophobicContact CB-CD2 4.1Å; K533-L537 PolarHBondContact O-N 2.65Å; D534-L537 PolarHBondContact O-N 2.6Å; L537-L540 PolarHBondContact O-N 2.96Å; L537-A541 VanDerWaalsContact O-CB 3.3Å; L537-A541 WeakPolarHBondContact O-CB 3.22Å; L537-A541 PolarHBondContact O-N 2.69Å; L537-V557 HydrophobicContact CD1-CG1 3.92Å; L537-N560 HydrophobicContact CD2-CB 4.43Å; L537-C561 HydrophobicContact CD2-CB 4.41Å; L537-C561 HydrophobicContact CG-CB 3.95Å; L537-L564 HydrophobicContact CD2-CB 4.28Å; L537-L564 HydrophobicContact CD2-CD2 3.73Å
538	S	97.1	Very high	95.4	Very high	55 Å²	55	52.3 Å²	52.3	39%	0.385	29%	0.286	S	S	.	.	H	α-helix	trans	-67	-41.8	174.9	-169.2	0	0	0	0	112.7	D534 A541 K542 C561	D534-S538 VanDerWaalsContact O-CB 3.31Å; D534-S538 WeakPolarHBondContact O-CB 3.46Å; D534-S538 PolarHBondContact O-N 3.19Å; S538-A541 PolarHBondContact O-N 3.04Å; S538-K542 PolarHBondContact O-N 3.34Å; S538-C561 VanDerWaalsContact CA-SG 3.55Å
539	A	96.4	Very high	95.2	Very high	50 Å²	50	57.5 Å²	57.5	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-47.8	173.1	0	0	0	0	0	111.5	V535 A536 A541 K542 D543	V535-A539 WeakPolarHBondContact O-CB 3.4Å; V535-A539 PolarHBondContact O-N 3.09Å; A536-A539 PolarHBondContact O-N 3.14Å; A539-A541 PolarHBondContact O-N 2.9Å; A539-K542 PolarHBondContact O-N 3.34Å; A539-D543 WeakPolarHBondContact O-CB 3.03Å; A539-D543 PolarHBondContact O-N 3.21Å
540	L	96.2	Very high	95.2	Very high	7 Å²	7	62.9 Å²	62.9	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-61.6	-42.6	177.5	-173.7	70.4	0	0	0	112.3	R511 Y524 L528 A536 L537 K542 D543 L544 V557	R511-L540 HydrophobicContact CG-CD1 4.22Å; Y524-L540 HydrophobicContact CD1-CD1 3.99Å; Y524-L540 HydrophobicContact CD1-CD2 3.39Å; Y524-L540 HydrophobicContact CD1-CG 4.34Å; Y524-L540 HydrophobicContact CE1-CD1 3.93Å; Y524-L540 HydrophobicContact CE1-CD2 3.75Å; Y524-L540 HydrophobicContact CE1-CG 4.42Å; Y524-L540 HydrophobicContact CG-CD2 4.08Å; L528-L540 HydrophobicContact CD1-CD2 3.91Å; A536-L540 WeakPolarHBondContact O-CB 3.44Å; A536-L540 PolarHBondContact O-N 3.06Å; L537-L540 PolarHBondContact O-N 2.96Å; L540-K542 VanDerWaalsContact C-N 3.35Å; L540-K542 PolarHBondContact O-N 3.23Å; L540-D543 PolarHBondContact O-N 3.33Å; L540-L544 HydrophobicContact CD1-CD1 3.96Å; L540-L544 HydrophobicContact CD1-CG 4.26Å; L540-L544 HydrophobicContact CG-CD1 3.83Å; L540-L544 HydrophobicContact CG-CG 4.44Å; L540-L544 WeakPolarHBondContact O-CB 3.46Å; L540-L544 VanDerWaalsContact O-CG 3.27Å; L540-L544 WeakPolarHBondContact O-CG 3.28Å; L540-L544 PolarHBondContact O-N 3.43Å; L540-V557 HydrophobicContact CB-CG1 4.17Å; L540-V557 HydrophobicContact CD2-CG1 3.8Å; L540-V557 HydrophobicContact CG-CG1 3.83Å
541	A	96.7	Very high	95.3	Very high	8 Å²	8	62.2 Å²	62.2	7%	0.066	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-44.3	176.5	0	0	0	0	0	111.6	L537 S538 A539 T545 V557 A558 C561	L537-A541 VanDerWaalsContact O-CB 3.3Å; L537-A541 WeakPolarHBondContact O-CB 3.22Å; L537-A541 PolarHBondContact O-N 2.69Å; S538-A541 PolarHBondContact O-N 3.04Å; A539-A541 PolarHBondContact O-N 2.9Å; A541-T545 WeakPolarHBondContact O-CB 3.28Å; A541-T545 WeakPolarHBondContact O-CG2 3.23Å; A541-T545 PolarHBondContact O-N 3.25Å; A541-T545 VanDerWaalsContact O-N 3.11Å; A541-T545 PolarHBondContact O-OG1 2.77Å; A541-V557 HydrophobicContact CB-CG1 3.95Å; A541-A558 HydrophobicContact CB-CB 4.4Å; A541-C561 HydrophobicContact CB-CB 4.12Å
542	K	96.4	Very high	95.4	Very high	130 Å²	130	60.5 Å²	60.5	57%	0.565	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-53.5	176.7	-172.2	-168.5	170.6	-167	0	111.3	S538 A539 L540 L544 T545 D546	S538-K542 PolarHBondContact O-N 3.34Å; A539-K542 PolarHBondContact O-N 3.34Å; L540-K542 VanDerWaalsContact C-N 3.35Å; L540-K542 PolarHBondContact O-N 3.23Å; K542-L544 VanDerWaalsContact C-N 3.33Å; K542-L544 PolarHBondContact O-N 3.24Å; K542-T545 PolarHBondContact O-N 3.02Å; K542-T545 PolarHBondContact O-OG1 3.14Å; K542-D546 WeakPolarHBondContact CE-OD2 3.1Å; K542-D546 WeakPolarHBondContact O-CB 3.25Å; K542-D546 PolarHBondContact O-N 3.21Å
543	D	95.9	Very high	95.4	Very high	72 Å²	72	57.2 Å²	57.2	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-49.3	-54.8	179.7	-82.3	6.2	0	0	0	111.1	R511 A539 L540 T545 D546 M547	R511-D543 IonicContact CZ-OD2 2.73Å; R511-D543 IonicContact NH2-OD2 2.79Å; R511-D543 PolarHBondContact NH2-OD2 3.14Å; A539-D543 WeakPolarHBondContact O-CB 3.03Å; A539-D543 PolarHBondContact O-N 3.21Å; L540-D543 PolarHBondContact O-N 3.33Å; D543-T545 PolarHBondContact O-N 3.49Å; D543-D546 PolarHBondContact O-N 3.34Å; D543-M547 WeakPolarHBondContact O-CB 3.45Å; D543-M547 WeakPolarHBondContact O-CG 3.4Å; D543-M547 PolarHBondContact O-N 2.98Å
544	L	95.8	Very high	95.5	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.5	-41.6	-174.9	-64.8	171.8	0	0	0	111.7	V518 M521 L540 K542 M547 D548 A554 V557	V518-L544 HydrophobicContact CB-CD2 4.24Å; V518-L544 HydrophobicContact CG1-CD2 3.88Å; M521-L544 HydrophobicContact CB-CD1 3.65Å; M521-L544 HydrophobicContact CG-CD1 4.16Å; M521-L544 HydrophobicContact CG-CD2 4.21Å; L540-L544 HydrophobicContact CD1-CD1 3.96Å; L540-L544 HydrophobicContact CD1-CG 4.26Å; L540-L544 HydrophobicContact CG-CD1 3.83Å; L540-L544 HydrophobicContact CG-CG 4.44Å; L540-L544 WeakPolarHBondContact O-CB 3.46Å; L540-L544 VanDerWaalsContact O-CG 3.27Å; L540-L544 WeakPolarHBondContact O-CG 3.28Å; L540-L544 PolarHBondContact O-N 3.43Å; K542-L544 VanDerWaalsContact C-N 3.33Å; K542-L544 PolarHBondContact O-N 3.24Å; L544-M547 PolarHBondContact O-N 3.29Å; L544-D548 PolarHBondContact O-N 3.34Å; L544-A554 HydrophobicContact CB-CB 3.72Å; L544-V557 HydrophobicContact CD1-CB 4.08Å; L544-V557 HydrophobicContact CD1-CG1 4.21Å; L544-V557 HydrophobicContact CD1-CG2 3.5Å
545	T	95.4	Very high	95.6	Very high	25 Å²	25	51.6 Å²	51.6	15%	0.153	28%	0.283	C	S	.	.	H	α-helix	trans	-75	-25.3	179.3	56.4	0	0	0	0	113.6	A541 K542 D543 K549 A554 W555 A558	A541-T545 WeakPolarHBondContact O-CB 3.28Å; A541-T545 WeakPolarHBondContact O-CG2 3.23Å; A541-T545 PolarHBondContact O-N 3.25Å; A541-T545 VanDerWaalsContact O-N 3.11Å; A541-T545 PolarHBondContact O-OG1 2.77Å; K542-T545 PolarHBondContact O-N 3.02Å; K542-T545 PolarHBondContact O-OG1 3.14Å; D543-T545 PolarHBondContact O-N 3.49Å; T545-K549 WeakPolarHBondContact O-CE 3.15Å; T545-K549 WeakPolarHBondContact O-CG 3.42Å; T545-A554 HydrophobicContact CG2-CB 3.91Å; T545-W555 HydrophobicContact CG2-CE3 4.41Å; T545-W555 HydrophobicContact CG2-CZ3 4.49Å; T545-A558 HydrophobicContact CG2-CB 4.28Å
546	D	95.6	Very high	95.6	Very high	100 Å²	100	45.5 Å²	45.5	54%	0.535	25%	0.246	S	C	.	.	H	α-helix	trans	-75.1	-28.5	169.8	-85.7	-26.6	0	0	0	111.9	K542 D543	K542-D546 WeakPolarHBondContact CE-OD2 3.1Å; K542-D546 WeakPolarHBondContact O-CB 3.25Å; K542-D546 PolarHBondContact O-N 3.21Å; D543-D546 PolarHBondContact O-N 3.34Å
547	M	93.3	Very high	95.7	Very high	98 Å²	98	43.7 Å²	43.7	48%	0.483	23%	0.231	S	C	.	.	H	α-helix	trans	-81.5	-50.2	179.2	-69.9	178.6	74.8	0	0	114	S515 D543 L544	S515-M547 VanDerWaalsContact O-CE 3.31Å; S515-M547 WeakPolarHBondContact O-CE 3.39Å; D543-M547 WeakPolarHBondContact O-CB 3.45Å; D543-M547 WeakPolarHBondContact O-CG 3.4Å; D543-M547 PolarHBondContact O-N 2.98Å; L544-M547 PolarHBondContact O-N 3.29Å
548	D	92.6	Very high	95.7	Very high	55 Å²	55	44 Å²	44	29%	0.294	23%	0.233	S	C	.	.			trans	-140.5	136.7	173	-169.9	12	0	0	0	112.1	L544 N550 C551	L544-D548 PolarHBondContact O-N 3.34Å; D548-N550 WeakPolarHBondContact OD1-CB 3.5Å; D548-N550 PolarHBondContact OD1-N 3Å; D548-C551 PolarHBondContact OD2-N 3.33Å
549	K	94.3	Very high	95.7	Very high	109 Å²	109	41.4 Å²	41.4	47%	0.474	22%	0.215	S	C	.	.	S	Bend	trans	-110.7	-2.2	-178.9	-63.9	173.7	-175.9	175.2	0	111.6	T545 W555	T545-K549 WeakPolarHBondContact O-CE 3.15Å; T545-K549 WeakPolarHBondContact O-CG 3.42Å; K549-W555 HydrophobicContact CB-CZ2 4.27Å; K549-W555 PolarHBondContact O-NE1 2.74Å
550	N	94	Very high	95.7	Very high	121 Å²	121	39.2 Å²	39.2	65%	0.647	20%	0.197	S	C	*	.	S	Bend	trans	-113.2	10.4	-179.1	-52.2	-55.1	0	0	0	113.2	D548 V581	D548-N550 WeakPolarHBondContact OD1-CB 3.5Å; D548-N550 PolarHBondContact OD1-N 3Å; N550-V581 WeakPolarHBondContact O-CG1 3.47Å
551	C	93.6	Very high	95.7	Very high	8 Å²	8	39.1 Å²	39.1	5%	0.054	20%	0.196	C	C	.	.			trans	-101.3	139.2	167.6	66.4	0	0	0	0	110.6	V518 D548 E553 A554 W555	V518-C551 HydrophobicContact CG2-CB 4.26Å; D548-C551 PolarHBondContact OD2-N 3.33Å; C551-E553 VanDerWaalsContact C-N 3.3Å; C551-E553 WeakPolarHBondContact CB-OE2 3.4Å; C551-A554 WeakPolarHBondContact SG-CB 3.41Å; C551-W555 VanDerWaalsContact O-CD1 3.27Å
552	P	96.4	Very high	95.7	Very high	11 Å²	11	41.5 Å²	41.5	7%	0.071	21%	0.205	C	C	.	.	H	α-helix	trans	-69.7	-26.5	177.4	29.5	-36.7	0	0	0	112.9	W555 C556 A578 D582 F585	P552-W555 PolarHBondContact O-N 2.92Å; P552-C556 PolarHBondContact O-N 2.95Å; P552-C556 PolarHBondContact O-SG 3.12Å; P552-A578 HydrophobicContact CB-CB 4.23Å; P552-D582 HydrophobicContact CB-CB 4.36Å; P552-D582 HydrophobicContact CG-CB 4.06Å; P552-F585 HydrophobicContact CB-CB 4.02Å; P552-F585 HydrophobicContact CB-CD1 3.85Å; P552-F585 HydrophobicContact CB-CD2 4.31Å; P552-F585 HydrophobicContact CB-CE1 4.35Å; P552-F585 HydrophobicContact CB-CG 3.82Å; P552-F585 HydrophobicContact CG-CB 4.02Å; P552-F585 HydrophobicContact CG-CD1 4.17Å; P552-F585 HydrophobicContact CG-CD2 3.72Å; P552-F585 HydrophobicContact CG-CE2 4.15Å; P552-F585 HydrophobicContact CG-CG 3.72Å
553	E	95.7	Very high	95.7	Very high	28 Å²	28	35.5 Å²	35.5	13%	0.131	18%	0.18	C	C	.	.	H	α-helix	trans	-62.9	-47.8	-176.7	-62.3	81.5	177.4	0	0	111.4	E522 C551 W555 C556 V557 F585	E522-E553 WeakPolarHBondContact OE2-CG 3.34Å; C551-E553 VanDerWaalsContact C-N 3.3Å; C551-E553 WeakPolarHBondContact CB-OE2 3.4Å; E553-W555 VanDerWaalsContact C-N 3.3Å; E553-W555 PolarHBondContact O-N 2.74Å; E553-C556 WeakPolarHBondContact O-CA 3.38Å; E553-C556 WeakPolarHBondContact O-CB 3.45Å; E553-C556 PolarHBondContact O-N 2.99Å; E553-V557 VanDerWaalsContact O-CG2 3.28Å; E553-V557 WeakPolarHBondContact O-CG2 3.36Å; E553-V557 PolarHBondContact O-N 3.31Å; E553-F585 HydrophobicContact CG-CE2 4.31Å; E553-F585 HydrophobicContact CG-CZ 4.09Å
554	A	96.3	Very high	95.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-40.7	179.4	0	0	0	0	0	112.3	L544 T545 C551 V557 A558	L544-A554 HydrophobicContact CB-CB 3.72Å; T545-A554 HydrophobicContact CG2-CB 3.91Å; C551-A554 WeakPolarHBondContact SG-CB 3.41Å; A554-V557 PolarHBondContact O-N 3.16Å; A554-A558 PolarHBondContact O-N 3.25Å
555	W	97.5	Very high	95.5	Very high	40 Å²	40	37.5 Å²	37.5	15%	0.152	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-30.8	175.4	-66.1	116	0	0	0	112.7	T545 K549 C551 P552 E553 G559 F574 R577 A578	T545-W555 HydrophobicContact CG2-CE3 4.41Å; T545-W555 HydrophobicContact CG2-CZ3 4.49Å; K549-W555 HydrophobicContact CB-CZ2 4.27Å; K549-W555 PolarHBondContact O-NE1 2.74Å; C551-W555 VanDerWaalsContact O-CD1 3.27Å; P552-W555 PolarHBondContact O-N 2.92Å; E553-W555 VanDerWaalsContact C-N 3.3Å; E553-W555 PolarHBondContact O-N 2.74Å; W555-G559 PolarHBondContact O-N 3.18Å; W555-F574 AromaticContact CE3-CD1 3.54Å; W555-F574 HydrophobicContact CE3-CD1 3.54Å; W555-F574 HydrophobicContact CE3-CE1 4.09Å; W555-F574 HydrophobicContact CE3-CG 4.41Å; W555-F574 AromaticContact CZ3-CD1 3.62Å; W555-F574 HydrophobicContact CZ3-CD1 3.62Å; W555-F574 AromaticContact CZ3-CE1 3.67Å; W555-F574 HydrophobicContact CZ3-CE1 3.67Å; W555-R577 HydrophobicContact CD2-CB 4.26Å; W555-R577 HydrophobicContact CD2-CG 3.68Å; W555-R577 HydrophobicContact CE3-CG 4.17Å; W555-R577 HydrophobicContact CG-CB 4.35Å; W555-R577 HydrophobicContact CG-CG 3.98Å; W555-R577 HydrophobicContact CZ2-CG 4.1Å; W555-A578 HydrophobicContact CB-CB 3.76Å
556	C	97.1	Very high	95.3	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-68.9	-41.3	170.6	-66.3	0	0	0	0	112.3	E522 P552 E553 G559 N560 F575 L591	E522-C556 HydrophobicContact CB-CB 4.35Å; P552-C556 PolarHBondContact O-N 2.95Å; P552-C556 PolarHBondContact O-SG 3.12Å; E553-C556 WeakPolarHBondContact O-CA 3.38Å; E553-C556 WeakPolarHBondContact O-CB 3.45Å; E553-C556 PolarHBondContact O-N 2.99Å; C556-G559 PolarHBondContact O-N 2.94Å; C556-N560 WeakPolarHBondContact O-CB 3.42Å; C556-N560 PolarHBondContact O-N 3.15Å; C556-F575 HydrophobicContact CB-CE1 4.33Å; C556-F575 WeakPolarHBondContact O-CE1 3.44Å; C556-L591 HydrophobicContact CB-CD1 4.07Å
557	V	97	Very high	95.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.2	-44	175	-177.9	0	0	0	0	110.8	M521 L537 L540 A541 L544 E553 A554 N560 C561	M521-V557 HydrophobicContact CB-CG2 4.35Å; M521-V557 WeakPolarHBondContact O-CG2 3.45Å; L537-V557 HydrophobicContact CD1-CG1 3.92Å; L540-V557 HydrophobicContact CB-CG1 4.17Å; L540-V557 HydrophobicContact CD2-CG1 3.8Å; L540-V557 HydrophobicContact CG-CG1 3.83Å; A541-V557 HydrophobicContact CB-CG1 3.95Å; L544-V557 HydrophobicContact CD1-CB 4.08Å; L544-V557 HydrophobicContact CD1-CG1 4.21Å; L544-V557 HydrophobicContact CD1-CG2 3.5Å; E553-V557 VanDerWaalsContact O-CG2 3.28Å; E553-V557 WeakPolarHBondContact O-CG2 3.36Å; E553-V557 PolarHBondContact O-N 3.31Å; A554-V557 PolarHBondContact O-N 3.16Å; V557-N560 PolarHBondContact O-N 3.41Å; V557-C561 PolarHBondContact O-N 3.34Å
558	A	96.9	Very high	95.5	Very high	7 Å²	7	38.9 Å²	38.9	6%	0.058	18%	0.183	C	C	.	.	H	α-helix	trans	-60.7	-46.8	173.8	0	0	0	0	0	111.9	A541 T545 A554 N560 C561 F562 F574	A541-A558 HydrophobicContact CB-CB 4.4Å; T545-A558 HydrophobicContact CG2-CB 4.28Å; A554-A558 PolarHBondContact O-N 3.25Å; A558-N560 PolarHBondContact O-N 3.49Å; A558-C561 WeakPolarHBondContact O-CB 3.43Å; A558-C561 PolarHBondContact O-N 2.89Å; A558-C561 VanDerWaalsContact O-N 3.12Å; A558-F562 WeakPolarHBondContact O-CD2 3.34Å; A558-F562 PolarHBondContact O-N 2.98Å; A558-F574 HydrophobicContact CB-CB 4.48Å; A558-F574 HydrophobicContact CB-CD2 4.28Å; A558-F574 HydrophobicContact CB-CG 4.23Å
559	G	96.8	Very high	95.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-45.7	175.6	0	0	0	0	0	112.8	W555 C556 C561 F562 S563 A571	W555-G559 PolarHBondContact O-N 3.18Å; C556-G559 PolarHBondContact O-N 2.94Å; G559-C561 VanDerWaalsContact C-N 3.33Å; G559-C561 PolarHBondContact O-N 3.06Å; G559-F562 PolarHBondContact O-N 3.39Å; G559-S563 WeakPolarHBondContact O-CB 3.34Å; G559-S563 PolarHBondContact O-N 3.03Å; G559-A571 VanDerWaalsContact O-CB 3.29Å; G559-A571 WeakPolarHBondContact O-CB 3.47Å
560	N	96.2	Very high	95.7	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.027	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-37.7	175.3	-83	-16.5	0	0	0	112.2	S525 T526 L537 C556 V557 A558 S563 L564 F575	S525-N560 PolarHBondContact OG-ND2 3.26Å; T526-N560 PolarHBondContact OG1-ND2 2.76Å; T526-N560 VanDerWaalsContact OG1-ND2 3.11Å; L537-N560 HydrophobicContact CD2-CB 4.43Å; C556-N560 WeakPolarHBondContact O-CB 3.42Å; C556-N560 PolarHBondContact O-N 3.15Å; V557-N560 PolarHBondContact O-N 3.41Å; A558-N560 PolarHBondContact O-N 3.49Å; N560-S563 PolarHBondContact O-N 2.96Å; N560-L564 PolarHBondContact O-N 2.99Å; N560-F575 WeakPolarHBondContact OD1-CZ 3.43Å
561	C	96.7	Very high	95.9	Very high	4 Å²	4	33.6 Å²	33.6	3%	0.027	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-46.6	176	-172.3	0	0	0	0	112.5	L537 S538 A541 V557 A558 G559 Q565	L537-C561 HydrophobicContact CD2-CB 4.41Å; L537-C561 HydrophobicContact CG-CB 3.95Å; S538-C561 VanDerWaalsContact CA-SG 3.55Å; A541-C561 HydrophobicContact CB-CB 4.12Å; V557-C561 PolarHBondContact O-N 3.34Å; A558-C561 WeakPolarHBondContact O-CB 3.43Å; A558-C561 PolarHBondContact O-N 2.89Å; A558-C561 VanDerWaalsContact O-N 3.12Å; G559-C561 VanDerWaalsContact C-N 3.33Å; G559-C561 PolarHBondContact O-N 3.06Å; C561-Q565 WeakPolarHBondContact O-CG 3.38Å; C561-Q565 PolarHBondContact O-N 3.42Å
562	F	96.6	Very high	96.1	Very high	58 Å²	58	34 Å²	34	25%	0.254	16%	0.16	S	C	.	.	H	α-helix	trans	-75.4	-31.4	179	-74.3	-80.9	0	0	0	112.7	A558 G559 Q565 R566 E567 I570 A571 F574	A558-F562 WeakPolarHBondContact O-CD2 3.34Å; A558-F562 PolarHBondContact O-N 2.98Å; G559-F562 PolarHBondContact O-N 3.39Å; F562-Q565 CarbonylContact O-C 3.57Å; F562-Q565 PolarHBondContact O-N 2.84Å; F562-R566 PolarHBondContact O-N 2.88Å; F562-R566 VanDerWaalsContact O-N 3.13Å; F562-E567 HydrophobicContact CB-CB 4.3Å; F562-E567 HydrophobicContact CD1-CB 4.09Å; F562-E567 VanDerWaalsContact CD1-OE2 3.31Å; F562-E567 WeakPolarHBondContact CD1-OE2 3.48Å; F562-E567 PolarHBondContact O-N 3.42Å; F562-I570 HydrophobicContact CB-CB 4.39Å; F562-I570 HydrophobicContact CB-CG2 4.04Å; F562-I570 HydrophobicContact CD1-CB 4.3Å; F562-I570 HydrophobicContact CD1-CG2 3.65Å; F562-I570 HydrophobicContact CD2-CG2 3.91Å; F562-I570 HydrophobicContact CE1-CG2 4.05Å; F562-I570 HydrophobicContact CE2-CG2 4.3Å; F562-I570 HydrophobicContact CG-CB 4.34Å; F562-I570 HydrophobicContact CG-CG2 3.57Å; F562-I570 HydrophobicContact CZ-CG2 4.36Å; F562-A571 HydrophobicContact CB-CB 4.24Å; F562-F574 AromaticContact CD2-CD2 3.78Å; F562-F574 HydrophobicContact CD2-CD2 3.78Å; F562-F574 AromaticContact CD2-CE2 3.44Å; F562-F574 HydrophobicContact CD2-CE2 3.44Å; F562-F574 VanDerWaalsContact CD2-CE2 3.44Å; F562-F574 HydrophobicContact CE2-CD2 4.24Å; F562-F574 AromaticContact CE2-CE2 3.47Å; F562-F574 HydrophobicContact CE2-CE2 3.47Å; F562-F574 VanDerWaalsContact CE2-CE2 3.47Å; F562-F574 HydrophobicContact CE2-CZ 4.28Å; F562-F574 HydrophobicContact CG-CE2 4.3Å; F562-F574 HydrophobicContact CZ-CE2 4.33Å
563	S	95.4	Very high	96.2	Very high	5 Å²	5	39.2 Å²	39.2	4%	0.035	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-45.1	170.4	171.3	0	0	0	0	111.5	W529 G559 N560 Q565 R566 E595	W529-S563 PolarHBondContact NE1-OG 3.3Å; W529-S563 VanDerWaalsContact NE1-OG 3.16Å; G559-S563 WeakPolarHBondContact O-CB 3.34Å; G559-S563 PolarHBondContact O-N 3.03Å; N560-S563 PolarHBondContact O-N 2.96Å; S563-Q565 VanDerWaalsContact C-N 3.3Å; S563-Q565 PolarHBondContact O-N 3.03Å; S563-R566 WeakPolarHBondContact O-CA 3.48Å; S563-R566 PolarHBondContact O-N 3.21Å; S563-E595 VanDerWaalsContact CB-OE1 3.24Å; S563-E595 WeakPolarHBondContact CB-OE1 3.09Å; S563-E595 PolarHBondContact OG-OE1 3.49Å
564	L	94.4	Very high	96.3	Very high	30 Å²	30	40.4 Å²	40.4	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-37.4	177.3	-171	58.6	0	0	0	112.3	W529 Q532 D534 L537 N560 R566	W529-L564 HydrophobicContact CG-CD1 4.34Å; Q532-L564 HydrophobicContact CB-CD1 4.46Å; Q532-L564 HydrophobicContact CG-CD1 4.2Å; D534-L564 WeakPolarHBondContact OD1-CD2 3.49Å; D534-L564 WeakPolarHBondContact OD1-CG 3.21Å; L537-L564 HydrophobicContact CD2-CB 4.28Å; L537-L564 HydrophobicContact CD2-CD2 3.73Å; N560-L564 PolarHBondContact O-N 2.99Å; L564-R566 PolarHBondContact O-N 2.92Å
565	Q	93.8	Very high	96.3	Very high	84 Å²	84	40.4 Å²	40.4	39%	0.393	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-3.3	174.3	-66.6	171.7	-3.3	0	0	113.6	C561 F562 S563 E567	C561-Q565 WeakPolarHBondContact O-CG 3.38Å; C561-Q565 PolarHBondContact O-N 3.42Å; F562-Q565 CarbonylContact O-C 3.57Å; F562-Q565 PolarHBondContact O-N 2.84Å; S563-Q565 VanDerWaalsContact C-N 3.3Å; S563-Q565 PolarHBondContact O-N 3.03Å; Q565-E567 VanDerWaalsContact C-N 3.27Å; Q565-E567 HydrophobicContact CB-CG 4.48Å; Q565-E567 PolarHBondContact O-N 3.42Å
566	R	92.1	Very high	96.3	Very high	119 Å²	119	42.3 Å²	42.3	45%	0.449	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	18.8	-174	-57.9	-178.9	169.2	159.7	0.6	115.6	A273 L275 F562 S563 L564 H568	A273-R566 PolarHBondContact O-NH1 3.14Å; A273-R566 PolarHBondContact O-NH2 3.21Å; L275-R566 VanDerWaalsContact CB-NH2 3.35Å; F562-R566 PolarHBondContact O-N 2.88Å; F562-R566 VanDerWaalsContact O-N 3.13Å; S563-R566 WeakPolarHBondContact O-CA 3.48Å; S563-R566 PolarHBondContact O-N 3.21Å; L564-R566 PolarHBondContact O-N 2.92Å; R566-H568 PolarHBondContact O-CD2 3.41Å; R566-H568 VanDerWaalsContact O-CD2 3.25Å; R566-H568 PolarHBondContact O-N 3.28Å
567	E	95.6	Very high	96.3	Very high	90 Å²	90	46.9 Å²	46.9	42%	0.421	22%	0.215	S	C	.	.			trans	-85.4	59.3	172.5	-61.8	-164.3	167.4	0	0	110.5	F562 Q565 D569 I570 A571	F562-E567 HydrophobicContact CB-CB 4.3Å; F562-E567 HydrophobicContact CD1-CB 4.09Å; F562-E567 VanDerWaalsContact CD1-OE2 3.31Å; F562-E567 WeakPolarHBondContact CD1-OE2 3.48Å; F562-E567 PolarHBondContact O-N 3.42Å; Q565-E567 VanDerWaalsContact C-N 3.27Å; Q565-E567 HydrophobicContact CB-CG 4.48Å; Q565-E567 PolarHBondContact O-N 3.42Å; E567-D569 VanDerWaalsContact C-N 3.28Å; E567-D569 PolarHBondContact O-N 3.08Å; E567-I570 HydrophobicContact CB-CB 4.31Å; E567-I570 HydrophobicContact CB-CD1 4.34Å; E567-I570 WeakPolarHBondContact O-CA 3.33Å; E567-I570 WeakPolarHBondContact O-CB 3.45Å; E567-I570 PolarHBondContact O-N 2.98Å; E567-I570 WeakPolarHBondContact OE2-CD1 3.08Å; E567-A571 PolarHBondContact O-N 3.5Å
568	H	96.1	Very high	96.3	Very high	42 Å²	42	46.9 Å²	46.9	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-55.5	-38.3	-172.3	-59.4	-60.1	0	0	0	113.2	R566 I570 A571 I572 E595 L598 T599	R566-H568 PolarHBondContact O-CD2 3.41Å; R566-H568 VanDerWaalsContact O-CD2 3.25Å; R566-H568 PolarHBondContact O-N 3.28Å; H568-I570 PolarHBondContact O-N 3.05Å; H568-A571 PolarHBondContact O-N 3.05Å; H568-I572 WeakPolarHBondContact O-CB 3.47Å; H568-I572 WeakPolarHBondContact O-CD1 3.44Å; H568-I572 VanDerWaalsContact O-CG1 3.23Å; H568-I572 WeakPolarHBondContact O-CG1 3.21Å; H568-I572 PolarHBondContact O-N 3.43Å; H568-E595 IonicContact CE1-OE2 2.64Å; H568-E595 IonicContact CG-OE2 2.74Å; H568-E595 IonicContact ND1-OE2 3.8Å; H568-E595 PolarHBondContact ND1-OE2 3.29Å; H568-L598 WeakPolarHBondContact CE1-CD1 3.44Å; H568-T599 HydrophobicContact CB-CG2 3.92Å
569	D	95.5	Very high	96.3	Very high	116 Å²	116	47.8 Å²	47.8	62%	0.62	22%	0.218	S	C	*	.	H	α-helix	trans	-59.7	-25.8	174.3	-77.1	-42.3	0	0	0	114.1	E567 K573	E567-D569 VanDerWaalsContact C-N 3.28Å; E567-D569 PolarHBondContact O-N 3.08Å; D569-K573 WeakPolarHBondContact O-CD 3.32Å; D569-K573 WeakPolarHBondContact O-CE 3.3Å; D569-K573 VanDerWaalsContact O-CG 3.31Å; D569-K573 WeakPolarHBondContact O-CG 3.31Å; D569-K573 PolarHBondContact O-NZ 2.71Å
570	I	97.1	Very high	96.3	Very high	59 Å²	59	53.6 Å²	53.6	30%	0.303	25%	0.246	S	C	.	.	H	α-helix	trans	-92.6	-40.7	179.5	-69.7	169.3	0	0	0	109.3	F562 E567 H568 I572 K573 F574	F562-I570 HydrophobicContact CB-CB 4.39Å; F562-I570 HydrophobicContact CB-CG2 4.04Å; F562-I570 HydrophobicContact CD1-CB 4.3Å; F562-I570 HydrophobicContact CD1-CG2 3.65Å; F562-I570 HydrophobicContact CD2-CG2 3.91Å; F562-I570 HydrophobicContact CE1-CG2 4.05Å; F562-I570 HydrophobicContact CE2-CG2 4.3Å; F562-I570 HydrophobicContact CG-CB 4.34Å; F562-I570 HydrophobicContact CG-CG2 3.57Å; F562-I570 HydrophobicContact CZ-CG2 4.36Å; E567-I570 HydrophobicContact CB-CB 4.31Å; E567-I570 HydrophobicContact CB-CD1 4.34Å; E567-I570 WeakPolarHBondContact O-CA 3.33Å; E567-I570 WeakPolarHBondContact O-CB 3.45Å; E567-I570 PolarHBondContact O-N 2.98Å; E567-I570 WeakPolarHBondContact OE2-CD1 3.08Å; H568-I570 PolarHBondContact O-N 3.05Å; I570-I572 PolarHBondContact O-N 3.31Å; I570-K573 WeakPolarHBondContact O-CB 3.46Å; I570-K573 PolarHBondContact O-N 3.45Å; I570-K573 VanDerWaalsContact O-N 3.14Å; I570-F574 HydrophobicContact CG2-CD2 3.87Å; I570-F574 HydrophobicContact CG2-CE2 3.36Å; I570-F574 HydrophobicContact CG2-CZ 4.24Å; I570-F574 VanDerWaalsContact O-CD2 3.32Å; I570-F574 WeakPolarHBondContact O-CD2 3.41Å; I570-F574 PolarHBondContact O-N 3.14Å; I570-F574 VanDerWaalsContact O-N 3.14Å
571	A	97.2	Very high	96.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.9	-48.2	171.1	0	0	0	0	0	112.2	G559 F562 E567 H568 K573 F574 F575 E595	G559-A571 VanDerWaalsContact O-CB 3.29Å; G559-A571 WeakPolarHBondContact O-CB 3.47Å; F562-A571 HydrophobicContact CB-CB 4.24Å; E567-A571 PolarHBondContact O-N 3.5Å; H568-A571 PolarHBondContact O-N 3.05Å; A571-K573 VanDerWaalsContact C-N 3.29Å; A571-K573 PolarHBondContact O-N 3.25Å; A571-F574 PolarHBondContact O-N 3.39Å; A571-F574 VanDerWaalsContact O-N 3.08Å; A571-F575 HydrophobicContact CB-CD2 4.42Å; A571-F575 HydrophobicContact CB-CE2 4.02Å; A571-F575 WeakPolarHBondContact O-CD2 3.17Å; A571-F575 PolarHBondContact O-N 3.14Å; A571-E595 HydrophobicContact CB-CG 4.26Å
572	I	97.8	Very high	96.1	Very high	15 Å²	15	58.1 Å²	58.1	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-54.2	-42.7	175.8	-75.1	165.5	0	0	0	111.6	H568 I570 Q576 L592 E595 F596 T599	H568-I572 WeakPolarHBondContact O-CB 3.47Å; H568-I572 WeakPolarHBondContact O-CD1 3.44Å; H568-I572 VanDerWaalsContact O-CG1 3.23Å; H568-I572 WeakPolarHBondContact O-CG1 3.21Å; H568-I572 PolarHBondContact O-N 3.43Å; I570-I572 PolarHBondContact O-N 3.31Å; I572-Q576 VanDerWaalsContact CG2-NE2 3.34Å; I572-Q576 WeakPolarHBondContact O-CB 3.48Å; I572-Q576 WeakPolarHBondContact O-CG 3.31Å; I572-Q576 PolarHBondContact O-N 3.26Å; I572-L592 HydrophobicContact CB-CD1 4.24Å; I572-L592 HydrophobicContact CG1-CD1 4.13Å; I572-L592 HydrophobicContact CG2-CD1 3.97Å; I572-E595 HydrophobicContact CD1-CB 4.3Å; I572-E595 HydrophobicContact CG1-CB 3.74Å; I572-E595 HydrophobicContact CG1-CG 4.45Å; I572-F596 HydrophobicContact CD1-CD1 3.96Å; I572-F596 HydrophobicContact CD1-CE1 3.89Å; I572-F596 HydrophobicContact CG1-CD1 4.44Å; I572-F596 HydrophobicContact CG1-CE1 4.24Å; I572-F596 HydrophobicContact CG2-CE1 4.02Å; I572-F596 HydrophobicContact CG2-CZ 4.19Å; I572-T599 HydrophobicContact CD1-CG2 4.1Å
573	K	97.8	Very high	96	Very high	122 Å²	122	59 Å²	59	53%	0.53	28%	0.282	S	S	.	.	H	α-helix	trans	-66.2	-38.4	178.6	-67.7	171.6	-172.6	104.8	0	111.9	D569 I570 A571 R577	D569-K573 WeakPolarHBondContact O-CD 3.32Å; D569-K573 WeakPolarHBondContact O-CE 3.3Å; D569-K573 VanDerWaalsContact O-CG 3.31Å; D569-K573 WeakPolarHBondContact O-CG 3.31Å; D569-K573 PolarHBondContact O-NZ 2.71Å; I570-K573 WeakPolarHBondContact O-CB 3.46Å; I570-K573 PolarHBondContact O-N 3.45Å; I570-K573 VanDerWaalsContact O-N 3.14Å; A571-K573 VanDerWaalsContact C-N 3.29Å; A571-K573 PolarHBondContact O-N 3.25Å; K573-R577 WeakPolarHBondContact O-CB 3.36Å; K573-R577 PolarHBondContact O-N 3.39Å
574	F	97.6	Very high	95.8	Very high	52 Å²	52	60.5 Å²	60.5	23%	0.228	30%	0.299	C	S	.	.	H	α-helix	trans	-72.8	-39.6	177	-66.8	-50.3	0	0	0	113	W555 A558 F562 I570 A571 R577 A578	W555-F574 AromaticContact CE3-CD1 3.54Å; W555-F574 HydrophobicContact CE3-CD1 3.54Å; W555-F574 HydrophobicContact CE3-CE1 4.09Å; W555-F574 HydrophobicContact CE3-CG 4.41Å; W555-F574 AromaticContact CZ3-CD1 3.62Å; W555-F574 HydrophobicContact CZ3-CD1 3.62Å; W555-F574 AromaticContact CZ3-CE1 3.67Å; W555-F574 HydrophobicContact CZ3-CE1 3.67Å; A558-F574 HydrophobicContact CB-CB 4.48Å; A558-F574 HydrophobicContact CB-CD2 4.28Å; A558-F574 HydrophobicContact CB-CG 4.23Å; F562-F574 AromaticContact CD2-CD2 3.78Å; F562-F574 HydrophobicContact CD2-CD2 3.78Å; F562-F574 AromaticContact CD2-CE2 3.44Å; F562-F574 HydrophobicContact CD2-CE2 3.44Å; F562-F574 VanDerWaalsContact CD2-CE2 3.44Å; F562-F574 HydrophobicContact CE2-CD2 4.24Å; F562-F574 AromaticContact CE2-CE2 3.47Å; F562-F574 HydrophobicContact CE2-CE2 3.47Å; F562-F574 VanDerWaalsContact CE2-CE2 3.47Å; F562-F574 HydrophobicContact CE2-CZ 4.28Å; F562-F574 HydrophobicContact CG-CE2 4.3Å; F562-F574 HydrophobicContact CZ-CE2 4.33Å; I570-F574 HydrophobicContact CG2-CD2 3.87Å; I570-F574 HydrophobicContact CG2-CE2 3.36Å; I570-F574 HydrophobicContact CG2-CZ 4.24Å; I570-F574 VanDerWaalsContact O-CD2 3.32Å; I570-F574 WeakPolarHBondContact O-CD2 3.41Å; I570-F574 PolarHBondContact O-N 3.14Å; I570-F574 VanDerWaalsContact O-N 3.14Å; A571-F574 PolarHBondContact O-N 3.39Å; A571-F574 VanDerWaalsContact O-N 3.08Å; F574-R577 CarbonylContact O-C 3.22Å; F574-R577 WeakPolarHBondContact O-CA 3.44Å; F574-R577 WeakPolarHBondContact O-CB 3.47Å; F574-R577 PolarHBondContact O-N 3.14Å; F574-A578 PolarHBondContact O-N 3.46Å
575	F	97.9	Very high	95.8	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-36.9	173	-61	-55	0	0	0	112.6	C556 N560 A571 R577 A578 I579 L591 L592 E595	C556-F575 HydrophobicContact CB-CE1 4.33Å; C556-F575 WeakPolarHBondContact O-CE1 3.44Å; N560-F575 WeakPolarHBondContact OD1-CZ 3.43Å; A571-F575 HydrophobicContact CB-CD2 4.42Å; A571-F575 HydrophobicContact CB-CE2 4.02Å; A571-F575 WeakPolarHBondContact O-CD2 3.17Å; A571-F575 PolarHBondContact O-N 3.14Å; F575-R577 VanDerWaalsContact C-N 3.26Å; F575-R577 PolarHBondContact O-N 3.15Å; F575-A578 WeakPolarHBondContact O-CB 3.46Å; F575-A578 PolarHBondContact O-N 2.88Å; F575-I579 WeakPolarHBondContact O-CG1 3.31Å; F575-I579 PolarHBondContact O-N 3.44Å; F575-I579 VanDerWaalsContact O-N 3.13Å; F575-L591 HydrophobicContact CD1-CB 3.82Å; F575-L591 HydrophobicContact CD1-CD1 4.19Å; F575-L591 HydrophobicContact CD2-CB 4.43Å; F575-L591 HydrophobicContact CE1-CB 3.55Å; F575-L591 HydrophobicContact CE1-CD1 3.5Å; F575-L591 VanDerWaalsContact CE1-CD1 3.5Å; F575-L591 HydrophobicContact CE1-CG 4.15Å; F575-L591 HydrophobicContact CE2-CB 4.19Å; F575-L591 HydrophobicContact CG-CB 4.26Å; F575-L591 HydrophobicContact CZ-CB 3.74Å; F575-L591 HydrophobicContact CZ-CD1 4.12Å; F575-L591 HydrophobicContact CZ-CG 4.48Å; F575-L592 HydrophobicContact CB-CB 3.84Å; F575-L592 HydrophobicContact CB-CD1 4.22Å; F575-L592 HydrophobicContact CB-CG 4.49Å; F575-E595 HydrophobicContact CD2-CG 3.84Å; F575-E595 HydrophobicContact CE2-CG 3.54Å
576	Q	97.6	Very high	95.9	Very high	79 Å²	79	57 Å²	57	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-36.6	168.3	-74.6	174.8	13.5	0	0	111.8	I572 I579 Q580 L592	I572-Q576 VanDerWaalsContact CG2-NE2 3.34Å; I572-Q576 WeakPolarHBondContact O-CB 3.48Å; I572-Q576 WeakPolarHBondContact O-CG 3.31Å; I572-Q576 PolarHBondContact O-N 3.26Å; Q576-I579 PolarHBondContact O-N 3.38Å; Q576-Q580 WeakPolarHBondContact O-CG 3.42Å; Q576-Q580 PolarHBondContact O-N 2.95Å; Q576-L592 HydrophobicContact CG-CD1 4.3Å; Q576-L592 HydrophobicContact CG-CD2 3.94Å
577	R	97.1	Very high	96.1	Very high	97 Å²	97	52.5 Å²	52.5	37%	0.366	27%	0.266	S	S	.	.	H	α-helix	trans	-68.2	-39.4	175.5	-174.3	60.1	-172.4	162.9	6.8	112.5	W555 K573 F574 F575 I579 Q580 V581	W555-R577 HydrophobicContact CD2-CB 4.26Å; W555-R577 HydrophobicContact CD2-CG 3.68Å; W555-R577 HydrophobicContact CE3-CG 4.17Å; W555-R577 HydrophobicContact CG-CB 4.35Å; W555-R577 HydrophobicContact CG-CG 3.98Å; W555-R577 HydrophobicContact CZ2-CG 4.1Å; K573-R577 WeakPolarHBondContact O-CB 3.36Å; K573-R577 PolarHBondContact O-N 3.39Å; F574-R577 CarbonylContact O-C 3.22Å; F574-R577 WeakPolarHBondContact O-CA 3.44Å; F574-R577 WeakPolarHBondContact O-CB 3.47Å; F574-R577 PolarHBondContact O-N 3.14Å; F575-R577 VanDerWaalsContact C-N 3.26Å; F575-R577 PolarHBondContact O-N 3.15Å; R577-I579 VanDerWaalsContact C-N 3.31Å; R577-I579 PolarHBondContact O-N 2.87Å; R577-Q580 WeakPolarHBondContact O-CB 3.49Å; R577-Q580 PolarHBondContact O-N 3.32Å; R577-V581 WeakPolarHBondContact O-CG2 3.35Å; R577-V581 PolarHBondContact O-N 3.07Å; R577-V581 VanDerWaalsContact O-N 3.07Å
578	A	97.1	Very high	96.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-56.7	-45.1	172.4	0	0	0	0	0	111.6	P552 W555 F574 F575 Q580 V581 D582 A588	P552-A578 HydrophobicContact CB-CB 4.23Å; W555-A578 HydrophobicContact CB-CB 3.76Å; F574-A578 PolarHBondContact O-N 3.46Å; F575-A578 WeakPolarHBondContact O-CB 3.46Å; F575-A578 PolarHBondContact O-N 2.88Å; A578-Q580 PolarHBondContact O-N 3.11Å; A578-V581 WeakPolarHBondContact O-CB 3.15Å; A578-V581 PolarHBondContact O-N 3.32Å; A578-V581 VanDerWaalsContact O-N 3.12Å; A578-D582 PolarHBondContact O-N 3.15Å; A578-A588 HydrophobicContact CB-CB 3.73Å
579	I	97	Very high	96.2	Very high	26 Å²	26	47.6 Å²	47.6	13%	0.133	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-33.3	177.6	-66.3	162.1	0	0	0	112.6	F575 Q576 R577 V581 D582 P583 A588 Y589 L592	F575-I579 WeakPolarHBondContact O-CG1 3.31Å; F575-I579 PolarHBondContact O-N 3.44Å; F575-I579 VanDerWaalsContact O-N 3.13Å; Q576-I579 PolarHBondContact O-N 3.38Å; R577-I579 VanDerWaalsContact C-N 3.31Å; R577-I579 PolarHBondContact O-N 2.87Å; I579-V581 VanDerWaalsContact C-N 3.28Å; I579-D582 CarbonylContact O-C 3.28Å; I579-P583 WeakPolarHBondContact O-CA 3.45Å; I579-P583 WeakPolarHBondContact O-CD 3.36Å; I579-P583 WeakPolarHBondContact O-CG 3.38Å; I579-A588 HydrophobicContact CD1-CB 4.44Å; I579-A588 HydrophobicContact CG1-CB 3.76Å; I579-Y589 HydrophobicContact CD1-CD1 3.67Å; I579-Y589 HydrophobicContact CD1-CD2 4.48Å; I579-Y589 HydrophobicContact CD1-CE1 3.97Å; I579-Y589 HydrophobicContact CD1-CG 3.97Å; I579-Y589 HydrophobicContact CG1-CD1 4.18Å; I579-Y589 HydrophobicContact CG1-CD2 4.21Å; I579-Y589 HydrophobicContact CG1-CE1 4.19Å; I579-Y589 HydrophobicContact CG1-CE2 4.21Å; I579-Y589 HydrophobicContact CG1-CG 4.2Å; I579-Y589 HydrophobicContact CG2-CD1 4.49Å; I579-Y589 HydrophobicContact CG2-CE1 3.69Å; I579-Y589 HydrophobicContact CG2-CE2 4.17Å; I579-L592 HydrophobicContact CD1-CB 4.42Å; I579-L592 HydrophobicContact CD1-CD2 3.54Å
580	Q	96.1	Very high	96.3	Very high	122 Å²	122	42.1 Å²	42.1	57%	0.57	21%	0.213	S	C	*	.	H	α-helix	trans	-69	-27	172.7	-72.1	169.5	16.8	0	0	112.9	Q576 R577 A578	Q576-Q580 WeakPolarHBondContact O-CG 3.42Å; Q576-Q580 PolarHBondContact O-N 2.95Å; R577-Q580 WeakPolarHBondContact O-CB 3.49Å; R577-Q580 PolarHBondContact O-N 3.32Å; A578-Q580 PolarHBondContact O-N 3.11Å
581	V	95.2	Very high	96.3	Very high	38 Å²	38	39.6 Å²	39.6	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-82.7	-50.2	-178.6	165.3	0	0	0	0	110.7	N550 R577 A578 I579	N550-V581 WeakPolarHBondContact O-CG1 3.47Å; R577-V581 WeakPolarHBondContact O-CG2 3.35Å; R577-V581 PolarHBondContact O-N 3.07Å; R577-V581 VanDerWaalsContact O-N 3.07Å; A578-V581 WeakPolarHBondContact O-CB 3.15Å; A578-V581 PolarHBondContact O-N 3.32Å; A578-V581 VanDerWaalsContact O-N 3.12Å; I579-V581 VanDerWaalsContact C-N 3.28Å
582	D	93.9	Very high	96.3	Very high	65 Å²	65	39.9 Å²	39.9	35%	0.348	20%	0.202	S	C	.	.			trans	-131.5	104.3	165.5	-178.4	26.5	0	0	0	112.3	P552 A578 I579 G584 F585	P552-D582 HydrophobicContact CB-CB 4.36Å; P552-D582 HydrophobicContact CG-CB 4.06Å; A578-D582 PolarHBondContact O-N 3.15Å; I579-D582 CarbonylContact O-C 3.28Å; D582-G584 PolarHBondContact O-N 2.89Å; D582-G584 VanDerWaalsContact O-N 3.13Å; D582-G584 WeakPolarHBondContact OD1-CA 3.42Å; D582-G584 PolarHBondContact OD1-N 2.85Å; D582-F585 HydrophobicContact CB-CB 4.15Å; D582-F585 WeakPolarHBondContact O-CB 3.37Å; D582-F585 PolarHBondContact O-N 2.85Å; D582-F585 VanDerWaalsContact O-N 3.11Å; D582-F585 PolarHBondContact OD2-N 3.3Å
583	P	93.4	Very high	96.2	Very high	77 Å²	77	39.2 Å²	39.2	50%	0.5	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.6	170.3	-23.2	34.1	0	0	0	114.4	I579 Y589	I579-P583 WeakPolarHBondContact O-CA 3.45Å; I579-P583 WeakPolarHBondContact O-CD 3.36Å; I579-P583 WeakPolarHBondContact O-CG 3.38Å; P583-Y589 WeakPolarHBondContact O-CE2 3.29Å; P583-Y589 PolarHBondContact O-OH 3.45Å
584	G	91.2	Very high	96.1	Very high	37 Å²	37	34 Å²	34	38%	0.381	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.3	173.5	0	0	0	0	0	115.2	D582 A586 V615	D582-G584 PolarHBondContact O-N 2.89Å; D582-G584 VanDerWaalsContact O-N 3.13Å; D582-G584 WeakPolarHBondContact OD1-CA 3.42Å; D582-G584 PolarHBondContact OD1-N 2.85Å; G584-A586 PolarHBondContact O-N 2.93Å; G584-V615 VanDerWaalsContact C-CG1 3.46Å; G584-V615 WeakPolarHBondContact O-CG1 3.48Å
585	F	95.1	Very high	96	Very high	31 Å²	31	31.8 Å²	31.8	14%	0.136	17%	0.166	C	C	.	.			trans	-91.6	90.3	-175.5	-165.4	-104.8	0	0	0	112.5	E522 P552 E553 D582 Y587 A588	E522-F585 HydrophobicContact CB-CZ 4.35Å; E522-F585 HydrophobicContact CG-CZ 3.94Å; P552-F585 HydrophobicContact CB-CB 4.02Å; P552-F585 HydrophobicContact CB-CD1 3.85Å; P552-F585 HydrophobicContact CB-CD2 4.31Å; P552-F585 HydrophobicContact CB-CE1 4.35Å; P552-F585 HydrophobicContact CB-CG 3.82Å; P552-F585 HydrophobicContact CG-CB 4.02Å; P552-F585 HydrophobicContact CG-CD1 4.17Å; P552-F585 HydrophobicContact CG-CD2 3.72Å; P552-F585 HydrophobicContact CG-CE2 4.15Å; P552-F585 HydrophobicContact CG-CG 3.72Å; E553-F585 HydrophobicContact CG-CE2 4.31Å; E553-F585 HydrophobicContact CG-CZ 4.09Å; D582-F585 HydrophobicContact CB-CB 4.15Å; D582-F585 WeakPolarHBondContact O-CB 3.37Å; D582-F585 PolarHBondContact O-N 2.85Å; D582-F585 VanDerWaalsContact O-N 3.11Å; D582-F585 PolarHBondContact OD2-N 3.3Å; F585-Y587 HydrophobicContact CE1-CD1 4.42Å; F585-Y587 PolarHBondContact O-N 2.85Å; F585-Y587 VanDerWaalsContact O-N 3.11Å; F585-A588 HydrophobicContact CD1-CB 3.77Å; F585-A588 HydrophobicContact CE1-CB 4.42Å; F585-A588 PolarHBondContact O-N 3.48Å
586	A	95.3	Very high	95.9	Very high	10 Å²	10	32.1 Å²	32.1	8%	0.083	17%	0.167	C	C	.	.	H	α-helix	trans	-56.7	-28.8	-173.8	0	0	0	0	0	115.2	G584 T590 V615 N616	G584-A586 PolarHBondContact O-N 2.93Å; A586-T590 PolarHBondContact O-N 2.85Å; A586-T590 PolarHBondContact O-OG1 3.48Å; A586-V615 HydrophobicContact CB-CB 4.2Å; A586-V615 HydrophobicContact CB-CG1 3.86Å; A586-N616 HydrophobicContact CB-CB 3.77Å
587	Y	95.9	Very high	95.8	Very high	23 Å²	23	29 Å²	29	9%	0.09	15%	0.154	C	C	.	.	H	α-helix	trans	-72.8	-34.1	-175.9	-167.2	-123.4	0	0	0	112.6	E522 T526 F585 Y589 T590 L591 H619	E522-Y587 HydrophobicContact CB-CD1 3.79Å; E522-Y587 HydrophobicContact CB-CE1 3.83Å; E522-Y587 HydrophobicContact CG-CD1 3.43Å; E522-Y587 VanDerWaalsContact CG-CD1 3.43Å; E522-Y587 HydrophobicContact CG-CE1 3.64Å; E522-Y587 HydrophobicContact CG-CG 4.41Å; T526-Y587 WeakPolarHBondContact CB-OH 3.47Å; T526-Y587 PolarHBondContact OG1-OH 3.18Å; F585-Y587 HydrophobicContact CE1-CD1 4.42Å; F585-Y587 PolarHBondContact O-N 2.85Å; F585-Y587 VanDerWaalsContact O-N 3.11Å; Y587-Y589 PolarHBondContact O-N 2.98Å; Y587-T590 WeakPolarHBondContact O-CA 3.35Å; Y587-T590 WeakPolarHBondContact O-CB 3.38Å; Y587-T590 PolarHBondContact O-N 2.87Å; Y587-L591 HydrophobicContact CD1-CD1 3.88Å; Y587-L591 HydrophobicContact CD1-CG 4.29Å; Y587-L591 HydrophobicContact CE1-CD1 3.71Å; Y587-L591 HydrophobicContact CE1-CD2 4.31Å; Y587-L591 HydrophobicContact CE1-CG 4.14Å; Y587-L591 HydrophobicContact CE2-CD2 4.46Å; Y587-L591 PolarHBondContact O-N 3.3Å; Y587-H619 AromaticContact CD2-CE1 3.7Å; Y587-H619 AromaticContact CD2-NE2 3.72Å
588	A	96.9	Very high	95.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.4	-39.5	175.9	0	0	0	0	0	112.5	A578 I579 F585 T590 L591 L592	A578-A588 HydrophobicContact CB-CB 3.73Å; I579-A588 HydrophobicContact CD1-CB 4.44Å; I579-A588 HydrophobicContact CG1-CB 3.76Å; F585-A588 HydrophobicContact CD1-CB 3.77Å; F585-A588 HydrophobicContact CE1-CB 4.42Å; F585-A588 PolarHBondContact O-N 3.48Å; A588-T590 PolarHBondContact O-N 3.08Å; A588-L591 PolarHBondContact O-N 3.22Å; A588-L592 VanDerWaalsContact O-CB 3.26Å; A588-L592 WeakPolarHBondContact O-CB 3.49Å; A588-L592 PolarHBondContact O-N 3.07Å
589	Y	97.9	Very high	95.3	Very high	30 Å²	30	29.9 Å²	29.9	12%	0.118	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-33.7	172.6	-69.9	-83.1	0	0	0	112.3	I579 P583 Y587 G593 C608 N611 V615	I579-Y589 HydrophobicContact CD1-CD1 3.67Å; I579-Y589 HydrophobicContact CD1-CD2 4.48Å; I579-Y589 HydrophobicContact CD1-CE1 3.97Å; I579-Y589 HydrophobicContact CD1-CG 3.97Å; I579-Y589 HydrophobicContact CG1-CD1 4.18Å; I579-Y589 HydrophobicContact CG1-CD2 4.21Å; I579-Y589 HydrophobicContact CG1-CE1 4.19Å; I579-Y589 HydrophobicContact CG1-CE2 4.21Å; I579-Y589 HydrophobicContact CG1-CG 4.2Å; I579-Y589 HydrophobicContact CG2-CD1 4.49Å; I579-Y589 HydrophobicContact CG2-CE1 3.69Å; I579-Y589 HydrophobicContact CG2-CE2 4.17Å; P583-Y589 WeakPolarHBondContact O-CE2 3.29Å; P583-Y589 PolarHBondContact O-OH 3.45Å; Y587-Y589 PolarHBondContact O-N 2.98Å; Y589-G593 PolarHBondContact O-N 3.42Å; Y589-C608 WeakPolarHBondContact O-CB 3.38Å; Y589-N611 HydrophobicContact CD1-CB 3.63Å; Y589-N611 HydrophobicContact CE1-CB 3.71Å; Y589-N611 HydrophobicContact CG-CB 4.29Å; Y589-V615 HydrophobicContact CE2-CG2 4.04Å
590	T	97.3	Very high	95.1	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-71.4	-49.5	178.4	-60.9	0	0	0	0	110.9	A586 Y587 A588 L592 G593 H594 F609 H619 N621	A586-T590 PolarHBondContact O-N 2.85Å; A586-T590 PolarHBondContact O-OG1 3.48Å; Y587-T590 WeakPolarHBondContact O-CA 3.35Å; Y587-T590 WeakPolarHBondContact O-CB 3.38Å; Y587-T590 PolarHBondContact O-N 2.87Å; A588-T590 PolarHBondContact O-N 3.08Å; T590-L592 PolarHBondContact O-N 3.23Å; T590-G593 WeakPolarHBondContact O-CA 3.47Å; T590-G593 PolarHBondContact O-N 2.88Å; T590-H594 PolarHBondContact O-CD2 3.37Å; T590-H594 PolarHBondContact O-N 3.16Å; T590-F609 HydrophobicContact CG2-CD1 4.47Å; T590-F609 HydrophobicContact CG2-CE1 4Å; T590-F609 WeakPolarHBondContact O-CE1 3.27Å; T590-H619 PolarHBondContact OG1-CD2 3.17Å; T590-H619 PolarHBondContact OG1-NE2 3.44Å; T590-H619 VanDerWaalsContact OG1-NE2 3.12Å; T590-N621 HydrophobicContact CG2-CB 3.63Å
591	L	96.4	Very high	95	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-60.6	-45	176.1	-63.6	177.2	0	0	0	111.8	C556 F575 Y587 A588 G593 H594 E595	C556-L591 HydrophobicContact CB-CD1 4.07Å; F575-L591 HydrophobicContact CD1-CB 3.82Å; F575-L591 HydrophobicContact CD1-CD1 4.19Å; F575-L591 HydrophobicContact CD2-CB 4.43Å; F575-L591 HydrophobicContact CE1-CB 3.55Å; F575-L591 HydrophobicContact CE1-CD1 3.5Å; F575-L591 VanDerWaalsContact CE1-CD1 3.5Å; F575-L591 HydrophobicContact CE1-CG 4.15Å; F575-L591 HydrophobicContact CE2-CB 4.19Å; F575-L591 HydrophobicContact CG-CB 4.26Å; F575-L591 HydrophobicContact CZ-CB 3.74Å; F575-L591 HydrophobicContact CZ-CD1 4.12Å; F575-L591 HydrophobicContact CZ-CG 4.48Å; Y587-L591 HydrophobicContact CD1-CD1 3.88Å; Y587-L591 HydrophobicContact CD1-CG 4.29Å; Y587-L591 HydrophobicContact CE1-CD1 3.71Å; Y587-L591 HydrophobicContact CE1-CD2 4.31Å; Y587-L591 HydrophobicContact CE1-CG 4.14Å; Y587-L591 HydrophobicContact CE2-CD2 4.46Å; Y587-L591 PolarHBondContact O-N 3.3Å; A588-L591 PolarHBondContact O-N 3.22Å; L591-G593 VanDerWaalsContact C-N 3.26Å; L591-G593 PolarHBondContact O-N 3.12Å; L591-H594 PolarHBondContact O-N 3.33Å; L591-E595 PolarHBondContact O-N 3.13Å
592	L	97.4	Very high	94.9	Very high	7 Å²	7	32.8 Å²	32.8	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-58.9	-37.2	172.4	-178.3	58.3	0	0	0	112.6	I572 F575 Q576 I579 A588 T590 H594 F596 C608	I572-L592 HydrophobicContact CB-CD1 4.24Å; I572-L592 HydrophobicContact CG1-CD1 4.13Å; I572-L592 HydrophobicContact CG2-CD1 3.97Å; F575-L592 HydrophobicContact CB-CB 3.84Å; F575-L592 HydrophobicContact CB-CD1 4.22Å; F575-L592 HydrophobicContact CB-CG 4.49Å; Q576-L592 HydrophobicContact CG-CD1 4.3Å; Q576-L592 HydrophobicContact CG-CD2 3.94Å; I579-L592 HydrophobicContact CD1-CB 4.42Å; I579-L592 HydrophobicContact CD1-CD2 3.54Å; A588-L592 VanDerWaalsContact O-CB 3.26Å; A588-L592 WeakPolarHBondContact O-CB 3.49Å; A588-L592 PolarHBondContact O-N 3.07Å; T590-L592 PolarHBondContact O-N 3.23Å; L592-H594 VanDerWaalsContact C-N 3.35Å; L592-F596 HydrophobicContact CD1-CD2 4.11Å; L592-F596 HydrophobicContact CD1-CE1 4.41Å; L592-F596 HydrophobicContact CD1-CE2 3.62Å; L592-F596 HydrophobicContact CD1-CZ 3.8Å; L592-F596 HydrophobicContact CD2-CE2 4.04Å; L592-F596 HydrophobicContact CG-CD2 3.97Å; L592-F596 HydrophobicContact CG-CE2 3.61Å; L592-F596 HydrophobicContact CG-CZ 4.28Å; L592-F596 VanDerWaalsContact O-CD2 3.31Å; L592-F596 WeakPolarHBondContact O-CD2 3.39Å; L592-F596 WeakPolarHBondContact O-CG 3.19Å; L592-F596 PolarHBondContact O-N 3.23Å; L592-F596 VanDerWaalsContact O-N 3.1Å; L592-C608 VanDerWaalsContact CD2-SG 3.6Å
593	G	96.4	Very high	95	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.6	-37.5	173.8	0	0	0	0	0	112.9	Y589 T590 L591 V597 A605	Y589-G593 PolarHBondContact O-N 3.42Å; T590-G593 WeakPolarHBondContact O-CA 3.47Å; T590-G593 PolarHBondContact O-N 2.88Å; L591-G593 VanDerWaalsContact C-N 3.26Å; L591-G593 PolarHBondContact O-N 3.12Å; G593-V597 WeakPolarHBondContact O-CG2 3.37Å; G593-V597 PolarHBondContact O-N 2.6Å; G593-V597 VanDerWaalsContact O-N 3.13Å; G593-A605 WeakPolarHBondContact O-CB 3.11Å
594	H	94.7	Very high	95.1	Very high	14 Å²	14	38.4 Å²	38.4	7%	0.065	19%	0.194	C	C	.	.	H	α-helix	trans	-70.3	-40.4	176.1	-69.3	-66.2	0	0	0	112.6	T590 L591 L592 F596 V597 L598 F609	T590-H594 PolarHBondContact O-CD2 3.37Å; T590-H594 PolarHBondContact O-N 3.16Å; L591-H594 PolarHBondContact O-N 3.33Å; L592-H594 VanDerWaalsContact C-N 3.35Å; H594-F596 VanDerWaalsContact C-N 3.34Å; H594-F596 PolarHBondContact O-N 3.19Å; H594-V597 WeakPolarHBondContact O-CB 3.28Å; H594-V597 PolarHBondContact O-N 2.98Å; H594-L598 PolarHBondContact O-N 3.24Å; H594-L598 VanDerWaalsContact O-N 3.11Å; H594-F609 AromaticContact CE1-CZ 3.79Å; H594-F609 AromaticContact ND1-CZ 3.87Å; H594-F609 AromaticContact NE2-CE1 3.79Å; H594-F609 AromaticContact NE2-CZ 3.94Å
595	E	96	Very high	95.3	Very high	4 Å²	4	36.6 Å²	36.6	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-61	-42.4	173	-63.6	-58.9	115.6	0	0	111.6	S563 H568 A571 I572 F575 L591 V597 L598 T599	S563-E595 VanDerWaalsContact CB-OE1 3.24Å; S563-E595 WeakPolarHBondContact CB-OE1 3.09Å; S563-E595 PolarHBondContact OG-OE1 3.49Å; H568-E595 IonicContact CE1-OE2 2.64Å; H568-E595 IonicContact CG-OE2 2.74Å; H568-E595 IonicContact ND1-OE2 3.8Å; H568-E595 PolarHBondContact ND1-OE2 3.29Å; A571-E595 HydrophobicContact CB-CG 4.26Å; I572-E595 HydrophobicContact CD1-CB 4.3Å; I572-E595 HydrophobicContact CG1-CB 3.74Å; I572-E595 HydrophobicContact CG1-CG 4.45Å; F575-E595 HydrophobicContact CD2-CG 3.84Å; F575-E595 HydrophobicContact CE2-CG 3.54Å; L591-E595 PolarHBondContact O-N 3.13Å; E595-V597 PolarHBondContact O-N 3.37Å; E595-L598 WeakPolarHBondContact O-CA 3.47Å; E595-L598 WeakPolarHBondContact O-CB 3.49Å; E595-L598 PolarHBondContact O-N 3.27Å; E595-T599 PolarHBondContact O-N 3.4Å; E595-T599 PolarHBondContact O-OG1 2.95Å
596	F	96.8	Very high	95.4	Very high	9 Å²	9	35.7 Å²	35.7	4%	0.039	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-19.2	173.8	-70.6	-39.8	0	0	0	114	I572 L592 H594 E600 E601 R604 A605	I572-F596 HydrophobicContact CD1-CD1 3.96Å; I572-F596 HydrophobicContact CD1-CE1 3.89Å; I572-F596 HydrophobicContact CG1-CD1 4.44Å; I572-F596 HydrophobicContact CG1-CE1 4.24Å; I572-F596 HydrophobicContact CG2-CE1 4.02Å; I572-F596 HydrophobicContact CG2-CZ 4.19Å; L592-F596 HydrophobicContact CD1-CD2 4.11Å; L592-F596 HydrophobicContact CD1-CE1 4.41Å; L592-F596 HydrophobicContact CD1-CE2 3.62Å; L592-F596 HydrophobicContact CD1-CZ 3.8Å; L592-F596 HydrophobicContact CD2-CE2 4.04Å; L592-F596 HydrophobicContact CG-CD2 3.97Å; L592-F596 HydrophobicContact CG-CE2 3.61Å; L592-F596 HydrophobicContact CG-CZ 4.28Å; L592-F596 VanDerWaalsContact O-CD2 3.31Å; L592-F596 WeakPolarHBondContact O-CD2 3.39Å; L592-F596 WeakPolarHBondContact O-CG 3.19Å; L592-F596 PolarHBondContact O-N 3.23Å; L592-F596 VanDerWaalsContact O-N 3.1Å; H594-F596 VanDerWaalsContact C-N 3.34Å; H594-F596 PolarHBondContact O-N 3.19Å; F596-E600 PolarHBondContact O-N 3.4Å; F596-E601 HydrophobicContact CB-CB 4.36Å; F596-E601 HydrophobicContact CD1-CB 4.22Å; F596-E601 WeakPolarHBondContact CD1-OE2 3.23Å; F596-E601 WeakPolarHBondContact CE1-OE2 3.43Å; F596-E601 CarbonylContact O-C 3.47Å; F596-E601 PolarHBondContact O-N 2.91Å; F596-R604 HydrophobicContact CB-CB 4.46Å; F596-R604 HydrophobicContact CD1-CB 4.3Å; F596-R604 HydrophobicContact CD2-CB 3.68Å; F596-R604 HydrophobicContact CE1-CB 4.44Å; F596-R604 HydrophobicContact CE2-CB 3.83Å; F596-R604 HydrophobicContact CG-CB 3.93Å; F596-R604 HydrophobicContact CZ-CB 4.22Å; F596-A605 HydrophobicContact CB-CB 3.7Å
597	V	94	Very high	95.4	Very high	13 Å²	13	37.5 Å²	37.5	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-81.7	-22.2	170.4	170.4	0	0	0	0	112.3	G593 H594 E595 L602 A605 F609 I629 K632	G593-V597 WeakPolarHBondContact O-CG2 3.37Å; G593-V597 PolarHBondContact O-N 2.6Å; G593-V597 VanDerWaalsContact O-N 3.13Å; H594-V597 WeakPolarHBondContact O-CB 3.28Å; H594-V597 PolarHBondContact O-N 2.98Å; E595-V597 PolarHBondContact O-N 3.37Å; V597-L602 HydrophobicContact CG2-CD2 4.47Å; V597-A605 HydrophobicContact CG2-CB 3.7Å; V597-F609 HydrophobicContact CG2-CE2 4.21Å; V597-I629 HydrophobicContact CG2-CD1 3.98Å; V597-I629 HydrophobicContact CG2-CG1 3.68Å; V597-K632 HydrophobicContact CG1-CD 4.41Å; V597-K632 PolarHBondContact O-NZ 2.86Å; V597-K632 VanDerWaalsContact O-NZ 3.14Å
598	L	90.6	Very high	95.5	Very high	68 Å²	68	37 Å²	37	36%	0.356	19%	0.187	S	C	.	.	H	α-helix	trans	-80.8	-40	171.6	-70.5	-175.3	0	0	0	112.7	P277 H568 H594 E595 E600	P277-L598 HydrophobicContact CB-CD2 3.98Å; P277-L598 HydrophobicContact CB-CG 4.31Å; P277-L598 HydrophobicContact CG-CD1 3.78Å; P277-L598 HydrophobicContact CG-CD2 3.96Å; P277-L598 HydrophobicContact CG-CG 3.91Å; H568-L598 WeakPolarHBondContact CE1-CD1 3.44Å; H594-L598 PolarHBondContact O-N 3.24Å; H594-L598 VanDerWaalsContact O-N 3.11Å; E595-L598 WeakPolarHBondContact O-CA 3.47Å; E595-L598 WeakPolarHBondContact O-CB 3.49Å; E595-L598 PolarHBondContact O-N 3.27Å; L598-E600 PolarHBondContact O-N 3.4Å
599	T	93.6	Very high	95.5	Very high	48 Å²	48	37 Å²	37	29%	0.294	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	8.6	174.1	61.8	0	0	0	0	113.5	H568 I572 E595 E601	H568-T599 HydrophobicContact CB-CG2 3.92Å; I572-T599 HydrophobicContact CD1-CG2 4.1Å; E595-T599 PolarHBondContact O-N 3.4Å; E595-T599 PolarHBondContact O-OG1 2.95Å; T599-E601 PolarHBondContact O-N 2.77Å; T599-E601 VanDerWaalsContact O-N 3.11Å
600	E	92.3	Very high	95.5	Very high	152 Å²	152	41.6 Å²	41.6	71%	0.71	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	12.9	179.2	-48	-157.9	127.1	0	0	115.7	F596 L598 L602	F596-E600 PolarHBondContact O-N 3.4Å; L598-E600 PolarHBondContact O-N 3.4Å; E600-L602 PolarHBondContact O-N 2.96Å
601	E	94.6	Very high	95.4	Very high	57 Å²	57	43.9 Å²	43.9	27%	0.266	22%	0.216	S	C	.	.			trans	-79	55.3	178.1	-59.9	-171.8	142.4	0	0	112.5	F596 T599 D603 R604 A605	F596-E601 HydrophobicContact CB-CB 4.36Å; F596-E601 HydrophobicContact CD1-CB 4.22Å; F596-E601 WeakPolarHBondContact CD1-OE2 3.23Å; F596-E601 WeakPolarHBondContact CE1-OE2 3.43Å; F596-E601 CarbonylContact O-C 3.47Å; F596-E601 PolarHBondContact O-N 2.91Å; T599-E601 PolarHBondContact O-N 2.77Å; T599-E601 VanDerWaalsContact O-N 3.11Å; E601-D603 VanDerWaalsContact C-N 3.27Å; E601-D603 PolarHBondContact O-N 3.48Å; E601-D603 VanDerWaalsContact O-N 3.07Å; E601-R604 HydrophobicContact CB-CB 4.42Å; E601-R604 HydrophobicContact CB-CG 4.41Å; E601-R604 PolarHBondContact O-N 3.39Å; E601-R604 IonicContact OE1-CZ 3.09Å; E601-R604 IonicContact OE1-NE 3.53Å; E601-R604 IonicContact OE1-NH1 3.68Å; E601-R604 PolarHBondContact OE1-NH1 3.39Å; E601-R604 IonicContact OE1-NH2 2.69Å; E601-R604 PolarHBondContact OE1-NH2 3.31Å; E601-R604 WeakPolarHBondContact OE2-CD 3.44Å; E601-R604 IonicContact OE2-CZ 2.91Å; E601-R604 IonicContact OE2-NE 2.94Å; E601-R604 IonicContact OE2-NH1 3.83Å; E601-R604 PolarHBondContact OE2-NH1 3.04Å; E601-R604 IonicContact OE2-NH2 3.7Å; E601-A605 PolarHBondContact O-N 2.84Å; E601-A605 VanDerWaalsContact O-N 3.14Å
602	L	94	Very high	95.4	Very high	37 Å²	37	43.6 Å²	43.6	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-52.5	-37.2	-167.6	-59.3	-175.3	0	0	0	114.4	V597 E600 A605 L606 I629 K632 Q633	V597-L602 HydrophobicContact CG2-CD2 4.47Å; E600-L602 PolarHBondContact O-N 2.96Å; L602-A605 WeakPolarHBondContact O-CB 3.45Å; L602-A605 PolarHBondContact O-N 3.2Å; L602-L606 WeakPolarHBondContact O-CG 3.38Å; L602-L606 PolarHBondContact O-N 3.14Å; L602-I629 HydrophobicContact CB-CG2 4.11Å; L602-I629 HydrophobicContact CD1-CG2 4.48Å; L602-I629 HydrophobicContact CD2-CG2 4.4Å; L602-K632 HydrophobicContact CD2-CD 4.21Å; L602-Q633 HydrophobicContact CD1-CG 4.12Å
603	D	94.7	Very high	95.3	Very high	126 Å²	126	44.4 Å²	44.4	67%	0.674	22%	0.219	S	C	*	.	H	α-helix	trans	-69.8	-33.2	179.4	-71.8	-38.5	0	0	0	113.2	E601 A607	E601-D603 VanDerWaalsContact C-N 3.27Å; E601-D603 PolarHBondContact O-N 3.48Å; E601-D603 VanDerWaalsContact O-N 3.07Å; D603-A607 PolarHBondContact O-N 3.04Å; D603-A607 VanDerWaalsContact O-N 3.14Å
604	R	95.6	Very high	95.2	Very high	134 Å²	134	53.2 Å²	53.2	51%	0.506	25%	0.252	S	S	.	.	H	α-helix	trans	-70.1	-39.9	171.7	-59.5	-169.6	-159.1	157.1	12.9	110.5	F596 E601 A607 C608	F596-R604 HydrophobicContact CB-CB 4.46Å; F596-R604 HydrophobicContact CD1-CB 4.3Å; F596-R604 HydrophobicContact CD2-CB 3.68Å; F596-R604 HydrophobicContact CE1-CB 4.44Å; F596-R604 HydrophobicContact CE2-CB 3.83Å; F596-R604 HydrophobicContact CG-CB 3.93Å; F596-R604 HydrophobicContact CZ-CB 4.22Å; E601-R604 HydrophobicContact CB-CB 4.42Å; E601-R604 HydrophobicContact CB-CG 4.41Å; E601-R604 PolarHBondContact O-N 3.39Å; E601-R604 IonicContact OE1-CZ 3.09Å; E601-R604 IonicContact OE1-NE 3.53Å; E601-R604 IonicContact OE1-NH1 3.68Å; E601-R604 PolarHBondContact OE1-NH1 3.39Å; E601-R604 IonicContact OE1-NH2 2.69Å; E601-R604 PolarHBondContact OE1-NH2 3.31Å; E601-R604 WeakPolarHBondContact OE2-CD 3.44Å; E601-R604 IonicContact OE2-CZ 2.91Å; E601-R604 IonicContact OE2-NE 2.94Å; E601-R604 IonicContact OE2-NH1 3.83Å; E601-R604 PolarHBondContact OE2-NH1 3.04Å; E601-R604 IonicContact OE2-NH2 3.7Å; R604-A607 WeakPolarHBondContact O-CB 3.47Å; R604-A607 PolarHBondContact O-N 3.19Å; R604-C608 PolarHBondContact O-N 3.18Å
605	A	96.1	Very high	95.1	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-44	174.5	0	0	0	0	0	112.2	G593 F596 V597 E601 L602 A607 C608 F609 I629	G593-A605 WeakPolarHBondContact O-CB 3.11Å; F596-A605 HydrophobicContact CB-CB 3.7Å; V597-A605 HydrophobicContact CG2-CB 3.7Å; E601-A605 PolarHBondContact O-N 2.84Å; E601-A605 VanDerWaalsContact O-N 3.14Å; L602-A605 WeakPolarHBondContact O-CB 3.45Å; L602-A605 PolarHBondContact O-N 3.2Å; A605-A607 VanDerWaalsContact C-N 3.31Å; A605-A607 PolarHBondContact O-N 3.49Å; A605-C608 PolarHBondContact O-N 2.7Å; A605-F609 HydrophobicContact CB-CE2 4.29Å; A605-F609 WeakPolarHBondContact O-CD2 3.18Å; A605-F609 PolarHBondContact O-N 2.88Å; A605-I629 HydrophobicContact CB-CD1 3.56Å; A605-I629 HydrophobicContact CB-CG1 4.5Å
606	L	96.3	Very high	94.8	Very high	12 Å²	12	57.7 Å²	57.7	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-57.5	-42.5	173.4	-74.8	175.6	0	0	0	111.8	L602 R610 L626 I629 Y630	L602-L606 WeakPolarHBondContact O-CG 3.38Å; L602-L606 PolarHBondContact O-N 3.14Å; L606-R610 VanDerWaalsContact O-CB 3.31Å; L606-R610 WeakPolarHBondContact O-CB 3.35Å; L606-R610 WeakPolarHBondContact O-CD 3.16Å; L606-R610 WeakPolarHBondContact O-CG 3.37Å; L606-R610 PolarHBondContact O-N 3.4Å; L606-L626 HydrophobicContact CD2-CD2 3.59Å; L606-I629 HydrophobicContact CD1-CG2 4.3Å; L606-I629 HydrophobicContact CD2-CB 4.01Å; L606-I629 HydrophobicContact CD2-CD1 3.82Å; L606-I629 HydrophobicContact CD2-CG2 3.75Å; L606-I629 HydrophobicContact CG-CD1 4Å; L606-I629 HydrophobicContact CG-CG2 3.88Å; L606-Y630 HydrophobicContact CD2-CE1 4.28Å; L606-Y630 HydrophobicContact CD2-CE2 4.39Å
607	A	97	Very high	94.6	Very high	47 Å²	47	61.6 Å²	61.6	39%	0.388	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-44	176	0	0	0	0	0	112	D603 R604 A605 R610 N611	D603-A607 PolarHBondContact O-N 3.04Å; D603-A607 VanDerWaalsContact O-N 3.14Å; R604-A607 WeakPolarHBondContact O-CB 3.47Å; R604-A607 PolarHBondContact O-N 3.19Å; A605-A607 VanDerWaalsContact C-N 3.31Å; A605-A607 PolarHBondContact O-N 3.49Å; A607-R610 PolarHBondContact O-N 3.22Å; A607-N611 WeakPolarHBondContact O-CB 3.42Å; A607-N611 PolarHBondContact O-N 2.89Å; A607-N611 PolarHBondContact O-ND2 3.27Å
608	C	97.1	Very high	94.5	Very high	12 Å²	12	63.5 Å²	63.5	8%	0.081	31%	0.306	C	S	.	.	H	α-helix	trans	-62.5	-49.3	177.4	-78.5	0	0	0	0	112.8	Y589 L592 R604 A605 R610 N611 A612	Y589-C608 WeakPolarHBondContact O-CB 3.38Å; L592-C608 VanDerWaalsContact CD2-SG 3.6Å; R604-C608 PolarHBondContact O-N 3.18Å; A605-C608 PolarHBondContact O-N 2.7Å; C608-R610 PolarHBondContact O-N 3.01Å; C608-N611 WeakPolarHBondContact O-CB 3.39Å; C608-N611 PolarHBondContact O-N 3.03Å; C608-N611 VanDerWaalsContact O-N 3.1Å; C608-A612 PolarHBondContact O-N 3.42Å
609	F	97.7	Very high	94.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-34.8	178.2	-64.9	-56.7	0	0	0	112.7	T590 H594 V597 A605 N611 A612 I613 A622 L626 I629	T590-F609 HydrophobicContact CG2-CD1 4.47Å; T590-F609 HydrophobicContact CG2-CE1 4Å; T590-F609 WeakPolarHBondContact O-CE1 3.27Å; H594-F609 AromaticContact CE1-CZ 3.79Å; H594-F609 AromaticContact ND1-CZ 3.87Å; H594-F609 AromaticContact NE2-CE1 3.79Å; H594-F609 AromaticContact NE2-CZ 3.94Å; V597-F609 HydrophobicContact CG2-CE2 4.21Å; A605-F609 HydrophobicContact CB-CE2 4.29Å; A605-F609 WeakPolarHBondContact O-CD2 3.18Å; A605-F609 PolarHBondContact O-N 2.88Å; F609-N611 VanDerWaalsContact C-N 3.31Å; F609-N611 PolarHBondContact O-N 3.45Å; F609-A612 PolarHBondContact O-N 2.76Å; F609-I613 WeakPolarHBondContact O-CG1 3.43Å; F609-I613 PolarHBondContact O-N 3.37Å; F609-A622 HydrophobicContact CB-CB 4.4Å; F609-A622 HydrophobicContact CD1-CB 4.12Å; F609-L626 HydrophobicContact CB-CD2 3.74Å; F609-L626 HydrophobicContact CB-CG 3.84Å; F609-I629 HydrophobicContact CD2-CD1 3.65Å; F609-I629 HydrophobicContact CE2-CD1 3.74Å
610	R	96.7	Very high	94.8	Very high	127 Å²	127	60.3 Å²	60.3	48%	0.479	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-35.1	171	-73.5	170.2	-174.9	-177.4	3	112.4	L606 A607 C608 R614 L626 Y630	L606-R610 VanDerWaalsContact O-CB 3.31Å; L606-R610 WeakPolarHBondContact O-CB 3.35Å; L606-R610 WeakPolarHBondContact O-CD 3.16Å; L606-R610 WeakPolarHBondContact O-CG 3.37Å; L606-R610 PolarHBondContact O-N 3.4Å; A607-R610 PolarHBondContact O-N 3.22Å; C608-R610 PolarHBondContact O-N 3.01Å; R610-R614 PolarHBondContact O-N 2.85Å; R610-R614 VanDerWaalsContact O-N 3.13Å; R610-L626 HydrophobicContact CG-CD2 4.34Å; R610-Y630 PolarHBondContact NH2-OH 3.16Å; R610-Y630 VanDerWaalsContact NH2-OH 3.07Å
611	N	96.3	Very high	94.9	Very high	49 Å²	49	54.3 Å²	54.3	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-69.7	-43.7	173.7	-68.5	-20.5	0	0	0	111.5	Y589 A607 C608 F609 I613 R614 V615	Y589-N611 HydrophobicContact CD1-CB 3.63Å; Y589-N611 HydrophobicContact CE1-CB 3.71Å; Y589-N611 HydrophobicContact CG-CB 4.29Å; A607-N611 WeakPolarHBondContact O-CB 3.42Å; A607-N611 PolarHBondContact O-N 2.89Å; A607-N611 PolarHBondContact O-ND2 3.27Å; C608-N611 WeakPolarHBondContact O-CB 3.39Å; C608-N611 PolarHBondContact O-N 3.03Å; C608-N611 VanDerWaalsContact O-N 3.1Å; F609-N611 VanDerWaalsContact C-N 3.31Å; F609-N611 PolarHBondContact O-N 3.45Å; N611-I613 VanDerWaalsContact C-N 3.3Å; N611-I613 PolarHBondContact O-N 3.04Å; N611-R614 PolarHBondContact O-N 3.2Å; N611-R614 VanDerWaalsContact O-N 3.11Å; N611-R614 PolarHBondContact OD1-NH1 2.98Å; N611-R614 PolarHBondContact OD1-NH2 3.09Å; N611-V615 WeakPolarHBondContact O-CG2 3.43Å; N611-V615 PolarHBondContact O-N 3Å
612	A	96.6	Very high	95	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-55.5	-43.5	174.3	0	0	0	0	0	112.2	C608 F609 V615 N616 A622	C608-A612 PolarHBondContact O-N 3.42Å; F609-A612 PolarHBondContact O-N 2.76Å; A612-V615 PolarHBondContact O-N 2.79Å; A612-N616 PolarHBondContact O-N 3.39Å; A612-A622 HydrophobicContact CB-CB 3.63Å
613	I	95.4	Very high	95.1	Very high	24 Å²	24	51.6 Å²	51.6	12%	0.123	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-37.1	176.6	-69.7	162.8	0	0	0	112.1	F609 N611 V615 N616 N617 A622 W623 L626	F609-I613 WeakPolarHBondContact O-CG1 3.43Å; F609-I613 PolarHBondContact O-N 3.37Å; N611-I613 VanDerWaalsContact C-N 3.3Å; N611-I613 PolarHBondContact O-N 3.04Å; I613-V615 VanDerWaalsContact C-N 3.29Å; I613-V615 PolarHBondContact O-N 2.73Å; I613-N616 CarbonylContact O-C 3.59Å; I613-N616 VanDerWaalsContact O-C 3.22Å; I613-N617 VanDerWaalsContact O-CA 3.32Å; I613-N617 WeakPolarHBondContact O-CA 3.42Å; I613-N617 PolarHBondContact O-N 3.2Å; I613-A622 HydrophobicContact CD1-CB 4.28Å; I613-A622 HydrophobicContact CG1-CB 3.8Å; I613-W623 HydrophobicContact CD1-CD2 3.66Å; I613-W623 HydrophobicContact CD1-CE3 3.8Å; I613-W623 HydrophobicContact CD1-CG 4.14Å; I613-W623 HydrophobicContact CD1-CH2 4.24Å; I613-W623 HydrophobicContact CD1-CZ2 4.11Å; I613-W623 HydrophobicContact CD1-CZ3 4.09Å; I613-W623 HydrophobicContact CG1-CD2 4.2Å; I613-W623 HydrophobicContact CG1-CG 4.45Å; I613-W623 HydrophobicContact CG1-CZ2 4.31Å; I613-W623 HydrophobicContact CG2-CH2 4.09Å; I613-W623 HydrophobicContact CG2-CZ2 3.53Å; I613-L626 HydrophobicContact CD1-CD1 3.47Å; I613-L626 VanDerWaalsContact CD1-CD1 3.47Å; I613-L626 HydrophobicContact CD1-CG 4.26Å
614	R	93.4	Very high	95.2	Very high	184 Å²	184	46.4 Å²	46.4	69%	0.694	21%	0.213	S	C	*	.	H	α-helix	trans	-66.7	-32	175	-164.1	-172.4	-55.2	101.3	4.4	112.3	R610 N611	R610-R614 PolarHBondContact O-N 2.85Å; R610-R614 VanDerWaalsContact O-N 3.13Å; N611-R614 PolarHBondContact O-N 3.2Å; N611-R614 VanDerWaalsContact O-N 3.11Å; N611-R614 PolarHBondContact OD1-NH1 2.98Å; N611-R614 PolarHBondContact OD1-NH2 3.09Å
615	V	91.9	Very high	95.1	Very high	57 Å²	57	40 Å²	40	35%	0.345	19%	0.19	S	C	.	.	H	α-helix	trans	-78.4	-43	176.5	175	0	0	0	0	111.1	G584 A586 Y589 N611 A612 I613	G584-V615 VanDerWaalsContact C-CG1 3.46Å; G584-V615 WeakPolarHBondContact O-CG1 3.48Å; A586-V615 HydrophobicContact CB-CB 4.2Å; A586-V615 HydrophobicContact CB-CG1 3.86Å; Y589-V615 HydrophobicContact CE2-CG2 4.04Å; N611-V615 WeakPolarHBondContact O-CG2 3.43Å; N611-V615 PolarHBondContact O-N 3Å; A612-V615 PolarHBondContact O-N 2.79Å; I613-V615 VanDerWaalsContact C-N 3.29Å; I613-V615 PolarHBondContact O-N 2.73Å
616	N	91.2	Very high	95.1	Very high	56 Å²	56	40.3 Å²	40.3	30%	0.299	19%	0.191	S	C	.	.			trans	-144.7	100.2	175	-176.3	-8.5	0	0	0	111.3	A586 A612 I613 R618 H619	A586-N616 HydrophobicContact CB-CB 3.77Å; A612-N616 PolarHBondContact O-N 3.39Å; I613-N616 CarbonylContact O-C 3.59Å; I613-N616 VanDerWaalsContact O-C 3.22Å; N616-R618 PolarHBondContact O-N 3.01Å; N616-R618 VanDerWaalsContact O-N 3.15Å; N616-R618 WeakPolarHBondContact OD1-CA 3.39Å; N616-R618 WeakPolarHBondContact OD1-CB 3.1Å; N616-R618 PolarHBondContact OD1-N 3.43Å; N616-H619 HydrophobicContact CB-CB 4.12Å; N616-H619 WeakPolarHBondContact O-CB 3.44Å; N616-H619 PolarHBondContact O-N 2.77Å; N616-H619 PolarHBondContact OD1-N 3.23Å
617	N	91.1	Very high	95	Very high	91 Å²	91	39.8 Å²	39.8	49%	0.487	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-25.3	177.7	-172.7	11.5	0	0	0	112.9	I613 H619 W623	I613-N617 VanDerWaalsContact O-CA 3.32Å; I613-N617 WeakPolarHBondContact O-CA 3.42Å; I613-N617 PolarHBondContact O-N 3.2Å; N617-H619 VanDerWaalsContact C-N 3.35Å; N617-W623 PolarHBondContact O-NE1 3.47Å; N617-W623 WeakPolarHBondContact OD1-CZ2 3.19Å
618	R	92.9	Very high	94.8	Very high	52 Å²	52	39.1 Å²	39.1	20%	0.196	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	9.4	178.5	-154.8	167.9	-176.4	-110.6	-24.2	113.3	C156 H157 C462 N616 Y620 I649	C156-R618 PolarHBondContact O-NH1 3.2Å; H157-R618 WeakPolarHBondContact O-CD 3.29Å; C462-R618 PolarHBondContact O-NH1 3.46Å; C462-R618 PolarHBondContact O-NH2 3.17Å; N616-R618 PolarHBondContact O-N 3.01Å; N616-R618 VanDerWaalsContact O-N 3.15Å; N616-R618 WeakPolarHBondContact OD1-CA 3.39Å; N616-R618 WeakPolarHBondContact OD1-CB 3.1Å; N616-R618 PolarHBondContact OD1-N 3.43Å; R618-Y620 PolarHBondContact O-N 3.42Å; R618-I649 HydrophobicContact CG-CG1 4.43Å; R618-I649 HydrophobicContact CG-CG2 3.74Å; R618-I649 WeakPolarHBondContact O-CG2 3.49Å
619	H	94.6	Very high	94.7	Very high	26 Å²	26	38.5 Å²	38.5	12%	0.12	17%	0.174	C	C	.	.			trans	-83.9	93.6	175.5	-167	53.7	0	0	0	111.8	Y587 T590 N616 N617 N621 A622	Y587-H619 AromaticContact CD2-CE1 3.7Å; Y587-H619 AromaticContact CD2-NE2 3.72Å; T590-H619 PolarHBondContact OG1-CD2 3.17Å; T590-H619 PolarHBondContact OG1-NE2 3.44Å; T590-H619 VanDerWaalsContact OG1-NE2 3.12Å; N616-H619 HydrophobicContact CB-CB 4.12Å; N616-H619 WeakPolarHBondContact O-CB 3.44Å; N616-H619 PolarHBondContact O-N 2.77Å; N616-H619 PolarHBondContact OD1-N 3.23Å; N617-H619 VanDerWaalsContact C-N 3.35Å; H619-N621 VanDerWaalsContact C-N 3.29Å; H619-N621 PolarHBondContact O-N 2.97Å; H619-A622 PolarHBondContact O-N 3.21Å
620	Y	95.3	Very high	94.6	Very high	24 Å²	24	39.7 Å²	39.7	9%	0.094	18%	0.178	C	C	.	.	H	α-helix	trans	-62	-31.3	-171.3	81.7	-89.5	0	0	0	114.1	Y464 E496 R618 A622 W623 Y624 N650 L656	Y464-Y620 AromaticContact CE1-CD1 3.9Å; Y464-Y620 HydrophobicContact CE1-CD1 3.9Å; Y464-Y620 AromaticContact CE1-CE1 3.75Å; Y464-Y620 HydrophobicContact CE1-CE1 3.75Å; Y464-Y620 AromaticContact CZ-CD1 3.85Å; E496-Y620 WeakPolarHBondContact OE2-CE1 3.24Å; E496-Y620 PolarHBondContact OE2-OH 3.02Å; R618-Y620 PolarHBondContact O-N 3.42Å; Y620-A622 VanDerWaalsContact C-N 3.26Å; Y620-A622 PolarHBondContact O-N 2.6Å; Y620-W623 WeakPolarHBondContact O-CB 3.23Å; Y620-W623 PolarHBondContact O-N 3.4Å; Y620-W623 VanDerWaalsContact O-N 3.13Å; Y620-Y624 PolarHBondContact O-N 2.91Å; Y620-N650 HydrophobicContact CD1-CB 4.19Å; Y620-N650 HydrophobicContact CD2-CB 4.42Å; Y620-N650 HydrophobicContact CG-CB 4.15Å; Y620-L656 HydrophobicContact CD2-CD1 3.94Å; Y620-L656 HydrophobicContact CE2-CD1 4.41Å
621	N	95	Very high	94.4	Very high	26 Å²	26	34.5 Å²	34.5	14%	0.139	16%	0.159	C	C	.	.	H	α-helix	trans	-59.9	-34	178.6	-69.8	-30	0	0	0	112.7	T590 H619 Y624 G625	T590-N621 HydrophobicContact CG2-CB 3.63Å; H619-N621 VanDerWaalsContact C-N 3.29Å; H619-N621 PolarHBondContact O-N 2.97Å; N621-Y624 PolarHBondContact O-N 3.06Å; N621-G625 PolarHBondContact O-N 2.8Å
622	A	95.4	Very high	94.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-73.5	-35.7	176.7	0	0	0	0	0	112.6	F609 A612 I613 H619 Y620 G625 L626	F609-A622 HydrophobicContact CB-CB 4.4Å; F609-A622 HydrophobicContact CD1-CB 4.12Å; A612-A622 HydrophobicContact CB-CB 3.63Å; I613-A622 HydrophobicContact CD1-CB 4.28Å; I613-A622 HydrophobicContact CG1-CB 3.8Å; H619-A622 PolarHBondContact O-N 3.21Å; Y620-A622 VanDerWaalsContact C-N 3.26Å; Y620-A622 PolarHBondContact O-N 2.6Å; A622-G625 PolarHBondContact O-N 3.29Å; A622-L626 PolarHBondContact O-N 3.29Å
623	W	97.2	Very high	93.8	Very high	37 Å²	37	37.7 Å²	37.7	14%	0.14	17%	0.171	C	C	.	.	H	α-helix	trans	-65.5	-39.6	171.3	-70.8	107.3	0	0	0	111.8	I613 N617 Y620 L626 G627 H642 K645 A646	I613-W623 HydrophobicContact CD1-CD2 3.66Å; I613-W623 HydrophobicContact CD1-CE3 3.8Å; I613-W623 HydrophobicContact CD1-CG 4.14Å; I613-W623 HydrophobicContact CD1-CH2 4.24Å; I613-W623 HydrophobicContact CD1-CZ2 4.11Å; I613-W623 HydrophobicContact CD1-CZ3 4.09Å; I613-W623 HydrophobicContact CG1-CD2 4.2Å; I613-W623 HydrophobicContact CG1-CG 4.45Å; I613-W623 HydrophobicContact CG1-CZ2 4.31Å; I613-W623 HydrophobicContact CG2-CH2 4.09Å; I613-W623 HydrophobicContact CG2-CZ2 3.53Å; N617-W623 PolarHBondContact O-NE1 3.47Å; N617-W623 WeakPolarHBondContact OD1-CZ2 3.19Å; Y620-W623 WeakPolarHBondContact O-CB 3.23Å; Y620-W623 PolarHBondContact O-N 3.4Å; Y620-W623 VanDerWaalsContact O-N 3.13Å; W623-L626 HydrophobicContact CE3-CD1 4.47Å; W623-G627 PolarHBondContact O-N 3.36Å; W623-H642 AromaticContact CE3-ND1 3.47Å; W623-H642 AromaticContact CZ3-CE1 3.88Å; W623-H642 AromaticContact CZ3-ND1 3.41Å; W623-H642 WeakPolarHBondContact CZ3-ND1 3.5Å; W623-K645 HydrophobicContact CD2-CB 4.23Å; W623-K645 HydrophobicContact CD2-CG 3.63Å; W623-K645 HydrophobicContact CE3-CB 4.16Å; W623-K645 HydrophobicContact CE3-CG 3.88Å; W623-K645 HydrophobicContact CG-CG 4.11Å; W623-K645 HydrophobicContact CH2-CG 4.22Å; W623-K645 HydrophobicContact CZ2-CG 3.99Å; W623-K645 HydrophobicContact CZ3-CG 4.17Å; W623-A646 HydrophobicContact CB-CB 3.87Å
624	Y	95.6	Very high	93.7	Very high	16 Å²	16	40.3 Å²	40.3	6%	0.063	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-45.5	171.8	172.1	-106.9	0	0	0	112	Y620 N621 L626 G627 M628 F643 L656 H659	Y620-Y624 PolarHBondContact O-N 2.91Å; N621-Y624 PolarHBondContact O-N 3.06Å; Y624-L626 PolarHBondContact O-N 2.99Å; Y624-G627 PolarHBondContact O-N 2.91Å; Y624-G627 VanDerWaalsContact O-N 3.13Å; Y624-M628 HydrophobicContact CE1-CE 4.5Å; Y624-M628 HydrophobicContact CE2-CE 3.98Å; Y624-M628 PolarHBondContact O-N 3.35Å; Y624-M628 VanDerWaalsContact OH-CE 3.24Å; Y624-M628 WeakPolarHBondContact OH-CE 3.36Å; Y624-F643 AromaticContact CD2-CD1 3.85Å; Y624-F643 HydrophobicContact CD2-CD1 3.85Å; Y624-F643 AromaticContact CD2-CE1 3.46Å; Y624-F643 HydrophobicContact CD2-CE1 3.46Å; Y624-F643 VanDerWaalsContact CD2-CE1 3.46Å; Y624-F643 AromaticContact CE2-CE1 3.86Å; Y624-F643 HydrophobicContact CE2-CE1 3.86Å; Y624-F643 HydrophobicContact CG-CE1 4.34Å; Y624-F643 WeakPolarHBondContact O-CE1 3.35Å; Y624-L656 HydrophobicContact CD2-CD2 3.48Å; Y624-L656 VanDerWaalsContact CD2-CD2 3.48Å; Y624-L656 HydrophobicContact CE2-CD2 4.28Å; Y624-L656 HydrophobicContact CG-CD2 3.99Å; Y624-H659 AromaticContact CE2-CD2 3.67Å; Y624-H659 PolarHBondContact OH-NE2 2.91Å
625	G	93.9	Very high	93.8	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-43.3	175.3	0	0	0	0	0	113.4	N621 A622 M628 I629	N621-G625 PolarHBondContact O-N 2.8Å; A622-G625 PolarHBondContact O-N 3.29Å; G625-M628 PolarHBondContact O-N 2.98Å; G625-I629 WeakPolarHBondContact O-CG1 3.45Å; G625-I629 PolarHBondContact O-N 3.44Å
626	L	95.6	Very high	93.9	Very high	6 Å²	6	35.2 Å²	35.2	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-60.8	-46.6	170.9	-73.1	-175	0	0	0	112.2	L606 F609 R610 I613 A622 W623 Y624 M628 I629 Y630	L606-L626 HydrophobicContact CD2-CD2 3.59Å; F609-L626 HydrophobicContact CB-CD2 3.74Å; F609-L626 HydrophobicContact CB-CG 3.84Å; R610-L626 HydrophobicContact CG-CD2 4.34Å; I613-L626 HydrophobicContact CD1-CD1 3.47Å; I613-L626 VanDerWaalsContact CD1-CD1 3.47Å; I613-L626 HydrophobicContact CD1-CG 4.26Å; A622-L626 PolarHBondContact O-N 3.29Å; W623-L626 HydrophobicContact CE3-CD1 4.47Å; Y624-L626 PolarHBondContact O-N 2.99Å; L626-M628 VanDerWaalsContact C-N 3.28Å; L626-M628 PolarHBondContact O-N 2.75Å; L626-I629 PolarHBondContact O-N 2.67Å; L626-Y630 HydrophobicContact CB-CD2 4.49Å; L626-Y630 HydrophobicContact CB-CE2 4.32Å; L626-Y630 WeakPolarHBondContact O-CD2 3.17Å; L626-Y630 PolarHBondContact O-N 3.3Å
627	G	95.1	Very high	94.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.1	-42.2	176.6	0	0	0	0	0	112.2	W623 Y624 Y630 Y631	W623-G627 PolarHBondContact O-N 3.36Å; Y624-G627 PolarHBondContact O-N 2.91Å; Y624-G627 VanDerWaalsContact O-N 3.13Å; G627-Y630 PolarHBondContact O-N 2.76Å; G627-Y631 VanDerWaalsContact O-CB 3.3Å; G627-Y631 WeakPolarHBondContact O-CB 3.34Å; G627-Y631 PolarHBondContact O-N 3.18Å
628	M	92.3	Very high	94.3	Very high	33 Å²	33	36.8 Å²	36.8	16%	0.163	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-39.1	178.1	-169.8	61.3	70.7	0	0	112.8	Y624 G625 L626 Y631 K632	Y624-M628 HydrophobicContact CE1-CE 4.5Å; Y624-M628 HydrophobicContact CE2-CE 3.98Å; Y624-M628 PolarHBondContact O-N 3.35Å; Y624-M628 VanDerWaalsContact OH-CE 3.24Å; Y624-M628 WeakPolarHBondContact OH-CE 3.36Å; G625-M628 PolarHBondContact O-N 2.98Å; L626-M628 VanDerWaalsContact C-N 3.28Å; L626-M628 PolarHBondContact O-N 2.75Å; M628-Y631 PolarHBondContact O-N 3.33Å; M628-Y631 HydrophobicContact SD-CD1 4.38Å; M628-K632 PolarHBondContact O-N 3.02Å
629	I	94.7	Very high	94.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.7	-45.8	174.6	-63.6	162.8	0	0	0	110.8	V597 L602 A605 L606 F609 G625 L626 Y631 K632 Q633	V597-I629 HydrophobicContact CG2-CD1 3.98Å; V597-I629 HydrophobicContact CG2-CG1 3.68Å; L602-I629 HydrophobicContact CB-CG2 4.11Å; L602-I629 HydrophobicContact CD1-CG2 4.48Å; L602-I629 HydrophobicContact CD2-CG2 4.4Å; A605-I629 HydrophobicContact CB-CD1 3.56Å; A605-I629 HydrophobicContact CB-CG1 4.5Å; L606-I629 HydrophobicContact CD1-CG2 4.3Å; L606-I629 HydrophobicContact CD2-CB 4.01Å; L606-I629 HydrophobicContact CD2-CD1 3.82Å; L606-I629 HydrophobicContact CD2-CG2 3.75Å; L606-I629 HydrophobicContact CG-CD1 4Å; L606-I629 HydrophobicContact CG-CG2 3.88Å; F609-I629 HydrophobicContact CD2-CD1 3.65Å; F609-I629 HydrophobicContact CE2-CD1 3.74Å; G625-I629 WeakPolarHBondContact O-CG1 3.45Å; G625-I629 PolarHBondContact O-N 3.44Å; L626-I629 PolarHBondContact O-N 2.67Å; I629-Y631 PolarHBondContact O-N 2.94Å; I629-K632 PolarHBondContact O-N 3.14Å; I629-Q633 HydrophobicContact CG2-CG 4.37Å; I629-Q633 WeakPolarHBondContact O-CG 3.36Å; I629-Q633 PolarHBondContact O-N 3.23Å
630	Y	95.7	Very high	94.4	Very high	25 Å²	25	33.7 Å²	33.7	10%	0.098	16%	0.157	C	C	.	.	H	α-helix	trans	-66.4	-27.8	177.6	-66.7	-57.2	0	0	0	112.4	L606 R610 L626 G627 Q633 E634 K635 L638 H642	L606-Y630 HydrophobicContact CD2-CE1 4.28Å; L606-Y630 HydrophobicContact CD2-CE2 4.39Å; R610-Y630 PolarHBondContact NH2-OH 3.16Å; R610-Y630 VanDerWaalsContact NH2-OH 3.07Å; L626-Y630 HydrophobicContact CB-CD2 4.49Å; L626-Y630 HydrophobicContact CB-CE2 4.32Å; L626-Y630 WeakPolarHBondContact O-CD2 3.17Å; L626-Y630 PolarHBondContact O-N 3.3Å; G627-Y630 PolarHBondContact O-N 2.76Å; Y630-Q633 CarbonylContact O-C 3.58Å; Y630-Q633 PolarHBondContact O-N 3.16Å; Y630-E634 PolarHBondContact O-N 2.98Å; Y630-K635 HydrophobicContact CD1-CB 4.46Å; Y630-K635 HydrophobicContact CD1-CD 4.2Å; Y630-K635 PolarHBondContact O-N 3.49Å; Y630-L638 HydrophobicContact CD1-CD1 4.2Å; Y630-L638 HydrophobicContact CD2-CB 4.26Å; Y630-L638 HydrophobicContact CE1-CD1 4.2Å; Y630-L638 HydrophobicContact CG-CB 4.13Å; Y630-H642 AromaticContact CD2-CD2 3.41Å; Y630-H642 VanDerWaalsContact CD2-CD2 3.41Å; Y630-H642 WeakPolarHBondContact CD2-CD2 3.44Å; Y630-H642 AromaticContact CD2-NE2 3.86Å; Y630-H642 AromaticContact CE2-CD2 3.41Å; Y630-H642 VanDerWaalsContact CE2-CD2 3.41Å; Y630-H642 WeakPolarHBondContact CE2-CD2 3.32Å; Y630-H642 AromaticContact CE2-NE2 3.33Å; Y630-H642 VanDerWaalsContact CE2-NE2 3.33Å; Y630-H642 WeakPolarHBondContact CE2-NE2 3.35Å
631	Y	92.2	Very high	94.5	Very high	18 Å²	18	37.5 Å²	37.5	7%	0.071	18%	0.178	C	C	.	.	H	α-helix	trans	-66.8	-48.6	168.9	-178.9	-100.4	0	0	0	112.1	I284 G627 M628 I629 Q633 E634 F636 V662 V663	I284-Y631 HydrophobicContact CB-CE1 4.29Å; I284-Y631 HydrophobicContact CG2-CE1 4.36Å; I284-Y631 WeakPolarHBondContact O-CE1 3.48Å; I284-Y631 PolarHBondContact O-OH 3.26Å; G627-Y631 VanDerWaalsContact O-CB 3.3Å; G627-Y631 WeakPolarHBondContact O-CB 3.34Å; G627-Y631 PolarHBondContact O-N 3.18Å; M628-Y631 PolarHBondContact O-N 3.33Å; M628-Y631 HydrophobicContact SD-CD1 4.38Å; I629-Y631 PolarHBondContact O-N 2.94Å; Y631-Q633 PolarHBondContact O-N 3.13Å; Y631-E634 PolarHBondContact O-N 3.44Å; Y631-F636 AromaticContact CD2-CD1 3.74Å; Y631-F636 HydrophobicContact CD2-CD1 3.74Å; Y631-F636 AromaticContact CD2-CE1 3.65Å; Y631-F636 HydrophobicContact CD2-CE1 3.65Å; Y631-F636 HydrophobicContact CE2-CD1 4.02Å; Y631-F636 AromaticContact CE2-CE1 3.66Å; Y631-F636 HydrophobicContact CE2-CE1 3.66Å; Y631-V662 HydrophobicContact CE2-CG1 3.95Å; Y631-V662 WeakPolarHBondContact OH-CG1 3.37Å; Y631-V663 HydrophobicContact CD2-CG2 3.76Å; Y631-V663 HydrophobicContact CE2-CG2 4.26Å
632	K	90.1	Very high	94.6	Very high	69 Å²	69	37.7 Å²	37.7	30%	0.3	18%	0.178	S	C	.	.	H	α-helix	trans	-57.6	-28.3	170.9	-84.2	-164.8	171.3	-164.4	0	112.9	I284 V597 L602 M628 I629	I284-K632 HydrophobicContact CD1-CG 4.45Å; V597-K632 HydrophobicContact CG1-CD 4.41Å; V597-K632 PolarHBondContact O-NZ 2.86Å; V597-K632 VanDerWaalsContact O-NZ 3.14Å; L602-K632 HydrophobicContact CD2-CD 4.21Å; M628-K632 PolarHBondContact O-N 3.02Å; I629-K632 PolarHBondContact O-N 3.14Å
633	Q	91.8	Very high	94.6	Very high	46 Å²	46	37.8 Å²	37.8	22%	0.215	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	12.6	175.4	-65.3	-176.2	4.4	0	0	113.8	L602 I629 Y630 Y631 K635	L602-Q633 HydrophobicContact CD1-CG 4.12Å; I629-Q633 HydrophobicContact CG2-CG 4.37Å; I629-Q633 WeakPolarHBondContact O-CG 3.36Å; I629-Q633 PolarHBondContact O-N 3.23Å; Y630-Q633 CarbonylContact O-C 3.58Å; Y630-Q633 PolarHBondContact O-N 3.16Å; Y631-Q633 PolarHBondContact O-N 3.13Å; Q633-K635 HydrophobicContact CB-CD 4Å; Q633-K635 HydrophobicContact CB-CG 4.5Å; Q633-K635 WeakPolarHBondContact O-CG 3.31Å; Q633-K635 PolarHBondContact O-N 3.42Å
634	E	92.1	Very high	94.5	Very high	80 Å²	80	40.8 Å²	40.8	37%	0.374	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	13.5	178.5	-54.3	-177.8	172.6	0	0	115.3	P286 L287 Y630 Y631 F636	P286-E634 HydrophobicContact CB-CG 3.85Å; P286-E634 VanDerWaalsContact CB-OE1 3.25Å; P286-E634 WeakPolarHBondContact CB-OE1 3.19Å; L287-E634 VanDerWaalsContact CD2-OE2 3.26Å; L287-E634 WeakPolarHBondContact CD2-OE2 3.3Å; L287-E634 PolarHBondContact N-OE1 2.87Å; Y630-E634 PolarHBondContact O-N 2.98Å; Y631-E634 PolarHBondContact O-N 3.44Å; E634-F636 HydrophobicContact CB-CE2 3.94Å; E634-F636 HydrophobicContact CB-CZ 3.84Å; E634-F636 HydrophobicContact CG-CZ 4.08Å; E634-F636 WeakPolarHBondContact O-CD2 3.44Å; E634-F636 WeakPolarHBondContact O-CE2 3.38Å; E634-F636 PolarHBondContact O-N 3.33Å
635	K	95.4	Very high	94.5	Very high	103 Å²	103	44.1 Å²	44.1	45%	0.448	21%	0.207	S	C	.	.			trans	-85	55.7	179.4	-70.7	158.5	-164.9	171	0	110.2	Y630 Q633 N637 L638 A639	Y630-K635 HydrophobicContact CD1-CB 4.46Å; Y630-K635 HydrophobicContact CD1-CD 4.2Å; Y630-K635 PolarHBondContact O-N 3.49Å; Q633-K635 HydrophobicContact CB-CD 4Å; Q633-K635 HydrophobicContact CB-CG 4.5Å; Q633-K635 WeakPolarHBondContact O-CG 3.31Å; Q633-K635 PolarHBondContact O-N 3.42Å; K635-N637 VanDerWaalsContact C-N 3.25Å; K635-N637 PolarHBondContact O-N 2.87Å; K635-N637 VanDerWaalsContact O-N 3.11Å; K635-L638 HydrophobicContact CB-CB 4.49Å; K635-L638 HydrophobicContact CB-CD1 4.3Å; K635-L638 PolarHBondContact O-N 3.37Å; K635-A639 PolarHBondContact O-N 2.88Å; K635-A639 VanDerWaalsContact O-N 3.11Å
636	F	94.7	Very high	94.6	Very high	30 Å²	30	44.1 Å²	44.1	13%	0.132	21%	0.207	C	C	.	.	H	α-helix	trans	-53.7	-36	-169.8	-55.5	-59.7	0	0	0	113.9	P286 Y631 E634 L638 A639 E640 V663 A666 L667	P286-F636 HydrophobicContact CB-CZ 3.96Å; P286-F636 HydrophobicContact CG-CZ 3.96Å; Y631-F636 AromaticContact CD2-CD1 3.74Å; Y631-F636 HydrophobicContact CD2-CD1 3.74Å; Y631-F636 AromaticContact CD2-CE1 3.65Å; Y631-F636 HydrophobicContact CD2-CE1 3.65Å; Y631-F636 HydrophobicContact CE2-CD1 4.02Å; Y631-F636 AromaticContact CE2-CE1 3.66Å; Y631-F636 HydrophobicContact CE2-CE1 3.66Å; E634-F636 HydrophobicContact CB-CE2 3.94Å; E634-F636 HydrophobicContact CB-CZ 3.84Å; E634-F636 HydrophobicContact CG-CZ 4.08Å; E634-F636 WeakPolarHBondContact O-CD2 3.44Å; E634-F636 WeakPolarHBondContact O-CE2 3.38Å; E634-F636 PolarHBondContact O-N 3.33Å; F636-L638 PolarHBondContact O-N 3.04Å; F636-A639 PolarHBondContact O-N 2.86Å; F636-E640 PolarHBondContact O-N 3.15Å; F636-V663 HydrophobicContact CB-CG1 4.24Å; F636-V663 VanDerWaalsContact O-CG1 3.27Å; F636-V663 WeakPolarHBondContact O-CG1 3.33Å; F636-A666 HydrophobicContact CD1-CB 3.85Å; F636-A666 HydrophobicContact CD2-CB 4.09Å; F636-A666 HydrophobicContact CE1-CB 3.98Å; F636-A666 HydrophobicContact CE2-CB 4.21Å; F636-A666 HydrophobicContact CG-CB 3.93Å; F636-A666 HydrophobicContact CZ-CB 4.16Å; F636-L667 HydrophobicContact CB-CD1 4.34Å; F636-L667 HydrophobicContact CB-CD2 3.64Å; F636-L667 HydrophobicContact CB-CG 3.75Å
637	N	95.3	Very high	94.6	Very high	104 Å²	104	45.1 Å²	45.1	56%	0.556	21%	0.212	S	C	*	.	H	α-helix	trans	-61.1	-39.3	175.2	-74.5	-48.6	0	0	0	113.2	K635 I641 L667	K635-N637 VanDerWaalsContact C-N 3.25Å; K635-N637 PolarHBondContact O-N 2.87Å; K635-N637 VanDerWaalsContact O-N 3.11Å; N637-I641 WeakPolarHBondContact O-CG1 3.46Å; N637-I641 PolarHBondContact O-N 3.23Å; N637-L667 VanDerWaalsContact OD1-CD2 3.3Å; N637-L667 WeakPolarHBondContact OD1-CD2 3.29Å
638	L	95.4	Very high	94.6	Very high	76 Å²	76	48.9 Å²	48.9	40%	0.398	24%	0.238	S	C	.	.	H	α-helix	trans	-73.8	-39	175.5	-63.7	178.5	0	0	0	110.8	Y630 K635 F636 E640 I641 H642	Y630-L638 HydrophobicContact CD1-CD1 4.2Å; Y630-L638 HydrophobicContact CD2-CB 4.26Å; Y630-L638 HydrophobicContact CE1-CD1 4.2Å; Y630-L638 HydrophobicContact CG-CB 4.13Å; K635-L638 HydrophobicContact CB-CB 4.49Å; K635-L638 HydrophobicContact CB-CD1 4.3Å; K635-L638 PolarHBondContact O-N 3.37Å; F636-L638 PolarHBondContact O-N 3.04Å; L638-E640 VanDerWaalsContact C-N 3.33Å; L638-E640 PolarHBondContact O-N 3.39Å; L638-I641 PolarHBondContact O-N 2.84Å; L638-H642 PolarHBondContact O-CD2 3.48Å; L638-H642 PolarHBondContact O-N 3.43Å
639	A	95.4	Very high	94.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-42.8	174.6	0	0	0	0	0	111.8	K635 F636 I641 H642 F643 V663	K635-A639 PolarHBondContact O-N 2.88Å; K635-A639 VanDerWaalsContact O-N 3.11Å; F636-A639 PolarHBondContact O-N 2.86Å; A639-I641 VanDerWaalsContact C-N 3.32Å; A639-I641 PolarHBondContact O-N 2.77Å; A639-H642 PolarHBondContact O-N 3.41Å; A639-F643 HydrophobicContact CB-CD2 4.23Å; A639-F643 HydrophobicContact CB-CE2 4.03Å; A639-F643 WeakPolarHBondContact O-CB 3.5Å; A639-F643 WeakPolarHBondContact O-CD2 3.4Å; A639-F643 WeakPolarHBondContact O-CG 3.29Å; A639-F643 PolarHBondContact O-N 3.45Å; A639-V663 HydrophobicContact CB-CG1 4.35Å; A639-V663 HydrophobicContact CB-CG2 4.07Å
640	E	94.9	Very high	94.5	Very high	13 Å²	13	48 Å²	48	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-42.3	177.5	-165.7	179.2	-174.3	0	0	111.3	F636 L638 K644 V663 Q664 L667 K669	F636-E640 PolarHBondContact O-N 3.15Å; L638-E640 VanDerWaalsContact C-N 3.33Å; L638-E640 PolarHBondContact O-N 3.39Å; E640-K644 VanDerWaalsContact CD-NZ 3.26Å; E640-K644 HydrophobicContact CG-CD 4.12Å; E640-K644 VanDerWaalsContact O-CB 3.26Å; E640-K644 WeakPolarHBondContact O-CB 3.43Å; E640-K644 WeakPolarHBondContact O-CG 3.19Å; E640-K644 PolarHBondContact O-N 3.34Å; E640-K644 WeakPolarHBondContact OE1-CE 3.42Å; E640-K644 IonicContact OE1-NZ 2.74Å; E640-K644 PolarHBondContact OE1-NZ 2.94Å; E640-K644 IonicContact OE2-NZ 3.28Å; E640-V663 HydrophobicContact CB-CG1 3.75Å; E640-V663 HydrophobicContact CG-CG1 4.42Å; E640-Q664 WeakPolarHBondContact OE1-CG 3.38Å; E640-Q664 PolarHBondContact OE1-NE2 3.03Å; E640-L667 HydrophobicContact CB-CD1 4.24Å; E640-L667 WeakPolarHBondContact OE2-CD1 3.39Å; E640-K669 IonicContact OE2-NZ 2.67Å; E640-K669 PolarHBondContact OE2-NZ 3.28Å
641	I	96.3	Very high	94.3	Very high	105 Å²	105	50 Å²	50	54%	0.538	25%	0.251	S	S	.	.	H	α-helix	trans	-65.2	-47.4	178.1	-65.1	165.8	0	0	0	111	N637 L638 A639 K644 K645	N637-I641 WeakPolarHBondContact O-CG1 3.46Å; N637-I641 PolarHBondContact O-N 3.23Å; L638-I641 PolarHBondContact O-N 2.84Å; A639-I641 VanDerWaalsContact C-N 3.32Å; A639-I641 PolarHBondContact O-N 2.77Å; I641-K644 PolarHBondContact O-N 2.89Å; I641-K645 PolarHBondContact O-N 3.46Å
642	H	96.9	Very high	94	Very high	30 Å²	30	53.1 Å²	53.1	14%	0.139	27%	0.265	C	S	.	.	H	α-helix	trans	-69.6	-39.8	-177.8	-70.5	-58.4	0	0	0	112.9	W623 Y630 L638 A639 K645 A646	W623-H642 AromaticContact CE3-ND1 3.47Å; W623-H642 AromaticContact CZ3-CE1 3.88Å; W623-H642 AromaticContact CZ3-ND1 3.41Å; W623-H642 WeakPolarHBondContact CZ3-ND1 3.5Å; Y630-H642 AromaticContact CD2-CD2 3.41Å; Y630-H642 VanDerWaalsContact CD2-CD2 3.41Å; Y630-H642 WeakPolarHBondContact CD2-CD2 3.44Å; Y630-H642 AromaticContact CD2-NE2 3.86Å; Y630-H642 AromaticContact CE2-CD2 3.41Å; Y630-H642 VanDerWaalsContact CE2-CD2 3.41Å; Y630-H642 WeakPolarHBondContact CE2-CD2 3.32Å; Y630-H642 AromaticContact CE2-NE2 3.33Å; Y630-H642 VanDerWaalsContact CE2-NE2 3.33Å; Y630-H642 WeakPolarHBondContact CE2-NE2 3.35Å; L638-H642 PolarHBondContact O-CD2 3.48Å; L638-H642 PolarHBondContact O-N 3.43Å; A639-H642 PolarHBondContact O-N 3.41Å; H642-K645 PolarHBondContact O-N 3.13Å; H642-A646 PolarHBondContact O-N 2.85Å
643	F	96.3	Very high	93.9	Very high	1 Å²	1	50.8 Å²	50.8	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-68.1	-38.8	173.4	-66.5	-49.2	0	0	0	112.3	Y624 A639 K645 A646 L647 H659 I660 V663	Y624-F643 AromaticContact CD2-CD1 3.85Å; Y624-F643 HydrophobicContact CD2-CD1 3.85Å; Y624-F643 AromaticContact CD2-CE1 3.46Å; Y624-F643 HydrophobicContact CD2-CE1 3.46Å; Y624-F643 VanDerWaalsContact CD2-CE1 3.46Å; Y624-F643 AromaticContact CE2-CE1 3.86Å; Y624-F643 HydrophobicContact CE2-CE1 3.86Å; Y624-F643 HydrophobicContact CG-CE1 4.34Å; Y624-F643 WeakPolarHBondContact O-CE1 3.35Å; A639-F643 HydrophobicContact CB-CD2 4.23Å; A639-F643 HydrophobicContact CB-CE2 4.03Å; A639-F643 WeakPolarHBondContact O-CB 3.5Å; A639-F643 WeakPolarHBondContact O-CD2 3.4Å; A639-F643 WeakPolarHBondContact O-CG 3.29Å; A639-F643 PolarHBondContact O-N 3.45Å; F643-K645 VanDerWaalsContact C-N 3.27Å; F643-K645 PolarHBondContact O-N 3.49Å; F643-A646 WeakPolarHBondContact O-CB 3.47Å; F643-A646 PolarHBondContact O-N 3.34Å; F643-L647 PolarHBondContact O-N 2.83Å; F643-H659 HydrophobicContact CE1-CB 4.43Å; F643-H659 HydrophobicContact CE2-CB 4.28Å; F643-H659 HydrophobicContact CZ-CB 4.22Å; F643-I660 HydrophobicContact CB-CD1 4.16Å; F643-I660 HydrophobicContact CB-CG1 3.52Å; F643-I660 HydrophobicContact CG-CG1 4.5Å; F643-V663 HydrophobicContact CD2-CG2 3.89Å; F643-V663 HydrophobicContact CE2-CG2 3.71Å
644	K	95.4	Very high	93.7	Very high	101 Å²	101	49.2 Å²	49.2	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-36.1	170.7	-78	175.3	-177.4	172.4	0	112	E640 I641 L647 S648 I660	E640-K644 VanDerWaalsContact CD-NZ 3.26Å; E640-K644 HydrophobicContact CG-CD 4.12Å; E640-K644 VanDerWaalsContact O-CB 3.26Å; E640-K644 WeakPolarHBondContact O-CB 3.43Å; E640-K644 WeakPolarHBondContact O-CG 3.19Å; E640-K644 PolarHBondContact O-N 3.34Å; E640-K644 WeakPolarHBondContact OE1-CE 3.42Å; E640-K644 IonicContact OE1-NZ 2.74Å; E640-K644 PolarHBondContact OE1-NZ 2.94Å; E640-K644 IonicContact OE2-NZ 3.28Å; I641-K644 PolarHBondContact O-N 2.89Å; K644-L647 PolarHBondContact O-N 3.24Å; K644-S648 PolarHBondContact O-N 3.47Å; K644-I660 HydrophobicContact CG-CD1 4.41Å
645	K	95.9	Very high	93.6	Very high	86 Å²	86	47.4 Å²	47.4	37%	0.374	25%	0.246	S	C	.	.	H	α-helix	trans	-66.4	-41.8	173.8	-174.2	61.1	-172.4	165.3	0	111.8	W623 I641 H642 F643 S648	W623-K645 HydrophobicContact CD2-CB 4.23Å; W623-K645 HydrophobicContact CD2-CG 3.63Å; W623-K645 HydrophobicContact CE3-CB 4.16Å; W623-K645 HydrophobicContact CE3-CG 3.88Å; W623-K645 HydrophobicContact CG-CG 4.11Å; W623-K645 HydrophobicContact CH2-CG 4.22Å; W623-K645 HydrophobicContact CZ2-CG 3.99Å; W623-K645 HydrophobicContact CZ3-CG 4.17Å; I641-K645 PolarHBondContact O-N 3.46Å; H642-K645 PolarHBondContact O-N 3.13Å; F643-K645 VanDerWaalsContact C-N 3.27Å; F643-K645 PolarHBondContact O-N 3.49Å; K645-S648 PolarHBondContact O-N 2.88Å; K645-S648 PolarHBondContact O-OG 3.09Å
646	A	95.9	Very high	93.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-60.1	-45.2	172.4	0	0	0	0	0	112.1	W623 H642 F643 S648 I649 N650 L656	W623-A646 HydrophobicContact CB-CB 3.87Å; H642-A646 PolarHBondContact O-N 2.85Å; F643-A646 WeakPolarHBondContact O-CB 3.47Å; F643-A646 PolarHBondContact O-N 3.34Å; A646-S648 VanDerWaalsContact C-N 3.32Å; A646-S648 PolarHBondContact O-N 3.09Å; A646-I649 WeakPolarHBondContact O-CB 3.49Å; A646-I649 PolarHBondContact O-N 2.83Å; A646-N650 PolarHBondContact O-N 2.98Å; A646-L656 HydrophobicContact CB-CD1 3.95Å; A646-L656 HydrophobicContact CB-CD2 4.03Å
647	L	94.8	Very high	93.4	Very high	28 Å²	28	41.2 Å²	41.2	15%	0.147	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-34.4	177.1	-173.2	73.9	0	0	0	112.6	F643 K644 I649 N650 P651 L656 L657 I660	F643-L647 PolarHBondContact O-N 2.83Å; K644-L647 PolarHBondContact O-N 3.24Å; L647-I649 PolarHBondContact O-N 3.28Å; L647-I649 VanDerWaalsContact O-N 3.16Å; L647-N650 CarbonylContact O-C 3.43Å; L647-N650 VanDerWaalsContact O-C 3.23Å; L647-P651 VanDerWaalsContact O-CA 3.29Å; L647-P651 WeakPolarHBondContact O-CA 3.36Å; L647-L656 HydrophobicContact CD1-CB 4.3Å; L647-L657 HydrophobicContact CD1-CD2 3.68Å; L647-L657 HydrophobicContact CD1-CG 3.76Å; L647-L657 HydrophobicContact CD2-CD2 3.62Å; L647-L657 HydrophobicContact CG-CD2 4.33Å; L647-I660 HydrophobicContact CB-CD1 3.95Å; L647-I660 HydrophobicContact CD2-CD1 3.78Å; L647-I660 HydrophobicContact CG-CD1 4.36Å
648	S	94.5	Very high	93.2	Very high	78 Å²	78	36.5 Å²	36.5	55%	0.545	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.9	174	77.9	0	0	0	0	113.7	K644 K645 A646	K644-S648 PolarHBondContact O-N 3.47Å; K645-S648 PolarHBondContact O-N 2.88Å; K645-S648 PolarHBondContact O-OG 3.09Å; A646-S648 VanDerWaalsContact C-N 3.32Å; A646-S648 PolarHBondContact O-N 3.09Å
649	I	93.6	Very high	93	Very high	10 Å²	10	34 Å²	34	5%	0.051	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-52.3	177.4	-62.7	165.3	0	0	0	110.2	Y464 R618 A646 L647 P651	Y464-I649 WeakPolarHBondContact CD2-O 3.19Å; Y464-I649 HydrophobicContact CE2-CG2 3.8Å; Y464-I649 WeakPolarHBondContact CE2-O 3.31Å; R618-I649 HydrophobicContact CG-CG1 4.43Å; R618-I649 HydrophobicContact CG-CG2 3.74Å; R618-I649 WeakPolarHBondContact O-CG2 3.49Å; A646-I649 WeakPolarHBondContact O-CB 3.49Å; A646-I649 PolarHBondContact O-N 2.83Å; L647-I649 PolarHBondContact O-N 3.28Å; L647-I649 VanDerWaalsContact O-N 3.16Å; I649-P651 WeakPolarHBondContact O-CD 3.34Å
650	N	92.8	Very high	92.9	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	18%	0.182	C	C	.	.			trans	-114.7	91.5	174.6	-178.8	-13.9	0	0	0	109.6	Y464 Y620 A646 L647 Q652 S653 L656	Y464-N650 HydrophobicContact CD1-CB 3.84Å; Y464-N650 VanDerWaalsContact CD1-ND2 3.33Å; Y464-N650 WeakPolarHBondContact CD1-ND2 3.44Å; Y464-N650 HydrophobicContact CD2-CB 3.95Å; Y464-N650 HydrophobicContact CE1-CB 4.1Å; Y464-N650 HydrophobicContact CE2-CB 4.22Å; Y464-N650 HydrophobicContact CG-CB 3.77Å; Y620-N650 HydrophobicContact CD1-CB 4.19Å; Y620-N650 HydrophobicContact CD2-CB 4.42Å; Y620-N650 HydrophobicContact CG-CB 4.15Å; A646-N650 PolarHBondContact O-N 2.98Å; L647-N650 CarbonylContact O-C 3.43Å; L647-N650 VanDerWaalsContact O-C 3.23Å; N650-Q652 VanDerWaalsContact C-N 3.33Å; N650-Q652 PolarHBondContact O-N 3.06Å; N650-Q652 PolarHBondContact OD1-N 3.36Å; N650-S653 PolarHBondContact OD1-N 2.83Å; N650-L656 HydrophobicContact CB-CD1 4.37Å
651	P	89.9	Confident	92.8	Very high	69 Å²	69	33.6 Å²	33.6	45%	0.448	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-11.8	-176.3	31.8	-36.3	0	0	0	114	L647 I649	L647-P651 VanDerWaalsContact O-CA 3.29Å; L647-P651 WeakPolarHBondContact O-CA 3.36Å; I649-P651 WeakPolarHBondContact O-CD 3.34Å
652	Q	85.8	Confident	92.5	Very high	82 Å²	82	29.3 Å²	29.3	38%	0.383	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.3	-178	-59.9	-164.9	6	0	0	113.3	Y464 N650 S654 I683	Y464-Q652 VanDerWaalsContact O-CD 3.28Å; Y464-Q652 PolarHBondContact O-OE1 3.5Å; N650-Q652 VanDerWaalsContact C-N 3.33Å; N650-Q652 PolarHBondContact O-N 3.06Å; N650-Q652 PolarHBondContact OD1-N 3.36Å; Q652-S654 PolarHBondContact O-N 3.5Å; Q652-I683 WeakPolarHBondContact O-CG2 3.35Å
653	S	88.7	Confident	92.4	Very high	20 Å²	20	27.9 Å²	27.9	14%	0.14	15%	0.151	C	C	.	.			trans	-73.8	111	179.1	-175.2	0	0	0	0	112.4	N650 V655 L656 L657	N650-S653 PolarHBondContact OD1-N 2.83Å; S653-V655 VanDerWaalsContact C-N 3.32Å; S653-V655 PolarHBondContact O-N 3.33Å; S653-L656 PolarHBondContact O-N 2.97Å; S653-L656 PolarHBondContact OG-N 2.85Å; S653-L657 PolarHBondContact O-N 2.83Å
654	S	88.5	Confident	92.3	Very high	13 Å²	13	28.5 Å²	28.5	9%	0.091	15%	0.154	C	C	.	.	H	α-helix	trans	-59.6	-41.8	171.2	57.8	0	0	0	0	111.4	Q652 L656 L657 C658 D684 N687	Q652-S654 PolarHBondContact O-N 3.5Å; S654-L656 PolarHBondContact O-N 2.91Å; S654-L657 PolarHBondContact O-N 3.44Å; S654-C658 PolarHBondContact O-N 2.9Å; S654-C658 PolarHBondContact O-SG 2.98Å; S654-D684 PolarHBondContact OG-OD2 3.16Å; S654-N687 PolarHBondContact OG-ND2 3.29Å
655	V	89.2	Confident	92.1	Very high	43 Å²	43	26 Å²	26	26%	0.261	14%	0.144	S	C	.	.	H	α-helix	trans	-58.2	-47.8	178	178.6	0	0	0	0	112.2	P280 S653 L657 C658 H659	P280-V655 HydrophobicContact CG-CG1 4.2Å; S653-V655 VanDerWaalsContact C-N 3.32Å; S653-V655 PolarHBondContact O-N 3.33Å; V655-L657 VanDerWaalsContact C-N 3.34Å; V655-L657 PolarHBondContact O-N 3.4Å; V655-C658 PolarHBondContact O-N 3.4Å; V655-H659 PolarHBondContact O-CD2 3.34Å; V655-H659 VanDerWaalsContact O-CD2 3.24Å; V655-H659 PolarHBondContact O-N 2.95Å; V655-H659 VanDerWaalsContact O-N 3.1Å
656	L	92	Very high	91.9	Very high	3 Å²	3	23.7 Å²	23.7	2%	0.016	14%	0.141	C	C	.	.	H	α-helix	trans	-61	-42	178.4	-67.9	-178.5	0	0	0	112.1	Y620 Y624 A646 L647 N650 S653 S654 C658 I660	Y620-L656 HydrophobicContact CD2-CD1 3.94Å; Y620-L656 HydrophobicContact CE2-CD1 4.41Å; Y624-L656 HydrophobicContact CD2-CD2 3.48Å; Y624-L656 VanDerWaalsContact CD2-CD2 3.48Å; Y624-L656 HydrophobicContact CE2-CD2 4.28Å; Y624-L656 HydrophobicContact CG-CD2 3.99Å; A646-L656 HydrophobicContact CB-CD1 3.95Å; A646-L656 HydrophobicContact CB-CD2 4.03Å; L647-L656 HydrophobicContact CD1-CB 4.3Å; N650-L656 HydrophobicContact CB-CD1 4.37Å; S653-L656 PolarHBondContact O-N 2.97Å; S653-L656 PolarHBondContact OG-N 2.85Å; S654-L656 PolarHBondContact O-N 2.91Å; L656-C658 VanDerWaalsContact C-N 3.32Å; L656-C658 PolarHBondContact O-N 3.35Å; L656-I660 VanDerWaalsContact O-CG1 3.32Å; L656-I660 WeakPolarHBondContact O-CG1 3.26Å; L656-I660 PolarHBondContact O-N 2.89Å; L656-I660 VanDerWaalsContact O-N 3.09Å
657	L	93.2	Very high	91.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.1	-39.8	176.5	-71.2	168	0	0	0	112	L647 S653 S654 V655 I660 G661 T676 R679 A680 I683	L647-L657 HydrophobicContact CD1-CD2 3.68Å; L647-L657 HydrophobicContact CD1-CG 3.76Å; L647-L657 HydrophobicContact CD2-CD2 3.62Å; L647-L657 HydrophobicContact CG-CD2 4.33Å; S653-L657 PolarHBondContact O-N 2.83Å; S654-L657 PolarHBondContact O-N 3.44Å; V655-L657 VanDerWaalsContact C-N 3.34Å; V655-L657 PolarHBondContact O-N 3.4Å; L657-I660 WeakPolarHBondContact O-CB 3.35Å; L657-I660 PolarHBondContact O-N 3.5Å; L657-G661 PolarHBondContact O-N 3.42Å; L657-T676 HydrophobicContact CB-CG2 4.35Å; L657-T676 HydrophobicContact CD2-CG2 4.03Å; L657-T676 WeakPolarHBondContact O-CG2 3.31Å; L657-R679 HydrophobicContact CD1-CG 4.44Å; L657-A680 HydrophobicContact CB-CB 3.64Å; L657-A680 HydrophobicContact CD1-CB 3.97Å; L657-A680 HydrophobicContact CG-CB 4.46Å; L657-I683 HydrophobicContact CD1-CD1 3.58Å
658	C	91.5	Very high	91.6	Very high	4 Å²	4	33.2 Å²	33.2	3%	0.027	18%	0.182	C	C	.	.	H	α-helix	trans	-73.3	-33.2	-176.3	-59.6	0	0	0	0	112.2	S654 V655 L656 G661 V662 L677 A680 C690	S654-C658 PolarHBondContact O-N 2.9Å; S654-C658 PolarHBondContact O-SG 2.98Å; V655-C658 PolarHBondContact O-N 3.4Å; L656-C658 VanDerWaalsContact C-N 3.32Å; L656-C658 PolarHBondContact O-N 3.35Å; C658-G661 PolarHBondContact O-N 3Å; C658-V662 WeakPolarHBondContact O-CG2 3.26Å; C658-V662 PolarHBondContact O-N 3Å; C658-L677 HydrophobicContact CB-CD2 3.78Å; C658-A680 WeakPolarHBondContact SG-CB 3.39Å; C658-C690 HydrophobicContact CB-CB 4.19Å; C658-C690 WeakPolarHBondContact CB-SG 3.32Å; C658-C690 VanDerWaalsContact SG-CA 3.54Å; C658-C690 WeakPolarHBondContact SG-CB 3.26Å; C658-C690 CovalentContact SG-SG 2.03Å; C658-C690 PolarHBondContact SG-SG 3.44Å
659	H	90.9	Very high	91.6	Very high	25 Å²	25	33.8 Å²	33.8	12%	0.116	18%	0.175	C	C	.	.	H	α-helix	trans	-68.2	-34.3	167.2	-72.3	-68.5	0	0	0	113.4	Y624 F643 V655 V662 V663	Y624-H659 AromaticContact CE2-CD2 3.67Å; Y624-H659 PolarHBondContact OH-NE2 2.91Å; F643-H659 HydrophobicContact CE1-CB 4.43Å; F643-H659 HydrophobicContact CE2-CB 4.28Å; F643-H659 HydrophobicContact CZ-CB 4.22Å; V655-H659 PolarHBondContact O-CD2 3.34Å; V655-H659 VanDerWaalsContact O-CD2 3.24Å; V655-H659 PolarHBondContact O-N 2.95Å; V655-H659 VanDerWaalsContact O-N 3.1Å; H659-V662 PolarHBondContact O-N 2.92Å; H659-V663 WeakPolarHBondContact O-CG2 3.33Å; H659-V663 PolarHBondContact O-N 2.99Å
660	I	93.8	Very high	91.5	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-43.8	171.7	-67.5	164.6	0	0	0	110.7	F643 K644 L647 L656 L657 V663 Q664 T676	F643-I660 HydrophobicContact CB-CD1 4.16Å; F643-I660 HydrophobicContact CB-CG1 3.52Å; F643-I660 HydrophobicContact CG-CG1 4.5Å; K644-I660 HydrophobicContact CG-CD1 4.41Å; L647-I660 HydrophobicContact CB-CD1 3.95Å; L647-I660 HydrophobicContact CD2-CD1 3.78Å; L647-I660 HydrophobicContact CG-CD1 4.36Å; L656-I660 VanDerWaalsContact O-CG1 3.32Å; L656-I660 WeakPolarHBondContact O-CG1 3.26Å; L656-I660 PolarHBondContact O-N 2.89Å; L656-I660 VanDerWaalsContact O-N 3.09Å; L657-I660 WeakPolarHBondContact O-CB 3.35Å; L657-I660 PolarHBondContact O-N 3.5Å; I660-V663 PolarHBondContact O-N 3.47Å; I660-Q664 HydrophobicContact CG2-CG 4.27Å; I660-Q664 WeakPolarHBondContact O-CB 3.36Å; I660-Q664 VanDerWaalsContact O-CG 3.29Å; I660-Q664 WeakPolarHBondContact O-CG 3.4Å; I660-Q664 PolarHBondContact O-N 3.32Å; I660-T676 HydrophobicContact CB-CG2 4.26Å; I660-T676 HydrophobicContact CG2-CG2 4.06Å
661	G	92.8	Very high	91.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.3	-46.2	176	0	0	0	0	0	112.8	L657 C658 V663 Q664 H665 A673	L657-G661 PolarHBondContact O-N 3.42Å; C658-G661 PolarHBondContact O-N 3Å; G661-V663 PolarHBondContact O-N 2.92Å; G661-Q664 PolarHBondContact O-N 2.85Å; G661-H665 PolarHBondContact O-N 3.13Å; G661-A673 WeakPolarHBondContact O-CB 3.4Å
662	V	90.8	Very high	91.6	Very high	14 Å²	14	37.5 Å²	37.5	9%	0.085	20%	0.198	C	C	.	.	H	α-helix	trans	-60.2	-44.7	175.7	171.9	0	0	0	0	111.7	Y631 C658 H659 Q664 H665 A666 H693	Y631-V662 HydrophobicContact CE2-CG1 3.95Å; Y631-V662 WeakPolarHBondContact OH-CG1 3.37Å; C658-V662 WeakPolarHBondContact O-CG2 3.26Å; C658-V662 PolarHBondContact O-N 3Å; H659-V662 PolarHBondContact O-N 2.92Å; V662-Q664 PolarHBondContact O-N 3.47Å; V662-H665 PolarHBondContact O-N 3.41Å; V662-A666 PolarHBondContact O-N 3.1Å; V662-H693 HydrophobicContact CG2-CB 3.89Å; V662-H693 VanDerWaalsContact CG2-CG 3.46Å
663	V	93.8	Very high	91.9	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-39.5	175.6	169.3	0	0	0	0	112.2	Y631 F636 A639 E640 F643 H659 I660 G661 A666 L667	Y631-V663 HydrophobicContact CD2-CG2 3.76Å; Y631-V663 HydrophobicContact CE2-CG2 4.26Å; F636-V663 HydrophobicContact CB-CG1 4.24Å; F636-V663 VanDerWaalsContact O-CG1 3.27Å; F636-V663 WeakPolarHBondContact O-CG1 3.33Å; A639-V663 HydrophobicContact CB-CG1 4.35Å; A639-V663 HydrophobicContact CB-CG2 4.07Å; E640-V663 HydrophobicContact CB-CG1 3.75Å; E640-V663 HydrophobicContact CG-CG1 4.42Å; F643-V663 HydrophobicContact CD2-CG2 3.89Å; F643-V663 HydrophobicContact CE2-CG2 3.71Å; H659-V663 WeakPolarHBondContact O-CG2 3.33Å; H659-V663 PolarHBondContact O-N 2.99Å; I660-V663 PolarHBondContact O-N 3.47Å; G661-V663 PolarHBondContact O-N 2.92Å; V663-A666 PolarHBondContact O-N 3.2Å; V663-L667 HydrophobicContact CG1-CD1 4.1Å; V663-L667 WeakPolarHBondContact O-CG 3.34Å; V663-L667 PolarHBondContact O-N 2.66Å
664	Q	94	Very high	92.1	Very high	13 Å²	13	33.5 Å²	33.5	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-66.4	-39	178.2	-76.8	173.8	-20.2	0	0	112	E640 I660 G661 V662 L667 K668 K669 A672 A673 T676	E640-Q664 WeakPolarHBondContact OE1-CG 3.38Å; E640-Q664 PolarHBondContact OE1-NE2 3.03Å; I660-Q664 HydrophobicContact CG2-CG 4.27Å; I660-Q664 WeakPolarHBondContact O-CB 3.36Å; I660-Q664 VanDerWaalsContact O-CG 3.29Å; I660-Q664 WeakPolarHBondContact O-CG 3.4Å; I660-Q664 PolarHBondContact O-N 3.32Å; G661-Q664 PolarHBondContact O-N 2.85Å; V662-Q664 PolarHBondContact O-N 3.47Å; Q664-L667 CarbonylContact O-C 3.41Å; Q664-L667 PolarHBondContact O-N 2.9Å; Q664-K668 PolarHBondContact O-N 3.09Å; Q664-K669 HydrophobicContact CB-CB 4.36Å; Q664-K669 WeakPolarHBondContact O-CA 3.33Å; Q664-K669 WeakPolarHBondContact O-CB 3.43Å; Q664-K669 PolarHBondContact O-N 2.86Å; Q664-A672 PolarHBondContact OE1-O 3.09Å; Q664-A673 HydrophobicContact CB-CB 3.87Å; Q664-T676 PolarHBondContact OE1-OG1 3.34Å
665	H	92.4	Very high	92.4	Very high	50 Å²	50	39.6 Å²	39.6	23%	0.231	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-41.4	172.3	179.2	61.1	0	0	0	112.4	G661 V662 L667 K668 S670 A673 I697	G661-H665 PolarHBondContact O-N 3.13Å; V662-H665 PolarHBondContact O-N 3.41Å; H665-L667 PolarHBondContact O-N 3.44Å; H665-K668 WeakPolarHBondContact O-CA 3.4Å; H665-K668 PolarHBondContact O-N 3.18Å; H665-S670 PolarHBondContact ND1-OG 2.97Å; H665-A673 HydrophobicContact CB-CB 4.18Å; H665-I697 HydrophobicContact CB-CD1 3.74Å; H665-I697 HydrophobicContact CB-CG1 3.91Å
666	A	91	Very high	92.6	Very high	37 Å²	37	38.3 Å²	38.3	31%	0.306	20%	0.197	S	C	.	.	H	α-helix	trans	-60.8	-29.6	172.4	0	0	0	0	0	112.7	F636 V662 V663 K668	F636-A666 HydrophobicContact CD1-CB 3.85Å; F636-A666 HydrophobicContact CD2-CB 4.09Å; F636-A666 HydrophobicContact CE1-CB 3.98Å; F636-A666 HydrophobicContact CE2-CB 4.21Å; F636-A666 HydrophobicContact CG-CB 3.93Å; F636-A666 HydrophobicContact CZ-CB 4.16Å; V662-A666 PolarHBondContact O-N 3.1Å; V663-A666 PolarHBondContact O-N 3.2Å; A666-K668 PolarHBondContact O-N 2.74Å
667	L	93	Very high	92.6	Very high	35 Å²	35	38.1 Å²	38.1	18%	0.183	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	12.6	170.3	-68.4	171.9	0	0	0	114.1	F636 N637 E640 V663 Q664 H665 K669	F636-L667 HydrophobicContact CB-CD1 4.34Å; F636-L667 HydrophobicContact CB-CD2 3.64Å; F636-L667 HydrophobicContact CB-CG 3.75Å; N637-L667 VanDerWaalsContact OD1-CD2 3.3Å; N637-L667 WeakPolarHBondContact OD1-CD2 3.29Å; E640-L667 HydrophobicContact CB-CD1 4.24Å; E640-L667 WeakPolarHBondContact OE2-CD1 3.39Å; V663-L667 HydrophobicContact CG1-CD1 4.1Å; V663-L667 WeakPolarHBondContact O-CG 3.34Å; V663-L667 PolarHBondContact O-N 2.66Å; Q664-L667 CarbonylContact O-C 3.41Å; Q664-L667 PolarHBondContact O-N 2.9Å; H665-L667 PolarHBondContact O-N 3.44Å; L667-K669 HydrophobicContact CB-CD 4.25Å; L667-K669 HydrophobicContact CB-CG 4.23Å; L667-K669 PolarHBondContact O-N 2.77Å
668	K	91.8	Very high	92.6	Very high	193 Å²	193	41.9 Å²	41.9	84%	0.839	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	15.6	-175.6	-55.6	-172	178	-172.8	0	115.5	Q664 H665 A666 S670	Q664-K668 PolarHBondContact O-N 3.09Å; H665-K668 WeakPolarHBondContact O-CA 3.4Å; H665-K668 PolarHBondContact O-N 3.18Å; A666-K668 PolarHBondContact O-N 2.74Å; K668-S670 VanDerWaalsContact C-N 3.3Å; K668-S670 PolarHBondContact O-N 2.77Å
669	K	93.7	Very high	92.6	Very high	89 Å²	89	48.1 Å²	48.1	39%	0.387	24%	0.239	S	C	.	.			trans	-90.4	53.1	178.2	-52.8	173.2	-166.9	169.4	0	111.1	E640 Q664 L667 D671 A672 A673	E640-K669 IonicContact OE2-NZ 2.67Å; E640-K669 PolarHBondContact OE2-NZ 3.28Å; Q664-K669 HydrophobicContact CB-CB 4.36Å; Q664-K669 WeakPolarHBondContact O-CA 3.33Å; Q664-K669 WeakPolarHBondContact O-CB 3.43Å; Q664-K669 PolarHBondContact O-N 2.86Å; L667-K669 HydrophobicContact CB-CD 4.25Å; L667-K669 HydrophobicContact CB-CG 4.23Å; L667-K669 PolarHBondContact O-N 2.77Å; K669-D671 PolarHBondContact O-N 3.43Å; K669-A672 PolarHBondContact O-N 3.16Å; K669-A673 PolarHBondContact O-N 3.1Å; K669-A673 VanDerWaalsContact O-N 3.1Å
670	S	91.4	Very high	92.6	Very high	19 Å²	19	46.9 Å²	46.9	13%	0.133	23%	0.233	C	C	.	.	H	α-helix	trans	-58.9	-36.9	-167.1	-71.1	0	0	0	0	115.1	H665 K668 A673 L674 N701	H665-S670 PolarHBondContact ND1-OG 2.97Å; K668-S670 VanDerWaalsContact C-N 3.3Å; K668-S670 PolarHBondContact O-N 2.77Å; S670-A673 WeakPolarHBondContact O-CB 3.39Å; S670-A673 PolarHBondContact O-N 3Å; S670-L674 WeakPolarHBondContact O-CG 3.23Å; S670-L674 PolarHBondContact O-N 3.13Å; S670-N701 WeakPolarHBondContact CB-OD1 3.39Å; S670-N701 PolarHBondContact OG-OD1 2.67Å
671	D	91.8	Very high	92.4	Very high	103 Å²	103	47.5 Å²	47.5	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-71.9	-42.8	-178.6	-58.9	-64.3	0	0	0	112.2	K669 A673 L674 E675	K669-D671 PolarHBondContact O-N 3.43Å; D671-A673 PolarHBondContact O-N 2.99Å; D671-L674 WeakPolarHBondContact O-CB 3.34Å; D671-L674 PolarHBondContact O-N 3.24Å; D671-L674 VanDerWaalsContact O-N 3.08Å; D671-E675 PolarHBondContact O-N 2.98Å
672	A	93.1	Very high	92.3	Very high	39 Å²	39	50.6 Å²	50.6	32%	0.322	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-30.7	172.8	0	0	0	0	0	112.6	Q664 K669 T676	Q664-A672 PolarHBondContact OE1-O 3.09Å; K669-A672 PolarHBondContact O-N 3.16Å; A672-T676 WeakPolarHBondContact O-CB 3.16Å; A672-T676 PolarHBondContact O-N 2.89Å; A672-T676 PolarHBondContact O-OG1 3.48Å
673	A	93.6	Very high	92.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.5	-43.9	171.4	0	0	0	0	0	111.9	G661 Q664 H665 K669 S670 D671 T676 L677 I697	G661-A673 WeakPolarHBondContact O-CB 3.4Å; Q664-A673 HydrophobicContact CB-CB 3.87Å; H665-A673 HydrophobicContact CB-CB 4.18Å; K669-A673 PolarHBondContact O-N 3.1Å; K669-A673 VanDerWaalsContact O-N 3.1Å; S670-A673 WeakPolarHBondContact O-CB 3.39Å; S670-A673 PolarHBondContact O-N 3Å; D671-A673 PolarHBondContact O-N 2.99Å; A673-T676 PolarHBondContact O-N 2.65Å; A673-L677 WeakPolarHBondContact O-CB 3.44Å; A673-L677 WeakPolarHBondContact O-CD1 3.47Å; A673-L677 VanDerWaalsContact O-CG 3.31Å; A673-L677 WeakPolarHBondContact O-CG 3.44Å; A673-L677 PolarHBondContact O-N 3.33Å; A673-I697 HydrophobicContact CB-CD1 4.1Å
674	L	92.8	Very high	91.6	Very high	19 Å²	19	54.2 Å²	54.2	10%	0.099	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-42.3	175.6	-71.4	174	0	0	0	112	S670 D671 L677 N678 R694 I697 L698	S670-L674 WeakPolarHBondContact O-CG 3.23Å; S670-L674 PolarHBondContact O-N 3.13Å; D671-L674 WeakPolarHBondContact O-CB 3.34Å; D671-L674 PolarHBondContact O-N 3.24Å; D671-L674 VanDerWaalsContact O-N 3.08Å; L674-L677 PolarHBondContact O-N 2.96Å; L674-N678 WeakPolarHBondContact O-CB 3.07Å; L674-N678 PolarHBondContact O-N 2.9Å; L674-N678 PolarHBondContact O-ND2 3.32Å; L674-N678 PolarHBondContact O-OD1 3.22Å; L674-R694 HydrophobicContact CD2-CG 4.09Å; L674-I697 HydrophobicContact CD1-CG2 4.38Å; L674-I697 HydrophobicContact CD2-CB 4.12Å; L674-I697 HydrophobicContact CD2-CG2 3.75Å; L674-I697 HydrophobicContact CG-CG2 3.82Å; L674-L698 HydrophobicContact CD1-CD2 4.11Å; L674-L698 HydrophobicContact CD2-CD2 4.08Å; L674-L698 HydrophobicContact CD2-CG 4.05Å
675	E	93.4	Very high	91.1	Very high	141 Å²	141	57.5 Å²	57.5	66%	0.659	31%	0.309	S	S	*	.	H	α-helix	trans	-58.9	-46.3	172.5	-70.9	-178.4	172.6	0	0	112.1	D671 L677 N678 R679	D671-E675 PolarHBondContact O-N 2.98Å; E675-L677 VanDerWaalsContact C-N 3.33Å; E675-L677 PolarHBondContact O-N 3.15Å; E675-N678 PolarHBondContact O-N 3.05Å; E675-R679 PolarHBondContact O-N 3.23Å
676	T	94.1	Very high	90.5	Very high	15 Å²	15	63 Å²	63	9%	0.092	33%	0.332	C	S	.	.	H	α-helix	trans	-64	-38.3	179.9	-62	0	0	0	0	111.9	L657 I660 Q664 A672 A673 R679 A680	L657-T676 HydrophobicContact CB-CG2 4.35Å; L657-T676 HydrophobicContact CD2-CG2 4.03Å; L657-T676 WeakPolarHBondContact O-CG2 3.31Å; I660-T676 HydrophobicContact CB-CG2 4.26Å; I660-T676 HydrophobicContact CG2-CG2 4.06Å; Q664-T676 PolarHBondContact OE1-OG1 3.34Å; A672-T676 WeakPolarHBondContact O-CB 3.16Å; A672-T676 PolarHBondContact O-N 2.89Å; A672-T676 PolarHBondContact O-OG1 3.48Å; A673-T676 PolarHBondContact O-N 2.65Å; T676-R679 PolarHBondContact O-N 2.92Å; T676-A680 PolarHBondContact O-N 3.31Å; T676-A680 VanDerWaalsContact O-N 3.1Å
677	L	92.3	Very high	90.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-72.5	-37.9	175.7	-73.1	164.5	0	0	0	112.6	C658 A673 L674 E675 R679 A680 I681 H693 R694 I697	C658-L677 HydrophobicContact CB-CD2 3.78Å; A673-L677 WeakPolarHBondContact O-CB 3.44Å; A673-L677 WeakPolarHBondContact O-CD1 3.47Å; A673-L677 VanDerWaalsContact O-CG 3.31Å; A673-L677 WeakPolarHBondContact O-CG 3.44Å; A673-L677 PolarHBondContact O-N 3.33Å; L674-L677 PolarHBondContact O-N 2.96Å; E675-L677 VanDerWaalsContact C-N 3.33Å; E675-L677 PolarHBondContact O-N 3.15Å; L677-R679 VanDerWaalsContact C-N 3.3Å; L677-R679 PolarHBondContact O-N 3.35Å; L677-A680 WeakPolarHBondContact O-CB 3.38Å; L677-A680 PolarHBondContact O-N 2.99Å; L677-A680 VanDerWaalsContact O-N 3.13Å; L677-I681 WeakPolarHBondContact O-CG1 3.36Å; L677-I681 PolarHBondContact O-N 3.17Å; L677-H693 HydrophobicContact CD1-CB 4.4Å; L677-H693 HydrophobicContact CD2-CB 4.3Å; L677-R694 HydrophobicContact CB-CB 4.38Å; L677-R694 HydrophobicContact CD1-CB 4.35Å; L677-I697 HydrophobicContact CD1-CD1 3.52Å
678	N	92.4	Very high	89.8	Confident	79 Å²	79	61.8 Å²	61.8	42%	0.422	32%	0.322	S	S	.	.	H	α-helix	trans	-59.9	-41.7	172	-71.9	-18.4	0	0	0	111	L674 E675 I681 G682 R694	L674-N678 WeakPolarHBondContact O-CB 3.07Å; L674-N678 PolarHBondContact O-N 2.9Å; L674-N678 PolarHBondContact O-ND2 3.32Å; L674-N678 PolarHBondContact O-OD1 3.22Å; E675-N678 PolarHBondContact O-N 3.05Å; N678-I681 PolarHBondContact O-N 3.47Å; N678-G682 PolarHBondContact O-N 3.36Å; N678-R694 VanDerWaalsContact OD1-CD 3.24Å; N678-R694 WeakPolarHBondContact OD1-CD 3.32Å; N678-R694 PolarHBondContact OD1-NH1 3.26Å
679	R	91.9	Very high	89.4	Confident	134 Å²	134	53.7 Å²	53.7	51%	0.506	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-40.3	172.7	-176.2	173.3	67	-150.8	-3.2	112.4	L657 E675 T676 L677 G682 I683	L657-R679 HydrophobicContact CD1-CG 4.44Å; E675-R679 PolarHBondContact O-N 3.23Å; T676-R679 PolarHBondContact O-N 2.92Å; L677-R679 VanDerWaalsContact C-N 3.3Å; L677-R679 PolarHBondContact O-N 3.35Å; R679-G682 PolarHBondContact O-N 3.01Å; R679-I683 HydrophobicContact CG-CD1 4.23Å; R679-I683 WeakPolarHBondContact O-CG1 3.31Å; R679-I683 PolarHBondContact O-N 3.13Å
680	A	91.5	Very high	89.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-44.4	178.4	0	0	0	0	0	112.5	L657 C658 T676 L677 G682 I683 D684 C690	L657-A680 HydrophobicContact CB-CB 3.64Å; L657-A680 HydrophobicContact CD1-CB 3.97Å; L657-A680 HydrophobicContact CG-CB 4.46Å; C658-A680 WeakPolarHBondContact SG-CB 3.39Å; T676-A680 PolarHBondContact O-N 3.31Å; T676-A680 VanDerWaalsContact O-N 3.1Å; L677-A680 WeakPolarHBondContact O-CB 3.38Å; L677-A680 PolarHBondContact O-N 2.99Å; L677-A680 VanDerWaalsContact O-N 3.13Å; A680-G682 VanDerWaalsContact C-N 3.3Å; A680-G682 PolarHBondContact O-N 2.92Å; A680-I683 PolarHBondContact O-N 3.1Å; A680-I683 VanDerWaalsContact O-N 3.15Å; A680-D684 PolarHBondContact O-N 3.34Å; A680-C690 HydrophobicContact CB-CB 4.48Å
681	I	89.9	Confident	89	Confident	17 Å²	17	49.5 Å²	49.5	9%	0.087	27%	0.268	C	S	.	.	H	α-helix	trans	-69.5	-29.1	178.2	-65.4	165	0	0	0	111.2	L677 N678 I683 D684 P685 C690 K691 R694	L677-I681 WeakPolarHBondContact O-CG1 3.36Å; L677-I681 PolarHBondContact O-N 3.17Å; N678-I681 PolarHBondContact O-N 3.47Å; I681-I683 VanDerWaalsContact C-N 3.33Å; I681-D684 CarbonylContact O-C 3.44Å; I681-D684 VanDerWaalsContact O-C 3.28Å; I681-P685 WeakPolarHBondContact O-CA 3.24Å; I681-P685 WeakPolarHBondContact O-CD 3.41Å; I681-P685 WeakPolarHBondContact O-CG 3.25Å; I681-P685 VanDerWaalsContact O-N 3.11Å; I681-C690 HydrophobicContact CD1-CB 4.33Å; I681-C690 HydrophobicContact CG1-CB 3.76Å; I681-K691 HydrophobicContact CD1-CG 4Å; I681-K691 HydrophobicContact CG1-CG 4.41Å; I681-R694 HydrophobicContact CD1-CB 4.36Å
682	G	89.1	Confident	88.9	Confident	64 Å²	64	45.4 Å²	45.4	66%	0.66	25%	0.245	S	C	*	.	H	α-helix	trans	-68.4	-25.8	170.4	0	0	0	0	0	114.6	N678 R679 A680	N678-G682 PolarHBondContact O-N 3.36Å; R679-G682 PolarHBondContact O-N 3.01Å; A680-G682 VanDerWaalsContact C-N 3.3Å; A680-G682 PolarHBondContact O-N 2.92Å
683	I	86.9	Confident	88.8	Confident	53 Å²	53	44.5 Å²	44.5	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-84.6	-41.5	175.3	-67.4	162.4	0	0	0	110.9	Q652 L657 R679 A680 I681	Q652-I683 WeakPolarHBondContact O-CG2 3.35Å; L657-I683 HydrophobicContact CD1-CD1 3.58Å; R679-I683 HydrophobicContact CG-CD1 4.23Å; R679-I683 WeakPolarHBondContact O-CG1 3.31Å; R679-I683 PolarHBondContact O-N 3.13Å; A680-I683 PolarHBondContact O-N 3.1Å; A680-I683 VanDerWaalsContact O-N 3.15Å; I681-I683 VanDerWaalsContact C-N 3.33Å
684	D	83.2	Confident	88.7	Confident	39 Å²	39	46.2 Å²	46.2	21%	0.209	24%	0.24	C	C	.	.			trans	-138.4	93.2	179.3	-179.4	4.9	0	0	0	111.3	S654 A680 I681 K686 N687	S654-D684 PolarHBondContact OG-OD2 3.16Å; A680-D684 PolarHBondContact O-N 3.34Å; I681-D684 CarbonylContact O-C 3.44Å; I681-D684 VanDerWaalsContact O-C 3.28Å; D684-K686 PolarHBondContact O-N 2.98Å; D684-K686 WeakPolarHBondContact OD1-CB 3.27Å; D684-K686 PolarHBondContact OD1-N 2.9Å; D684-N687 HydrophobicContact CB-CB 4.44Å; D684-N687 PolarHBondContact O-N 3.48Å; D684-N687 PolarHBondContact OD1-N 3.3Å; D684-N687 WeakPolarHBondContact OD2-CB 3.43Å
685	P	83.8	Confident	88.6	Confident	81 Å²	81	45.3 Å²	45.3	53%	0.526	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13	177.9	-22.1	33.3	0	0	0	114.6	I681	I681-P685 WeakPolarHBondContact O-CA 3.24Å; I681-P685 WeakPolarHBondContact O-CD 3.41Å; I681-P685 WeakPolarHBondContact O-CG 3.25Å; I681-P685 VanDerWaalsContact O-N 3.11Å
686	K	79.8	Confident	88.5	Confident	166 Å²	166	40 Å²	40	72%	0.722	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-17.7	-176.2	-63.7	179.9	-179.1	175	0	112.7	D684 P688	D684-K686 PolarHBondContact O-N 2.98Å; D684-K686 WeakPolarHBondContact OD1-CB 3.27Å; D684-K686 PolarHBondContact OD1-N 2.9Å; K686-P688 WeakPolarHBondContact O-CD 3.4Å
687	N	82.9	Confident	88.4	Confident	13 Å²	13	39.4 Å²	39.4	7%	0.07	21%	0.211	C	C	.	.			trans	-64.1	111.9	-176.4	-169	-32.2	0	0	0	112.1	S654 D684 L689 C690	S654-N687 PolarHBondContact OG-ND2 3.29Å; D684-N687 HydrophobicContact CB-CB 4.44Å; D684-N687 PolarHBondContact O-N 3.48Å; D684-N687 PolarHBondContact OD1-N 3.3Å; D684-N687 WeakPolarHBondContact OD2-CB 3.43Å; N687-L689 PolarHBondContact O-N 3.18Å; N687-L689 WeakPolarHBondContact OD1-CB 3.44Å; N687-L689 PolarHBondContact OD1-N 3.04Å; N687-C690 HydrophobicContact CB-CB 4.31Å; N687-C690 VanDerWaalsContact CG-SG 3.55Å
688	P	86	Confident	88.4	Confident	33 Å²	33	40.3 Å²	40.3	21%	0.214	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-37	-177.1	-23.7	37	0	0	0	113.5	F282 K686 C690 K691 F692 L714 I717 V718	F282-P688 HydrophobicContact CE1-CB 4.25Å; F282-P688 HydrophobicContact CZ-CB 3.79Å; K686-P688 WeakPolarHBondContact O-CD 3.4Å; P688-C690 PolarHBondContact O-N 3.03Å; P688-K691 PolarHBondContact O-N 2.94Å; P688-F692 PolarHBondContact O-N 3.02Å; P688-L714 HydrophobicContact CB-CD1 3.71Å; P688-L714 WeakPolarHBondContact O-CD1 3.33Å; P688-I717 HydrophobicContact CG-CG2 4.16Å; P688-V718 HydrophobicContact CB-CG2 3.6Å; P688-V718 HydrophobicContact CG-CG2 3.48Å; P688-V718 VanDerWaalsContact CG-CG2 3.48Å
689	L	84.5	Confident	88.5	Confident	23 Å²	23	38.6 Å²	38.6	12%	0.12	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-37.7	-173.7	-76.4	137.1	0	0	0	112.4	P280 F282 N687 F692 H693	P280-L689 HydrophobicContact CB-CD1 3.87Å; P280-L689 HydrophobicContact CB-CD2 3.79Å; P280-L689 HydrophobicContact CB-CG 4.44Å; P280-L689 HydrophobicContact CG-CD1 3.84Å; F282-L689 HydrophobicContact CB-CD2 4.47Å; F282-L689 HydrophobicContact CD1-CD2 3.53Å; F282-L689 HydrophobicContact CD1-CG 3.95Å; F282-L689 HydrophobicContact CD2-CD2 4.43Å; F282-L689 HydrophobicContact CE1-CB 4.33Å; F282-L689 HydrophobicContact CE1-CD2 3.9Å; F282-L689 HydrophobicContact CE1-CG 3.76Å; F282-L689 HydrophobicContact CG-CD2 3.86Å; F282-L689 HydrophobicContact CZ-CD2 4.49Å; F282-L689 HydrophobicContact CZ-CG 4.17Å; N687-L689 PolarHBondContact O-N 3.18Å; N687-L689 WeakPolarHBondContact OD1-CB 3.44Å; N687-L689 PolarHBondContact OD1-N 3.04Å; L689-F692 PolarHBondContact O-N 3.25Å; L689-H693 WeakPolarHBondContact O-CB 3.4Å; L689-H693 PolarHBondContact O-CD2 2.95Å; L689-H693 PolarHBondContact O-N 2.9Å
690	C	86.6	Confident	88.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.8	-40.4	177.4	-63.3	0	0	0	0	111.8	C658 A680 I681 N687 P688 R694	C658-C690 HydrophobicContact CB-CB 4.19Å; C658-C690 WeakPolarHBondContact CB-SG 3.32Å; C658-C690 VanDerWaalsContact SG-CA 3.54Å; C658-C690 WeakPolarHBondContact SG-CB 3.26Å; C658-C690 CovalentContact SG-SG 2.03Å; C658-C690 PolarHBondContact SG-SG 3.44Å; A680-C690 HydrophobicContact CB-CB 4.48Å; I681-C690 HydrophobicContact CD1-CB 4.33Å; I681-C690 HydrophobicContact CG1-CB 3.76Å; N687-C690 HydrophobicContact CB-CB 4.31Å; N687-C690 VanDerWaalsContact CG-SG 3.55Å; P688-C690 PolarHBondContact O-N 3.03Å; C690-R694 WeakPolarHBondContact O-CB 3.34Å; C690-R694 PolarHBondContact O-N 2.86Å
691	K	89.4	Confident	88.4	Confident	20 Å²	20	36.4 Å²	36.4	9%	0.087	21%	0.21	C	C	.	.	H	α-helix	trans	-66.7	-43.3	172.1	-69.3	-161.9	179.5	-167.5	0	112.2	I681 P688 R694 A695 E713 L714 I717	I681-K691 HydrophobicContact CD1-CG 4Å; I681-K691 HydrophobicContact CG1-CG 4.41Å; P688-K691 PolarHBondContact O-N 2.94Å; K691-R694 PolarHBondContact O-N 3.29Å; K691-A695 WeakPolarHBondContact O-CB 3.41Å; K691-A695 PolarHBondContact O-N 3.45Å; K691-E713 IonicContact NZ-OE2 3.18Å; K691-E713 PolarHBondContact NZ-OE2 3.2Å; K691-L714 HydrophobicContact CB-CD1 4.34Å; K691-I717 HydrophobicContact CD-CD1 4.09Å
692	F	90.6	Very high	88.5	Confident	18 Å²	18	40.6 Å²	40.6	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-48.7	177.9	-177.8	-96.8	0	0	0	112.8	F282 P688 L689 R694 A695 S696 L714 L723 V724 L727	F282-F692 HydrophobicContact CB-CD1 4.1Å; F282-F692 HydrophobicContact CB-CE1 3.97Å; F282-F692 HydrophobicContact CB-CZ 4.36Å; F282-F692 HydrophobicContact CD1-CB 3.48Å; F282-F692 VanDerWaalsContact CD1-CB 3.48Å; F282-F692 AromaticContact CD1-CD1 3.55Å; F282-F692 HydrophobicContact CD1-CD1 3.55Å; F282-F692 HydrophobicContact CD1-CD2 4.04Å; F282-F692 HydrophobicContact CD1-CE1 4.25Å; F282-F692 AromaticContact CD1-CG 3.41Å; F282-F692 HydrophobicContact CD1-CG 3.41Å; F282-F692 VanDerWaalsContact CD1-CG 3.41Å; F282-F692 HydrophobicContact CE1-CB 3.46Å; F282-F692 VanDerWaalsContact CE1-CB 3.46Å; F282-F692 HydrophobicContact CE1-CD1 4.41Å; F282-F692 HydrophobicContact CE1-CD2 4.38Å; F282-F692 AromaticContact CE1-CG 3.86Å; F282-F692 HydrophobicContact CE1-CG 3.86Å; F282-F692 HydrophobicContact CG-CD1 4.27Å; F282-F692 HydrophobicContact CG-CG 4.35Å; P688-F692 PolarHBondContact O-N 3.02Å; L689-F692 PolarHBondContact O-N 3.25Å; F692-R694 VanDerWaalsContact C-N 3.31Å; F692-R694 PolarHBondContact O-N 3.26Å; F692-A695 PolarHBondContact O-N 3.02Å; F692-S696 WeakPolarHBondContact O-CB 3.36Å; F692-S696 PolarHBondContact O-N 3.24Å; F692-L714 HydrophobicContact CB-CD2 3.68Å; F692-L714 HydrophobicContact CD2-CD2 3.96Å; F692-L714 HydrophobicContact CG-CD2 4.34Å; F692-L723 HydrophobicContact CE2-CB 4.31Å; F692-L723 WeakPolarHBondContact CE2-O 3.35Å; F692-L723 HydrophobicContact CZ-CB 4.27Å; F692-V724 HydrophobicContact CD2-CG2 4.26Å; F692-L727 HydrophobicContact CD2-CD2 4.1Å; F692-L727 HydrophobicContact CE2-CB 4.06Å; F692-L727 HydrophobicContact CE2-CD2 3.65Å; F692-L727 HydrophobicContact CZ-CD2 3.95Å
693	H	90.2	Very high	88.7	Confident	20 Å²	20	42.4 Å²	42.4	9%	0.093	22%	0.222	C	C	.	.	H	α-helix	trans	-65.9	-34.7	178	-68.6	-53.2	0	0	0	111.6	V662 L677 L689 S696 I697	V662-H693 HydrophobicContact CG2-CB 3.89Å; V662-H693 VanDerWaalsContact CG2-CG 3.46Å; L677-H693 HydrophobicContact CD1-CB 4.4Å; L677-H693 HydrophobicContact CD2-CB 4.3Å; L689-H693 WeakPolarHBondContact O-CB 3.4Å; L689-H693 PolarHBondContact O-CD2 2.95Å; L689-H693 PolarHBondContact O-N 2.9Å; H693-S696 PolarHBondContact O-N 3.43Å; H693-I697 WeakPolarHBondContact O-CD1 3.47Å; H693-I697 VanDerWaalsContact O-CG1 3.28Å; H693-I697 WeakPolarHBondContact O-CG1 3.4Å; H693-I697 PolarHBondContact O-N 2.77Å
694	R	91.3	Very high	89.1	Confident	35 Å²	35	41.5 Å²	41.5	13%	0.132	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-49.1	169.7	-177.9	163.6	73.8	171.7	2.5	111.6	L674 L677 N678 I681 C690 K691 F692 S696 I697 L698 E710	L674-R694 HydrophobicContact CD2-CG 4.09Å; L677-R694 HydrophobicContact CB-CB 4.38Å; L677-R694 HydrophobicContact CD1-CB 4.35Å; N678-R694 VanDerWaalsContact OD1-CD 3.24Å; N678-R694 WeakPolarHBondContact OD1-CD 3.32Å; N678-R694 PolarHBondContact OD1-NH1 3.26Å; I681-R694 HydrophobicContact CD1-CB 4.36Å; C690-R694 WeakPolarHBondContact O-CB 3.34Å; C690-R694 PolarHBondContact O-N 2.86Å; K691-R694 PolarHBondContact O-N 3.29Å; F692-R694 VanDerWaalsContact C-N 3.31Å; F692-R694 PolarHBondContact O-N 3.26Å; R694-S696 PolarHBondContact O-N 3.48Å; R694-I697 PolarHBondContact O-N 3.49Å; R694-L698 HydrophobicContact CG-CD1 4.02Å; R694-L698 HydrophobicContact CG-CG 4.47Å; R694-L698 VanDerWaalsContact O-CG 3.31Å; R694-L698 WeakPolarHBondContact O-CG 3.34Å; R694-L698 PolarHBondContact O-N 2.98Å; R694-E710 VanDerWaalsContact CZ-CD 3.5Å; R694-E710 IonicContact CZ-OE1 3.55Å; R694-E710 IonicContact CZ-OE2 2.95Å; R694-E710 IonicContact NE-OE1 3.19Å; R694-E710 PolarHBondContact NE-OE1 2.96Å; R694-E710 IonicContact NE-OE2 3.43Å; R694-E710 PolarHBondContact NE-OE2 3.21Å; R694-E710 IonicContact NH2-OE1 2.71Å; R694-E710 PolarHBondContact NH2-OE1 3.49Å; R694-E710 IonicContact NH2-OE2 3.58Å; R694-E710 PolarHBondContact NH2-OE2 2.96Å
695	A	91.9	Very high	89.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-40	177.1	0	0	0	0	0	113	K691 F692 I697 L698 F699 E710 L711 L727	K691-A695 WeakPolarHBondContact O-CB 3.41Å; K691-A695 PolarHBondContact O-N 3.45Å; F692-A695 PolarHBondContact O-N 3.02Å; A695-I697 VanDerWaalsContact C-N 3.35Å; A695-I697 PolarHBondContact O-N 2.89Å; A695-L698 PolarHBondContact O-N 3.42Å; A695-F699 WeakPolarHBondContact O-CB 3.32Å; A695-F699 PolarHBondContact O-N 2.82Å; A695-E710 HydrophobicContact CB-CB 3.95Å; A695-L711 HydrophobicContact CB-CD1 4.32Å; A695-L711 HydrophobicContact CB-CD2 3.77Å; A695-L711 HydrophobicContact CB-CG 3.73Å; A695-L727 HydrophobicContact CB-CD2 4.46Å
696	S	90.7	Very high	90	Very high	30 Å²	30	46.5 Å²	46.5	21%	0.21	24%	0.235	C	C	.	.	H	α-helix	trans	-64.2	-37.9	176.6	-170.6	0	0	0	0	112.3	F692 H693 R694 A700	F692-S696 WeakPolarHBondContact O-CB 3.36Å; F692-S696 PolarHBondContact O-N 3.24Å; H693-S696 PolarHBondContact O-N 3.43Å; R694-S696 PolarHBondContact O-N 3.48Å; S696-A700 WeakPolarHBondContact O-CB 3.41Å; S696-A700 PolarHBondContact O-N 3.43Å
697	I	91.2	Very high	90.7	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-76	-35.1	176.9	-66.3	164.3	0	0	0	110.9	H665 A673 L674 L677 H693 R694 A695 F699 A700 N701	H665-I697 HydrophobicContact CB-CD1 3.74Å; H665-I697 HydrophobicContact CB-CG1 3.91Å; A673-I697 HydrophobicContact CB-CD1 4.1Å; L674-I697 HydrophobicContact CD1-CG2 4.38Å; L674-I697 HydrophobicContact CD2-CB 4.12Å; L674-I697 HydrophobicContact CD2-CG2 3.75Å; L674-I697 HydrophobicContact CG-CG2 3.82Å; L677-I697 HydrophobicContact CD1-CD1 3.52Å; H693-I697 WeakPolarHBondContact O-CD1 3.47Å; H693-I697 VanDerWaalsContact O-CG1 3.28Å; H693-I697 WeakPolarHBondContact O-CG1 3.4Å; H693-I697 PolarHBondContact O-N 2.77Å; R694-I697 PolarHBondContact O-N 3.49Å; A695-I697 VanDerWaalsContact C-N 3.35Å; A695-I697 PolarHBondContact O-N 2.89Å; I697-F699 VanDerWaalsContact C-N 3.35Å; I697-A700 PolarHBondContact O-N 3.19Å; I697-N701 WeakPolarHBondContact O-CB 3.17Å; I697-N701 PolarHBondContact O-N 2.84Å; I697-N701 PolarHBondContact O-ND2 3.48Å
698	L	93.8	Very high	91.2	Very high	19 Å²	19	39.6 Å²	39.6	10%	0.099	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-39	171	-71.4	170.1	0	0	0	111.9	L674 R694 A695 N701 D702 K703 A706 A707 E710	L674-L698 HydrophobicContact CD1-CD2 4.11Å; L674-L698 HydrophobicContact CD2-CD2 4.08Å; L674-L698 HydrophobicContact CD2-CG 4.05Å; R694-L698 HydrophobicContact CG-CD1 4.02Å; R694-L698 HydrophobicContact CG-CG 4.47Å; R694-L698 VanDerWaalsContact O-CG 3.31Å; R694-L698 WeakPolarHBondContact O-CG 3.34Å; R694-L698 PolarHBondContact O-N 2.98Å; A695-L698 PolarHBondContact O-N 3.42Å; L698-N701 CarbonylContact O-C 3.5Å; L698-N701 PolarHBondContact O-N 3.4Å; L698-D702 PolarHBondContact O-N 3.26Å; L698-K703 HydrophobicContact CB-CB 4.32Å; L698-K703 HydrophobicContact CD2-CB 3.98Å; L698-K703 HydrophobicContact CD2-CD 3.96Å; L698-K703 WeakPolarHBondContact O-CA 3.39Å; L698-K703 WeakPolarHBondContact O-CB 3.35Å; L698-K703 PolarHBondContact O-N 3.26Å; L698-A706 HydrophobicContact CD1-CB 4.14Å; L698-A707 HydrophobicContact CB-CB 4.01Å; L698-E710 HydrophobicContact CD1-CG 3.93Å
699	F	92.7	Very high	91.5	Very high	43 Å²	43	44.1 Å²	44.1	19%	0.189	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-43.7	171.9	171.1	-99.5	0	0	0	112	A695 I697 N701 D702 Y704 A707 L727 K730 V731 K734	A695-F699 WeakPolarHBondContact O-CB 3.32Å; A695-F699 PolarHBondContact O-N 2.82Å; I697-F699 VanDerWaalsContact C-N 3.35Å; F699-N701 PolarHBondContact O-N 3.28Å; F699-D702 PolarHBondContact O-N 2.86Å; F699-Y704 AromaticContact CD2-CD1 3.77Å; F699-Y704 HydrophobicContact CD2-CD1 3.77Å; F699-Y704 AromaticContact CD2-CE1 3.57Å; F699-Y704 HydrophobicContact CD2-CE1 3.57Å; F699-Y704 HydrophobicContact CE2-CD1 4.23Å; F699-Y704 AromaticContact CE2-CE1 3.71Å; F699-Y704 HydrophobicContact CE2-CE1 3.71Å; F699-Y704 HydrophobicContact CG-CE1 4.48Å; F699-A707 HydrophobicContact CB-CB 4.41Å; F699-L727 HydrophobicContact CB-CD1 4.43Å; F699-L727 HydrophobicContact CD1-CD1 4.19Å; F699-L727 HydrophobicContact CG-CD1 4.21Å; F699-K730 HydrophobicContact CE2-CB 4.1Å; F699-K730 HydrophobicContact CZ-CB 3.93Å; F699-V731 HydrophobicContact CB-CG2 4.39Å; F699-V731 HydrophobicContact CD2-CB 4.32Å; F699-V731 HydrophobicContact CD2-CG2 3.55Å; F699-V731 HydrophobicContact CE2-CG2 4.22Å; F699-V731 HydrophobicContact CG-CG2 4.27Å; F699-K734 HydrophobicContact CE2-CB 4.37Å; F699-K734 HydrophobicContact CE2-CG 3.85Å; F699-K734 HydrophobicContact CZ-CG 4.18Å
700	A	90.3	Very high	91.8	Very high	51 Å²	51	44 Å²	44	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-69.4	-17.7	177	0	0	0	0	0	114.1	S696 I697	S696-A700 WeakPolarHBondContact O-CB 3.41Å; S696-A700 PolarHBondContact O-N 3.43Å; I697-A700 PolarHBondContact O-N 3.19Å
701	N	91.3	Very high	92	Very high	37 Å²	37	44 Å²	44	20%	0.198	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	22.2	173.7	-63	-14.5	0	0	0	112.3	S670 I697 L698 F699 K703	S670-N701 WeakPolarHBondContact CB-OD1 3.39Å; S670-N701 PolarHBondContact OG-OD1 2.67Å; I697-N701 WeakPolarHBondContact O-CB 3.17Å; I697-N701 PolarHBondContact O-N 2.84Å; I697-N701 PolarHBondContact O-ND2 3.48Å; L698-N701 CarbonylContact O-C 3.5Å; L698-N701 PolarHBondContact O-N 3.4Å; F699-N701 PolarHBondContact O-N 3.28Å; N701-K703 HydrophobicContact CB-CD 4.33Å; N701-K703 WeakPolarHBondContact O-CG 3.42Å; N701-K703 PolarHBondContact O-N 2.95Å
702	D	92.6	Very high	92.1	Very high	105 Å²	105	46.9 Å²	46.9	56%	0.561	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.5	12.9	-179.4	-62.6	-69	0	0	0	116.6	L698 F699 Y704	L698-D702 PolarHBondContact O-N 3.26Å; F699-D702 PolarHBondContact O-N 2.86Å; D702-Y704 HydrophobicContact CB-CE2 3.96Å; D702-Y704 VanDerWaalsContact O-CD2 3.25Å; D702-Y704 WeakPolarHBondContact O-CD2 3.21Å; D702-Y704 PolarHBondContact O-N 3.35Å; D702-Y704 WeakPolarHBondContact OD1-CE2 3.42Å; D702-Y704 PolarHBondContact OD1-OH 3.47Å
703	K	93.9	Very high	92.1	Very high	101 Å²	101	49 Å²	49	44%	0.439	25%	0.247	S	C	.	.			trans	-81.6	48	-179.9	-71.5	164.2	-173.5	174.3	0	111.2	L698 N701 K705 A706 A707	L698-K703 HydrophobicContact CB-CB 4.32Å; L698-K703 HydrophobicContact CD2-CB 3.98Å; L698-K703 HydrophobicContact CD2-CD 3.96Å; L698-K703 WeakPolarHBondContact O-CA 3.39Å; L698-K703 WeakPolarHBondContact O-CB 3.35Å; L698-K703 PolarHBondContact O-N 3.26Å; N701-K703 HydrophobicContact CB-CD 4.33Å; N701-K703 WeakPolarHBondContact O-CG 3.42Å; N701-K703 PolarHBondContact O-N 2.95Å; K703-K705 VanDerWaalsContact C-N 3.32Å; K703-K705 PolarHBondContact O-N 3.37Å; K703-K705 VanDerWaalsContact O-N 3.16Å; K703-A706 PolarHBondContact O-N 2.94Å; K703-A707 PolarHBondContact O-N 3.47Å
704	Y	93.9	Very high	92.1	Very high	35 Å²	35	48.1 Å²	48.1	14%	0.137	24%	0.242	C	C	.	.	H	α-helix	trans	-51.5	-40.4	-169.8	-60.2	-57.7	0	0	0	114.9	F699 D702 A707 L708 V731 K734 L735	F699-Y704 AromaticContact CD2-CD1 3.77Å; F699-Y704 HydrophobicContact CD2-CD1 3.77Å; F699-Y704 AromaticContact CD2-CE1 3.57Å; F699-Y704 HydrophobicContact CD2-CE1 3.57Å; F699-Y704 HydrophobicContact CE2-CD1 4.23Å; F699-Y704 AromaticContact CE2-CE1 3.71Å; F699-Y704 HydrophobicContact CE2-CE1 3.71Å; F699-Y704 HydrophobicContact CG-CE1 4.48Å; D702-Y704 HydrophobicContact CB-CE2 3.96Å; D702-Y704 VanDerWaalsContact O-CD2 3.25Å; D702-Y704 WeakPolarHBondContact O-CD2 3.21Å; D702-Y704 PolarHBondContact O-N 3.35Å; D702-Y704 WeakPolarHBondContact OD1-CE2 3.42Å; D702-Y704 PolarHBondContact OD1-OH 3.47Å; Y704-A707 PolarHBondContact O-N 2.91Å; Y704-L708 PolarHBondContact O-N 3.43Å; Y704-V731 HydrophobicContact CD1-CG1 4.16Å; Y704-K734 HydrophobicContact CD1-CB 4.17Å; Y704-K734 HydrophobicContact CE1-CB 3.6Å; Y704-K734 HydrophobicContact CE1-CG 3.86Å; Y704-K734 HydrophobicContact CE2-CB 4.26Å; Y704-K734 WeakPolarHBondContact OH-CD 3.37Å; Y704-L735 HydrophobicContact CD2-CD2 4.36Å; Y704-L735 HydrophobicContact CG-CD2 4.35Å
705	K	93.4	Very high	92	Very high	182 Å²	182	48.8 Å²	48.8	79%	0.791	25%	0.246	S	C	*	.	H	α-helix	trans	-64	-41.9	179	-66.4	-179.5	-179.3	176.4	0	112.3	K703 Q709	K703-K705 VanDerWaalsContact C-N 3.32Å; K703-K705 PolarHBondContact O-N 3.37Å; K703-K705 VanDerWaalsContact O-N 3.16Å; K705-Q709 PolarHBondContact O-N 3.34Å
706	A	93.2	Very high	91.9	Very high	43 Å²	43	55.7 Å²	55.7	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-70.7	-38.8	175.8	0	0	0	0	0	111.1	L698 K703 L708 Q709 E710	L698-A706 HydrophobicContact CD1-CB 4.14Å; K703-A706 PolarHBondContact O-N 2.94Å; A706-L708 VanDerWaalsContact C-N 3.34Å; A706-L708 PolarHBondContact O-N 3.2Å; A706-Q709 PolarHBondContact O-N 3.38Å; A706-E710 WeakPolarHBondContact O-CG 3.48Å; A706-E710 PolarHBondContact O-N 2.97Å
707	A	93.7	Very high	91.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-42.1	174.4	0	0	0	0	0	112.3	L698 F699 K703 Y704 E710 L711 V731	L698-A707 HydrophobicContact CB-CB 4.01Å; F699-A707 HydrophobicContact CB-CB 4.41Å; K703-A707 PolarHBondContact O-N 3.47Å; Y704-A707 PolarHBondContact O-N 2.91Å; A707-E710 PolarHBondContact O-N 3.28Å; A707-L711 WeakPolarHBondContact O-CB 3.37Å; A707-L711 VanDerWaalsContact O-CD1 3.31Å; A707-L711 WeakPolarHBondContact O-CD1 3.36Å; A707-L711 WeakPolarHBondContact O-CG 3.2Å; A707-L711 PolarHBondContact O-N 3.05Å; A707-V731 HydrophobicContact CB-CG2 4.29Å
708	L	93.4	Very high	91.5	Very high	34 Å²	34	59 Å²	59	18%	0.178	30%	0.295	C	S	.	.	H	α-helix	trans	-62.2	-42.7	174.4	-75.8	-175.7	0	0	0	113	Y704 A706 L711 E712 I728 V731 Y732 L735	Y704-L708 PolarHBondContact O-N 3.43Å; A706-L708 VanDerWaalsContact C-N 3.34Å; A706-L708 PolarHBondContact O-N 3.2Å; L708-L711 PolarHBondContact O-N 3.41Å; L708-E712 WeakPolarHBondContact O-CB 3.39Å; L708-E712 PolarHBondContact O-N 2.78Å; L708-I728 HydrophobicContact CD2-CG2 4.46Å; L708-V731 HydrophobicContact CD1-CG1 4.37Å; L708-V731 HydrophobicContact CD2-CB 3.87Å; L708-V731 HydrophobicContact CD2-CG1 3.6Å; L708-V731 HydrophobicContact CG-CB 4.43Å; L708-V731 HydrophobicContact CG-CG1 3.6Å; L708-Y732 HydrophobicContact CD1-CD1 4.19Å; L708-Y732 HydrophobicContact CD1-CE1 3.55Å; L708-Y732 HydrophobicContact CD2-CD1 4.44Å; L708-Y732 HydrophobicContact CD2-CD2 4.45Å; L708-Y732 HydrophobicContact CD2-CE1 4.05Å; L708-Y732 HydrophobicContact CD2-CE2 4.07Å; L708-Y732 HydrophobicContact CG-CE1 4.48Å; L708-L735 HydrophobicContact CD1-CD1 3.6Å; L708-L735 HydrophobicContact CG-CD1 4.32Å
709	Q	92.7	Very high	91.2	Very high	127 Å²	127	61.6 Å²	61.6	59%	0.593	31%	0.312	S	S	*	.	H	α-helix	trans	-60.7	-48	178.3	-178.6	179.8	-18.6	0	0	111.3	K705 A706 L711 E712 E713	K705-Q709 PolarHBondContact O-N 3.34Å; A706-Q709 PolarHBondContact O-N 3.38Å; Q709-L711 VanDerWaalsContact C-N 3.3Å; Q709-L711 PolarHBondContact O-N 2.84Å; Q709-E712 PolarHBondContact O-N 3.38Å; Q709-E713 PolarHBondContact O-N 2.78Å
710	E	90.8	Very high	90.9	Very high	22 Å²	22	67.6 Å²	67.6	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-59.4	-39.4	176.4	-68.9	-71.3	143.1	0	0	112.7	R694 A695 L698 A706 A707 L714	R694-E710 VanDerWaalsContact CZ-CD 3.5Å; R694-E710 IonicContact CZ-OE1 3.55Å; R694-E710 IonicContact CZ-OE2 2.95Å; R694-E710 IonicContact NE-OE1 3.19Å; R694-E710 PolarHBondContact NE-OE1 2.96Å; R694-E710 IonicContact NE-OE2 3.43Å; R694-E710 PolarHBondContact NE-OE2 3.21Å; R694-E710 IonicContact NH2-OE1 2.71Å; R694-E710 PolarHBondContact NH2-OE1 3.49Å; R694-E710 IonicContact NH2-OE2 3.58Å; R694-E710 PolarHBondContact NH2-OE2 2.96Å; A695-E710 HydrophobicContact CB-CB 3.95Å; L698-E710 HydrophobicContact CD1-CG 3.93Å; A706-E710 WeakPolarHBondContact O-CG 3.48Å; A706-E710 PolarHBondContact O-N 2.97Å; A707-E710 PolarHBondContact O-N 3.28Å; E710-L714 VanDerWaalsContact O-CB 3.28Å; E710-L714 WeakPolarHBondContact O-CB 3.28Å; E710-L714 PolarHBondContact O-N 2.89Å
711	L	91.4	Very high	90.6	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-74.5	-32.5	179.5	-69.2	163.9	0	0	0	112.7	A695 A707 L708 Q709 L714 K715 V724 L727 I728 V731	A695-L711 HydrophobicContact CB-CD1 4.32Å; A695-L711 HydrophobicContact CB-CD2 3.77Å; A695-L711 HydrophobicContact CB-CG 3.73Å; A707-L711 WeakPolarHBondContact O-CB 3.37Å; A707-L711 VanDerWaalsContact O-CD1 3.31Å; A707-L711 WeakPolarHBondContact O-CD1 3.36Å; A707-L711 WeakPolarHBondContact O-CG 3.2Å; A707-L711 PolarHBondContact O-N 3.05Å; L708-L711 PolarHBondContact O-N 3.41Å; Q709-L711 VanDerWaalsContact C-N 3.3Å; Q709-L711 PolarHBondContact O-N 2.84Å; L711-L714 HydrophobicContact CD2-CD2 4.31Å; L711-L714 PolarHBondContact O-N 3.05Å; L711-K715 WeakPolarHBondContact O-CB 3.41Å; L711-K715 PolarHBondContact O-N 3.28Å; L711-V724 HydrophobicContact CD2-CG1 4.21Å; L711-L727 HydrophobicContact CD1-CB 4.48Å; L711-L727 HydrophobicContact CD1-CD2 4.44Å; L711-L727 HydrophobicContact CD1-CG 3.98Å; L711-L727 HydrophobicContact CD2-CB 4.33Å; L711-L727 HydrophobicContact CD2-CD2 3.97Å; L711-L727 HydrophobicContact CD2-CG 4.19Å; L711-I728 HydrophobicContact CB-CD1 4Å; L711-I728 HydrophobicContact CB-CG1 3.54Å; L711-I728 HydrophobicContact CD1-CG1 3.85Å; L711-I728 HydrophobicContact CD2-CG1 4.42Å; L711-I728 HydrophobicContact CG-CG1 4.12Å; L711-V731 HydrophobicContact CD1-CG2 3.98Å
712	E	91.6	Very high	90.4	Very high	79 Å²	79	66.1 Å²	66.1	37%	0.369	32%	0.322	S	S	.	.	H	α-helix	trans	-68.9	-41.4	174.4	-172	60.7	-155.2	0	0	111.1	L708 Q709 K715 Q716	L708-E712 WeakPolarHBondContact O-CB 3.39Å; L708-E712 PolarHBondContact O-N 2.78Å; Q709-E712 PolarHBondContact O-N 3.38Å; E712-K715 PolarHBondContact O-N 3.33Å; E712-K715 VanDerWaalsContact OE1-CE 3.24Å; E712-K715 WeakPolarHBondContact OE1-CE 3.35Å; E712-K715 IonicContact OE1-NZ 2.64Å; E712-K715 PolarHBondContact OE1-NZ 3.3Å; E712-K715 WeakPolarHBondContact OE2-CE 3.41Å; E712-K715 IonicContact OE2-NZ 3.6Å; E712-K715 PolarHBondContact OE2-NZ 2.99Å; E712-Q716 WeakPolarHBondContact O-CG 3.48Å; E712-Q716 PolarHBondContact O-N 2.96Å
713	E	90	Very high	90.1	Very high	64 Å²	64	62.9 Å²	62.9	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-43.9	168.6	-71.9	-177.5	-153.9	0	0	111.7	K691 Q709 K715 Q716 I717	K691-E713 IonicContact NZ-OE2 3.18Å; K691-E713 PolarHBondContact NZ-OE2 3.2Å; Q709-E713 PolarHBondContact O-N 2.78Å; E713-K715 VanDerWaalsContact C-N 3.34Å; E713-K715 PolarHBondContact O-N 2.91Å; E713-Q716 WeakPolarHBondContact O-CB 3.28Å; E713-Q716 PolarHBondContact O-N 3Å; E713-I717 WeakPolarHBondContact O-CG1 3.14Å; E713-I717 PolarHBondContact O-N 3.05Å
714	L	90.1	Very high	89.9	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65	-37.3	179.4	-179	59.3	0	0	0	112.3	P688 K691 F692 E710 L711 Q716 I717 V718 V724	P688-L714 HydrophobicContact CB-CD1 3.71Å; P688-L714 WeakPolarHBondContact O-CD1 3.33Å; K691-L714 HydrophobicContact CB-CD1 4.34Å; F692-L714 HydrophobicContact CB-CD2 3.68Å; F692-L714 HydrophobicContact CD2-CD2 3.96Å; F692-L714 HydrophobicContact CG-CD2 4.34Å; E710-L714 VanDerWaalsContact O-CB 3.28Å; E710-L714 WeakPolarHBondContact O-CB 3.28Å; E710-L714 PolarHBondContact O-N 2.89Å; L711-L714 HydrophobicContact CD2-CD2 4.31Å; L711-L714 PolarHBondContact O-N 3.05Å; L714-Q716 VanDerWaalsContact C-N 3.26Å; L714-Q716 PolarHBondContact O-N 2.96Å; L714-I717 PolarHBondContact O-N 3.04Å; L714-I717 VanDerWaalsContact O-N 3.08Å; L714-V718 PolarHBondContact O-N 3.09Å; L714-V724 HydrophobicContact CB-CG1 4.48Å; L714-V724 HydrophobicContact CD2-CG1 4.11Å; L714-V724 HydrophobicContact CD2-CG2 3.62Å; L714-V724 HydrophobicContact CG-CG1 4.14Å; L714-V724 HydrophobicContact CG-CG2 3.88Å
715	K	90.1	Very high	89.7	Confident	49 Å²	49	57.7 Å²	57.7	21%	0.213	28%	0.282	C	S	.	.	H	α-helix	trans	-62.3	-32.3	174.6	-169.6	-172.1	74.2	-166.2	0	112.1	L711 E712 E713 P719 Y725	L711-K715 WeakPolarHBondContact O-CB 3.41Å; L711-K715 PolarHBondContact O-N 3.28Å; E712-K715 PolarHBondContact O-N 3.33Å; E712-K715 VanDerWaalsContact OE1-CE 3.24Å; E712-K715 WeakPolarHBondContact OE1-CE 3.35Å; E712-K715 IonicContact OE1-NZ 2.64Å; E712-K715 PolarHBondContact OE1-NZ 3.3Å; E712-K715 WeakPolarHBondContact OE2-CE 3.41Å; E712-K715 IonicContact OE2-NZ 3.6Å; E712-K715 PolarHBondContact OE2-NZ 2.99Å; E713-K715 VanDerWaalsContact C-N 3.34Å; E713-K715 PolarHBondContact O-N 2.91Å; K715-P719 VanDerWaalsContact O-CA 3.32Å; K715-P719 WeakPolarHBondContact O-CA 3.38Å; K715-P719 WeakPolarHBondContact O-CB 3.39Å; K715-P719 WeakPolarHBondContact O-CD 3.4Å; K715-Y725 HydrophobicContact CD-CE1 3.81Å; K715-Y725 HydrophobicContact CG-CE1 4.12Å
716	Q	89.7	Confident	89.5	Confident	145 Å²	145	49.6 Å²	49.6	68%	0.678	25%	0.247	S	C	*	.	H	α-helix	trans	-71	-31.7	173.2	-64.9	170.4	27.3	0	0	112.3	E712 E713 L714	E712-Q716 WeakPolarHBondContact O-CG 3.48Å; E712-Q716 PolarHBondContact O-N 2.96Å; E713-Q716 WeakPolarHBondContact O-CB 3.28Å; E713-Q716 PolarHBondContact O-N 3Å; L714-Q716 VanDerWaalsContact C-N 3.26Å; L714-Q716 PolarHBondContact O-N 2.96Å
717	I	87.3	Confident	89.4	Confident	71 Å²	71	48 Å²	48	36%	0.364	23%	0.233	S	C	.	.	H	α-helix	trans	-80.7	-42.9	178.8	-58.5	166.6	0	0	0	111.3	P688 K691 E713 L714	P688-I717 HydrophobicContact CG-CG2 4.16Å; K691-I717 HydrophobicContact CD-CD1 4.09Å; E713-I717 WeakPolarHBondContact O-CG1 3.14Å; E713-I717 PolarHBondContact O-N 3.05Å; L714-I717 PolarHBondContact O-N 3.04Å; L714-I717 VanDerWaalsContact O-N 3.08Å
718	V	86.2	Confident	89.3	Confident	33 Å²	33	48.2 Å²	48.2	20%	0.2	23%	0.234	C	C	.	.			trans	-133.4	74.9	-177.6	-163.4	0	0	0	0	111.6	P688 L714 K720 E721	P688-V718 HydrophobicContact CB-CG2 3.6Å; P688-V718 HydrophobicContact CG-CG2 3.48Å; P688-V718 VanDerWaalsContact CG-CG2 3.48Å; L714-V718 PolarHBondContact O-N 3.09Å; V718-K720 PolarHBondContact O-N 3.39Å; V718-E721 HydrophobicContact CB-CB 4.45Å; V718-E721 HydrophobicContact CG1-CB 3.82Å; V718-E721 PolarHBondContact O-N 3.46Å
719	P	87.9	Confident	89.2	Confident	72 Å²	72	46.6 Å²	46.6	47%	0.468	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	10.8	-178	29.8	-37.1	0	0	0	114.9	K715 Y725	K715-P719 VanDerWaalsContact O-CA 3.32Å; K715-P719 WeakPolarHBondContact O-CA 3.38Å; K715-P719 WeakPolarHBondContact O-CB 3.39Å; K715-P719 WeakPolarHBondContact O-CD 3.4Å; P719-Y725 PolarHBondContact O-OH 2.89Å
720	K	85.4	Confident	89.1	Confident	170 Å²	170	44.1 Å²	44.1	74%	0.739	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-1.9	-177.7	-64.7	-172.9	178.2	-177.2	0	113.9	V718 S722	V718-K720 PolarHBondContact O-N 3.39Å; K720-S722 PolarHBondContact O-N 3.18Å
721	E	84.6	Confident	89.3	Confident	51 Å²	51	43 Å²	43	24%	0.238	21%	0.207	C	C	.	.			trans	-88.8	107.9	-174.4	-173.4	65	-140.7	0	0	111.1	F282 V718 L723 V724 Y725	F282-E721 HydrophobicContact CD2-CG 3.66Å; F282-E721 WeakPolarHBondContact CD2-OE1 3.31Å; F282-E721 HydrophobicContact CE2-CB 4.43Å; F282-E721 HydrophobicContact CE2-CG 3.46Å; F282-E721 VanDerWaalsContact CE2-CG 3.46Å; F282-E721 WeakPolarHBondContact CE2-OE2 3.34Å; F282-E721 HydrophobicContact CZ-CG 4.2Å; V718-E721 HydrophobicContact CB-CB 4.45Å; V718-E721 HydrophobicContact CG1-CB 3.82Å; V718-E721 PolarHBondContact O-N 3.46Å; E721-L723 HydrophobicContact CG-CB 4.37Å; E721-L723 PolarHBondContact O-N 3.14Å; E721-V724 HydrophobicContact CB-CB 4.46Å; E721-V724 HydrophobicContact CB-CG2 3.79Å; E721-V724 HydrophobicContact CG-CG2 3.83Å; E721-V724 PolarHBondContact O-N 2.77Å; E721-V724 VanDerWaalsContact O-N 3.12Å; E721-Y725 WeakPolarHBondContact O-CD2 3.21Å
722	S	87.1	Confident	89.4	Confident	6 Å²	6	45 Å²	45	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-50.5	-41.4	179.1	172.5	0	0	0	0	112.8	K720 V724 Y725 F726 A748	K720-S722 PolarHBondContact O-N 3.18Å; S722-V724 VanDerWaalsContact C-N 3.28Å; S722-V724 PolarHBondContact O-N 3.14Å; S722-Y725 PolarHBondContact O-N 2.73Å; S722-Y725 VanDerWaalsContact O-N 3.15Å; S722-F726 PolarHBondContact O-N 2.98Å; S722-A748 WeakPolarHBondContact CB-O 3.39Å; S722-A748 WeakPolarHBondContact OG-CA 3.5Å; S722-A748 PolarHBondContact OG-O 3.17Å
723	L	84.9	Confident	89.4	Confident	37 Å²	37	45.3 Å²	45.3	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-27	-175.4	-68.3	166.7	0	0	0	113.5	F282 F692 E721 F726 L727	F282-L723 HydrophobicContact CB-CB 4.44Å; F282-L723 HydrophobicContact CB-CD1 3.8Å; F692-L723 HydrophobicContact CE2-CB 4.31Å; F692-L723 WeakPolarHBondContact CE2-O 3.35Å; F692-L723 HydrophobicContact CZ-CB 4.27Å; E721-L723 HydrophobicContact CG-CB 4.37Å; E721-L723 PolarHBondContact O-N 3.14Å; L723-F726 HydrophobicContact CD2-CD1 4.25Å; L723-L727 WeakPolarHBondContact O-CB 3.41Å; L723-L727 PolarHBondContact O-N 3.21Å
724	V	89.4	Confident	89.5	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-48.8	173.5	179.8	0	0	0	0	110	F692 L711 L714 E721 S722 F726 L727 I728	F692-V724 HydrophobicContact CD2-CG2 4.26Å; L711-V724 HydrophobicContact CD2-CG1 4.21Å; L714-V724 HydrophobicContact CB-CG1 4.48Å; L714-V724 HydrophobicContact CD2-CG1 4.11Å; L714-V724 HydrophobicContact CD2-CG2 3.62Å; L714-V724 HydrophobicContact CG-CG1 4.14Å; L714-V724 HydrophobicContact CG-CG2 3.88Å; E721-V724 HydrophobicContact CB-CB 4.46Å; E721-V724 HydrophobicContact CB-CG2 3.79Å; E721-V724 HydrophobicContact CG-CG2 3.83Å; E721-V724 PolarHBondContact O-N 2.77Å; E721-V724 VanDerWaalsContact O-N 3.12Å; S722-V724 VanDerWaalsContact C-N 3.28Å; S722-V724 PolarHBondContact O-N 3.14Å; V724-F726 PolarHBondContact O-N 2.95Å; V724-L727 PolarHBondContact O-N 3.33Å; V724-I728 HydrophobicContact CG1-CD1 4.01Å; V724-I728 VanDerWaalsContact O-CG1 3.28Å; V724-I728 WeakPolarHBondContact O-CG1 3.49Å; V724-I728 PolarHBondContact O-N 2.97Å
725	Y	90.7	Very high	89.6	Confident	27 Å²	27	51.7 Å²	51.7	11%	0.106	25%	0.245	C	C	.	.	H	α-helix	trans	-65	-37.5	176.6	-67.3	-83.5	0	0	0	112.4	K715 P719 E721 S722 L727 I728 G729 W747 L751	K715-Y725 HydrophobicContact CD-CE1 3.81Å; K715-Y725 HydrophobicContact CG-CE1 4.12Å; P719-Y725 PolarHBondContact O-OH 2.89Å; E721-Y725 WeakPolarHBondContact O-CD2 3.21Å; S722-Y725 PolarHBondContact O-N 2.73Å; S722-Y725 VanDerWaalsContact O-N 3.15Å; Y725-L727 PolarHBondContact O-N 3.25Å; Y725-I728 PolarHBondContact O-N 3.12Å; Y725-G729 PolarHBondContact O-N 3.38Å; Y725-W747 HydrophobicContact CD1-CB 4.15Å; Y725-W747 AromaticContact CD1-CE3 3.75Å; Y725-W747 HydrophobicContact CD1-CE3 3.75Å; Y725-W747 AromaticContact CE1-CE3 3.72Å; Y725-W747 HydrophobicContact CE1-CE3 3.72Å; Y725-W747 HydrophobicContact CE1-CZ3 4.32Å; Y725-W747 HydrophobicContact CG-CB 4.35Å; Y725-L751 HydrophobicContact CD2-CD1 3.38Å; Y725-L751 HydrophobicContact CE2-CD1 3.41Å; Y725-L751 VanDerWaalsContact CE2-CD1 3.41Å; Y725-L751 HydrophobicContact CG-CD1 4.34Å
726	F	89.4	Confident	89.6	Confident	11 Å²	11	52 Å²	52	5%	0.048	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-42.7	173.3	-179.9	-128.8	0	0	0	112.4	S722 L723 V724 G729 K730 F745 A748 Q759 I760 A763	S722-F726 PolarHBondContact O-N 2.98Å; L723-F726 HydrophobicContact CD2-CD1 4.25Å; V724-F726 PolarHBondContact O-N 2.95Å; F726-G729 PolarHBondContact O-N 3.12Å; F726-K730 HydrophobicContact CE1-CD 4.45Å; F726-K730 VanDerWaalsContact CE1-NZ 3.33Å; F726-K730 HydrophobicContact CZ-CD 4.44Å; F726-K730 PolarHBondContact O-N 3.37Å; F726-F745 AromaticContact CD2-CD1 3.83Å; F726-F745 HydrophobicContact CD2-CD1 3.83Å; F726-F745 AromaticContact CD2-CE1 3.64Å; F726-F745 HydrophobicContact CD2-CE1 3.64Å; F726-F745 HydrophobicContact CE2-CD1 4.42Å; F726-F745 HydrophobicContact CE2-CE1 4.03Å; F726-F745 WeakPolarHBondContact O-CE1 3.32Å; F726-A748 HydrophobicContact CB-CB 4.14Å; F726-Q759 HydrophobicContact CZ-CB 4.15Å; F726-I760 HydrophobicContact CD2-CG1 3.78Å; F726-I760 HydrophobicContact CE2-CB 4.36Å; F726-I760 HydrophobicContact CE2-CG1 3.91Å; F726-I760 HydrophobicContact CG-CG1 4.36Å; F726-A763 HydrophobicContact CE2-CB 3.99Å
727	L	90.3	Very high	89.8	Confident	10 Å²	10	49 Å²	49	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-70.8	-39.1	177.2	-173.5	53.3	0	0	0	111.8	F692 A695 F699 L711 L723 V724 Y725 G729 K730 V731	F692-L727 HydrophobicContact CD2-CD2 4.1Å; F692-L727 HydrophobicContact CE2-CB 4.06Å; F692-L727 HydrophobicContact CE2-CD2 3.65Å; F692-L727 HydrophobicContact CZ-CD2 3.95Å; A695-L727 HydrophobicContact CB-CD2 4.46Å; F699-L727 HydrophobicContact CB-CD1 4.43Å; F699-L727 HydrophobicContact CD1-CD1 4.19Å; F699-L727 HydrophobicContact CG-CD1 4.21Å; L711-L727 HydrophobicContact CD1-CB 4.48Å; L711-L727 HydrophobicContact CD1-CD2 4.44Å; L711-L727 HydrophobicContact CD1-CG 3.98Å; L711-L727 HydrophobicContact CD2-CB 4.33Å; L711-L727 HydrophobicContact CD2-CD2 3.97Å; L711-L727 HydrophobicContact CD2-CG 4.19Å; L723-L727 WeakPolarHBondContact O-CB 3.41Å; L723-L727 PolarHBondContact O-N 3.21Å; V724-L727 PolarHBondContact O-N 3.33Å; Y725-L727 PolarHBondContact O-N 3.25Å; L727-G729 VanDerWaalsContact C-N 3.32Å; L727-G729 PolarHBondContact O-N 3Å; L727-K730 PolarHBondContact O-N 3.11Å; L727-V731 VanDerWaalsContact O-CG2 3.27Å; L727-V731 WeakPolarHBondContact O-CG2 3.02Å; L727-V731 PolarHBondContact O-N 3.25Å
728	I	92.1	Very high	90	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	25%	0.25	C	C	.	.	H	α-helix	trans	-57.1	-45.7	170.1	-69	167.6	0	0	0	110.7	L708 L711 V724 Y725 K730 V731 Y732 N744	L708-I728 HydrophobicContact CD2-CG2 4.46Å; L711-I728 HydrophobicContact CB-CD1 4Å; L711-I728 HydrophobicContact CB-CG1 3.54Å; L711-I728 HydrophobicContact CD1-CG1 3.85Å; L711-I728 HydrophobicContact CD2-CG1 4.42Å; L711-I728 HydrophobicContact CG-CG1 4.12Å; V724-I728 HydrophobicContact CG1-CD1 4.01Å; V724-I728 VanDerWaalsContact O-CG1 3.28Å; V724-I728 WeakPolarHBondContact O-CG1 3.49Å; V724-I728 PolarHBondContact O-N 2.97Å; Y725-I728 PolarHBondContact O-N 3.12Å; I728-K730 PolarHBondContact O-N 2.88Å; I728-V731 PolarHBondContact O-N 2.71Å; I728-Y732 HydrophobicContact CG2-CD2 3.51Å; I728-Y732 HydrophobicContact CG2-CE2 3.3Å; I728-Y732 WeakPolarHBondContact O-CD2 3.41Å; I728-Y732 PolarHBondContact O-N 2.85Å; I728-N744 HydrophobicContact CG2-CB 4.16Å; I728-N744 WeakPolarHBondContact CG2-OD1 3.27Å
729	G	91.6	Very high	90.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.7	-42.1	176.2	0	0	0	0	0	113	Y725 F726 L727 Y732 K733 A741	Y725-G729 PolarHBondContact O-N 3.38Å; F726-G729 PolarHBondContact O-N 3.12Å; L727-G729 VanDerWaalsContact C-N 3.32Å; L727-G729 PolarHBondContact O-N 3Å; G729-Y732 PolarHBondContact O-N 3.32Å; G729-K733 WeakPolarHBondContact O-CB 3.5Å; G729-K733 PolarHBondContact O-N 2.91Å; G729-A741 WeakPolarHBondContact O-CB 3.42Å
730	K	90.9	Very high	90.5	Very high	74 Å²	74	52.2 Å²	52.2	32%	0.322	26%	0.258	S	S	.	.	H	α-helix	trans	-61.9	-42.4	173.2	-77.4	179.8	173.4	176.4	0	112.5	F699 F726 L727 I728 K733 K734 F745	F699-K730 HydrophobicContact CE2-CB 4.1Å; F699-K730 HydrophobicContact CZ-CB 3.93Å; F726-K730 HydrophobicContact CE1-CD 4.45Å; F726-K730 VanDerWaalsContact CE1-NZ 3.33Å; F726-K730 HydrophobicContact CZ-CD 4.44Å; F726-K730 PolarHBondContact O-N 3.37Å; L727-K730 PolarHBondContact O-N 3.11Å; I728-K730 PolarHBondContact O-N 2.88Å; K730-K733 PolarHBondContact O-N 3.42Å; K730-K734 PolarHBondContact O-N 2.95Å; K730-K734 VanDerWaalsContact O-N 3.11Å; K730-F745 HydrophobicContact CG-CE1 4.3Å; K730-F745 HydrophobicContact CG-CZ 4.27Å
731	V	93.7	Very high	90.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-45	177.3	-177.6	0	0	0	0	110.7	F699 Y704 A707 L708 L711 L727 I728 K733 K734 L735	F699-V731 HydrophobicContact CB-CG2 4.39Å; F699-V731 HydrophobicContact CD2-CB 4.32Å; F699-V731 HydrophobicContact CD2-CG2 3.55Å; F699-V731 HydrophobicContact CE2-CG2 4.22Å; F699-V731 HydrophobicContact CG-CG2 4.27Å; Y704-V731 HydrophobicContact CD1-CG1 4.16Å; A707-V731 HydrophobicContact CB-CG2 4.29Å; L708-V731 HydrophobicContact CD1-CG1 4.37Å; L708-V731 HydrophobicContact CD2-CB 3.87Å; L708-V731 HydrophobicContact CD2-CG1 3.6Å; L708-V731 HydrophobicContact CG-CB 4.43Å; L708-V731 HydrophobicContact CG-CG1 3.6Å; L711-V731 HydrophobicContact CD1-CG2 3.98Å; L727-V731 VanDerWaalsContact O-CG2 3.27Å; L727-V731 WeakPolarHBondContact O-CG2 3.02Å; L727-V731 PolarHBondContact O-N 3.25Å; I728-V731 PolarHBondContact O-N 2.71Å; V731-K733 VanDerWaalsContact C-N 3.35Å; V731-K733 PolarHBondContact O-N 3.29Å; V731-K734 PolarHBondContact O-N 2.9Å; V731-L735 HydrophobicContact CG1-CD1 3.97Å; V731-L735 WeakPolarHBondContact O-CG 3.38Å; V731-L735 PolarHBondContact O-N 2.86Å
732	Y	94.4	Very high	91	Very high	40 Å²	40	45.1 Å²	45.1	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-32.5	175.6	-74.4	-54.4	0	0	0	113.4	L708 I728 G729 L735 G736 Q737 L740	L708-Y732 HydrophobicContact CD1-CD1 4.19Å; L708-Y732 HydrophobicContact CD1-CE1 3.55Å; L708-Y732 HydrophobicContact CD2-CD1 4.44Å; L708-Y732 HydrophobicContact CD2-CD2 4.45Å; L708-Y732 HydrophobicContact CD2-CE1 4.05Å; L708-Y732 HydrophobicContact CD2-CE2 4.07Å; L708-Y732 HydrophobicContact CG-CE1 4.48Å; I728-Y732 HydrophobicContact CG2-CD2 3.51Å; I728-Y732 HydrophobicContact CG2-CE2 3.3Å; I728-Y732 WeakPolarHBondContact O-CD2 3.41Å; I728-Y732 PolarHBondContact O-N 2.85Å; G729-Y732 PolarHBondContact O-N 3.32Å; Y732-L735 CarbonylContact O-C 3.53Å; Y732-L735 PolarHBondContact O-N 2.94Å; Y732-G736 PolarHBondContact O-N 3.47Å; Y732-Q737 HydrophobicContact CD1-CB 4.03Å; Y732-Q737 VanDerWaalsContact CD1-OE1 3.25Å; Y732-Q737 VanDerWaalsContact CE1-OE1 3.26Å; Y732-Q737 PolarHBondContact O-N 3.25Å; Y732-L740 HydrophobicContact CD1-CB 4.16Å; Y732-L740 HydrophobicContact CD1-CD2 4.16Å; Y732-L740 HydrophobicContact CD2-CB 3.88Å; Y732-L740 HydrophobicContact CD2-CD2 4.46Å; Y732-L740 HydrophobicContact CE1-CB 4.46Å; Y732-L740 HydrophobicContact CE1-CD2 3.66Å; Y732-L740 HydrophobicContact CE2-CB 4.19Å; Y732-L740 HydrophobicContact CE2-CD2 3.99Å; Y732-L740 HydrophobicContact CG-CB 3.88Å
733	K	91.6	Very high	91.2	Very high	87 Å²	87	48.4 Å²	48.4	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-60.8	-46.3	171.6	-170.6	175.4	-174.8	175.8	0	110.5	G729 K730 V731 L735 G736 A741 A763 K766	G729-K733 WeakPolarHBondContact O-CB 3.5Å; G729-K733 PolarHBondContact O-N 2.91Å; K730-K733 PolarHBondContact O-N 3.42Å; V731-K733 VanDerWaalsContact C-N 3.35Å; V731-K733 PolarHBondContact O-N 3.29Å; K733-L735 VanDerWaalsContact C-N 3.33Å; K733-L735 PolarHBondContact O-N 3.33Å; K733-G736 PolarHBondContact O-N 3.12Å; K733-A741 HydrophobicContact CB-CB 4.26Å; K733-A763 PolarHBondContact NZ-O 3.35Å; K733-K766 PolarHBondContact NZ-O 3.37Å
734	K	92.4	Very high	91.5	Very high	134 Å²	134	47 Å²	47	58%	0.583	24%	0.239	S	C	*	.	H	α-helix	trans	-67.8	-26.4	176.2	-78.2	-68.8	-165.4	167.1	0	114.3	F699 Y704 K730 V731 G736	F699-K734 HydrophobicContact CE2-CB 4.37Å; F699-K734 HydrophobicContact CE2-CG 3.85Å; F699-K734 HydrophobicContact CZ-CG 4.18Å; Y704-K734 HydrophobicContact CD1-CB 4.17Å; Y704-K734 HydrophobicContact CE1-CB 3.6Å; Y704-K734 HydrophobicContact CE1-CG 3.86Å; Y704-K734 HydrophobicContact CE2-CB 4.26Å; Y704-K734 WeakPolarHBondContact OH-CD 3.37Å; K730-K734 PolarHBondContact O-N 2.95Å; K730-K734 VanDerWaalsContact O-N 3.11Å; V731-K734 PolarHBondContact O-N 2.9Å; K734-G736 VanDerWaalsContact C-N 3.31Å
735	L	92.6	Very high	91.5	Very high	63 Å²	63	47.4 Å²	47.4	33%	0.33	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	6.7	173.3	-68.9	171.2	0	0	0	114	Y704 L708 V731 Y732 K733 Q737	Y704-L735 HydrophobicContact CD2-CD2 4.36Å; Y704-L735 HydrophobicContact CG-CD2 4.35Å; L708-L735 HydrophobicContact CD1-CD1 3.6Å; L708-L735 HydrophobicContact CG-CD1 4.32Å; V731-L735 HydrophobicContact CG1-CD1 3.97Å; V731-L735 WeakPolarHBondContact O-CG 3.38Å; V731-L735 PolarHBondContact O-N 2.86Å; Y732-L735 CarbonylContact O-C 3.53Å; Y732-L735 PolarHBondContact O-N 2.94Å; K733-L735 VanDerWaalsContact C-N 3.33Å; K733-L735 PolarHBondContact O-N 3.33Å; L735-Q737 PolarHBondContact O-N 3.33Å; L735-Q737 VanDerWaalsContact O-N 3.14Å
736	G	89.6	Confident	91.4	Very high	55 Å²	55	48.3 Å²	48.3	57%	0.567	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	0.9	-178.6	0	0	0	0	0	115.2	Y732 K733 K734 T738	Y732-G736 PolarHBondContact O-N 3.47Å; K733-G736 PolarHBondContact O-N 3.12Å; K734-G736 VanDerWaalsContact C-N 3.31Å; G736-T738 PolarHBondContact O-N 3.41Å
737	Q	93.9	Very high	91.4	Very high	82 Å²	82	52.7 Å²	52.7	38%	0.383	27%	0.267	S	S	.	.			trans	-82.9	61.7	-177.6	-64.4	-173.3	-2.6	0	0	111.1	Y732 L735 H739 L740 A741	Y732-Q737 HydrophobicContact CD1-CB 4.03Å; Y732-Q737 VanDerWaalsContact CD1-OE1 3.25Å; Y732-Q737 VanDerWaalsContact CE1-OE1 3.26Å; Y732-Q737 PolarHBondContact O-N 3.25Å; L735-Q737 PolarHBondContact O-N 3.33Å; L735-Q737 VanDerWaalsContact O-N 3.14Å; Q737-H739 VanDerWaalsContact C-N 3.26Å; Q737-H739 PolarHBondContact O-N 3.34Å; Q737-H739 VanDerWaalsContact O-N 3.13Å; Q737-L740 HydrophobicContact CB-CB 4.45Å; Q737-L740 PolarHBondContact O-N 2.96Å; Q737-L740 VanDerWaalsContact O-N 3.09Å; Q737-A741 PolarHBondContact O-N 2.84Å
738	T	91.1	Very high	91.3	Very high	67 Å²	67	52.2 Å²	52.2	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-54.5	-35.2	-170.4	55.7	0	0	0	0	114.3	G736 A741 L742	G736-T738 PolarHBondContact O-N 3.41Å; T738-A741 PolarHBondContact O-N 3.49Å; T738-L742 WeakPolarHBondContact O-CG 3.09Å; T738-L742 PolarHBondContact O-N 3.34Å
739	H	91	Very high	90.9	Very high	134 Å²	134	55.2 Å²	55.2	62%	0.62	28%	0.279	S	S	*	.	H	α-helix	trans	-69	-42.5	177.8	66.6	-71.5	0	0	0	113.1	Q737 A741 M743	Q737-H739 VanDerWaalsContact C-N 3.26Å; Q737-H739 PolarHBondContact O-N 3.34Å; Q737-H739 VanDerWaalsContact O-N 3.13Å; H739-A741 VanDerWaalsContact C-N 3.35Å; H739-M743 PolarHBondContact O-N 3.26Å
740	L	92.9	Very high	90.7	Very high	43 Å²	43	60.9 Å²	60.9	23%	0.225	31%	0.309	C	S	.	.	H	α-helix	trans	-67.7	-35.9	171.5	-92.6	67.9	0	0	0	111.5	Y732 Q737 M743 N744	Y732-L740 HydrophobicContact CD1-CB 4.16Å; Y732-L740 HydrophobicContact CD1-CD2 4.16Å; Y732-L740 HydrophobicContact CD2-CB 3.88Å; Y732-L740 HydrophobicContact CD2-CD2 4.46Å; Y732-L740 HydrophobicContact CE1-CB 4.46Å; Y732-L740 HydrophobicContact CE1-CD2 3.66Å; Y732-L740 HydrophobicContact CE2-CB 4.19Å; Y732-L740 HydrophobicContact CE2-CD2 3.99Å; Y732-L740 HydrophobicContact CG-CB 3.88Å; Q737-L740 HydrophobicContact CB-CB 4.45Å; Q737-L740 PolarHBondContact O-N 2.96Å; Q737-L740 VanDerWaalsContact O-N 3.09Å; L740-M743 HydrophobicContact CG-CE 4.28Å; L740-M743 PolarHBondContact O-N 3.31Å; L740-N744 PolarHBondContact O-N 2.93Å; L740-N744 VanDerWaalsContact O-N 3.12Å; L740-N744 PolarHBondContact O-ND2 2.87Å
741	A	91.4	Very high	90.4	Very high	4 Å²	4	60.7 Å²	60.7	3%	0.033	31%	0.312	C	S	.	.	H	α-helix	trans	-60.1	-50.6	176.3	0	0	0	0	0	111.5	G729 K733 Q737 T738 H739 M743 N744 F745	G729-A741 WeakPolarHBondContact O-CB 3.42Å; K733-A741 HydrophobicContact CB-CB 4.26Å; Q737-A741 PolarHBondContact O-N 2.84Å; T738-A741 PolarHBondContact O-N 3.49Å; H739-A741 VanDerWaalsContact C-N 3.35Å; A741-M743 PolarHBondContact O-N 2.98Å; A741-N744 PolarHBondContact O-N 3.1Å; A741-F745 HydrophobicContact CB-CE2 4.22Å; A741-F745 WeakPolarHBondContact O-CD2 3.45Å; A741-F745 WeakPolarHBondContact O-CG 3.44Å; A741-F745 PolarHBondContact O-N 3.35Å
742	L	89.8	Confident	89.7	Confident	69 Å²	69	63.5 Å²	63.5	36%	0.361	33%	0.326	S	S	.	.	H	α-helix	trans	-56.7	-48.1	175.7	-74.3	172.6	0	0	0	112.3	T738 N744 F745 S746	T738-L742 WeakPolarHBondContact O-CG 3.09Å; T738-L742 PolarHBondContact O-N 3.34Å; L742-N744 VanDerWaalsContact C-N 3.32Å; L742-N744 PolarHBondContact O-N 2.92Å; L742-F745 PolarHBondContact O-N 3.32Å; L742-F745 VanDerWaalsContact O-N 3.11Å; L742-S746 PolarHBondContact O-N 3.19Å; L742-S746 PolarHBondContact O-OG 3.06Å; L742-S746 VanDerWaalsContact O-OG 3.14Å
743	M	91.4	Very high	88.5	Confident	75 Å²	75	65.9 Å²	65.9	37%	0.369	35%	0.347	S	S	.	.	H	α-helix	trans	-57.7	-43.8	-179.1	-177.4	179.4	67.6	0	0	112.2	H739 L740 A741 S746 W747	H739-M743 PolarHBondContact O-N 3.26Å; L740-M743 HydrophobicContact CG-CE 4.28Å; L740-M743 PolarHBondContact O-N 3.31Å; A741-M743 PolarHBondContact O-N 2.98Å; M743-S746 WeakPolarHBondContact CA-OG 3.3Å; M743-S746 PolarHBondContact O-N 3.17Å; M743-S746 PolarHBondContact O-OG 3.19Å; M743-W747 HydrophobicContact CE-CH2 3.51Å; M743-W747 HydrophobicContact CE-CZ2 4.18Å; M743-W747 HydrophobicContact CE-CZ3 3.87Å; M743-W747 HydrophobicContact CG-CD2 4.22Å; M743-W747 HydrophobicContact CG-CE3 4.4Å; M743-W747 HydrophobicContact CG-CH2 3.78Å; M743-W747 HydrophobicContact CG-CZ2 3.51Å; M743-W747 HydrophobicContact CG-CZ3 4.2Å; M743-W747 VanDerWaalsContact O-CG 3.31Å; M743-W747 PolarHBondContact O-N 2.7Å; M743-W747 VanDerWaalsContact O-N 3.15Å; M743-W747 HydrophobicContact SD-CH2 3.57Å; M743-W747 VanDerWaalsContact SD-CH2 3.57Å; M743-W747 HydrophobicContact SD-CZ2 3.61Å; M743-W747 HydrophobicContact SD-CZ3 4.36Å
744	N	90.9	Very high	87.4	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.043	37%	0.366	C	S	.	.	H	α-helix	trans	-72.5	-31.9	177.1	-73.7	-86	0	0	0	112.4	I728 L740 A741 L742 W747 A748	I728-N744 HydrophobicContact CG2-CB 4.16Å; I728-N744 WeakPolarHBondContact CG2-OD1 3.27Å; L740-N744 PolarHBondContact O-N 2.93Å; L740-N744 VanDerWaalsContact O-N 3.12Å; L740-N744 PolarHBondContact O-ND2 2.87Å; A741-N744 PolarHBondContact O-N 3.1Å; L742-N744 VanDerWaalsContact C-N 3.32Å; L742-N744 PolarHBondContact O-N 2.92Å; N744-W747 PolarHBondContact O-N 3.03Å; N744-A748 WeakPolarHBondContact O-CB 3.23Å; N744-A748 PolarHBondContact O-N 3.02Å
745	F	89.6	Confident	85.8	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.035	35%	0.352	C	S	.	.	H	α-helix	trans	-68.1	-36.9	171.7	-67.9	-45.2	0	0	0	113	F726 K730 A741 L742 A748 M749 I760 I764	F726-F745 AromaticContact CD2-CD1 3.83Å; F726-F745 HydrophobicContact CD2-CD1 3.83Å; F726-F745 AromaticContact CD2-CE1 3.64Å; F726-F745 HydrophobicContact CD2-CE1 3.64Å; F726-F745 HydrophobicContact CE2-CD1 4.42Å; F726-F745 HydrophobicContact CE2-CE1 4.03Å; F726-F745 WeakPolarHBondContact O-CE1 3.32Å; K730-F745 HydrophobicContact CG-CE1 4.3Å; K730-F745 HydrophobicContact CG-CZ 4.27Å; A741-F745 HydrophobicContact CB-CE2 4.22Å; A741-F745 WeakPolarHBondContact O-CD2 3.45Å; A741-F745 WeakPolarHBondContact O-CG 3.44Å; A741-F745 PolarHBondContact O-N 3.35Å; L742-F745 PolarHBondContact O-N 3.32Å; L742-F745 VanDerWaalsContact O-N 3.11Å; F745-A748 PolarHBondContact O-N 2.86Å; F745-M749 WeakPolarHBondContact O-CG 3.35Å; F745-M749 PolarHBondContact O-N 2.76Å; F745-M749 VanDerWaalsContact O-N 3.15Å; F745-I760 HydrophobicContact CB-CG2 4.4Å; F745-I764 HydrophobicContact CB-CD1 4.19Å; F745-I764 HydrophobicContact CB-CG1 4.39Å; F745-I764 HydrophobicContact CD2-CG1 4.38Å
746	S	89.2	Confident	83.9	Confident	45 Å²	45	63.5 Å²	63.5	32%	0.315	35%	0.347	S	S	.	.	H	α-helix	trans	-61	-48.6	170.7	35.8	0	0	0	0	111.5	L742 M743 A748 M749 D750	L742-S746 PolarHBondContact O-N 3.19Å; L742-S746 PolarHBondContact O-OG 3.06Å; L742-S746 VanDerWaalsContact O-OG 3.14Å; M743-S746 WeakPolarHBondContact CA-OG 3.3Å; M743-S746 PolarHBondContact O-N 3.17Å; M743-S746 PolarHBondContact O-OG 3.19Å; S746-A748 VanDerWaalsContact C-N 3.26Å; S746-A748 PolarHBondContact O-N 2.83Å; S746-M749 PolarHBondContact O-N 2.86Å; S746-D750 VanDerWaalsContact O-CG 3.29Å; S746-D750 PolarHBondContact O-N 3.07Å
747	W	89.7	Confident	82.2	Confident	103 Å²	103	63.8 Å²	63.8	39%	0.39	34%	0.336	S	S	.	.	H	α-helix	trans	-60.9	-33.6	177.6	-62	-22	0	0	0	113.1	Y725 M743 N744 D750 L751	Y725-W747 HydrophobicContact CD1-CB 4.15Å; Y725-W747 AromaticContact CD1-CE3 3.75Å; Y725-W747 HydrophobicContact CD1-CE3 3.75Å; Y725-W747 AromaticContact CE1-CE3 3.72Å; Y725-W747 HydrophobicContact CE1-CE3 3.72Å; Y725-W747 HydrophobicContact CE1-CZ3 4.32Å; Y725-W747 HydrophobicContact CG-CB 4.35Å; M743-W747 HydrophobicContact CE-CH2 3.51Å; M743-W747 HydrophobicContact CE-CZ2 4.18Å; M743-W747 HydrophobicContact CE-CZ3 3.87Å; M743-W747 HydrophobicContact CG-CD2 4.22Å; M743-W747 HydrophobicContact CG-CE3 4.4Å; M743-W747 HydrophobicContact CG-CH2 3.78Å; M743-W747 HydrophobicContact CG-CZ2 3.51Å; M743-W747 HydrophobicContact CG-CZ3 4.2Å; M743-W747 VanDerWaalsContact O-CG 3.31Å; M743-W747 PolarHBondContact O-N 2.7Å; M743-W747 VanDerWaalsContact O-N 3.15Å; M743-W747 HydrophobicContact SD-CH2 3.57Å; M743-W747 VanDerWaalsContact SD-CH2 3.57Å; M743-W747 HydrophobicContact SD-CZ2 3.61Å; M743-W747 HydrophobicContact SD-CZ3 4.36Å; N744-W747 PolarHBondContact O-N 3.03Å; W747-D750 PolarHBondContact O-N 3.3Å; W747-L751 WeakPolarHBondContact O-CB 3.36Å; W747-L751 WeakPolarHBondContact O-CD1 3.48Å; W747-L751 VanDerWaalsContact O-CG 3.24Å; W747-L751 WeakPolarHBondContact O-CG 3.39Å; W747-L751 PolarHBondContact O-N 2.87Å
748	A	87.4	Confident	80.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-64.2	-40.6	172.5	0	0	0	0	0	112.5	S722 F726 N744 F745 S746 D752 I760	S722-A748 WeakPolarHBondContact CB-O 3.39Å; S722-A748 WeakPolarHBondContact OG-CA 3.5Å; S722-A748 PolarHBondContact OG-O 3.17Å; F726-A748 HydrophobicContact CB-CB 4.14Å; N744-A748 WeakPolarHBondContact O-CB 3.23Å; N744-A748 PolarHBondContact O-N 3.02Å; F745-A748 PolarHBondContact O-N 2.86Å; S746-A748 VanDerWaalsContact C-N 3.26Å; S746-A748 PolarHBondContact O-N 2.83Å; A748-D752 PolarHBondContact O-N 3.35Å; A748-I760 HydrophobicContact CB-CD1 3.97Å
749	M	84.3	Confident	78.8	Confident	68 Å²	68	68.4 Å²	68.4	34%	0.335	36%	0.357	S	S	.	.	H	α-helix	trans	-71.3	-36.7	176	-65.7	-174.9	-70.7	0	0	112.7	F745 S746 L751 D752 I760 I764	F745-M749 WeakPolarHBondContact O-CG 3.35Å; F745-M749 PolarHBondContact O-N 2.76Å; F745-M749 VanDerWaalsContact O-N 3.15Å; S746-M749 PolarHBondContact O-N 2.86Å; M749-L751 VanDerWaalsContact C-N 3.32Å; M749-D752 CarbonylContact O-C 3.54Å; M749-I760 HydrophobicContact CG-CB 4.15Å; M749-I760 HydrophobicContact CG-CD1 4.06Å; M749-I760 HydrophobicContact CG-CG2 3.54Å; M749-I760 HydrophobicContact SD-CG2 3.9Å; M749-I764 HydrophobicContact CE-CD1 3.71Å; M749-I764 HydrophobicContact SD-CD1 4.02Å
750	D	87.1	Confident	77.4	Confident	120 Å²	120	62.1 Å²	62.1	64%	0.642	33%	0.328	S	S	*	.	H	α-helix	trans	-66.3	-34.9	177.3	-65.1	-36.7	0	0	0	111.9	S746 W747	S746-D750 VanDerWaalsContact O-CG 3.29Å; S746-D750 PolarHBondContact O-N 3.07Å; W747-D750 PolarHBondContact O-N 3.3Å
751	L	84.8	Confident	75.8	Confident	70 Å²	70	64.3 Å²	64.3	37%	0.366	34%	0.336	S	S	.	.	H	α-helix	trans	-78.9	-31.8	-179.5	-75.2	171.1	0	0	0	114.1	Y725 W747 M749	Y725-L751 HydrophobicContact CD2-CD1 3.38Å; Y725-L751 HydrophobicContact CE2-CD1 3.41Å; Y725-L751 VanDerWaalsContact CE2-CD1 3.41Å; Y725-L751 HydrophobicContact CG-CD1 4.34Å; W747-L751 WeakPolarHBondContact O-CB 3.36Å; W747-L751 WeakPolarHBondContact O-CD1 3.48Å; W747-L751 VanDerWaalsContact O-CG 3.24Å; W747-L751 WeakPolarHBondContact O-CG 3.39Å; W747-L751 PolarHBondContact O-N 2.87Å; M749-L751 VanDerWaalsContact C-N 3.32Å
752	D	78.5	Confident	74.2	Confident	58 Å²	58	68.9 Å²	68.9	31%	0.31	36%	0.356	S	S	.	.			trans	-132	93.2	172	-169.3	-3.4	0	0	0	112.7	A748 M749 K754 G755	A748-D752 PolarHBondContact O-N 3.35Å; M749-D752 CarbonylContact O-C 3.54Å; D752-K754 PolarHBondContact O-N 3.45Å; D752-K754 VanDerWaalsContact O-N 3.16Å; D752-K754 WeakPolarHBondContact OD1-CA 3.45Å; D752-K754 PolarHBondContact OD1-N 3.33Å; D752-G755 PolarHBondContact OD1-N 3.27Å; D752-G755 WeakPolarHBondContact OD2-CA 3.37Å; D752-G755 PolarHBondContact OD2-N 3.18Å; D752-G755 VanDerWaalsContact OD2-N 3.09Å
753	P	69.4	Low	72.8	Confident	90 Å²	90	66.5 Å²	66.5	58%	0.584	35%	0.346	S	S	*	.	S	Bend	trans	-69.4	-1.2	174.3	-22.9	35.3	0	0	0	115.3	N757	P753-N757 PolarHBondContact O-ND2 3Å
754	K	67.7	Low	71.3	Confident	178 Å²	178	64.4 Å²	64.4	77%	0.774	34%	0.336	S	S	*	.	S	Bend	trans	-124.3	-52.6	-174	-70.4	-175.6	178.1	178.4	0	113.5	D752	D752-K754 PolarHBondContact O-N 3.45Å; D752-K754 VanDerWaalsContact O-N 3.16Å; D752-K754 WeakPolarHBondContact OD1-CA 3.45Å; D752-K754 PolarHBondContact OD1-N 3.33Å
755	G	58.5	Low	69.5	Low	28 Å²	28	68 Å²	68	29%	0.289	36%	0.355	S	S	.	.	S	Bend	trans	-74.4	159.9	171.5	0	0	0	0	0	111.7	D752 N757	D752-G755 PolarHBondContact OD1-N 3.27Å; D752-G755 WeakPolarHBondContact OD2-CA 3.37Å; D752-G755 PolarHBondContact OD2-N 3.18Å; D752-G755 VanDerWaalsContact OD2-N 3.09Å; G755-N757 PolarHBondContact O-N 3.37Å
756	A	54.1	Low	67.9	Low	29 Å²	29	74.1 Å²	74.1	24%	0.24	38%	0.382	C	S	.	.	S	Bend	trans	52.5	5.7	178.4	0	0	0	0	0	117.6	N758 Q759 I760	A756-N758 CarbonylContact O-C 3.44Å; A756-N758 PolarHBondContact O-N 2.98Å; A756-Q759 PolarHBondContact O-N 2.96Å; A756-I760 HydrophobicContact CB-CD1 3.69Å; A756-I760 HydrophobicContact CB-CG1 3.86Å; A756-I760 WeakPolarHBondContact O-CG1 3.43Å; A756-I760 PolarHBondContact O-N 3.39Å
757	N	53	Low	65.8	Low	60 Å²	60	78 Å²	78	32%	0.321	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-11.7	-177.4	-144.4	-34.1	0	0	0	113.8	P753 G755 K761	P753-N757 PolarHBondContact O-ND2 3Å; G755-N757 PolarHBondContact O-N 3.37Å; N757-K761 WeakPolarHBondContact O-CD 3.35Å; N757-K761 WeakPolarHBondContact O-CE 3.29Å; N757-K761 VanDerWaalsContact O-CG 3.29Å; N757-K761 WeakPolarHBondContact O-CG 3.47Å; N757-K761 PolarHBondContact O-NZ 3.27Å; N757-K761 WeakPolarHBondContact OD1-CE 3.49Å; N757-K761 PolarHBondContact OD1-NZ 3.45Å
758	N	53.8	Low	63.5	Low	132 Å²	132	81.6 Å²	81.6	71%	0.706	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-47.6	166.6	-71.1	9.1	0	0	0	112.2	A756 I760 K761 E762	A756-N758 CarbonylContact O-C 3.44Å; A756-N758 PolarHBondContact O-N 2.98Å; N758-I760 PolarHBondContact O-N 3.07Å; N758-K761 PolarHBondContact O-N 2.95Å; N758-E762 WeakPolarHBondContact O-CB 3.36Å; N758-E762 PolarHBondContact O-N 3.22Å
759	Q	60.5	Low	61	Low	115 Å²	115	88.4 Å²	88.4	54%	0.537	44%	0.44	S	S	.	.	H	α-helix	trans	-66.5	-34.3	-177.7	-69.6	-173	2.7	0	0	113.8	F726 A756 A763	F726-Q759 HydrophobicContact CZ-CB 4.15Å; A756-Q759 PolarHBondContact O-N 2.96Å; Q759-A763 WeakPolarHBondContact O-CB 3.48Å; Q759-A763 PolarHBondContact O-N 3.41Å
760	I	61.2	Low	58.6	Low	1 Å²	1	89.8 Å²	89.8	1%	0.005	45%	0.454	C	S	.	.	H	α-helix	trans	-72.6	-40.7	175.6	-57.2	164.1	0	0	0	109.7	F726 F745 A748 M749 A756 N758 A763 I764	F726-I760 HydrophobicContact CD2-CG1 3.78Å; F726-I760 HydrophobicContact CE2-CB 4.36Å; F726-I760 HydrophobicContact CE2-CG1 3.91Å; F726-I760 HydrophobicContact CG-CG1 4.36Å; F745-I760 HydrophobicContact CB-CG2 4.4Å; A748-I760 HydrophobicContact CB-CD1 3.97Å; M749-I760 HydrophobicContact CG-CB 4.15Å; M749-I760 HydrophobicContact CG-CD1 4.06Å; M749-I760 HydrophobicContact CG-CG2 3.54Å; M749-I760 HydrophobicContact SD-CG2 3.9Å; A756-I760 HydrophobicContact CB-CD1 3.69Å; A756-I760 HydrophobicContact CB-CG1 3.86Å; A756-I760 WeakPolarHBondContact O-CG1 3.43Å; A756-I760 PolarHBondContact O-N 3.39Å; N758-I760 PolarHBondContact O-N 3.07Å; I760-A763 PolarHBondContact O-N 2.8Å; I760-I764 HydrophobicContact CG2-CD1 3.86Å; I760-I764 WeakPolarHBondContact O-CD1 3.25Å; I760-I764 VanDerWaalsContact O-CG1 3.26Å; I760-I764 WeakPolarHBondContact O-CG1 3.31Å; I760-I764 PolarHBondContact O-N 2.93Å
761	K	58.6	Low	56.2	Low	90 Å²	90	93.6 Å²	93.6	39%	0.391	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-52.4	173	-73.3	-168.8	-163.8	112.2	0	111.5	N757 N758 A763 I764 D765	N757-K761 WeakPolarHBondContact O-CD 3.35Å; N757-K761 WeakPolarHBondContact O-CE 3.29Å; N757-K761 VanDerWaalsContact O-CG 3.29Å; N757-K761 WeakPolarHBondContact O-CG 3.47Å; N757-K761 PolarHBondContact O-NZ 3.27Å; N757-K761 WeakPolarHBondContact OD1-CE 3.49Å; N757-K761 PolarHBondContact OD1-NZ 3.45Å; N758-K761 PolarHBondContact O-N 2.95Å; K761-A763 PolarHBondContact O-N 2.96Å; K761-A763 VanDerWaalsContact O-N 3.16Å; K761-I764 CarbonylContact O-C 3.44Å; K761-I764 WeakPolarHBondContact O-CA 3.3Å; K761-I764 WeakPolarHBondContact O-CB 3.47Å; K761-I764 PolarHBondContact O-N 2.96Å; K761-D765 WeakPolarHBondContact O-CB 3.25Å; K761-D765 PolarHBondContact O-N 3.4Å
762	E	59.4	Low	53.8	Low	100 Å²	100	97 Å²	97	47%	0.467	49%	0.487	S	S	.	.	H	α-helix	trans	-56.2	-37.5	179	-164.2	-149.4	134.4	0	0	113	N758 I764 K766	N758-E762 WeakPolarHBondContact O-CB 3.36Å; N758-E762 PolarHBondContact O-N 3.22Å; E762-I764 VanDerWaalsContact C-N 3.3Å; E762-I764 PolarHBondContact O-N 3.25Å; E762-K766 HydrophobicContact CG-CD 4.42Å; E762-K766 WeakPolarHBondContact O-CB 3.49Å; E762-K766 WeakPolarHBondContact O-CG 3.34Å; E762-K766 PolarHBondContact O-N 3.35Å; E762-K766 WeakPolarHBondContact OE1-CE 3.46Å; E762-K766 IonicContact OE1-NZ 2.64Å; E762-K766 PolarHBondContact OE1-NZ 2.76Å
763	A	59.4	Low	52	Low	18 Å²	18	103.5 Å²	103.5	15%	0.149	52%	0.515	C	S	.	.	H	α-helix	trans	-68.5	-26.4	175.5	0	0	0	0	0	114.1	F726 K733 Q759 I760 K761	F726-A763 HydrophobicContact CE2-CB 3.99Å; K733-A763 PolarHBondContact NZ-O 3.35Å; Q759-A763 WeakPolarHBondContact O-CB 3.48Å; Q759-A763 PolarHBondContact O-N 3.41Å; I760-A763 PolarHBondContact O-N 2.8Å; K761-A763 PolarHBondContact O-N 2.96Å; K761-A763 VanDerWaalsContact O-N 3.16Å
764	I	60.7	Low	50.1	Low	31 Å²	31	105.9 Å²	105.9	16%	0.159	53%	0.528	C	S	.	.	H	α-helix	trans	-86.2	-41.2	174.1	-66.8	166.1	0	0	0	111.1	F745 M749 I760 K761 E762 R767 Y768	F745-I764 HydrophobicContact CB-CD1 4.19Å; F745-I764 HydrophobicContact CB-CG1 4.39Å; F745-I764 HydrophobicContact CD2-CG1 4.38Å; M749-I764 HydrophobicContact CE-CD1 3.71Å; M749-I764 HydrophobicContact SD-CD1 4.02Å; I760-I764 HydrophobicContact CG2-CD1 3.86Å; I760-I764 WeakPolarHBondContact O-CD1 3.25Å; I760-I764 VanDerWaalsContact O-CG1 3.26Å; I760-I764 WeakPolarHBondContact O-CG1 3.31Å; I760-I764 PolarHBondContact O-N 2.93Å; K761-I764 CarbonylContact O-C 3.44Å; K761-I764 WeakPolarHBondContact O-CA 3.3Å; K761-I764 WeakPolarHBondContact O-CB 3.47Å; K761-I764 PolarHBondContact O-N 2.96Å; E762-I764 VanDerWaalsContact C-N 3.3Å; E762-I764 PolarHBondContact O-N 3.25Å; I764-R767 WeakPolarHBondContact O-CB 3.44Å; I764-R767 PolarHBondContact O-N 2.7Å; I764-Y768 HydrophobicContact CG2-CE2 4.34Å
765	D	53	Low	48.3	Very low	84 Å²	84	101.6 Å²	101.6	45%	0.449	53%	0.526	S	S	.	.	H	α-helix	trans	-74.4	-27.2	-174.8	-64.8	-27	0	0	0	111.7	K761 R767 Y768	K761-D765 WeakPolarHBondContact O-CB 3.25Å; K761-D765 PolarHBondContact O-N 3.4Å; D765-R767 PolarHBondContact O-N 3.11Å; D765-Y768 PolarHBondContact O-N 3.5Å
766	K	54.9	Low	47.2	Very low	136 Å²	136	109.5 Å²	109.5	59%	0.591	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	46.4	158.5	-70.3	174.7	171.9	171.5	0	112.3	K733 E762	K733-K766 PolarHBondContact NZ-O 3.37Å; E762-K766 HydrophobicContact CG-CD 4.42Å; E762-K766 WeakPolarHBondContact O-CB 3.49Å; E762-K766 WeakPolarHBondContact O-CG 3.34Å; E762-K766 PolarHBondContact O-N 3.35Å; E762-K766 WeakPolarHBondContact OE1-CE 3.46Å; E762-K766 IonicContact OE1-NZ 2.64Å; E762-K766 PolarHBondContact OE1-NZ 2.76Å
767	R	45.2	Very low	46.1	Very low	126 Å²	126	114.8 Å²	114.8	48%	0.475	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-156.7	-4.3	173.4	-156.7	179.7	173.6	-108.4	0.4	111.8	I764 D765	I764-R767 WeakPolarHBondContact O-CB 3.44Å; I764-R767 PolarHBondContact O-N 2.7Å; D765-R767 PolarHBondContact O-N 3.11Å
768	Y	42.1	Very low	44.9	Very low	179 Å²	179	117.6 Å²	117.6	70%	0.702	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-7.5	176.1	-81.6	-69	0	0	0	113.7	I764 D765	I764-Y768 HydrophobicContact CG2-CE2 4.34Å; D765-Y768 PolarHBondContact O-N 3.5Å
769	L	34	Very low	43.9	Very low	143 Å²	143	119.3 Å²	119.3	75%	0.749	61%	0.609	S	S	*	*	S	Bend	trans	-79.8	128	151.1	-65.5	174.7	0	0	0	107.5
770	P	33.8	Very low	42.4	Very low	98 Å²	98	117.1 Å²	117.1	64%	0.636	61%	0.606	S	S	*	*			trans	-58.8	150.1	168.9	-22.3	34.1	0	0	0	111.2	D772	P770-D772 HydrophobicContact CB-CB 4.34Å
771	E	37.1	Very low	40.9	Very low	200 Å²	200	126.2 Å²	126.2	94%	0.935	65%	0.648	S	S	*	*	S	Bend	trans	-85.1	3.8	168	-67.7	176.1	147.1	0	0	111.4
772	D	35.1	Very low	39.4	Very low	141 Å²	141	129.1 Å²	129.1	75%	0.754	67%	0.668	S	S	*	*	S	Bend	trans	-87.9	120.6	168.6	-56.1	-59.3	0	0	0	109.7	P770	P770-D772 HydrophobicContact CB-CB 4.34Å
773	E	39.7	Very low	37.9	Very low	194 Å²	194	129.2 Å²	129.2	91%	0.907	68%	0.679	S	S	*	*	S	Bend	trans	87.2	53.6	-176	-57.3	-163.1	157.4	0	0	119.1
774	V	31.2	Very low	36.3	Very low	141 Å²	141	133.1 Å²	133.1	86%	0.855	71%	0.706	S	S	*	*	S	Bend		-135.2	138.1	121.7	-174.8	0	0	0	0	108.3
775	A	29.7	Very low	34.7	Very low	88 Å²	88	141.4 Å²	141.4	73%	0.727	74%	0.741	S	S	*	*			trans	-71.3	165.2	-177	0	0	0	0	0	113.7	V777	A775-V777 PolarHBondContact O-N 2.7Å
776	E	35.1	Very low	33.6	Very low	194 Å²	194	145 Å²	145	91%	0.907	76%	0.757	S	S	*	*			trans	-51.7	131.2	173.3	-59.5	175.8	144.7	0	0	111.9
777	V	29.5	Very low	32.3	Very low	140 Å²	140	144 Å²	144	85%	0.848	76%	0.763	S	S	*	*			trans	-124.8	107.8	154.9	-178.9	0	0	0	0	106.2	A775	A775-V777 PolarHBondContact O-N 2.7Å
778	D	28.9	Very low	31.6	Very low	118 Å²	118	145.4 Å²	145.4	63%	0.631	78%	0.779	S	S	*	*			trans	-65.3	131.9	179.6	-175.4	0.4	0	0	0	110.7	S780	D778-S780 WeakPolarHBondContact OD1-CB 3.38Å; D778-S780 PolarHBondContact OD1-N 3.2Å; D778-S780 VanDerWaalsContact OD1-N 3.13Å; D778-S780 PolarHBondContact OD1-OG 3.28Å; D778-S780 PolarHBondContact OD2-OG 3.11Å
779	D	33.3	Very low	31.1	Very low	169 Å²	169	141.2 Å²	141.2	90%	0.904	78%	0.782	S	S	*	*			trans	-103.5	46.8	178.2	-161.9	17.7	0	0	0	110
780	S	29.4	Very low	31.2	Very low	68 Å²	68	141.8 Å²	141.8	48%	0.476	79%	0.786	S	S	.	*			trans	-149.6	78	-178.2	72.5	0	0	0	0	116.5	D778	D778-S780 WeakPolarHBondContact OD1-CB 3.38Å; D778-S780 PolarHBondContact OD1-N 3.2Å; D778-S780 VanDerWaalsContact OD1-N 3.13Å; D778-S780 PolarHBondContact OD1-OG 3.28Å; D778-S780 PolarHBondContact OD2-OG 3.11Å
781	Q	28.7	Very low	31.1	Very low	193 Å²	193	143 Å²	143	90%	0.902	79%	0.787	S	S	*	*			trans	-163.3	129.5	133.9	-113.4	144.3	101.7	0	0	115.8
782	D	27.6	Very low	30.9	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	78%	0.78	S	S	*	*			trans	-75.7	147.4	160.4	-106.4	-47.8	0	0	0	111
783	S	26.8	Very low	30.8	Very low	101 Å²	101	140.1 Å²	140.1	71%	0.706	78%	0.778	S	S	*	*			trans	66.5	132.6	149.6	70.9	0	0	0	0	121.7
784	S	26.9	Very low	30.5	Very low	101 Å²	101	137.5 Å²	137.5	71%	0.706	77%	0.769	S	S	*	*			trans	58.2	115.2	152	61.1	0	0	0	0	120.5
785	F	26.7	Very low	30.6	Very low	205 Å²	205	139.6 Å²	139.6	90%	0.899	77%	0.77	S	S	*	*				-156.7	166.1	94.9	-128.5	-104	0	0	0	112.2
786	M	29.1	Very low	30.6	Very low	159 Å²	159	140.9 Å²	140.9	78%	0.783	77%	0.768	S	S	*	*			trans	-106.6	150.8	175.1	-66.4	155.8	55.8	0	0	110.1
787	T	28.8	Very low	31.3	Very low	116 Å²	116	136.4 Å²	136.4	71%	0.712	76%	0.756	S	S	*	*				153.5	130.8	125.4	48.8	0	0	0	0	112.2
788	D	29.1	Very low	31.5	Very low	154 Å²	154	136.8 Å²	136.8	82%	0.824	75%	0.753	S	S	*	*			trans	57.6	148.9	136.6	-49.5	-8.3	0	0	0	120.1
789	A	33.6	Very low	31.8	Very low	91 Å²	91	135.5 Å²	135.5	75%	0.752	75%	0.754	S	S	*	*			cis	-155.4	135.4	-11.6	0	0	0	0	0	106.1
790	D	35.5	Very low	32.2	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	75%	0.749	S	S	*	*				66.8	119.2	74.5	-168.7	31.7	0	0	0	115.2
791	D	31.6	Very low	32.8	Very low	123 Å²	123	138.6 Å²	138.6	66%	0.658	77%	0.765	S	S	*	*			trans	-170.8	108	149.5	-157.7	-11.6	0	0	0	112.1
792	T	32.3	Very low	33.6	Very low	128 Å²	128	135 Å²	135	79%	0.785	76%	0.756	S	S	*	*				-170.2	82.5	129.1	15.1	0	0	0	0	114.5
793	Q	32.4	Very low	34.6	Very low	154 Å²	154	138.8 Å²	138.8	72%	0.72	78%	0.775	S	S	*	*			trans	56	108.8	136.6	-58.9	-173.4	7.9	0	0	122.7
794	L	34.3	Very low	34.9	Very low	139 Å²	139	140.7 Å²	140.7	73%	0.728	78%	0.778	S	S	*	*				60.7	110.6	122.2	-68.3	160.1	0	0	0	121.2
795	H	32.3	Very low	35.4	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.856	78%	0.782	S	S	*	*				-162	143.2	100.3	-115.8	-77	0	0	0	113.8
796	T	31	Very low	35.8	Very low	114 Å²	114	139.3 Å²	139.3	70%	0.699	78%	0.776	S	S	*	*			trans	-104	179.5	177.4	47.8	0	0	0	0	110.2
797	P	49.8	Very low	36.2	Very low	100 Å²	100	138.2 Å²	138.2	65%	0.649	78%	0.775	S	S	*	*			cis	-145.9	178.8	17.8	46.8	-27.5	0	0	0	119.1
798	D	33.7	Very low	36.7	Very low	148 Å²	148	139.6 Å²	139.6	79%	0.791	78%	0.779	S	S	*	*			trans	55.3	148.5	145.3	-61.4	0.8	0	0	0	121.9
799	S	35.7	Very low	37.2	Very low	92 Å²	92	138.6 Å²	138.6	64%	0.643	78%	0.776	S	S	*	*			cis	-169.8	-174	-12.5	-95.6	0	0	0	0	110.7
800	D	40.4	Very low	37.5	Very low	152 Å²	152	142 Å²	142	81%	0.813	78%	0.778	S	S	*	*			trans	78.3	64.2	158.2	-59.5	-9.2	0	0	0	119.9
801	D	43.1	Very low	37.6	Very low	150 Å²	150	141 Å²	141	80%	0.802	77%	0.774	S	S	*	*				42.9	154.6	100.5	-135.8	-2.9	0	0	0	123.1
802	V	45.6	Very low	38.1	Very low	117 Å²	117	142.5 Å²	142.5	71%	0.709	78%	0.784	S	S	*	*			trans	68.2	130.2	160	170.2	0	0	0	0	117.9
803	L	47.2	Very low	38.7	Very low	231 Å²	231	143.8 Å²	143.8	100%	1.209	78%	0.784	S	S	*	*			cis	-145.4	0	8.7	-141	168	0	0	0	111

Retrieved 803 of 803 residues in 1120.5 ms (Link to these results)

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